USER MOD reduce.3.24.130724 H: found=0, std=0, add=1209, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1210 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 115 TYR OH : rot -175:sc= 1.29 USER MOD Set 1.2: A 153 THR OG1 : rot -57:sc= 1.82 USER MOD Set 2.1: A 125 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 136 HIS : no HD1:sc= -0.189 X(o=-0.19,f=-0.072) USER MOD Set 3.1: A 103 THR OG1 : rot -170:sc= 0.218 USER MOD Set 3.2: A 121 THR OG1 : rot -104:sc= -0.13 USER MOD Single : A 17 THR OG1 : rot 43:sc= 0.112 USER MOD Single : A 20 SER OG : rot 180:sc= 0.00748 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 156:sc= 1.28 (180deg=1.22) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ -166:sc= -0.0464 (180deg=-0.26) USER MOD Single : A 35 SER OG : rot 180:sc= -1.44! USER MOD Single : A 38 LYS NZ :NH3+ -158:sc= 2.05 (180deg=1.28) USER MOD Single : A 40 HIS :FLIP no HD1:sc= -1.24 F(o=-2.5!,f=-1.2) USER MOD Single : A 41 HIS :FLIP no HE2:sc= 0.625 F(o=-2!,f=0.63) USER MOD Single : A 42 MET CE :methyl -144:sc= -0.054 (180deg=-0.665) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 HIS : no HD1:sc= 0 X(o=0,f=-0.0029) USER MOD Single : A 49 HIS : no HD1:sc= -0.0066 X(o=-0.0066,f=0) USER MOD Single : A 51 SER OG : rot 100:sc= -1.98! USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 180:sc= -0.025 USER MOD Single : A 57 ASN : amide:sc= -0.0167 X(o=-0.017,f=0) USER MOD Single : A 59 GLN : amide:sc= -0.0119 K(o=-0.012,f=-1.2) USER MOD Single : A 61 CYS SG : rot -110:sc= 0.97 USER MOD Single : A 64 HIS :FLIP no HD1:sc= -0.0318 F(o=-0.6,f=-0.032) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0224 USER MOD Single : A 73 SER OG : rot 34:sc= 0.461 USER MOD Single : A 78 ASN :FLIP amide:sc= -0.357 F(o=-1.1,f=-0.36) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 HIS : no HD1:sc= -0.0906 X(o=-0.091,f=-0.13) USER MOD Single : A 86 LYS NZ :NH3+ -109:sc= -0.634! (180deg=-5.19!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ -151:sc= 1.22 (180deg=0.941) USER MOD Single : A 100 ASN : amide:sc= -2.43! C(o=-2.4!,f=-5.9!) USER MOD Single : A 112 MET CE :methyl -137:sc= -1.66 (180deg=-6.04!) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -1 X(o=-1,f=-0.85) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot -15:sc= 1.22 USER MOD Single : A 138 HIS : no HE2:sc= 1.12 K(o=1.1,f=-4.6!) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ -161:sc= -0.0638 (180deg=-0.415) USER MOD Single : A 145 SER OG : rot 180:sc=-0.00552 USER MOD Single : A 150 HIS : no HD1:sc= -0.185 X(o=-0.19,f=0.027) USER MOD Single : A 156 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 158 CYS SG : rot 63:sc= 1.16 USER MOD Single : A 162 SER OG : rot 56:sc= 1.07 USER MOD Single : A 163 LYS NZ :NH3+ -145:sc= -1.24 (180deg=-3.07!) USER MOD Single : A 168 HIS : no HD1:sc= -0.0193 X(o=-0.019,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 17 -3.610 -32.365 0.029 1.00 2.31 N ATOM 2 CA THR A 17 -3.730 -32.217 1.485 1.00 1.33 C ATOM 3 C THR A 17 -3.253 -30.814 1.963 1.00 0.14 C ATOM 4 O THR A 17 -3.824 -30.231 2.897 1.00 20.22 O ATOM 5 CB THR A 17 -2.957 -33.341 2.228 1.00 61.10 C ATOM 6 OG1 THR A 17 -3.406 -34.628 1.745 1.00 22.21 O ATOM 7 CG2 THR A 17 -3.177 -33.261 3.736 1.00 31.41 C ATOM 0 HA THR A 17 -4.788 -32.309 1.731 1.00 1.33 H new ATOM 0 HB THR A 17 -1.892 -33.214 2.031 1.00 61.10 H new ATOM 0 HG1 THR A 17 -3.486 -34.601 0.769 1.00 22.21 H new ATOM 0 HG21 THR A 17 -2.623 -34.061 4.227 1.00 31.41 H new ATOM 0 HG22 THR A 17 -2.826 -32.297 4.104 1.00 31.41 H new ATOM 0 HG23 THR A 17 -4.239 -33.368 3.955 1.00 31.41 H new ATOM 15 N GLU A 18 -2.241 -30.285 1.296 1.00 24.13 N ATOM 16 CA GLU A 18 -1.651 -29.021 1.640 1.00 2.03 C ATOM 17 C GLU A 18 -2.544 -27.855 1.248 1.00 63.34 C ATOM 18 O GLU A 18 -2.517 -27.368 0.103 1.00 12.43 O ATOM 19 CB GLU A 18 -0.263 -28.881 1.035 1.00 20.01 C ATOM 20 CG GLU A 18 0.682 -30.014 1.412 1.00 42.41 C ATOM 21 CD GLU A 18 0.794 -30.213 2.909 1.00 14.21 C ATOM 22 OE1 GLU A 18 1.581 -29.496 3.558 1.00 23.12 O ATOM 23 OE2 GLU A 18 0.113 -31.101 3.455 1.00 65.41 O ATOM 0 H GLU A 18 -1.807 -30.735 0.490 1.00 24.13 H new ATOM 0 HA GLU A 18 -1.548 -28.996 2.725 1.00 2.03 H new ATOM 0 HB2 GLU A 18 -0.351 -28.838 -0.051 1.00 20.01 H new ATOM 0 HB3 GLU A 18 0.171 -27.934 1.357 1.00 20.01 H new ATOM 0 HG2 GLU A 18 0.334 -30.939 0.952 1.00 42.41 H new ATOM 0 HG3 GLU A 18 1.671 -29.807 1.003 1.00 42.41 H new ATOM 30 N ALA A 19 -3.375 -27.498 2.192 1.00 15.20 N ATOM 31 CA ALA A 19 -4.314 -26.386 2.153 1.00 62.42 C ATOM 32 C ALA A 19 -5.062 -26.431 3.466 1.00 42.35 C ATOM 33 O ALA A 19 -6.174 -25.927 3.595 1.00 51.50 O ATOM 34 CB ALA A 19 -5.301 -26.546 1.000 1.00 65.42 C ATOM 0 H ALA A 19 -3.424 -28.007 3.075 1.00 15.20 H new ATOM 0 HA ALA A 19 -3.792 -25.441 2.006 1.00 62.42 H new ATOM 0 HB1 ALA A 19 -5.992 -25.703 0.993 1.00 65.42 H new ATOM 0 HB2 ALA A 19 -4.756 -26.577 0.056 1.00 65.42 H new ATOM 0 HB3 ALA A 19 -5.861 -27.473 1.126 1.00 65.42 H new ATOM 40 N SER A 20 -4.393 -27.004 4.452 1.00 15.52 N ATOM 41 CA SER A 20 -4.947 -27.310 5.742 1.00 14.45 C ATOM 42 C SER A 20 -5.521 -26.078 6.449 1.00 62.31 C ATOM 43 O SER A 20 -6.655 -26.101 6.916 1.00 44.50 O ATOM 44 CB SER A 20 -3.847 -27.941 6.576 1.00 30.50 C ATOM 45 OG SER A 20 -3.232 -28.994 5.845 1.00 31.14 O ATOM 0 H SER A 20 -3.414 -27.275 4.364 1.00 15.52 H new ATOM 0 HA SER A 20 -5.785 -27.995 5.613 1.00 14.45 H new ATOM 0 HB2 SER A 20 -3.104 -27.189 6.843 1.00 30.50 H new ATOM 0 HB3 SER A 20 -4.260 -28.326 7.508 1.00 30.50 H new ATOM 0 HG SER A 20 -2.522 -29.397 6.387 1.00 31.14 H new ATOM 51 N SER A 21 -4.763 -25.015 6.492 1.00 13.24 N ATOM 52 CA SER A 21 -5.169 -23.831 7.203 1.00 71.11 C ATOM 53 C SER A 21 -6.037 -22.917 6.335 1.00 31.20 C ATOM 54 O SER A 21 -6.900 -22.215 6.854 1.00 2.42 O ATOM 55 CB SER A 21 -3.928 -23.074 7.671 1.00 23.54 C ATOM 56 OG SER A 21 -3.069 -23.923 8.428 1.00 54.55 O ATOM 0 H SER A 21 -3.852 -24.944 6.038 1.00 13.24 H new ATOM 0 HA SER A 21 -5.768 -24.138 8.060 1.00 71.11 H new ATOM 0 HB2 SER A 21 -3.390 -22.682 6.808 1.00 23.54 H new ATOM 0 HB3 SER A 21 -4.226 -22.218 8.277 1.00 23.54 H new ATOM 0 HG SER A 21 -2.280 -23.418 8.716 1.00 54.55 H new ATOM 62 N LEU A 22 -5.815 -22.968 5.001 1.00 0.41 N ATOM 63 CA LEU A 22 -6.444 -22.058 4.013 1.00 41.32 C ATOM 64 C LEU A 22 -5.998 -20.608 4.192 1.00 43.23 C ATOM 65 O LEU A 22 -6.462 -19.709 3.499 1.00 22.01 O ATOM 66 CB LEU A 22 -7.950 -22.192 4.021 1.00 64.30 C ATOM 67 CG LEU A 22 -8.467 -23.551 3.586 1.00 10.41 C ATOM 68 CD1 LEU A 22 -9.914 -23.670 3.912 1.00 53.43 C ATOM 69 CD2 LEU A 22 -8.246 -23.755 2.090 1.00 53.22 C ATOM 0 H LEU A 22 -5.187 -23.650 4.575 1.00 0.41 H new ATOM 0 HA LEU A 22 -6.094 -22.367 3.028 1.00 41.32 H new ATOM 0 HB2 LEU A 22 -8.314 -21.985 5.027 1.00 64.30 H new ATOM 0 HB3 LEU A 22 -8.373 -21.431 3.366 1.00 64.30 H new ATOM 0 HG LEU A 22 -7.916 -24.323 4.123 1.00 10.41 H new ATOM 0 HD11 LEU A 22 -10.279 -24.648 3.597 1.00 53.43 H new ATOM 0 HD12 LEU A 22 -10.055 -23.559 4.987 1.00 53.43 H new ATOM 0 HD13 LEU A 22 -10.470 -22.890 3.391 1.00 53.43 H new ATOM 0 HD21 LEU A 22 -8.623 -24.735 1.797 1.00 53.22 H new ATOM 0 HD22 LEU A 22 -8.776 -22.981 1.535 1.00 53.22 H new ATOM 0 HD23 LEU A 22 -7.181 -23.695 1.868 1.00 53.22 H new ATOM 81 N VAL A 23 -5.077 -20.402 5.092 1.00 40.44 N ATOM 82 CA VAL A 23 -4.535 -19.107 5.326 1.00 11.14 C ATOM 83 C VAL A 23 -3.296 -18.957 4.506 1.00 60.42 C ATOM 84 O VAL A 23 -2.330 -19.720 4.647 1.00 41.03 O ATOM 85 CB VAL A 23 -4.221 -18.859 6.819 1.00 71.51 C ATOM 86 CG1 VAL A 23 -3.617 -17.470 7.022 1.00 5.43 C ATOM 87 CG2 VAL A 23 -5.484 -18.995 7.632 1.00 0.05 C ATOM 0 H VAL A 23 -4.684 -21.135 5.682 1.00 40.44 H new ATOM 0 HA VAL A 23 -5.280 -18.365 5.038 1.00 11.14 H new ATOM 0 HB VAL A 23 -3.494 -19.601 7.150 1.00 71.51 H new ATOM 0 HG11 VAL A 23 -3.404 -17.317 8.080 1.00 5.43 H new ATOM 0 HG12 VAL A 23 -2.693 -17.388 6.450 1.00 5.43 H new ATOM 0 HG13 VAL A 23 -4.323 -16.713 6.681 1.00 5.43 H new ATOM 0 HG21 VAL A 23 -5.260 -18.820 8.684 1.00 0.05 H new ATOM 0 HG22 VAL A 23 -6.217 -18.264 7.290 1.00 0.05 H new ATOM 0 HG23 VAL A 23 -5.889 -20.000 7.510 1.00 0.05 H new ATOM 97 N GLY A 24 -3.321 -18.007 3.658 1.00 71.03 N ATOM 98 CA GLY A 24 -2.232 -17.779 2.796 1.00 31.01 C ATOM 99 C GLY A 24 -1.433 -16.623 3.256 1.00 23.34 C ATOM 100 O GLY A 24 -1.975 -15.587 3.587 1.00 31.11 O ATOM 0 H GLY A 24 -4.102 -17.361 3.541 1.00 71.03 H new ATOM 0 HA2 GLY A 24 -1.603 -18.668 2.754 1.00 31.01 H new ATOM 0 HA3 GLY A 24 -2.595 -17.597 1.784 1.00 31.01 H new ATOM 104 N LYS A 25 -0.173 -16.792 3.303 1.00 24.30 N ATOM 105 CA LYS A 25 0.696 -15.739 3.675 1.00 20.44 C ATOM 106 C LYS A 25 1.949 -15.790 2.860 1.00 31.20 C ATOM 107 O LYS A 25 2.563 -16.837 2.703 1.00 52.12 O ATOM 108 CB LYS A 25 0.905 -15.637 5.224 1.00 11.11 C ATOM 109 CG LYS A 25 1.285 -16.926 5.966 1.00 70.14 C ATOM 110 CD LYS A 25 2.693 -17.414 5.647 1.00 51.53 C ATOM 111 CE LYS A 25 3.761 -16.422 6.105 1.00 72.12 C ATOM 112 NZ LYS A 25 5.125 -16.876 5.760 1.00 34.13 N ATOM 0 H LYS A 25 0.295 -17.671 3.083 1.00 24.30 H new ATOM 0 HA LYS A 25 0.220 -14.789 3.434 1.00 20.44 H new ATOM 0 HB2 LYS A 25 1.683 -14.897 5.412 1.00 11.11 H new ATOM 0 HB3 LYS A 25 -0.015 -15.252 5.665 1.00 11.11 H new ATOM 0 HG2 LYS A 25 1.201 -16.757 7.040 1.00 70.14 H new ATOM 0 HG3 LYS A 25 0.570 -17.708 5.710 1.00 70.14 H new ATOM 0 HD2 LYS A 25 2.861 -18.376 6.130 1.00 51.53 H new ATOM 0 HD3 LYS A 25 2.786 -17.576 4.573 1.00 51.53 H new ATOM 0 HE2 LYS A 25 3.575 -15.451 5.645 1.00 72.12 H new ATOM 0 HE3 LYS A 25 3.687 -16.283 7.184 1.00 72.12 H new ATOM 0 HZ1 LYS A 25 5.760 -16.055 5.703 1.00 34.13 H new ATOM 0 HZ2 LYS A 25 5.469 -17.530 6.492 1.00 34.13 H new ATOM 0 HZ3 LYS A 25 5.107 -17.364 4.842 1.00 34.13 H new ATOM 126 N LEU A 26 2.299 -14.687 2.320 1.00 62.42 N ATOM 127 CA LEU A 26 3.408 -14.606 1.441 1.00 72.33 C ATOM 128 C LEU A 26 4.220 -13.411 1.828 1.00 73.15 C ATOM 129 O LEU A 26 3.669 -12.385 2.191 1.00 74.24 O ATOM 130 CB LEU A 26 2.890 -14.491 0.007 1.00 4.32 C ATOM 131 CG LEU A 26 3.925 -14.503 -1.105 1.00 32.42 C ATOM 132 CD1 LEU A 26 4.734 -15.789 -1.064 1.00 73.40 C ATOM 133 CD2 LEU A 26 3.232 -14.365 -2.442 1.00 51.22 C ATOM 0 H LEU A 26 1.820 -13.800 2.475 1.00 62.42 H new ATOM 0 HA LEU A 26 4.037 -15.494 1.505 1.00 72.33 H new ATOM 0 HB2 LEU A 26 2.195 -15.312 -0.169 1.00 4.32 H new ATOM 0 HB3 LEU A 26 2.318 -13.567 -0.073 1.00 4.32 H new ATOM 0 HG LEU A 26 4.607 -13.664 -0.964 1.00 32.42 H new ATOM 0 HD11 LEU A 26 5.471 -15.781 -1.867 1.00 73.40 H new ATOM 0 HD12 LEU A 26 5.245 -15.867 -0.104 1.00 73.40 H new ATOM 0 HD13 LEU A 26 4.068 -16.642 -1.191 1.00 73.40 H new ATOM 0 HD21 LEU A 26 3.975 -14.374 -3.240 1.00 51.22 H new ATOM 0 HD22 LEU A 26 2.541 -15.196 -2.581 1.00 51.22 H new ATOM 0 HD23 LEU A 26 2.680 -13.425 -2.470 1.00 51.22 H new ATOM 145 N GLU A 27 5.503 -13.537 1.797 1.00 61.33 N ATOM 146 CA GLU A 27 6.361 -12.468 2.215 1.00 52.01 C ATOM 147 C GLU A 27 7.413 -12.223 1.162 1.00 30.23 C ATOM 148 O GLU A 27 7.932 -13.169 0.564 1.00 1.51 O ATOM 149 CB GLU A 27 6.991 -12.810 3.571 1.00 53.53 C ATOM 150 CG GLU A 27 5.957 -13.064 4.667 1.00 53.24 C ATOM 151 CD GLU A 27 6.567 -13.475 5.967 1.00 64.20 C ATOM 152 OE1 GLU A 27 6.941 -12.597 6.754 1.00 40.23 O ATOM 153 OE2 GLU A 27 6.672 -14.686 6.228 1.00 4.32 O ATOM 0 H GLU A 27 5.990 -14.377 1.484 1.00 61.33 H new ATOM 0 HA GLU A 27 5.782 -11.552 2.335 1.00 52.01 H new ATOM 0 HB2 GLU A 27 7.619 -13.694 3.460 1.00 53.53 H new ATOM 0 HB3 GLU A 27 7.643 -11.993 3.878 1.00 53.53 H new ATOM 0 HG2 GLU A 27 5.368 -12.159 4.819 1.00 53.24 H new ATOM 0 HG3 GLU A 27 5.268 -13.840 4.335 1.00 53.24 H new ATOM 160 N THR A 28 7.712 -10.984 0.923 1.00 32.33 N ATOM 161 CA THR A 28 8.665 -10.619 -0.079 1.00 52.42 C ATOM 162 C THR A 28 9.332 -9.313 0.335 1.00 75.11 C ATOM 163 O THR A 28 8.775 -8.551 1.135 1.00 43.01 O ATOM 164 CB THR A 28 7.970 -10.459 -1.482 1.00 71.20 C ATOM 165 OG1 THR A 28 8.941 -10.238 -2.504 1.00 0.13 O ATOM 166 CG2 THR A 28 6.971 -9.295 -1.488 1.00 11.13 C ATOM 0 H THR A 28 7.300 -10.194 1.419 1.00 32.33 H new ATOM 0 HA THR A 28 9.414 -11.405 -0.169 1.00 52.42 H new ATOM 0 HB THR A 28 7.432 -11.387 -1.678 1.00 71.20 H new ATOM 0 HG1 THR A 28 8.490 -10.143 -3.369 1.00 0.13 H new ATOM 0 HG21 THR A 28 6.511 -9.215 -2.473 1.00 11.13 H new ATOM 0 HG22 THR A 28 6.199 -9.475 -0.740 1.00 11.13 H new ATOM 0 HG23 THR A 28 7.493 -8.367 -1.255 1.00 11.13 H new ATOM 174 N ASP A 29 10.502 -9.066 -0.160 1.00 53.15 N ATOM 175 CA ASP A 29 11.178 -7.837 0.130 1.00 45.05 C ATOM 176 C ASP A 29 11.529 -7.142 -1.163 1.00 64.33 C ATOM 177 O ASP A 29 12.263 -7.673 -2.002 1.00 45.01 O ATOM 178 CB ASP A 29 12.407 -8.035 1.062 1.00 11.22 C ATOM 179 CG ASP A 29 13.525 -8.887 0.490 1.00 62.24 C ATOM 180 OD1 ASP A 29 13.377 -10.122 0.410 1.00 64.24 O ATOM 181 OD2 ASP A 29 14.581 -8.333 0.131 1.00 31.52 O ATOM 0 H ASP A 29 11.014 -9.702 -0.771 1.00 53.15 H new ATOM 0 HA ASP A 29 10.503 -7.193 0.694 1.00 45.05 H new ATOM 0 HB2 ASP A 29 12.812 -7.055 1.314 1.00 11.22 H new ATOM 0 HB3 ASP A 29 12.067 -8.489 1.993 1.00 11.22 H new ATOM 186 N VAL A 30 10.969 -5.975 -1.335 1.00 23.25 N ATOM 187 CA VAL A 30 11.140 -5.206 -2.543 1.00 54.24 C ATOM 188 C VAL A 30 12.046 -4.033 -2.260 1.00 74.03 C ATOM 189 O VAL A 30 11.914 -3.378 -1.230 1.00 2.04 O ATOM 190 CB VAL A 30 9.770 -4.682 -3.082 1.00 71.13 C ATOM 191 CG1 VAL A 30 9.958 -3.833 -4.317 1.00 25.22 C ATOM 192 CG2 VAL A 30 8.829 -5.831 -3.393 1.00 14.33 C ATOM 0 H VAL A 30 10.376 -5.526 -0.637 1.00 23.25 H new ATOM 0 HA VAL A 30 11.581 -5.853 -3.302 1.00 54.24 H new ATOM 0 HB VAL A 30 9.329 -4.068 -2.297 1.00 71.13 H new ATOM 0 HG11 VAL A 30 8.988 -3.483 -4.669 1.00 25.22 H new ATOM 0 HG12 VAL A 30 10.588 -2.976 -4.077 1.00 25.22 H new ATOM 0 HG13 VAL A 30 10.434 -4.426 -5.097 1.00 25.22 H new ATOM 0 HG21 VAL A 30 7.884 -5.436 -3.766 1.00 14.33 H new ATOM 0 HG22 VAL A 30 9.278 -6.474 -4.150 1.00 14.33 H new ATOM 0 HG23 VAL A 30 8.648 -6.409 -2.487 1.00 14.33 H new ATOM 202 N GLU A 31 12.958 -3.768 -3.150 1.00 41.21 N ATOM 203 CA GLU A 31 13.869 -2.675 -2.951 1.00 3.10 C ATOM 204 C GLU A 31 13.280 -1.434 -3.572 1.00 22.32 C ATOM 205 O GLU A 31 12.632 -1.505 -4.627 1.00 44.41 O ATOM 206 CB GLU A 31 15.244 -2.891 -3.606 1.00 5.40 C ATOM 207 CG GLU A 31 15.910 -4.253 -3.443 1.00 40.24 C ATOM 208 CD GLU A 31 15.222 -5.341 -4.220 1.00 34.11 C ATOM 209 OE1 GLU A 31 15.111 -5.215 -5.468 1.00 14.11 O ATOM 210 OE2 GLU A 31 14.809 -6.343 -3.622 1.00 70.41 O ATOM 0 H GLU A 31 13.092 -4.289 -4.016 1.00 41.21 H new ATOM 0 HA GLU A 31 14.013 -2.589 -1.874 1.00 3.10 H new ATOM 0 HB2 GLU A 31 15.139 -2.696 -4.673 1.00 5.40 H new ATOM 0 HB3 GLU A 31 15.924 -2.137 -3.210 1.00 5.40 H new ATOM 0 HG2 GLU A 31 16.949 -4.184 -3.767 1.00 40.24 H new ATOM 0 HG3 GLU A 31 15.922 -4.521 -2.387 1.00 40.24 H new ATOM 217 N ILE A 32 13.474 -0.330 -2.938 1.00 71.02 N ATOM 218 CA ILE A 32 13.078 0.927 -3.492 1.00 2.43 C ATOM 219 C ILE A 32 14.302 1.812 -3.607 1.00 22.13 C ATOM 220 O ILE A 32 15.366 1.482 -3.067 1.00 34.21 O ATOM 221 CB ILE A 32 11.945 1.639 -2.678 1.00 22.03 C ATOM 222 CG1 ILE A 32 12.365 1.875 -1.213 1.00 5.21 C ATOM 223 CG2 ILE A 32 10.638 0.849 -2.766 1.00 63.42 C ATOM 224 CD1 ILE A 32 11.325 2.591 -0.363 1.00 74.23 C ATOM 0 H ILE A 32 13.912 -0.268 -2.019 1.00 71.02 H new ATOM 0 HA ILE A 32 12.650 0.738 -4.476 1.00 2.43 H new ATOM 0 HB ILE A 32 11.776 2.619 -3.124 1.00 22.03 H new ATOM 0 HG12 ILE A 32 12.590 0.912 -0.754 1.00 5.21 H new ATOM 0 HG13 ILE A 32 13.287 2.457 -1.202 1.00 5.21 H new ATOM 0 HG21 ILE A 32 9.864 1.361 -2.194 1.00 63.42 H new ATOM 0 HG22 ILE A 32 10.328 0.773 -3.808 1.00 63.42 H new ATOM 0 HG23 ILE A 32 10.789 -0.151 -2.359 1.00 63.42 H new ATOM 0 HD11 ILE A 32 11.706 2.714 0.651 1.00 74.23 H new ATOM 0 HD12 ILE A 32 11.115 3.570 -0.793 1.00 74.23 H new ATOM 0 HD13 ILE A 32 10.408 2.002 -0.337 1.00 74.23 H new ATOM 236 N LYS A 33 14.174 2.887 -4.308 1.00 50.50 N ATOM 237 CA LYS A 33 15.243 3.827 -4.506 1.00 11.33 C ATOM 238 C LYS A 33 15.014 4.998 -3.584 1.00 41.42 C ATOM 239 O LYS A 33 15.943 5.734 -3.225 1.00 22.04 O ATOM 240 CB LYS A 33 15.278 4.280 -5.966 1.00 5.02 C ATOM 241 CG LYS A 33 15.488 3.130 -6.936 1.00 43.51 C ATOM 242 CD LYS A 33 15.479 3.586 -8.381 1.00 32.43 C ATOM 243 CE LYS A 33 15.670 2.404 -9.325 1.00 4.32 C ATOM 244 NZ LYS A 33 16.969 1.718 -9.110 1.00 71.31 N ATOM 0 H LYS A 33 13.305 3.150 -4.774 1.00 50.50 H new ATOM 0 HA LYS A 33 16.204 3.366 -4.280 1.00 11.33 H new ATOM 0 HB2 LYS A 33 14.343 4.786 -6.207 1.00 5.02 H new ATOM 0 HB3 LYS A 33 16.078 5.009 -6.096 1.00 5.02 H new ATOM 0 HG2 LYS A 33 16.438 2.642 -6.717 1.00 43.51 H new ATOM 0 HG3 LYS A 33 14.706 2.385 -6.788 1.00 43.51 H new ATOM 0 HD2 LYS A 33 14.536 4.085 -8.603 1.00 32.43 H new ATOM 0 HD3 LYS A 33 16.272 4.316 -8.541 1.00 32.43 H new ATOM 0 HE2 LYS A 33 14.857 1.692 -9.182 1.00 4.32 H new ATOM 0 HE3 LYS A 33 15.611 2.752 -10.356 1.00 4.32 H new ATOM 0 HZ1 LYS A 33 17.164 1.084 -9.911 1.00 71.31 H new ATOM 0 HZ2 LYS A 33 17.727 2.426 -9.036 1.00 71.31 H new ATOM 0 HZ3 LYS A 33 16.927 1.163 -8.232 1.00 71.31 H new ATOM 258 N ALA A 34 13.767 5.158 -3.197 1.00 44.20 N ATOM 259 CA ALA A 34 13.378 6.162 -2.256 1.00 14.02 C ATOM 260 C ALA A 34 13.949 5.843 -0.872 1.00 11.22 C ATOM 261 O ALA A 34 14.315 4.692 -0.573 1.00 21.40 O ATOM 262 CB ALA A 34 11.874 6.270 -2.206 1.00 74.14 C ATOM 0 H ALA A 34 12.994 4.585 -3.535 1.00 44.20 H new ATOM 0 HA ALA A 34 13.781 7.123 -2.576 1.00 14.02 H new ATOM 0 HB1 ALA A 34 11.588 7.037 -1.486 1.00 74.14 H new ATOM 0 HB2 ALA A 34 11.495 6.538 -3.192 1.00 74.14 H new ATOM 0 HB3 ALA A 34 11.450 5.313 -1.903 1.00 74.14 H new ATOM 268 N SER A 35 14.042 6.842 -0.047 1.00 14.21 N ATOM 269 CA SER A 35 14.611 6.685 1.259 1.00 2.13 C ATOM 270 C SER A 35 13.523 6.471 2.309 1.00 3.01 C ATOM 271 O SER A 35 12.485 7.145 2.284 1.00 31.32 O ATOM 272 CB SER A 35 15.424 7.922 1.585 1.00 73.31 C ATOM 273 OG SER A 35 16.360 8.158 0.552 1.00 62.21 O ATOM 0 H SER A 35 13.726 7.788 -0.259 1.00 14.21 H new ATOM 0 HA SER A 35 15.253 5.804 1.269 1.00 2.13 H new ATOM 0 HB2 SER A 35 14.766 8.783 1.697 1.00 73.31 H new ATOM 0 HB3 SER A 35 15.941 7.790 2.535 1.00 73.31 H new ATOM 0 HG SER A 35 16.884 8.959 0.762 1.00 62.21 H new ATOM 279 N ALA A 36 13.775 5.537 3.221 1.00 34.12 N ATOM 280 CA ALA A 36 12.866 5.216 4.337 1.00 53.40 C ATOM 281 C ALA A 36 12.529 6.458 5.153 1.00 22.11 C ATOM 282 O ALA A 36 11.426 6.596 5.677 1.00 61.12 O ATOM 283 CB ALA A 36 13.510 4.176 5.236 1.00 42.32 C ATOM 0 H ALA A 36 14.623 4.971 3.213 1.00 34.12 H new ATOM 0 HA ALA A 36 11.940 4.823 3.918 1.00 53.40 H new ATOM 0 HB1 ALA A 36 12.837 3.940 6.060 1.00 42.32 H new ATOM 0 HB2 ALA A 36 13.710 3.272 4.661 1.00 42.32 H new ATOM 0 HB3 ALA A 36 14.446 4.568 5.633 1.00 42.32 H new ATOM 289 N ASP A 37 13.491 7.356 5.230 1.00 11.03 N ATOM 290 CA ASP A 37 13.358 8.611 5.955 1.00 43.51 C ATOM 291 C ASP A 37 12.149 9.421 5.479 1.00 73.00 C ATOM 292 O ASP A 37 11.390 9.944 6.288 1.00 60.41 O ATOM 293 CB ASP A 37 14.630 9.437 5.795 1.00 24.04 C ATOM 294 CG ASP A 37 14.547 10.779 6.487 1.00 24.14 C ATOM 295 OD1 ASP A 37 14.792 10.850 7.705 1.00 43.54 O ATOM 296 OD2 ASP A 37 14.260 11.781 5.822 1.00 12.25 O ATOM 0 H ASP A 37 14.401 7.236 4.786 1.00 11.03 H new ATOM 0 HA ASP A 37 13.202 8.371 7.007 1.00 43.51 H new ATOM 0 HB2 ASP A 37 15.474 8.877 6.197 1.00 24.04 H new ATOM 0 HB3 ASP A 37 14.826 9.592 4.734 1.00 24.04 H new ATOM 301 N LYS A 38 11.940 9.483 4.172 1.00 11.11 N ATOM 302 CA LYS A 38 10.847 10.277 3.636 1.00 41.11 C ATOM 303 C LYS A 38 9.509 9.643 3.932 1.00 24.14 C ATOM 304 O LYS A 38 8.504 10.334 4.104 1.00 43.01 O ATOM 305 CB LYS A 38 11.001 10.531 2.157 1.00 54.45 C ATOM 306 CG LYS A 38 12.278 11.261 1.824 1.00 65.40 C ATOM 307 CD LYS A 38 12.276 11.760 0.409 1.00 75.33 C ATOM 308 CE LYS A 38 11.238 12.866 0.208 1.00 54.21 C ATOM 309 NZ LYS A 38 11.281 13.439 -1.151 1.00 73.33 N ATOM 0 H LYS A 38 12.504 9.000 3.473 1.00 11.11 H new ATOM 0 HA LYS A 38 10.886 11.243 4.139 1.00 41.11 H new ATOM 0 HB2 LYS A 38 10.981 9.580 1.625 1.00 54.45 H new ATOM 0 HB3 LYS A 38 10.151 11.113 1.802 1.00 54.45 H new ATOM 0 HG2 LYS A 38 12.406 12.101 2.507 1.00 65.40 H new ATOM 0 HG3 LYS A 38 13.128 10.596 1.975 1.00 65.40 H new ATOM 0 HD2 LYS A 38 13.266 12.137 0.153 1.00 75.33 H new ATOM 0 HD3 LYS A 38 12.065 10.933 -0.270 1.00 75.33 H new ATOM 0 HE2 LYS A 38 10.243 12.465 0.399 1.00 54.21 H new ATOM 0 HE3 LYS A 38 11.408 13.657 0.938 1.00 54.21 H new ATOM 0 HZ1 LYS A 38 10.857 14.389 -1.141 1.00 73.33 H new ATOM 0 HZ2 LYS A 38 12.269 13.504 -1.469 1.00 73.33 H new ATOM 0 HZ3 LYS A 38 10.747 12.829 -1.802 1.00 73.33 H new ATOM 323 N PHE A 39 9.511 8.322 4.017 1.00 55.32 N ATOM 324 CA PHE A 39 8.322 7.561 4.349 1.00 63.14 C ATOM 325 C PHE A 39 7.910 7.940 5.775 1.00 73.14 C ATOM 326 O PHE A 39 6.734 8.195 6.061 1.00 65.24 O ATOM 327 CB PHE A 39 8.649 6.055 4.251 1.00 3.25 C ATOM 328 CG PHE A 39 7.478 5.121 4.422 1.00 73.31 C ATOM 329 CD1 PHE A 39 7.025 4.765 5.687 1.00 65.35 C ATOM 330 CD2 PHE A 39 6.834 4.597 3.315 1.00 52.34 C ATOM 331 CE1 PHE A 39 5.954 3.908 5.837 1.00 51.11 C ATOM 332 CE2 PHE A 39 5.762 3.738 3.459 1.00 71.21 C ATOM 333 CZ PHE A 39 5.322 3.394 4.722 1.00 32.54 C ATOM 0 H PHE A 39 10.339 7.749 3.857 1.00 55.32 H new ATOM 0 HA PHE A 39 7.503 7.779 3.664 1.00 63.14 H new ATOM 0 HB2 PHE A 39 9.105 5.863 3.280 1.00 3.25 H new ATOM 0 HB3 PHE A 39 9.396 5.814 5.007 1.00 3.25 H new ATOM 0 HD1 PHE A 39 7.517 5.164 6.562 1.00 65.35 H new ATOM 0 HD2 PHE A 39 7.174 4.863 2.325 1.00 52.34 H new ATOM 0 HE1 PHE A 39 5.610 3.640 6.825 1.00 51.11 H new ATOM 0 HE2 PHE A 39 5.269 3.336 2.586 1.00 71.21 H new ATOM 0 HZ PHE A 39 4.484 2.723 4.838 1.00 32.54 H new ATOM 343 N HIS A 40 8.914 8.008 6.638 1.00 2.33 N ATOM 344 CA HIS A 40 8.770 8.384 8.039 1.00 75.40 C ATOM 345 C HIS A 40 8.175 9.806 8.141 1.00 34.13 C ATOM 346 O HIS A 40 7.217 10.039 8.873 1.00 42.41 O ATOM 347 CB HIS A 40 10.171 8.354 8.692 1.00 50.25 C ATOM 348 CG HIS A 40 10.228 8.512 10.190 1.00 62.32 C ATOM 349 ND1 HIS A 40 9.790 9.492 11.019 1.00 51.21 N flip ATOM 350 CD2 HIS A 40 10.877 7.613 10.992 1.00 70.32 C flip ATOM 351 CE1 HIS A 40 10.188 9.155 12.283 1.00 13.44 C flip ATOM 352 NE2 HIS A 40 10.842 8.019 12.233 1.00 71.34 N flip ATOM 0 H HIS A 40 9.877 7.798 6.377 1.00 2.33 H new ATOM 0 HA HIS A 40 8.101 7.690 8.549 1.00 75.40 H new ATOM 0 HB2 HIS A 40 10.646 7.408 8.432 1.00 50.25 H new ATOM 0 HB3 HIS A 40 10.771 9.146 8.244 1.00 50.25 H new ATOM 0 HD2 HIS A 40 11.348 6.703 10.650 1.00 70.32 H new ATOM 0 HE1 HIS A 40 9.995 9.730 13.177 1.00 13.44 H new ATOM 0 HE2 HIS A 40 11.254 7.534 13.030 1.00 71.34 H new ATOM 361 N HIS A 41 8.753 10.741 7.385 1.00 64.45 N ATOM 362 CA HIS A 41 8.325 12.157 7.421 1.00 13.31 C ATOM 363 C HIS A 41 6.920 12.378 6.894 1.00 3.42 C ATOM 364 O HIS A 41 6.133 13.108 7.512 1.00 50.45 O ATOM 365 CB HIS A 41 9.293 13.095 6.666 1.00 10.01 C ATOM 366 CG HIS A 41 10.605 13.366 7.337 1.00 41.22 C ATOM 367 ND1 HIS A 41 11.679 12.586 7.529 1.00 12.51 N flip ATOM 368 CD2 HIS A 41 10.943 14.596 7.849 1.00 21.23 C flip ATOM 369 CE1 HIS A 41 12.636 13.345 8.136 1.00 40.34 C flip ATOM 370 NE2 HIS A 41 12.164 14.554 8.319 1.00 2.34 N flip ATOM 0 H HIS A 41 9.519 10.552 6.738 1.00 64.45 H new ATOM 0 HA HIS A 41 8.338 12.409 8.481 1.00 13.31 H new ATOM 0 HB2 HIS A 41 9.492 12.665 5.684 1.00 10.01 H new ATOM 0 HB3 HIS A 41 8.789 14.047 6.501 1.00 10.01 H new ATOM 0 HD1 HIS A 41 11.765 11.604 7.268 1.00 12.51 H new ATOM 0 HD2 HIS A 41 10.300 15.464 7.862 1.00 21.23 H new ATOM 0 HE1 HIS A 41 13.621 13.005 8.419 1.00 40.34 H new ATOM 379 N MET A 42 6.590 11.747 5.774 1.00 60.11 N ATOM 380 CA MET A 42 5.310 12.009 5.103 1.00 61.12 C ATOM 381 C MET A 42 4.093 11.582 5.921 1.00 12.40 C ATOM 382 O MET A 42 2.998 12.108 5.716 1.00 14.54 O ATOM 383 CB MET A 42 5.228 11.381 3.706 1.00 13.43 C ATOM 384 CG MET A 42 5.152 9.864 3.692 1.00 74.22 C ATOM 385 SD MET A 42 4.910 9.212 2.033 1.00 53.42 S ATOM 386 CE MET A 42 4.778 7.460 2.371 1.00 60.24 C ATOM 0 H MET A 42 7.180 11.056 5.310 1.00 60.11 H new ATOM 0 HA MET A 42 5.284 13.094 5.001 1.00 61.12 H new ATOM 0 HB2 MET A 42 4.351 11.779 3.195 1.00 13.43 H new ATOM 0 HB3 MET A 42 6.100 11.692 3.132 1.00 13.43 H new ATOM 0 HG2 MET A 42 6.069 9.452 4.112 1.00 74.22 H new ATOM 0 HG3 MET A 42 4.333 9.537 4.332 1.00 74.22 H new ATOM 0 HE1 MET A 42 5.247 6.897 1.564 1.00 60.24 H new ATOM 0 HE2 MET A 42 5.280 7.232 3.311 1.00 60.24 H new ATOM 0 HE3 MET A 42 3.727 7.182 2.444 1.00 60.24 H new ATOM 396 N PHE A 43 4.256 10.644 6.834 1.00 33.03 N ATOM 397 CA PHE A 43 3.104 10.188 7.593 1.00 72.41 C ATOM 398 C PHE A 43 3.083 10.825 8.995 1.00 32.51 C ATOM 399 O PHE A 43 2.226 10.547 9.811 1.00 51.24 O ATOM 400 CB PHE A 43 3.038 8.643 7.652 1.00 71.24 C ATOM 401 CG PHE A 43 1.706 8.124 8.154 1.00 50.40 C ATOM 402 CD1 PHE A 43 0.619 8.057 7.298 1.00 43.02 C ATOM 403 CD2 PHE A 43 1.535 7.738 9.472 1.00 11.44 C ATOM 404 CE1 PHE A 43 -0.607 7.611 7.745 1.00 25.42 C ATOM 405 CE2 PHE A 43 0.310 7.296 9.925 1.00 0.34 C ATOM 406 CZ PHE A 43 -0.762 7.231 9.061 1.00 11.54 C ATOM 0 H PHE A 43 5.142 10.195 7.065 1.00 33.03 H new ATOM 0 HA PHE A 43 2.205 10.519 7.073 1.00 72.41 H new ATOM 0 HB2 PHE A 43 3.227 8.239 6.657 1.00 71.24 H new ATOM 0 HB3 PHE A 43 3.832 8.276 8.302 1.00 71.24 H new ATOM 0 HD1 PHE A 43 0.733 8.358 6.267 1.00 43.02 H new ATOM 0 HD2 PHE A 43 2.371 7.784 10.154 1.00 11.44 H new ATOM 0 HE1 PHE A 43 -1.444 7.560 7.065 1.00 25.42 H new ATOM 0 HE2 PHE A 43 0.190 7.001 10.957 1.00 0.34 H new ATOM 0 HZ PHE A 43 -1.721 6.883 9.414 1.00 11.54 H new ATOM 416 N ALA A 44 4.004 11.730 9.248 1.00 72.45 N ATOM 417 CA ALA A 44 4.070 12.405 10.551 1.00 74.33 C ATOM 418 C ALA A 44 3.019 13.543 10.642 1.00 55.22 C ATOM 419 O ALA A 44 3.118 14.455 11.473 1.00 64.13 O ATOM 420 CB ALA A 44 5.472 12.935 10.771 1.00 54.20 C ATOM 0 H ALA A 44 4.718 12.022 8.581 1.00 72.45 H new ATOM 0 HA ALA A 44 3.836 11.687 11.337 1.00 74.33 H new ATOM 0 HB1 ALA A 44 5.524 13.437 11.737 1.00 54.20 H new ATOM 0 HB2 ALA A 44 6.181 12.107 10.753 1.00 54.20 H new ATOM 0 HB3 ALA A 44 5.721 13.643 9.981 1.00 54.20 H new ATOM 426 N GLY A 45 2.002 13.433 9.822 1.00 75.11 N ATOM 427 CA GLY A 45 0.958 14.393 9.745 1.00 73.51 C ATOM 428 C GLY A 45 0.237 14.233 8.444 1.00 52.10 C ATOM 429 O GLY A 45 0.089 13.110 7.954 1.00 32.35 O ATOM 0 H GLY A 45 1.886 12.650 9.179 1.00 75.11 H new ATOM 0 HA2 GLY A 45 0.266 14.262 10.577 1.00 73.51 H new ATOM 0 HA3 GLY A 45 1.367 15.400 9.826 1.00 73.51 H new ATOM 433 N LYS A 46 -0.178 15.319 7.872 1.00 60.14 N ATOM 434 CA LYS A 46 -0.852 15.310 6.597 1.00 15.55 C ATOM 435 C LYS A 46 -0.477 16.575 5.850 1.00 30.14 C ATOM 436 O LYS A 46 -0.236 17.610 6.475 1.00 3.11 O ATOM 437 CB LYS A 46 -2.413 15.177 6.730 1.00 61.52 C ATOM 438 CG LYS A 46 -3.144 16.335 7.426 1.00 11.24 C ATOM 439 CD LYS A 46 -2.765 16.453 8.884 1.00 4.42 C ATOM 440 CE LYS A 46 -3.413 17.645 9.535 1.00 74.03 C ATOM 441 NZ LYS A 46 -2.987 17.777 10.939 1.00 21.00 N ATOM 0 H LYS A 46 -0.061 16.249 8.274 1.00 60.14 H new ATOM 0 HA LYS A 46 -0.528 14.429 6.043 1.00 15.55 H new ATOM 0 HB2 LYS A 46 -2.832 15.061 5.730 1.00 61.52 H new ATOM 0 HB3 LYS A 46 -2.632 14.259 7.275 1.00 61.52 H new ATOM 0 HG2 LYS A 46 -2.911 17.269 6.915 1.00 11.24 H new ATOM 0 HG3 LYS A 46 -4.221 16.186 7.343 1.00 11.24 H new ATOM 0 HD2 LYS A 46 -3.060 15.546 9.411 1.00 4.42 H new ATOM 0 HD3 LYS A 46 -1.682 16.535 8.973 1.00 4.42 H new ATOM 0 HE2 LYS A 46 -3.153 18.550 8.986 1.00 74.03 H new ATOM 0 HE3 LYS A 46 -4.497 17.545 9.488 1.00 74.03 H new ATOM 0 HZ1 LYS A 46 -3.448 18.606 11.365 1.00 21.00 H new ATOM 0 HZ2 LYS A 46 -3.257 16.922 11.466 1.00 21.00 H new ATOM 0 HZ3 LYS A 46 -1.955 17.896 10.979 1.00 21.00 H new ATOM 455 N PRO A 47 -0.386 16.513 4.525 1.00 2.20 N ATOM 456 CA PRO A 47 -0.020 17.668 3.718 1.00 0.34 C ATOM 457 C PRO A 47 -1.169 18.668 3.600 1.00 71.24 C ATOM 458 O PRO A 47 -2.305 18.403 4.032 1.00 21.05 O ATOM 459 CB PRO A 47 0.284 17.052 2.350 1.00 31.13 C ATOM 460 CG PRO A 47 -0.583 15.846 2.291 1.00 12.22 C ATOM 461 CD PRO A 47 -0.630 15.311 3.694 1.00 11.40 C ATOM 0 HA PRO A 47 0.811 18.227 4.148 1.00 0.34 H new ATOM 0 HB2 PRO A 47 0.056 17.746 1.541 1.00 31.13 H new ATOM 0 HB3 PRO A 47 1.338 16.790 2.257 1.00 31.13 H new ATOM 0 HG2 PRO A 47 -1.582 16.099 1.935 1.00 12.22 H new ATOM 0 HG3 PRO A 47 -0.177 15.105 1.603 1.00 12.22 H new ATOM 0 HD2 PRO A 47 -1.594 14.855 3.919 1.00 11.40 H new ATOM 0 HD3 PRO A 47 0.130 14.547 3.859 1.00 11.40 H new ATOM 469 N HIS A 48 -0.880 19.806 3.020 1.00 51.13 N ATOM 470 CA HIS A 48 -1.886 20.814 2.792 1.00 31.22 C ATOM 471 C HIS A 48 -2.637 20.484 1.532 1.00 31.32 C ATOM 472 O HIS A 48 -2.179 20.750 0.413 1.00 30.30 O ATOM 473 CB HIS A 48 -1.297 22.232 2.759 1.00 42.13 C ATOM 474 CG HIS A 48 -0.812 22.717 4.095 1.00 4.13 C ATOM 475 ND1 HIS A 48 -1.483 23.657 4.840 1.00 14.32 N ATOM 476 CD2 HIS A 48 0.287 22.395 4.816 1.00 22.51 C ATOM 477 CE1 HIS A 48 -0.823 23.888 5.952 1.00 51.31 C ATOM 478 NE2 HIS A 48 0.250 23.138 5.962 1.00 41.40 N ATOM 0 H HIS A 48 0.053 20.059 2.694 1.00 51.13 H new ATOM 0 HA HIS A 48 -2.582 20.808 3.631 1.00 31.22 H new ATOM 0 HB2 HIS A 48 -0.468 22.255 2.052 1.00 42.13 H new ATOM 0 HB3 HIS A 48 -2.054 22.921 2.385 1.00 42.13 H new ATOM 0 HD2 HIS A 48 1.051 21.684 4.538 1.00 22.51 H new ATOM 0 HE1 HIS A 48 -1.116 24.580 6.727 1.00 51.31 H new ATOM 0 HE2 HIS A 48 0.947 23.112 6.706 1.00 41.40 H new ATOM 487 N HIS A 49 -3.760 19.862 1.712 1.00 43.03 N ATOM 488 CA HIS A 49 -4.550 19.375 0.622 1.00 14.11 C ATOM 489 C HIS A 49 -5.846 20.143 0.555 1.00 44.05 C ATOM 490 O HIS A 49 -6.631 20.143 1.508 1.00 42.41 O ATOM 491 CB HIS A 49 -4.812 17.866 0.825 1.00 63.32 C ATOM 492 CG HIS A 49 -5.586 17.167 -0.273 1.00 13.33 C ATOM 493 ND1 HIS A 49 -4.995 16.340 -1.203 1.00 45.23 N ATOM 494 CD2 HIS A 49 -6.912 17.134 -0.546 1.00 75.10 C ATOM 495 CE1 HIS A 49 -5.916 15.832 -1.992 1.00 3.23 C ATOM 496 NE2 HIS A 49 -7.088 16.297 -1.612 1.00 3.13 N ATOM 0 H HIS A 49 -4.160 19.675 2.631 1.00 43.03 H new ATOM 0 HA HIS A 49 -4.020 19.516 -0.320 1.00 14.11 H new ATOM 0 HB2 HIS A 49 -3.851 17.364 0.939 1.00 63.32 H new ATOM 0 HB3 HIS A 49 -5.353 17.736 1.762 1.00 63.32 H new ATOM 0 HD2 HIS A 49 -7.687 17.670 -0.019 1.00 75.10 H new ATOM 0 HE1 HIS A 49 -5.741 15.150 -2.811 1.00 3.23 H new ATOM 0 HE2 HIS A 49 -7.983 16.069 -2.044 1.00 3.13 H new ATOM 505 N VAL A 50 -6.068 20.794 -0.545 1.00 71.11 N ATOM 506 CA VAL A 50 -7.288 21.516 -0.753 1.00 43.10 C ATOM 507 C VAL A 50 -8.336 20.556 -1.260 1.00 64.54 C ATOM 508 O VAL A 50 -8.040 19.653 -2.050 1.00 61.22 O ATOM 509 CB VAL A 50 -7.124 22.723 -1.717 1.00 73.32 C ATOM 510 CG1 VAL A 50 -6.201 23.765 -1.105 1.00 61.11 C ATOM 511 CG2 VAL A 50 -6.576 22.272 -3.064 1.00 20.02 C ATOM 0 H VAL A 50 -5.411 20.841 -1.324 1.00 71.11 H new ATOM 0 HA VAL A 50 -7.597 21.943 0.201 1.00 43.10 H new ATOM 0 HB VAL A 50 -8.107 23.166 -1.875 1.00 73.32 H new ATOM 0 HG11 VAL A 50 -6.095 24.605 -1.791 1.00 61.11 H new ATOM 0 HG12 VAL A 50 -6.623 24.117 -0.163 1.00 61.11 H new ATOM 0 HG13 VAL A 50 -5.223 23.321 -0.921 1.00 61.11 H new ATOM 0 HG21 VAL A 50 -6.470 23.135 -3.721 1.00 20.02 H new ATOM 0 HG22 VAL A 50 -5.603 21.803 -2.922 1.00 20.02 H new ATOM 0 HG23 VAL A 50 -7.262 21.555 -3.514 1.00 20.02 H new ATOM 521 N SER A 51 -9.522 20.715 -0.807 1.00 64.55 N ATOM 522 CA SER A 51 -10.560 19.817 -1.147 1.00 24.15 C ATOM 523 C SER A 51 -11.815 20.650 -1.350 1.00 40.43 C ATOM 524 O SER A 51 -11.740 21.881 -1.274 1.00 51.04 O ATOM 525 CB SER A 51 -10.700 18.797 -0.003 1.00 1.23 C ATOM 526 OG SER A 51 -11.547 17.721 -0.336 1.00 34.22 O ATOM 0 H SER A 51 -9.802 21.475 -0.187 1.00 64.55 H new ATOM 0 HA SER A 51 -10.364 19.257 -2.061 1.00 24.15 H new ATOM 0 HB2 SER A 51 -9.714 18.411 0.257 1.00 1.23 H new ATOM 0 HB3 SER A 51 -11.089 19.300 0.882 1.00 1.23 H new ATOM 0 HG SER A 51 -11.005 16.946 -0.594 1.00 34.22 H new ATOM 532 N LYS A 52 -12.943 20.025 -1.613 1.00 34.21 N ATOM 533 CA LYS A 52 -14.144 20.779 -1.863 1.00 61.42 C ATOM 534 C LYS A 52 -14.656 21.433 -0.608 1.00 3.32 C ATOM 535 O LYS A 52 -14.911 20.773 0.400 1.00 5.31 O ATOM 536 CB LYS A 52 -15.211 19.948 -2.551 1.00 64.10 C ATOM 537 CG LYS A 52 -16.505 20.702 -2.797 1.00 73.22 C ATOM 538 CD LYS A 52 -17.426 19.941 -3.711 1.00 31.41 C ATOM 539 CE LYS A 52 -16.835 19.842 -5.108 1.00 34.25 C ATOM 540 NZ LYS A 52 -17.743 19.160 -6.043 1.00 70.11 N ATOM 0 H LYS A 52 -13.050 19.012 -1.658 1.00 34.21 H new ATOM 0 HA LYS A 52 -13.882 21.577 -2.558 1.00 61.42 H new ATOM 0 HB2 LYS A 52 -14.822 19.590 -3.504 1.00 64.10 H new ATOM 0 HB3 LYS A 52 -15.423 19.069 -1.943 1.00 64.10 H new ATOM 0 HG2 LYS A 52 -17.006 20.886 -1.846 1.00 73.22 H new ATOM 0 HG3 LYS A 52 -16.282 21.676 -3.233 1.00 73.22 H new ATOM 0 HD2 LYS A 52 -17.598 18.941 -3.312 1.00 31.41 H new ATOM 0 HD3 LYS A 52 -18.395 20.438 -3.755 1.00 31.41 H new ATOM 0 HE2 LYS A 52 -16.615 20.843 -5.481 1.00 34.25 H new ATOM 0 HE3 LYS A 52 -15.888 19.303 -5.064 1.00 34.25 H new ATOM 0 HZ1 LYS A 52 -17.302 19.114 -6.984 1.00 70.11 H new ATOM 0 HZ2 LYS A 52 -17.933 18.196 -5.702 1.00 70.11 H new ATOM 0 HZ3 LYS A 52 -18.637 19.687 -6.106 1.00 70.11 H new ATOM 554 N ALA A 53 -14.796 22.722 -0.686 1.00 4.03 N ATOM 555 CA ALA A 53 -15.186 23.533 0.430 1.00 44.24 C ATOM 556 C ALA A 53 -16.643 23.345 0.761 1.00 32.51 C ATOM 557 O ALA A 53 -17.529 23.742 -0.009 1.00 61.23 O ATOM 558 CB ALA A 53 -14.894 24.988 0.141 1.00 32.32 C ATOM 0 H ALA A 53 -14.639 23.251 -1.544 1.00 4.03 H new ATOM 0 HA ALA A 53 -14.605 23.219 1.297 1.00 44.24 H new ATOM 0 HB1 ALA A 53 -15.194 25.596 0.995 1.00 32.32 H new ATOM 0 HB2 ALA A 53 -13.827 25.116 -0.039 1.00 32.32 H new ATOM 0 HB3 ALA A 53 -15.451 25.302 -0.742 1.00 32.32 H new ATOM 564 N SER A 54 -16.906 22.708 1.861 1.00 53.13 N ATOM 565 CA SER A 54 -18.249 22.525 2.327 1.00 13.21 C ATOM 566 C SER A 54 -18.274 22.470 3.852 1.00 61.03 C ATOM 567 O SER A 54 -18.210 21.394 4.438 1.00 32.05 O ATOM 568 CB SER A 54 -18.883 21.259 1.722 1.00 40.44 C ATOM 569 OG SER A 54 -18.865 21.315 0.296 1.00 22.23 O ATOM 0 H SER A 54 -16.193 22.298 2.464 1.00 53.13 H new ATOM 0 HA SER A 54 -18.843 23.378 1.999 1.00 13.21 H new ATOM 0 HB2 SER A 54 -18.341 20.377 2.063 1.00 40.44 H new ATOM 0 HB3 SER A 54 -19.910 21.157 2.074 1.00 40.44 H new ATOM 0 HG SER A 54 -19.271 20.501 -0.068 1.00 22.23 H new ATOM 575 N PRO A 55 -18.289 23.640 4.516 1.00 22.01 N ATOM 576 CA PRO A 55 -18.347 23.712 5.967 1.00 13.12 C ATOM 577 C PRO A 55 -19.738 23.348 6.471 1.00 72.34 C ATOM 578 O PRO A 55 -20.752 23.589 5.778 1.00 2.32 O ATOM 579 CB PRO A 55 -18.038 25.196 6.280 1.00 4.13 C ATOM 580 CG PRO A 55 -17.587 25.789 4.986 1.00 45.41 C ATOM 581 CD PRO A 55 -18.233 24.976 3.912 1.00 13.14 C ATOM 0 HA PRO A 55 -17.653 23.021 6.446 1.00 13.12 H new ATOM 0 HB2 PRO A 55 -18.921 25.709 6.661 1.00 4.13 H new ATOM 0 HB3 PRO A 55 -17.265 25.284 7.043 1.00 4.13 H new ATOM 0 HG2 PRO A 55 -17.882 26.836 4.913 1.00 45.41 H new ATOM 0 HG3 PRO A 55 -16.501 25.757 4.900 1.00 45.41 H new ATOM 0 HD2 PRO A 55 -19.226 25.350 3.661 1.00 13.14 H new ATOM 0 HD3 PRO A 55 -17.649 24.981 2.992 1.00 13.14 H new ATOM 589 N GLY A 56 -19.798 22.767 7.637 1.00 33.41 N ATOM 590 CA GLY A 56 -21.052 22.398 8.213 1.00 73.52 C ATOM 591 C GLY A 56 -21.562 23.469 9.135 1.00 24.52 C ATOM 592 O GLY A 56 -20.957 24.545 9.245 1.00 12.52 O ATOM 0 H GLY A 56 -18.984 22.539 8.207 1.00 33.41 H new ATOM 0 HA2 GLY A 56 -21.780 22.219 7.422 1.00 73.52 H new ATOM 0 HA3 GLY A 56 -20.942 21.463 8.763 1.00 73.52 H new ATOM 596 N ASN A 57 -22.656 23.208 9.785 1.00 31.22 N ATOM 597 CA ASN A 57 -23.238 24.158 10.702 1.00 63.43 C ATOM 598 C ASN A 57 -22.576 24.035 12.054 1.00 15.13 C ATOM 599 O ASN A 57 -22.827 23.079 12.783 1.00 1.42 O ATOM 600 CB ASN A 57 -24.761 23.946 10.818 1.00 34.30 C ATOM 601 CG ASN A 57 -25.438 24.885 11.817 1.00 31.32 C ATOM 602 OD1 ASN A 57 -25.851 25.992 11.474 1.00 61.33 O ATOM 603 ND2 ASN A 57 -25.582 24.441 13.042 1.00 23.54 N ATOM 0 H ASN A 57 -23.174 22.334 9.699 1.00 31.22 H new ATOM 0 HA ASN A 57 -23.071 25.164 10.318 1.00 63.43 H new ATOM 0 HB2 ASN A 57 -25.214 24.086 9.837 1.00 34.30 H new ATOM 0 HB3 ASN A 57 -24.954 22.915 11.114 1.00 34.30 H new ATOM 0 HD21 ASN A 57 -26.048 25.018 13.742 1.00 23.54 H new ATOM 0 HD22 ASN A 57 -25.228 23.518 13.295 1.00 23.54 H new ATOM 610 N ILE A 58 -21.685 24.977 12.356 1.00 65.01 N ATOM 611 CA ILE A 58 -20.981 25.037 13.651 1.00 62.24 C ATOM 612 C ILE A 58 -20.054 23.777 13.837 1.00 42.24 C ATOM 613 O ILE A 58 -19.666 23.397 14.950 1.00 60.24 O ATOM 614 CB ILE A 58 -22.026 25.198 14.831 1.00 40.13 C ATOM 615 CG1 ILE A 58 -22.963 26.397 14.556 1.00 1.33 C ATOM 616 CG2 ILE A 58 -21.339 25.397 16.182 1.00 54.40 C ATOM 617 CD1 ILE A 58 -22.254 27.738 14.417 1.00 45.42 C ATOM 0 H ILE A 58 -21.425 25.725 11.713 1.00 65.01 H new ATOM 0 HA ILE A 58 -20.332 25.912 13.669 1.00 62.24 H new ATOM 0 HB ILE A 58 -22.604 24.275 14.876 1.00 40.13 H new ATOM 0 HG12 ILE A 58 -23.523 26.201 13.642 1.00 1.33 H new ATOM 0 HG13 ILE A 58 -23.689 26.467 15.366 1.00 1.33 H new ATOM 0 HG21 ILE A 58 -22.093 25.503 16.962 1.00 54.40 H new ATOM 0 HG22 ILE A 58 -20.710 24.534 16.401 1.00 54.40 H new ATOM 0 HG23 ILE A 58 -20.723 26.296 16.148 1.00 54.40 H new ATOM 0 HD11 ILE A 58 -22.989 28.520 14.226 1.00 45.42 H new ATOM 0 HD12 ILE A 58 -21.717 27.963 15.338 1.00 45.42 H new ATOM 0 HD13 ILE A 58 -21.549 27.692 13.587 1.00 45.42 H new ATOM 629 N GLN A 59 -19.681 23.175 12.723 1.00 12.51 N ATOM 630 CA GLN A 59 -18.782 22.026 12.699 1.00 35.12 C ATOM 631 C GLN A 59 -18.287 21.811 11.285 1.00 60.40 C ATOM 632 O GLN A 59 -18.658 22.568 10.382 1.00 2.23 O ATOM 633 CB GLN A 59 -19.453 20.744 13.231 1.00 10.35 C ATOM 634 CG GLN A 59 -20.726 20.332 12.510 1.00 52.23 C ATOM 635 CD GLN A 59 -21.222 18.970 12.965 1.00 4.23 C ATOM 636 OE1 GLN A 59 -20.429 18.105 13.347 1.00 12.52 O ATOM 637 NE2 GLN A 59 -22.510 18.762 12.930 1.00 10.44 N ATOM 0 H GLN A 59 -19.994 23.469 11.798 1.00 12.51 H new ATOM 0 HA GLN A 59 -17.944 22.241 13.362 1.00 35.12 H new ATOM 0 HB2 GLN A 59 -18.737 19.925 13.167 1.00 10.35 H new ATOM 0 HB3 GLN A 59 -19.682 20.885 14.287 1.00 10.35 H new ATOM 0 HG2 GLN A 59 -21.501 21.078 12.687 1.00 52.23 H new ATOM 0 HG3 GLN A 59 -20.544 20.311 11.436 1.00 52.23 H new ATOM 0 HE21 GLN A 59 -23.137 19.499 12.609 1.00 10.44 H new ATOM 0 HE22 GLN A 59 -22.889 17.862 13.224 1.00 10.44 H new ATOM 646 N GLY A 60 -17.459 20.818 11.082 1.00 53.12 N ATOM 647 CA GLY A 60 -16.979 20.543 9.761 1.00 13.03 C ATOM 648 C GLY A 60 -15.593 19.971 9.772 1.00 41.23 C ATOM 649 O GLY A 60 -15.105 19.516 10.812 1.00 22.45 O ATOM 0 H GLY A 60 -17.109 20.195 11.809 1.00 53.12 H new ATOM 0 HA2 GLY A 60 -17.655 19.844 9.268 1.00 13.03 H new ATOM 0 HA3 GLY A 60 -16.987 21.462 9.174 1.00 13.03 H new ATOM 653 N CYS A 61 -14.959 19.996 8.636 1.00 64.32 N ATOM 654 CA CYS A 61 -13.636 19.471 8.475 1.00 70.33 C ATOM 655 C CYS A 61 -12.907 20.313 7.432 1.00 53.14 C ATOM 656 O CYS A 61 -13.549 20.911 6.560 1.00 45.45 O ATOM 657 CB CYS A 61 -13.731 18.004 8.023 1.00 52.52 C ATOM 658 SG CYS A 61 -12.154 17.158 7.837 1.00 73.51 S ATOM 0 H CYS A 61 -15.354 20.389 7.782 1.00 64.32 H new ATOM 0 HA CYS A 61 -13.085 19.510 9.415 1.00 70.33 H new ATOM 0 HB2 CYS A 61 -14.336 17.456 8.745 1.00 52.52 H new ATOM 0 HB3 CYS A 61 -14.260 17.967 7.071 1.00 52.52 H new ATOM 0 HG CYS A 61 -11.925 16.938 6.576 1.00 73.51 H new ATOM 664 N ASP A 62 -11.586 20.390 7.531 1.00 64.11 N ATOM 665 CA ASP A 62 -10.800 21.178 6.575 1.00 20.03 C ATOM 666 C ASP A 62 -10.652 20.398 5.292 1.00 23.31 C ATOM 667 O ASP A 62 -10.934 20.905 4.196 1.00 11.02 O ATOM 668 CB ASP A 62 -9.424 21.529 7.149 1.00 74.14 C ATOM 669 CG ASP A 62 -8.576 22.368 6.208 1.00 4.12 C ATOM 670 OD1 ASP A 62 -8.726 23.608 6.213 1.00 43.25 O ATOM 671 OD2 ASP A 62 -7.722 21.809 5.476 1.00 43.04 O ATOM 0 H ASP A 62 -11.036 19.924 8.253 1.00 64.11 H new ATOM 0 HA ASP A 62 -11.323 22.114 6.375 1.00 20.03 H new ATOM 0 HB2 ASP A 62 -9.556 22.069 8.087 1.00 74.14 H new ATOM 0 HB3 ASP A 62 -8.890 20.608 7.384 1.00 74.14 H new ATOM 676 N LEU A 63 -10.228 19.167 5.424 1.00 63.34 N ATOM 677 CA LEU A 63 -10.122 18.291 4.292 1.00 73.15 C ATOM 678 C LEU A 63 -11.440 17.573 4.106 1.00 11.00 C ATOM 679 O LEU A 63 -11.836 16.766 4.941 1.00 74.11 O ATOM 680 CB LEU A 63 -8.972 17.249 4.429 1.00 63.34 C ATOM 681 CG LEU A 63 -7.507 17.761 4.450 1.00 55.31 C ATOM 682 CD1 LEU A 63 -7.187 18.556 5.707 1.00 24.13 C ATOM 683 CD2 LEU A 63 -6.537 16.605 4.287 1.00 14.42 C ATOM 0 H LEU A 63 -9.950 18.749 6.312 1.00 63.34 H new ATOM 0 HA LEU A 63 -9.883 18.905 3.424 1.00 73.15 H new ATOM 0 HB2 LEU A 63 -9.140 16.689 5.349 1.00 63.34 H new ATOM 0 HB3 LEU A 63 -9.065 16.543 3.604 1.00 63.34 H new ATOM 0 HG LEU A 63 -7.394 18.442 3.606 1.00 55.31 H new ATOM 0 HD11 LEU A 63 -6.150 18.891 5.672 1.00 24.13 H new ATOM 0 HD12 LEU A 63 -7.846 19.422 5.767 1.00 24.13 H new ATOM 0 HD13 LEU A 63 -7.335 17.926 6.584 1.00 24.13 H new ATOM 0 HD21 LEU A 63 -5.515 16.983 4.304 1.00 14.42 H new ATOM 0 HD22 LEU A 63 -6.676 15.896 5.103 1.00 14.42 H new ATOM 0 HD23 LEU A 63 -6.723 16.105 3.337 1.00 14.42 H new ATOM 695 N HIS A 64 -12.137 17.897 3.041 1.00 71.44 N ATOM 696 CA HIS A 64 -13.400 17.244 2.720 1.00 31.51 C ATOM 697 C HIS A 64 -13.101 15.767 2.451 1.00 14.25 C ATOM 698 O HIS A 64 -13.834 14.877 2.881 1.00 14.02 O ATOM 699 CB HIS A 64 -14.016 17.922 1.484 1.00 24.23 C ATOM 700 CG HIS A 64 -15.430 17.531 1.133 1.00 21.43 C ATOM 701 ND1 HIS A 64 -15.933 16.464 0.468 1.00 24.43 N flip ATOM 702 CD2 HIS A 64 -16.505 18.335 1.420 1.00 53.35 C flip ATOM 703 CE1 HIS A 64 -17.287 16.651 0.368 1.00 22.55 C flip ATOM 704 NE2 HIS A 64 -17.608 17.788 0.952 1.00 52.23 N flip ATOM 0 H HIS A 64 -11.853 18.614 2.373 1.00 71.44 H new ATOM 0 HA HIS A 64 -14.114 17.326 3.539 1.00 31.51 H new ATOM 0 HB2 HIS A 64 -13.989 19.001 1.638 1.00 24.23 H new ATOM 0 HB3 HIS A 64 -13.380 17.707 0.625 1.00 24.23 H new ATOM 0 HD2 HIS A 64 -16.454 19.275 1.950 1.00 53.35 H new ATOM 0 HE1 HIS A 64 -17.979 15.975 -0.112 1.00 22.55 H new ATOM 0 HE2 HIS A 64 -18.548 18.177 1.028 1.00 52.23 H new ATOM 713 N GLU A 65 -12.000 15.545 1.748 1.00 4.24 N ATOM 714 CA GLU A 65 -11.447 14.233 1.439 1.00 31.12 C ATOM 715 C GLU A 65 -9.927 14.369 1.451 1.00 62.45 C ATOM 716 O GLU A 65 -9.407 15.450 1.132 1.00 44.32 O ATOM 717 CB GLU A 65 -11.905 13.782 0.046 1.00 33.21 C ATOM 718 CG GLU A 65 -13.401 13.574 -0.081 1.00 30.12 C ATOM 719 CD GLU A 65 -13.834 13.383 -1.500 1.00 72.43 C ATOM 720 OE1 GLU A 65 -14.118 14.383 -2.167 1.00 40.30 O ATOM 721 OE2 GLU A 65 -13.890 12.240 -1.980 1.00 74.32 O ATOM 0 H GLU A 65 -11.443 16.307 1.360 1.00 4.24 H new ATOM 0 HA GLU A 65 -11.784 13.496 2.168 1.00 31.12 H new ATOM 0 HB2 GLU A 65 -11.590 14.526 -0.686 1.00 33.21 H new ATOM 0 HB3 GLU A 65 -11.398 12.851 -0.207 1.00 33.21 H new ATOM 0 HG2 GLU A 65 -13.695 12.703 0.505 1.00 30.12 H new ATOM 0 HG3 GLU A 65 -13.921 14.433 0.342 1.00 30.12 H new ATOM 728 N GLY A 66 -9.220 13.322 1.829 1.00 75.54 N ATOM 729 CA GLY A 66 -7.770 13.391 1.839 1.00 21.51 C ATOM 730 C GLY A 66 -7.144 12.496 2.889 1.00 65.43 C ATOM 731 O GLY A 66 -7.776 11.551 3.362 1.00 11.41 O ATOM 0 H GLY A 66 -9.615 12.430 2.128 1.00 75.54 H new ATOM 0 HA2 GLY A 66 -7.391 13.110 0.856 1.00 21.51 H new ATOM 0 HA3 GLY A 66 -7.462 14.421 2.016 1.00 21.51 H new ATOM 735 N ASP A 67 -5.915 12.798 3.245 1.00 72.45 N ATOM 736 CA ASP A 67 -5.149 12.025 4.227 1.00 61.04 C ATOM 737 C ASP A 67 -5.548 12.423 5.611 1.00 14.14 C ATOM 738 O ASP A 67 -5.568 13.610 5.935 1.00 13.35 O ATOM 739 CB ASP A 67 -3.635 12.272 4.074 1.00 13.44 C ATOM 740 CG ASP A 67 -3.062 11.802 2.765 1.00 33.23 C ATOM 741 OD1 ASP A 67 -3.108 12.569 1.769 1.00 35.35 O ATOM 742 OD2 ASP A 67 -2.547 10.665 2.705 1.00 5.22 O ATOM 0 H ASP A 67 -5.404 13.594 2.863 1.00 72.45 H new ATOM 0 HA ASP A 67 -5.362 10.970 4.053 1.00 61.04 H new ATOM 0 HB2 ASP A 67 -3.440 13.339 4.181 1.00 13.44 H new ATOM 0 HB3 ASP A 67 -3.112 11.769 4.888 1.00 13.44 H new ATOM 747 N TRP A 68 -5.857 11.458 6.443 1.00 21.51 N ATOM 748 CA TRP A 68 -6.246 11.776 7.792 1.00 42.32 C ATOM 749 C TRP A 68 -5.032 11.731 8.721 1.00 13.45 C ATOM 750 O TRP A 68 -5.074 12.243 9.839 1.00 43.14 O ATOM 751 CB TRP A 68 -7.380 10.864 8.261 1.00 33.12 C ATOM 752 CG TRP A 68 -8.563 10.897 7.324 1.00 5.22 C ATOM 753 CD1 TRP A 68 -9.023 9.871 6.554 1.00 61.23 C ATOM 754 CD2 TRP A 68 -9.398 12.028 7.020 1.00 73.41 C ATOM 755 NE1 TRP A 68 -10.106 10.279 5.816 1.00 61.01 N ATOM 756 CE2 TRP A 68 -10.354 11.597 6.079 1.00 24.34 C ATOM 757 CE3 TRP A 68 -9.438 13.356 7.459 1.00 63.45 C ATOM 758 CZ2 TRP A 68 -11.334 12.442 5.570 1.00 30.42 C ATOM 759 CZ3 TRP A 68 -10.410 14.191 6.948 1.00 5.12 C ATOM 760 CH2 TRP A 68 -11.346 13.732 6.015 1.00 34.32 C ATOM 0 H TRP A 68 -5.847 10.464 6.214 1.00 21.51 H new ATOM 0 HA TRP A 68 -6.634 12.794 7.820 1.00 42.32 H new ATOM 0 HB2 TRP A 68 -7.012 9.841 8.342 1.00 33.12 H new ATOM 0 HB3 TRP A 68 -7.700 11.168 9.258 1.00 33.12 H new ATOM 0 HD1 TRP A 68 -8.597 8.879 6.528 1.00 61.23 H new ATOM 0 HE1 TRP A 68 -10.640 9.693 5.174 1.00 61.01 H new ATOM 0 HE3 TRP A 68 -8.723 13.720 8.182 1.00 63.45 H new ATOM 0 HZ2 TRP A 68 -12.058 12.091 4.850 1.00 30.42 H new ATOM 0 HZ3 TRP A 68 -10.449 15.220 7.275 1.00 5.12 H new ATOM 0 HH2 TRP A 68 -12.094 14.414 5.639 1.00 34.32 H new ATOM 771 N GLY A 69 -3.956 11.090 8.257 1.00 11.15 N ATOM 772 CA GLY A 69 -2.675 11.144 8.962 1.00 55.05 C ATOM 773 C GLY A 69 -2.585 10.292 10.221 1.00 34.13 C ATOM 774 O GLY A 69 -1.653 10.450 11.004 1.00 10.41 O ATOM 0 H GLY A 69 -3.947 10.532 7.403 1.00 11.15 H new ATOM 0 HA2 GLY A 69 -1.888 10.831 8.275 1.00 55.05 H new ATOM 0 HA3 GLY A 69 -2.471 12.181 9.230 1.00 55.05 H new ATOM 778 N THR A 70 -3.529 9.408 10.431 1.00 1.42 N ATOM 779 CA THR A 70 -3.527 8.615 11.639 1.00 25.14 C ATOM 780 C THR A 70 -4.050 7.195 11.350 1.00 24.43 C ATOM 781 O THR A 70 -4.354 6.861 10.193 1.00 11.13 O ATOM 782 CB THR A 70 -4.375 9.324 12.762 1.00 30.51 C ATOM 783 OG1 THR A 70 -4.303 8.607 14.016 1.00 51.12 O ATOM 784 CG2 THR A 70 -5.839 9.470 12.342 1.00 23.12 C ATOM 0 H THR A 70 -4.301 9.219 9.791 1.00 1.42 H new ATOM 0 HA THR A 70 -2.503 8.525 12.001 1.00 25.14 H new ATOM 0 HB THR A 70 -3.945 10.316 12.902 1.00 30.51 H new ATOM 0 HG1 THR A 70 -4.838 9.074 14.691 1.00 51.12 H new ATOM 0 HG21 THR A 70 -6.398 9.963 13.137 1.00 23.12 H new ATOM 0 HG22 THR A 70 -5.899 10.068 11.432 1.00 23.12 H new ATOM 0 HG23 THR A 70 -6.264 8.484 12.156 1.00 23.12 H new ATOM 792 N VAL A 71 -4.140 6.377 12.383 1.00 61.14 N ATOM 793 CA VAL A 71 -4.609 5.009 12.262 1.00 4.01 C ATOM 794 C VAL A 71 -6.082 5.031 11.869 1.00 54.21 C ATOM 795 O VAL A 71 -6.862 5.806 12.419 1.00 54.21 O ATOM 796 CB VAL A 71 -4.460 4.233 13.605 1.00 61.31 C ATOM 797 CG1 VAL A 71 -4.847 2.769 13.446 1.00 55.44 C ATOM 798 CG2 VAL A 71 -3.052 4.362 14.172 1.00 51.24 C ATOM 0 H VAL A 71 -3.888 6.645 13.335 1.00 61.14 H new ATOM 0 HA VAL A 71 -4.007 4.504 11.506 1.00 4.01 H new ATOM 0 HB VAL A 71 -5.149 4.687 14.317 1.00 61.31 H new ATOM 0 HG11 VAL A 71 -4.732 2.256 14.401 1.00 55.44 H new ATOM 0 HG12 VAL A 71 -5.885 2.700 13.120 1.00 55.44 H new ATOM 0 HG13 VAL A 71 -4.202 2.301 12.703 1.00 55.44 H new ATOM 0 HG21 VAL A 71 -2.985 3.808 15.109 1.00 51.24 H new ATOM 0 HG22 VAL A 71 -2.334 3.957 13.459 1.00 51.24 H new ATOM 0 HG23 VAL A 71 -2.828 5.413 14.355 1.00 51.24 H new ATOM 808 N GLY A 72 -6.454 4.211 10.911 1.00 4.03 N ATOM 809 CA GLY A 72 -7.827 4.179 10.475 1.00 70.11 C ATOM 810 C GLY A 72 -8.066 5.090 9.296 1.00 74.04 C ATOM 811 O GLY A 72 -9.187 5.160 8.778 1.00 42.34 O ATOM 0 H GLY A 72 -5.831 3.565 10.425 1.00 4.03 H new ATOM 0 HA2 GLY A 72 -8.098 3.158 10.206 1.00 70.11 H new ATOM 0 HA3 GLY A 72 -8.476 4.474 11.299 1.00 70.11 H new ATOM 815 N SER A 73 -7.014 5.797 8.873 1.00 4.00 N ATOM 816 CA SER A 73 -7.098 6.679 7.727 1.00 21.43 C ATOM 817 C SER A 73 -7.414 5.856 6.486 1.00 41.03 C ATOM 818 O SER A 73 -6.974 4.697 6.364 1.00 44.22 O ATOM 819 CB SER A 73 -5.773 7.460 7.544 1.00 33.40 C ATOM 820 OG SER A 73 -5.846 8.427 6.495 1.00 22.41 O ATOM 0 H SER A 73 -6.095 5.769 9.315 1.00 4.00 H new ATOM 0 HA SER A 73 -7.894 7.406 7.887 1.00 21.43 H new ATOM 0 HB2 SER A 73 -5.519 7.961 8.478 1.00 33.40 H new ATOM 0 HB3 SER A 73 -4.968 6.757 7.330 1.00 33.40 H new ATOM 0 HG SER A 73 -6.753 8.797 6.454 1.00 22.41 H new ATOM 826 N ILE A 74 -8.205 6.424 5.620 1.00 32.11 N ATOM 827 CA ILE A 74 -8.600 5.796 4.399 1.00 62.43 C ATOM 828 C ILE A 74 -8.334 6.731 3.252 1.00 53.31 C ATOM 829 O ILE A 74 -8.899 7.822 3.184 1.00 51.20 O ATOM 830 CB ILE A 74 -10.095 5.414 4.437 1.00 42.53 C ATOM 831 CG1 ILE A 74 -10.310 4.380 5.530 1.00 22.53 C ATOM 832 CG2 ILE A 74 -10.558 4.880 3.089 1.00 12.35 C ATOM 833 CD1 ILE A 74 -11.735 3.972 5.723 1.00 41.03 C ATOM 0 H ILE A 74 -8.599 7.356 5.749 1.00 32.11 H new ATOM 0 HA ILE A 74 -8.021 4.882 4.268 1.00 62.43 H new ATOM 0 HB ILE A 74 -10.688 6.303 4.654 1.00 42.53 H new ATOM 0 HG12 ILE A 74 -9.720 3.494 5.296 1.00 22.53 H new ATOM 0 HG13 ILE A 74 -9.928 4.778 6.470 1.00 22.53 H new ATOM 0 HG21 ILE A 74 -11.615 4.619 3.145 1.00 12.35 H new ATOM 0 HG22 ILE A 74 -10.413 5.644 2.326 1.00 12.35 H new ATOM 0 HG23 ILE A 74 -9.978 3.994 2.830 1.00 12.35 H new ATOM 0 HD11 ILE A 74 -11.797 3.232 6.521 1.00 41.03 H new ATOM 0 HD12 ILE A 74 -12.330 4.845 5.990 1.00 41.03 H new ATOM 0 HD13 ILE A 74 -12.118 3.541 4.798 1.00 41.03 H new ATOM 845 N VAL A 75 -7.470 6.325 2.392 1.00 65.25 N ATOM 846 CA VAL A 75 -7.101 7.092 1.224 1.00 20.55 C ATOM 847 C VAL A 75 -7.492 6.268 -0.008 1.00 21.30 C ATOM 848 O VAL A 75 -7.820 5.094 0.122 1.00 43.40 O ATOM 849 CB VAL A 75 -5.567 7.407 1.226 1.00 42.54 C ATOM 850 CG1 VAL A 75 -5.167 8.314 0.074 1.00 75.41 C ATOM 851 CG2 VAL A 75 -5.145 8.026 2.550 1.00 74.53 C ATOM 0 H VAL A 75 -6.981 5.433 2.469 1.00 65.25 H new ATOM 0 HA VAL A 75 -7.620 8.051 1.218 1.00 20.55 H new ATOM 0 HB VAL A 75 -5.048 6.458 1.095 1.00 42.54 H new ATOM 0 HG11 VAL A 75 -4.095 8.505 0.117 1.00 75.41 H new ATOM 0 HG12 VAL A 75 -5.412 7.831 -0.872 1.00 75.41 H new ATOM 0 HG13 VAL A 75 -5.707 9.258 0.150 1.00 75.41 H new ATOM 0 HG21 VAL A 75 -4.076 8.236 2.529 1.00 74.53 H new ATOM 0 HG22 VAL A 75 -5.694 8.954 2.709 1.00 74.53 H new ATOM 0 HG23 VAL A 75 -5.362 7.332 3.362 1.00 74.53 H new ATOM 861 N PHE A 76 -7.527 6.874 -1.173 1.00 33.33 N ATOM 862 CA PHE A 76 -7.908 6.157 -2.359 1.00 41.14 C ATOM 863 C PHE A 76 -6.874 6.300 -3.435 1.00 41.32 C ATOM 864 O PHE A 76 -6.390 7.405 -3.698 1.00 42.43 O ATOM 865 CB PHE A 76 -9.292 6.612 -2.839 1.00 23.30 C ATOM 866 CG PHE A 76 -10.311 6.440 -1.765 1.00 73.53 C ATOM 867 CD1 PHE A 76 -10.569 5.192 -1.276 1.00 54.31 C ATOM 868 CD2 PHE A 76 -10.968 7.522 -1.216 1.00 42.03 C ATOM 869 CE1 PHE A 76 -11.460 4.996 -0.265 1.00 10.10 C ATOM 870 CE2 PHE A 76 -11.879 7.341 -0.197 1.00 24.44 C ATOM 871 CZ PHE A 76 -12.125 6.073 0.280 1.00 40.35 C ATOM 0 H PHE A 76 -7.297 7.857 -1.320 1.00 33.33 H new ATOM 0 HA PHE A 76 -7.971 5.097 -2.114 1.00 41.14 H new ATOM 0 HB2 PHE A 76 -9.250 7.658 -3.142 1.00 23.30 H new ATOM 0 HB3 PHE A 76 -9.584 6.037 -3.718 1.00 23.30 H new ATOM 0 HD1 PHE A 76 -10.055 4.342 -1.700 1.00 54.31 H new ATOM 0 HD2 PHE A 76 -10.768 8.516 -1.587 1.00 42.03 H new ATOM 0 HE1 PHE A 76 -11.645 4.000 0.109 1.00 10.10 H new ATOM 0 HE2 PHE A 76 -12.397 8.190 0.225 1.00 24.44 H new ATOM 0 HZ PHE A 76 -12.837 5.923 1.078 1.00 40.35 H new ATOM 881 N TRP A 77 -6.522 5.202 -4.044 1.00 34.43 N ATOM 882 CA TRP A 77 -5.572 5.221 -5.123 1.00 53.34 C ATOM 883 C TRP A 77 -6.294 4.968 -6.414 1.00 24.31 C ATOM 884 O TRP A 77 -7.077 4.019 -6.521 1.00 44.12 O ATOM 885 CB TRP A 77 -4.476 4.145 -4.960 1.00 73.14 C ATOM 886 CG TRP A 77 -3.650 4.248 -3.715 1.00 41.23 C ATOM 887 CD1 TRP A 77 -2.933 5.324 -3.299 1.00 40.34 C ATOM 888 CD2 TRP A 77 -3.412 3.209 -2.751 1.00 70.02 C ATOM 889 NE1 TRP A 77 -2.291 5.037 -2.124 1.00 71.13 N ATOM 890 CE2 TRP A 77 -2.563 3.743 -1.768 1.00 12.34 C ATOM 891 CE3 TRP A 77 -3.842 1.887 -2.619 1.00 41.34 C ATOM 892 CZ2 TRP A 77 -2.133 3.001 -0.668 1.00 20.02 C ATOM 893 CZ3 TRP A 77 -3.415 1.152 -1.529 1.00 54.04 C ATOM 894 CH2 TRP A 77 -2.569 1.710 -0.567 1.00 34.15 C ATOM 0 H TRP A 77 -6.881 4.276 -3.810 1.00 34.43 H new ATOM 0 HA TRP A 77 -5.091 6.199 -5.118 1.00 53.34 H new ATOM 0 HB2 TRP A 77 -4.949 3.163 -4.981 1.00 73.14 H new ATOM 0 HB3 TRP A 77 -3.810 4.196 -5.822 1.00 73.14 H new ATOM 0 HD1 TRP A 77 -2.877 6.269 -3.819 1.00 40.34 H new ATOM 0 HE1 TRP A 77 -1.704 5.684 -1.598 1.00 71.13 H new ATOM 0 HE3 TRP A 77 -4.497 1.446 -3.356 1.00 41.34 H new ATOM 0 HZ2 TRP A 77 -1.479 3.431 0.077 1.00 20.02 H new ATOM 0 HZ3 TRP A 77 -3.741 0.128 -1.419 1.00 54.04 H new ATOM 0 HH2 TRP A 77 -2.253 1.109 0.273 1.00 34.15 H new ATOM 905 N ASN A 78 -6.063 5.804 -7.378 1.00 13.10 N ATOM 906 CA ASN A 78 -6.636 5.609 -8.683 1.00 44.42 C ATOM 907 C ASN A 78 -5.571 5.064 -9.576 1.00 24.12 C ATOM 908 O ASN A 78 -4.457 5.586 -9.611 1.00 2.44 O ATOM 909 CB ASN A 78 -7.192 6.921 -9.267 1.00 55.14 C ATOM 910 CG ASN A 78 -8.385 7.477 -8.505 1.00 40.34 C ATOM 911 OD1 ASN A 78 -9.580 7.114 -8.926 1.00 30.02 O flip ATOM 912 ND2 ASN A 78 -8.230 8.248 -7.552 1.00 52.21 N flip ATOM 0 H ASN A 78 -5.478 6.635 -7.289 1.00 13.10 H new ATOM 0 HA ASN A 78 -7.473 4.915 -8.605 1.00 44.42 H new ATOM 0 HB2 ASN A 78 -6.399 7.668 -9.276 1.00 55.14 H new ATOM 0 HB3 ASN A 78 -7.482 6.752 -10.304 1.00 55.14 H new ATOM 0 HD21 ASN A 78 -7.290 8.507 -7.253 1.00 52.21 H new ATOM 0 HD22 ASN A 78 -9.042 8.625 -7.064 1.00 52.21 H new ATOM 919 N TYR A 79 -5.878 4.027 -10.275 1.00 62.45 N ATOM 920 CA TYR A 79 -4.922 3.397 -11.138 1.00 44.54 C ATOM 921 C TYR A 79 -5.634 2.757 -12.290 1.00 14.24 C ATOM 922 O TYR A 79 -6.762 2.311 -12.155 1.00 3.31 O ATOM 923 CB TYR A 79 -4.061 2.369 -10.358 1.00 43.23 C ATOM 924 CG TYR A 79 -4.825 1.222 -9.702 1.00 1.50 C ATOM 925 CD1 TYR A 79 -5.559 1.426 -8.541 1.00 4.03 C ATOM 926 CD2 TYR A 79 -4.799 -0.062 -10.241 1.00 24.25 C ATOM 927 CE1 TYR A 79 -6.247 0.395 -7.940 1.00 30.25 C ATOM 928 CE2 TYR A 79 -5.484 -1.102 -9.642 1.00 21.25 C ATOM 929 CZ TYR A 79 -6.207 -0.866 -8.488 1.00 11.23 C ATOM 930 OH TYR A 79 -6.896 -1.898 -7.880 1.00 10.20 O ATOM 0 H TYR A 79 -6.798 3.586 -10.269 1.00 62.45 H new ATOM 0 HA TYR A 79 -4.240 4.153 -11.528 1.00 44.54 H new ATOM 0 HB2 TYR A 79 -3.326 1.946 -11.043 1.00 43.23 H new ATOM 0 HB3 TYR A 79 -3.507 2.901 -9.584 1.00 43.23 H new ATOM 0 HD1 TYR A 79 -5.591 2.412 -8.101 1.00 4.03 H new ATOM 0 HD2 TYR A 79 -4.234 -0.248 -11.142 1.00 24.25 H new ATOM 0 HE1 TYR A 79 -6.817 0.576 -7.041 1.00 30.25 H new ATOM 0 HE2 TYR A 79 -5.455 -2.092 -10.073 1.00 21.25 H new ATOM 0 HH TYR A 79 -6.767 -2.724 -8.392 1.00 10.20 H new ATOM 940 N VAL A 80 -5.001 2.711 -13.405 1.00 15.51 N ATOM 941 CA VAL A 80 -5.606 2.153 -14.568 1.00 31.44 C ATOM 942 C VAL A 80 -4.993 0.811 -14.842 1.00 45.25 C ATOM 943 O VAL A 80 -3.781 0.697 -15.056 1.00 2.01 O ATOM 944 CB VAL A 80 -5.452 3.092 -15.798 1.00 72.40 C ATOM 945 CG1 VAL A 80 -6.081 2.477 -17.046 1.00 61.13 C ATOM 946 CG2 VAL A 80 -6.094 4.441 -15.503 1.00 42.12 C ATOM 0 H VAL A 80 -4.051 3.057 -13.542 1.00 15.51 H new ATOM 0 HA VAL A 80 -6.675 2.037 -14.388 1.00 31.44 H new ATOM 0 HB VAL A 80 -4.388 3.230 -15.989 1.00 72.40 H new ATOM 0 HG11 VAL A 80 -5.957 3.157 -17.889 1.00 61.13 H new ATOM 0 HG12 VAL A 80 -5.592 1.529 -17.270 1.00 61.13 H new ATOM 0 HG13 VAL A 80 -7.143 2.306 -16.871 1.00 61.13 H new ATOM 0 HG21 VAL A 80 -5.983 5.094 -16.369 1.00 42.12 H new ATOM 0 HG22 VAL A 80 -7.153 4.301 -15.288 1.00 42.12 H new ATOM 0 HG23 VAL A 80 -5.606 4.895 -14.641 1.00 42.12 H new ATOM 956 N HIS A 81 -5.814 -0.204 -14.805 1.00 51.24 N ATOM 957 CA HIS A 81 -5.358 -1.546 -15.046 1.00 34.42 C ATOM 958 C HIS A 81 -6.200 -2.155 -16.142 1.00 71.41 C ATOM 959 O HIS A 81 -7.427 -2.285 -15.986 1.00 14.52 O ATOM 960 CB HIS A 81 -5.433 -2.382 -13.751 1.00 4.21 C ATOM 961 CG HIS A 81 -4.821 -3.752 -13.864 1.00 3.21 C ATOM 962 ND1 HIS A 81 -3.463 -3.967 -13.821 1.00 32.21 N ATOM 963 CD2 HIS A 81 -5.385 -4.970 -14.025 1.00 43.54 C ATOM 964 CE1 HIS A 81 -3.220 -5.249 -13.955 1.00 1.44 C ATOM 965 NE2 HIS A 81 -4.363 -5.880 -14.077 1.00 34.11 N ATOM 0 H HIS A 81 -6.812 -0.125 -14.608 1.00 51.24 H new ATOM 0 HA HIS A 81 -4.315 -1.533 -15.363 1.00 34.42 H new ATOM 0 HB2 HIS A 81 -4.932 -1.837 -12.951 1.00 4.21 H new ATOM 0 HB3 HIS A 81 -6.478 -2.486 -13.459 1.00 4.21 H new ATOM 0 HD2 HIS A 81 -6.441 -5.185 -14.099 1.00 43.54 H new ATOM 0 HE1 HIS A 81 -2.242 -5.708 -13.963 1.00 1.44 H new ATOM 0 HE2 HIS A 81 -4.473 -6.887 -14.192 1.00 34.11 H new ATOM 974 N ASP A 82 -5.552 -2.488 -17.254 1.00 70.33 N ATOM 975 CA ASP A 82 -6.205 -3.076 -18.437 1.00 21.25 C ATOM 976 C ASP A 82 -7.188 -2.121 -19.079 1.00 35.42 C ATOM 977 O ASP A 82 -8.183 -2.536 -19.678 1.00 71.41 O ATOM 978 CB ASP A 82 -6.857 -4.435 -18.131 1.00 1.40 C ATOM 979 CG ASP A 82 -5.850 -5.555 -18.017 1.00 14.34 C ATOM 980 OD1 ASP A 82 -5.291 -5.775 -16.925 1.00 2.22 O ATOM 981 OD2 ASP A 82 -5.603 -6.232 -19.029 1.00 54.42 O ATOM 0 H ASP A 82 -4.547 -2.359 -17.368 1.00 70.33 H new ATOM 0 HA ASP A 82 -5.413 -3.260 -19.163 1.00 21.25 H new ATOM 0 HB2 ASP A 82 -7.419 -4.362 -17.200 1.00 1.40 H new ATOM 0 HB3 ASP A 82 -7.573 -4.675 -18.917 1.00 1.40 H new ATOM 986 N GLY A 83 -6.885 -0.844 -18.991 1.00 11.23 N ATOM 987 CA GLY A 83 -7.692 0.164 -19.650 1.00 22.12 C ATOM 988 C GLY A 83 -8.818 0.709 -18.800 1.00 31.24 C ATOM 989 O GLY A 83 -9.428 1.717 -19.152 1.00 71.31 O ATOM 0 H GLY A 83 -6.088 -0.478 -18.471 1.00 11.23 H new ATOM 0 HA2 GLY A 83 -7.047 0.989 -19.952 1.00 22.12 H new ATOM 0 HA3 GLY A 83 -8.113 -0.262 -20.561 1.00 22.12 H new ATOM 993 N GLU A 84 -9.103 0.069 -17.696 1.00 52.51 N ATOM 994 CA GLU A 84 -10.149 0.560 -16.815 1.00 12.22 C ATOM 995 C GLU A 84 -9.544 1.282 -15.680 1.00 14.12 C ATOM 996 O GLU A 84 -8.428 0.947 -15.240 1.00 1.10 O ATOM 997 CB GLU A 84 -10.981 -0.549 -16.232 1.00 43.53 C ATOM 998 CG GLU A 84 -11.711 -1.387 -17.214 1.00 63.22 C ATOM 999 CD GLU A 84 -12.489 -2.463 -16.529 1.00 41.14 C ATOM 1000 OE1 GLU A 84 -11.899 -3.505 -16.238 1.00 23.13 O ATOM 1001 OE2 GLU A 84 -13.680 -2.262 -16.229 1.00 24.22 O ATOM 0 H GLU A 84 -8.637 -0.782 -17.382 1.00 52.51 H new ATOM 0 HA GLU A 84 -10.784 1.205 -17.422 1.00 12.22 H new ATOM 0 HB2 GLU A 84 -10.331 -1.195 -15.642 1.00 43.53 H new ATOM 0 HB3 GLU A 84 -11.705 -0.113 -15.544 1.00 43.53 H new ATOM 0 HG2 GLU A 84 -12.386 -0.762 -17.799 1.00 63.22 H new ATOM 0 HG3 GLU A 84 -11.004 -1.834 -17.913 1.00 63.22 H new ATOM 1008 N ALA A 85 -10.253 2.222 -15.180 1.00 52.53 N ATOM 1009 CA ALA A 85 -9.805 2.943 -14.047 1.00 33.14 C ATOM 1010 C ALA A 85 -10.290 2.242 -12.805 1.00 52.02 C ATOM 1011 O ALA A 85 -11.495 2.155 -12.546 1.00 13.41 O ATOM 1012 CB ALA A 85 -10.309 4.371 -14.087 1.00 45.12 C ATOM 0 H ALA A 85 -11.160 2.515 -15.543 1.00 52.53 H new ATOM 0 HA ALA A 85 -8.716 2.979 -14.045 1.00 33.14 H new ATOM 0 HB1 ALA A 85 -9.953 4.907 -13.207 1.00 45.12 H new ATOM 0 HB2 ALA A 85 -9.938 4.863 -14.986 1.00 45.12 H new ATOM 0 HB3 ALA A 85 -11.399 4.372 -14.096 1.00 45.12 H new ATOM 1018 N LYS A 86 -9.372 1.748 -12.057 1.00 45.33 N ATOM 1019 CA LYS A 86 -9.656 1.091 -10.831 1.00 30.22 C ATOM 1020 C LYS A 86 -9.352 2.008 -9.679 1.00 45.13 C ATOM 1021 O LYS A 86 -8.483 2.893 -9.775 1.00 4.03 O ATOM 1022 CB LYS A 86 -8.869 -0.222 -10.666 1.00 5.52 C ATOM 1023 CG LYS A 86 -9.413 -1.484 -11.367 1.00 52.55 C ATOM 1024 CD LYS A 86 -9.367 -1.508 -12.894 1.00 13.21 C ATOM 1025 CE LYS A 86 -9.914 -2.873 -13.361 1.00 42.35 C ATOM 1026 NZ LYS A 86 -9.726 -3.154 -14.796 1.00 73.03 N ATOM 0 H LYS A 86 -8.379 1.789 -12.284 1.00 45.33 H new ATOM 0 HA LYS A 86 -10.716 0.836 -10.842 1.00 30.22 H new ATOM 0 HB2 LYS A 86 -7.854 -0.051 -11.026 1.00 5.52 H new ATOM 0 HB3 LYS A 86 -8.797 -0.437 -9.600 1.00 5.52 H new ATOM 0 HG2 LYS A 86 -8.853 -2.343 -10.998 1.00 52.55 H new ATOM 0 HG3 LYS A 86 -10.449 -1.622 -11.058 1.00 52.55 H new ATOM 0 HD2 LYS A 86 -9.965 -0.695 -13.307 1.00 13.21 H new ATOM 0 HD3 LYS A 86 -8.346 -1.364 -13.248 1.00 13.21 H new ATOM 0 HE2 LYS A 86 -9.429 -3.660 -12.784 1.00 42.35 H new ATOM 0 HE3 LYS A 86 -10.979 -2.920 -13.132 1.00 42.35 H new ATOM 0 HZ1 LYS A 86 -10.645 -3.111 -15.281 1.00 73.03 H new ATOM 0 HZ2 LYS A 86 -9.084 -2.446 -15.207 1.00 73.03 H new ATOM 0 HZ3 LYS A 86 -9.316 -4.103 -14.913 1.00 73.03 H new ATOM 1040 N VAL A 87 -10.061 1.822 -8.610 1.00 72.11 N ATOM 1041 CA VAL A 87 -9.865 2.602 -7.424 1.00 2.02 C ATOM 1042 C VAL A 87 -9.601 1.655 -6.283 1.00 32.13 C ATOM 1043 O VAL A 87 -10.275 0.627 -6.153 1.00 52.45 O ATOM 1044 CB VAL A 87 -11.111 3.485 -7.092 1.00 41.42 C ATOM 1045 CG1 VAL A 87 -10.873 4.335 -5.845 1.00 44.54 C ATOM 1046 CG2 VAL A 87 -11.469 4.376 -8.272 1.00 2.22 C ATOM 0 H VAL A 87 -10.797 1.121 -8.533 1.00 72.11 H new ATOM 0 HA VAL A 87 -9.023 3.276 -7.582 1.00 2.02 H new ATOM 0 HB VAL A 87 -11.946 2.814 -6.892 1.00 41.42 H new ATOM 0 HG11 VAL A 87 -11.758 4.938 -5.641 1.00 44.54 H new ATOM 0 HG12 VAL A 87 -10.673 3.684 -4.994 1.00 44.54 H new ATOM 0 HG13 VAL A 87 -10.018 4.991 -6.009 1.00 44.54 H new ATOM 0 HG21 VAL A 87 -12.339 4.982 -8.019 1.00 2.22 H new ATOM 0 HG22 VAL A 87 -10.627 5.028 -8.504 1.00 2.22 H new ATOM 0 HG23 VAL A 87 -11.698 3.757 -9.139 1.00 2.22 H new ATOM 1056 N ALA A 88 -8.636 1.970 -5.479 1.00 33.34 N ATOM 1057 CA ALA A 88 -8.301 1.151 -4.361 1.00 70.34 C ATOM 1058 C ALA A 88 -8.732 1.846 -3.114 1.00 12.34 C ATOM 1059 O ALA A 88 -8.478 3.040 -2.941 1.00 2.44 O ATOM 1060 CB ALA A 88 -6.809 0.882 -4.314 1.00 64.14 C ATOM 0 H ALA A 88 -8.058 2.804 -5.580 1.00 33.34 H new ATOM 0 HA ALA A 88 -8.812 0.192 -4.453 1.00 70.34 H new ATOM 0 HB1 ALA A 88 -6.579 0.255 -3.452 1.00 64.14 H new ATOM 0 HB2 ALA A 88 -6.503 0.371 -5.227 1.00 64.14 H new ATOM 0 HB3 ALA A 88 -6.271 1.826 -4.229 1.00 64.14 H new ATOM 1066 N LYS A 89 -9.416 1.119 -2.271 1.00 53.34 N ATOM 1067 CA LYS A 89 -9.891 1.628 -1.044 1.00 12.04 C ATOM 1068 C LYS A 89 -9.160 0.869 0.055 1.00 54.54 C ATOM 1069 O LYS A 89 -9.153 -0.383 0.063 1.00 61.54 O ATOM 1070 CB LYS A 89 -11.415 1.446 -0.964 1.00 34.41 C ATOM 1071 CG LYS A 89 -12.194 2.036 -2.153 1.00 71.33 C ATOM 1072 CD LYS A 89 -13.697 1.814 -1.999 1.00 71.22 C ATOM 1073 CE LYS A 89 -14.482 2.289 -3.225 1.00 4.43 C ATOM 1074 NZ LYS A 89 -14.375 3.750 -3.458 1.00 21.44 N ATOM 0 H LYS A 89 -9.655 0.141 -2.435 1.00 53.34 H new ATOM 0 HA LYS A 89 -9.700 2.696 -0.939 1.00 12.04 H new ATOM 0 HB2 LYS A 89 -11.637 0.381 -0.893 1.00 34.41 H new ATOM 0 HB3 LYS A 89 -11.775 1.909 -0.045 1.00 34.41 H new ATOM 0 HG2 LYS A 89 -11.988 3.104 -2.231 1.00 71.33 H new ATOM 0 HG3 LYS A 89 -11.850 1.577 -3.080 1.00 71.33 H new ATOM 0 HD2 LYS A 89 -13.891 0.754 -1.834 1.00 71.22 H new ATOM 0 HD3 LYS A 89 -14.052 2.344 -1.115 1.00 71.22 H new ATOM 0 HE2 LYS A 89 -14.121 1.760 -4.107 1.00 4.43 H new ATOM 0 HE3 LYS A 89 -15.532 2.023 -3.101 1.00 4.43 H new ATOM 0 HZ1 LYS A 89 -14.927 4.009 -4.301 1.00 21.44 H new ATOM 0 HZ2 LYS A 89 -14.745 4.261 -2.631 1.00 21.44 H new ATOM 0 HZ3 LYS A 89 -13.378 4.006 -3.606 1.00 21.44 H new ATOM 1088 N GLU A 90 -8.568 1.595 0.951 1.00 1.55 N ATOM 1089 CA GLU A 90 -7.670 1.055 1.933 1.00 31.54 C ATOM 1090 C GLU A 90 -8.158 1.359 3.326 1.00 72.33 C ATOM 1091 O GLU A 90 -9.017 2.204 3.524 1.00 54.41 O ATOM 1092 CB GLU A 90 -6.301 1.717 1.762 1.00 43.33 C ATOM 1093 CG GLU A 90 -6.375 3.229 1.956 1.00 51.54 C ATOM 1094 CD GLU A 90 -5.042 3.942 1.832 1.00 45.30 C ATOM 1095 OE1 GLU A 90 -4.675 4.342 0.713 1.00 24.44 O ATOM 1096 OE2 GLU A 90 -4.373 4.148 2.864 1.00 35.21 O ATOM 0 H GLU A 90 -8.696 2.604 1.025 1.00 1.55 H new ATOM 0 HA GLU A 90 -7.612 -0.025 1.795 1.00 31.54 H new ATOM 0 HB2 GLU A 90 -5.600 1.292 2.480 1.00 43.33 H new ATOM 0 HB3 GLU A 90 -5.912 1.497 0.768 1.00 43.33 H new ATOM 0 HG2 GLU A 90 -7.065 3.644 1.221 1.00 51.54 H new ATOM 0 HG3 GLU A 90 -6.794 3.437 2.940 1.00 51.54 H new ATOM 1103 N ARG A 91 -7.643 0.644 4.261 1.00 1.14 N ATOM 1104 CA ARG A 91 -7.869 0.892 5.641 1.00 13.23 C ATOM 1105 C ARG A 91 -6.548 0.722 6.367 1.00 52.43 C ATOM 1106 O ARG A 91 -5.934 -0.340 6.276 1.00 65.24 O ATOM 1107 CB ARG A 91 -8.895 -0.120 6.160 1.00 1.22 C ATOM 1108 CG ARG A 91 -9.162 -0.094 7.653 1.00 33.10 C ATOM 1109 CD ARG A 91 -9.804 1.198 8.089 1.00 24.02 C ATOM 1110 NE ARG A 91 -10.091 1.208 9.533 1.00 61.10 N ATOM 1111 CZ ARG A 91 -10.958 2.030 10.149 1.00 12.02 C ATOM 1112 NH1 ARG A 91 -11.670 2.912 9.444 1.00 31.12 N ATOM 1113 NH2 ARG A 91 -11.129 1.948 11.471 1.00 43.23 N ATOM 0 H ARG A 91 -7.034 -0.154 4.082 1.00 1.14 H new ATOM 0 HA ARG A 91 -8.252 1.899 5.805 1.00 13.23 H new ATOM 0 HB2 ARG A 91 -9.838 0.050 5.640 1.00 1.22 H new ATOM 0 HB3 ARG A 91 -8.557 -1.120 5.889 1.00 1.22 H new ATOM 0 HG2 ARG A 91 -9.810 -0.929 7.920 1.00 33.10 H new ATOM 0 HG3 ARG A 91 -8.225 -0.233 8.191 1.00 33.10 H new ATOM 0 HD2 ARG A 91 -9.146 2.031 7.844 1.00 24.02 H new ATOM 0 HD3 ARG A 91 -10.730 1.349 7.534 1.00 24.02 H new ATOM 0 HE ARG A 91 -9.591 0.536 10.114 1.00 61.10 H new ATOM 0 HH11 ARG A 91 -11.558 2.965 8.432 1.00 31.12 H new ATOM 0 HH12 ARG A 91 -12.326 3.533 9.918 1.00 31.12 H new ATOM 0 HH21 ARG A 91 -10.602 1.262 12.012 1.00 43.23 H new ATOM 0 HH22 ARG A 91 -11.787 2.571 11.940 1.00 43.23 H new ATOM 1127 N ILE A 92 -6.091 1.738 7.059 1.00 14.33 N ATOM 1128 CA ILE A 92 -4.887 1.577 7.848 1.00 32.12 C ATOM 1129 C ILE A 92 -5.242 0.862 9.134 1.00 34.21 C ATOM 1130 O ILE A 92 -6.100 1.328 9.898 1.00 23.42 O ATOM 1131 CB ILE A 92 -4.185 2.927 8.151 1.00 40.21 C ATOM 1132 CG1 ILE A 92 -3.741 3.595 6.838 1.00 54.54 C ATOM 1133 CG2 ILE A 92 -2.998 2.732 9.100 1.00 22.01 C ATOM 1134 CD1 ILE A 92 -2.982 4.894 7.026 1.00 42.41 C ATOM 0 H ILE A 92 -6.519 2.663 7.095 1.00 14.33 H new ATOM 0 HA ILE A 92 -4.177 0.987 7.269 1.00 32.12 H new ATOM 0 HB ILE A 92 -4.897 3.583 8.651 1.00 40.21 H new ATOM 0 HG12 ILE A 92 -3.113 2.898 6.283 1.00 54.54 H new ATOM 0 HG13 ILE A 92 -4.622 3.788 6.226 1.00 54.54 H new ATOM 0 HG21 ILE A 92 -2.526 3.695 9.294 1.00 22.01 H new ATOM 0 HG22 ILE A 92 -3.349 2.304 10.039 1.00 22.01 H new ATOM 0 HG23 ILE A 92 -2.274 2.058 8.643 1.00 22.01 H new ATOM 0 HD11 ILE A 92 -2.706 5.299 6.052 1.00 42.41 H new ATOM 0 HD12 ILE A 92 -3.613 5.611 7.551 1.00 42.41 H new ATOM 0 HD13 ILE A 92 -2.081 4.708 7.610 1.00 42.41 H new ATOM 1146 N GLU A 93 -4.601 -0.248 9.376 1.00 31.03 N ATOM 1147 CA GLU A 93 -4.925 -1.042 10.531 1.00 41.42 C ATOM 1148 C GLU A 93 -3.927 -0.775 11.658 1.00 3.34 C ATOM 1149 O GLU A 93 -4.296 -0.653 12.820 1.00 2.43 O ATOM 1150 CB GLU A 93 -4.927 -2.523 10.160 1.00 51.12 C ATOM 1151 CG GLU A 93 -5.549 -3.403 11.212 1.00 32.42 C ATOM 1152 CD GLU A 93 -7.006 -3.062 11.415 1.00 31.33 C ATOM 1153 OE1 GLU A 93 -7.316 -2.134 12.198 1.00 4.03 O ATOM 1154 OE2 GLU A 93 -7.862 -3.698 10.787 1.00 34.04 O ATOM 0 H GLU A 93 -3.854 -0.623 8.792 1.00 31.03 H new ATOM 0 HA GLU A 93 -5.920 -0.766 10.881 1.00 41.42 H new ATOM 0 HB2 GLU A 93 -5.467 -2.654 9.222 1.00 51.12 H new ATOM 0 HB3 GLU A 93 -3.901 -2.848 9.986 1.00 51.12 H new ATOM 0 HG2 GLU A 93 -5.455 -4.448 10.918 1.00 32.42 H new ATOM 0 HG3 GLU A 93 -5.011 -3.286 12.153 1.00 32.42 H new ATOM 1161 N ALA A 94 -2.677 -0.668 11.301 1.00 54.04 N ATOM 1162 CA ALA A 94 -1.619 -0.399 12.249 1.00 73.42 C ATOM 1163 C ALA A 94 -0.561 0.383 11.549 1.00 53.32 C ATOM 1164 O ALA A 94 -0.246 0.089 10.408 1.00 1.45 O ATOM 1165 CB ALA A 94 -1.027 -1.700 12.790 1.00 1.11 C ATOM 0 H ALA A 94 -2.356 -0.765 10.338 1.00 54.04 H new ATOM 0 HA ALA A 94 -2.019 0.162 13.093 1.00 73.42 H new ATOM 0 HB1 ALA A 94 -0.233 -1.471 13.501 1.00 1.11 H new ATOM 0 HB2 ALA A 94 -1.807 -2.274 13.290 1.00 1.11 H new ATOM 0 HB3 ALA A 94 -0.618 -2.284 11.966 1.00 1.11 H new ATOM 1171 N VAL A 95 -0.050 1.391 12.177 1.00 63.12 N ATOM 1172 CA VAL A 95 0.983 2.173 11.565 1.00 45.32 C ATOM 1173 C VAL A 95 1.952 2.716 12.596 1.00 30.25 C ATOM 1174 O VAL A 95 1.550 3.287 13.619 1.00 12.04 O ATOM 1175 CB VAL A 95 0.415 3.305 10.655 1.00 51.43 C ATOM 1176 CG1 VAL A 95 -0.472 4.264 11.430 1.00 73.34 C ATOM 1177 CG2 VAL A 95 1.536 4.048 9.934 1.00 1.31 C ATOM 0 H VAL A 95 -0.327 1.695 13.110 1.00 63.12 H new ATOM 0 HA VAL A 95 1.539 1.501 10.911 1.00 45.32 H new ATOM 0 HB VAL A 95 -0.210 2.828 9.900 1.00 51.43 H new ATOM 0 HG11 VAL A 95 -0.846 5.037 10.758 1.00 73.34 H new ATOM 0 HG12 VAL A 95 -1.312 3.717 11.858 1.00 73.34 H new ATOM 0 HG13 VAL A 95 0.105 4.727 12.230 1.00 73.34 H new ATOM 0 HG21 VAL A 95 1.109 4.831 9.307 1.00 1.31 H new ATOM 0 HG22 VAL A 95 2.207 4.496 10.668 1.00 1.31 H new ATOM 0 HG23 VAL A 95 2.094 3.349 9.311 1.00 1.31 H new ATOM 1187 N GLU A 96 3.207 2.511 12.342 1.00 73.55 N ATOM 1188 CA GLU A 96 4.249 3.018 13.163 1.00 71.51 C ATOM 1189 C GLU A 96 5.127 3.889 12.295 1.00 10.44 C ATOM 1190 O GLU A 96 5.885 3.379 11.458 1.00 4.32 O ATOM 1191 CB GLU A 96 5.056 1.856 13.759 1.00 1.23 C ATOM 1192 CG GLU A 96 6.220 2.249 14.630 1.00 72.42 C ATOM 1193 CD GLU A 96 5.839 3.166 15.741 1.00 60.20 C ATOM 1194 OE1 GLU A 96 5.478 2.687 16.835 1.00 25.53 O ATOM 1195 OE2 GLU A 96 5.901 4.383 15.536 1.00 73.42 O ATOM 0 H GLU A 96 3.537 1.974 11.540 1.00 73.55 H new ATOM 0 HA GLU A 96 3.845 3.600 13.991 1.00 71.51 H new ATOM 0 HB2 GLU A 96 4.381 1.232 14.345 1.00 1.23 H new ATOM 0 HB3 GLU A 96 5.430 1.240 12.941 1.00 1.23 H new ATOM 0 HG2 GLU A 96 6.672 1.350 15.049 1.00 72.42 H new ATOM 0 HG3 GLU A 96 6.980 2.731 14.014 1.00 72.42 H new ATOM 1202 N PRO A 97 5.026 5.206 12.456 1.00 14.00 N ATOM 1203 CA PRO A 97 5.820 6.160 11.700 1.00 71.04 C ATOM 1204 C PRO A 97 7.289 6.050 12.036 1.00 73.33 C ATOM 1205 O PRO A 97 8.139 6.319 11.201 1.00 63.33 O ATOM 1206 CB PRO A 97 5.275 7.532 12.135 1.00 11.45 C ATOM 1207 CG PRO A 97 3.956 7.238 12.750 1.00 64.42 C ATOM 1208 CD PRO A 97 4.096 5.889 13.370 1.00 64.41 C ATOM 0 HA PRO A 97 5.745 5.990 10.626 1.00 71.04 H new ATOM 0 HB2 PRO A 97 5.944 8.016 12.846 1.00 11.45 H new ATOM 0 HB3 PRO A 97 5.173 8.205 11.284 1.00 11.45 H new ATOM 0 HG2 PRO A 97 3.696 7.988 13.497 1.00 64.42 H new ATOM 0 HG3 PRO A 97 3.164 7.245 12.001 1.00 64.42 H new ATOM 0 HD2 PRO A 97 4.495 5.949 14.383 1.00 64.41 H new ATOM 0 HD3 PRO A 97 3.139 5.372 13.434 1.00 64.41 H new ATOM 1216 N ASP A 98 7.588 5.625 13.257 1.00 12.11 N ATOM 1217 CA ASP A 98 8.978 5.593 13.710 1.00 3.54 C ATOM 1218 C ASP A 98 9.746 4.457 13.084 1.00 54.03 C ATOM 1219 O ASP A 98 10.911 4.597 12.737 1.00 73.52 O ATOM 1220 CB ASP A 98 9.090 5.542 15.238 1.00 22.40 C ATOM 1221 CG ASP A 98 10.534 5.448 15.714 1.00 42.34 C ATOM 1222 OD1 ASP A 98 11.211 6.489 15.829 1.00 1.53 O ATOM 1223 OD2 ASP A 98 11.014 4.327 15.980 1.00 41.11 O ATOM 0 H ASP A 98 6.904 5.303 13.942 1.00 12.11 H new ATOM 0 HA ASP A 98 9.428 6.529 13.378 1.00 3.54 H new ATOM 0 HB2 ASP A 98 8.628 6.433 15.663 1.00 22.40 H new ATOM 0 HB3 ASP A 98 8.531 4.684 15.612 1.00 22.40 H new ATOM 1228 N LYS A 99 9.078 3.357 12.903 1.00 61.12 N ATOM 1229 CA LYS A 99 9.712 2.170 12.389 1.00 22.23 C ATOM 1230 C LYS A 99 9.426 2.000 10.911 1.00 71.00 C ATOM 1231 O LYS A 99 9.870 1.016 10.315 1.00 40.23 O ATOM 1232 CB LYS A 99 9.221 0.935 13.144 1.00 53.03 C ATOM 1233 CG LYS A 99 9.438 0.966 14.642 1.00 62.50 C ATOM 1234 CD LYS A 99 10.907 1.008 14.977 1.00 51.12 C ATOM 1235 CE LYS A 99 11.147 0.945 16.483 1.00 72.34 C ATOM 1236 NZ LYS A 99 10.495 2.059 17.209 1.00 43.12 N ATOM 0 H LYS A 99 8.084 3.252 13.105 1.00 61.12 H new ATOM 0 HA LYS A 99 10.787 2.279 12.530 1.00 22.23 H new ATOM 0 HB2 LYS A 99 8.156 0.810 12.950 1.00 53.03 H new ATOM 0 HB3 LYS A 99 9.724 0.057 12.738 1.00 53.03 H new ATOM 0 HG2 LYS A 99 8.940 1.838 15.067 1.00 62.50 H new ATOM 0 HG3 LYS A 99 8.983 0.086 15.097 1.00 62.50 H new ATOM 0 HD2 LYS A 99 11.414 0.173 14.493 1.00 51.12 H new ATOM 0 HD3 LYS A 99 11.345 1.922 14.577 1.00 51.12 H new ATOM 0 HE2 LYS A 99 10.772 -0.004 16.868 1.00 72.34 H new ATOM 0 HE3 LYS A 99 12.219 0.967 16.678 1.00 72.34 H new ATOM 0 HZ1 LYS A 99 11.037 2.277 18.069 1.00 43.12 H new ATOM 0 HZ2 LYS A 99 10.462 2.900 16.598 1.00 43.12 H new ATOM 0 HZ3 LYS A 99 9.527 1.783 17.471 1.00 43.12 H new ATOM 1250 N ASN A 100 8.689 2.960 10.332 1.00 60.13 N ATOM 1251 CA ASN A 100 8.295 2.921 8.897 1.00 2.34 C ATOM 1252 C ASN A 100 7.472 1.672 8.614 1.00 43.54 C ATOM 1253 O ASN A 100 7.654 1.009 7.592 1.00 11.14 O ATOM 1254 CB ASN A 100 9.539 2.938 7.990 1.00 73.24 C ATOM 1255 CG ASN A 100 10.379 4.177 8.159 1.00 70.13 C ATOM 1256 OD1 ASN A 100 9.871 5.248 8.448 1.00 63.20 O ATOM 1257 ND2 ASN A 100 11.668 4.033 7.997 1.00 62.53 N ATOM 0 H ASN A 100 8.347 3.781 10.831 1.00 60.13 H new ATOM 0 HA ASN A 100 7.694 3.805 8.684 1.00 2.34 H new ATOM 0 HB2 ASN A 100 10.149 2.061 8.205 1.00 73.24 H new ATOM 0 HB3 ASN A 100 9.223 2.860 6.950 1.00 73.24 H new ATOM 0 HD21 ASN A 100 12.289 4.834 8.112 1.00 62.53 H new ATOM 0 HD22 ASN A 100 12.053 3.120 7.755 1.00 62.53 H new ATOM 1264 N LEU A 101 6.521 1.407 9.486 1.00 74.33 N ATOM 1265 CA LEU A 101 5.706 0.203 9.424 1.00 61.35 C ATOM 1266 C LEU A 101 4.260 0.571 9.225 1.00 71.03 C ATOM 1267 O LEU A 101 3.754 1.468 9.894 1.00 14.31 O ATOM 1268 CB LEU A 101 5.800 -0.534 10.757 1.00 1.00 C ATOM 1269 CG LEU A 101 4.920 -1.772 10.901 1.00 12.34 C ATOM 1270 CD1 LEU A 101 5.421 -2.910 10.058 1.00 53.22 C ATOM 1271 CD2 LEU A 101 4.747 -2.170 12.351 1.00 0.45 C ATOM 0 H LEU A 101 6.287 2.023 10.265 1.00 74.33 H new ATOM 0 HA LEU A 101 6.062 -0.416 8.600 1.00 61.35 H new ATOM 0 HB2 LEU A 101 6.837 -0.830 10.913 1.00 1.00 H new ATOM 0 HB3 LEU A 101 5.544 0.164 11.554 1.00 1.00 H new ATOM 0 HG LEU A 101 3.930 -1.512 10.525 1.00 12.34 H new ATOM 0 HD11 LEU A 101 4.768 -3.773 10.187 1.00 53.22 H new ATOM 0 HD12 LEU A 101 5.425 -2.612 9.010 1.00 53.22 H new ATOM 0 HD13 LEU A 101 6.434 -3.172 10.365 1.00 53.22 H new ATOM 0 HD21 LEU A 101 4.114 -3.055 12.412 1.00 0.45 H new ATOM 0 HD22 LEU A 101 5.722 -2.390 12.787 1.00 0.45 H new ATOM 0 HD23 LEU A 101 4.280 -1.352 12.900 1.00 0.45 H new ATOM 1283 N ILE A 102 3.593 -0.112 8.332 1.00 32.45 N ATOM 1284 CA ILE A 102 2.199 0.137 8.108 1.00 71.45 C ATOM 1285 C ILE A 102 1.458 -1.127 7.639 1.00 32.53 C ATOM 1286 O ILE A 102 1.884 -1.821 6.711 1.00 75.12 O ATOM 1287 CB ILE A 102 1.980 1.323 7.131 1.00 55.24 C ATOM 1288 CG1 ILE A 102 0.479 1.608 6.927 1.00 23.42 C ATOM 1289 CG2 ILE A 102 2.679 1.058 5.809 1.00 31.41 C ATOM 1290 CD1 ILE A 102 0.192 2.830 6.076 1.00 75.13 C ATOM 0 H ILE A 102 3.996 -0.845 7.749 1.00 32.45 H new ATOM 0 HA ILE A 102 1.768 0.422 9.068 1.00 71.45 H new ATOM 0 HB ILE A 102 2.421 2.216 7.573 1.00 55.24 H new ATOM 0 HG12 ILE A 102 0.015 0.738 6.463 1.00 23.42 H new ATOM 0 HG13 ILE A 102 0.009 1.738 7.902 1.00 23.42 H new ATOM 0 HG21 ILE A 102 2.515 1.899 5.136 1.00 31.41 H new ATOM 0 HG22 ILE A 102 3.748 0.934 5.981 1.00 31.41 H new ATOM 0 HG23 ILE A 102 2.276 0.150 5.360 1.00 31.41 H new ATOM 0 HD11 ILE A 102 -0.886 2.962 5.980 1.00 75.13 H new ATOM 0 HD12 ILE A 102 0.625 3.712 6.548 1.00 75.13 H new ATOM 0 HD13 ILE A 102 0.630 2.696 5.087 1.00 75.13 H new ATOM 1302 N THR A 103 0.400 -1.425 8.324 1.00 24.25 N ATOM 1303 CA THR A 103 -0.482 -2.519 8.011 1.00 3.44 C ATOM 1304 C THR A 103 -1.718 -1.991 7.248 1.00 74.05 C ATOM 1305 O THR A 103 -2.477 -1.151 7.769 1.00 3.12 O ATOM 1306 CB THR A 103 -0.951 -3.191 9.322 1.00 71.42 C ATOM 1307 OG1 THR A 103 0.188 -3.609 10.085 1.00 61.01 O ATOM 1308 CG2 THR A 103 -1.825 -4.397 9.037 1.00 61.23 C ATOM 0 H THR A 103 0.111 -0.898 9.148 1.00 24.25 H new ATOM 0 HA THR A 103 0.049 -3.242 7.392 1.00 3.44 H new ATOM 0 HB THR A 103 -1.534 -2.462 9.885 1.00 71.42 H new ATOM 0 HG1 THR A 103 -0.107 -4.170 10.832 1.00 61.01 H new ATOM 0 HG21 THR A 103 -2.140 -4.849 9.978 1.00 61.23 H new ATOM 0 HG22 THR A 103 -2.704 -4.084 8.473 1.00 61.23 H new ATOM 0 HG23 THR A 103 -1.261 -5.126 8.455 1.00 61.23 H new ATOM 1316 N PHE A 104 -1.904 -2.480 6.041 1.00 41.54 N ATOM 1317 CA PHE A 104 -3.017 -2.098 5.190 1.00 45.53 C ATOM 1318 C PHE A 104 -4.064 -3.189 5.184 1.00 64.11 C ATOM 1319 O PHE A 104 -3.739 -4.371 5.030 1.00 22.14 O ATOM 1320 CB PHE A 104 -2.555 -1.933 3.723 1.00 51.21 C ATOM 1321 CG PHE A 104 -1.557 -0.864 3.444 1.00 55.42 C ATOM 1322 CD1 PHE A 104 -1.956 0.450 3.251 1.00 61.11 C ATOM 1323 CD2 PHE A 104 -0.221 -1.178 3.331 1.00 10.30 C ATOM 1324 CE1 PHE A 104 -1.027 1.426 2.953 1.00 13.31 C ATOM 1325 CE2 PHE A 104 0.704 -0.213 3.042 1.00 1.33 C ATOM 1326 CZ PHE A 104 0.308 1.089 2.849 1.00 43.12 C ATOM 0 H PHE A 104 -1.279 -3.164 5.615 1.00 41.54 H new ATOM 0 HA PHE A 104 -3.415 -1.161 5.581 1.00 45.53 H new ATOM 0 HB2 PHE A 104 -2.135 -2.883 3.391 1.00 51.21 H new ATOM 0 HB3 PHE A 104 -3.436 -1.742 3.110 1.00 51.21 H new ATOM 0 HD1 PHE A 104 -3.001 0.711 3.334 1.00 61.11 H new ATOM 0 HD2 PHE A 104 0.100 -2.199 3.472 1.00 10.30 H new ATOM 0 HE1 PHE A 104 -1.342 2.448 2.802 1.00 13.31 H new ATOM 0 HE2 PHE A 104 1.749 -0.475 2.965 1.00 1.33 H new ATOM 0 HZ PHE A 104 1.040 1.848 2.616 1.00 43.12 H new ATOM 1336 N ARG A 105 -5.296 -2.807 5.347 1.00 42.21 N ATOM 1337 CA ARG A 105 -6.397 -3.710 5.161 1.00 33.23 C ATOM 1338 C ARG A 105 -7.081 -3.276 3.895 1.00 62.01 C ATOM 1339 O ARG A 105 -7.544 -2.136 3.799 1.00 44.31 O ATOM 1340 CB ARG A 105 -7.422 -3.652 6.327 1.00 62.01 C ATOM 1341 CG ARG A 105 -8.634 -4.566 6.080 1.00 54.35 C ATOM 1342 CD ARG A 105 -9.769 -4.373 7.087 1.00 74.33 C ATOM 1343 NE ARG A 105 -9.390 -4.679 8.475 1.00 35.41 N ATOM 1344 CZ ARG A 105 -10.105 -5.452 9.318 1.00 13.23 C ATOM 1345 NH1 ARG A 105 -11.196 -6.091 8.898 1.00 64.33 N ATOM 1346 NH2 ARG A 105 -9.716 -5.576 10.579 1.00 23.14 N ATOM 0 H ARG A 105 -5.568 -1.861 5.613 1.00 42.21 H new ATOM 0 HA ARG A 105 -6.024 -4.733 5.121 1.00 33.23 H new ATOM 0 HB2 ARG A 105 -6.931 -3.945 7.255 1.00 62.01 H new ATOM 0 HB3 ARG A 105 -7.764 -2.625 6.458 1.00 62.01 H new ATOM 0 HG2 ARG A 105 -9.017 -4.383 5.076 1.00 54.35 H new ATOM 0 HG3 ARG A 105 -8.306 -5.605 6.111 1.00 54.35 H new ATOM 0 HD2 ARG A 105 -10.117 -3.341 7.034 1.00 74.33 H new ATOM 0 HD3 ARG A 105 -10.608 -5.008 6.801 1.00 74.33 H new ATOM 0 HE ARG A 105 -8.521 -4.276 8.826 1.00 35.41 H new ATOM 0 HH11 ARG A 105 -11.500 -5.999 7.929 1.00 64.33 H new ATOM 0 HH12 ARG A 105 -11.728 -6.672 9.546 1.00 64.33 H new ATOM 0 HH21 ARG A 105 -8.882 -5.089 10.906 1.00 23.14 H new ATOM 0 HH22 ARG A 105 -10.251 -6.159 11.223 1.00 23.14 H new ATOM 1360 N VAL A 106 -7.117 -4.131 2.917 1.00 3.52 N ATOM 1361 CA VAL A 106 -7.768 -3.787 1.685 1.00 64.31 C ATOM 1362 C VAL A 106 -9.264 -3.977 1.865 1.00 42.20 C ATOM 1363 O VAL A 106 -9.712 -5.057 2.265 1.00 10.55 O ATOM 1364 CB VAL A 106 -7.235 -4.639 0.509 1.00 24.32 C ATOM 1365 CG1 VAL A 106 -7.914 -4.257 -0.780 1.00 1.53 C ATOM 1366 CG2 VAL A 106 -5.734 -4.469 0.372 1.00 71.54 C ATOM 0 H VAL A 106 -6.707 -5.065 2.945 1.00 3.52 H new ATOM 0 HA VAL A 106 -7.556 -2.747 1.439 1.00 64.31 H new ATOM 0 HB VAL A 106 -7.457 -5.685 0.721 1.00 24.32 H new ATOM 0 HG11 VAL A 106 -7.523 -4.869 -1.593 1.00 1.53 H new ATOM 0 HG12 VAL A 106 -8.988 -4.419 -0.688 1.00 1.53 H new ATOM 0 HG13 VAL A 106 -7.723 -3.205 -0.994 1.00 1.53 H new ATOM 0 HG21 VAL A 106 -5.374 -5.075 -0.460 1.00 71.54 H new ATOM 0 HG22 VAL A 106 -5.502 -3.421 0.185 1.00 71.54 H new ATOM 0 HG23 VAL A 106 -5.246 -4.790 1.292 1.00 71.54 H new ATOM 1376 N ILE A 107 -10.030 -2.930 1.607 1.00 23.53 N ATOM 1377 CA ILE A 107 -11.457 -2.989 1.851 1.00 22.41 C ATOM 1378 C ILE A 107 -12.249 -3.256 0.568 1.00 11.12 C ATOM 1379 O ILE A 107 -13.149 -4.089 0.561 1.00 35.24 O ATOM 1380 CB ILE A 107 -11.975 -1.730 2.598 1.00 53.11 C ATOM 1381 CG1 ILE A 107 -11.845 -0.498 1.746 1.00 10.21 C ATOM 1382 CG2 ILE A 107 -11.167 -1.528 3.868 1.00 13.23 C ATOM 1383 CD1 ILE A 107 -12.279 0.753 2.428 1.00 72.41 C ATOM 0 H ILE A 107 -9.692 -2.043 1.234 1.00 23.53 H new ATOM 0 HA ILE A 107 -11.625 -3.840 2.511 1.00 22.41 H new ATOM 0 HB ILE A 107 -13.028 -1.887 2.832 1.00 53.11 H new ATOM 0 HG12 ILE A 107 -10.806 -0.390 1.436 1.00 10.21 H new ATOM 0 HG13 ILE A 107 -12.436 -0.630 0.840 1.00 10.21 H new ATOM 0 HG21 ILE A 107 -11.530 -0.644 4.393 1.00 13.23 H new ATOM 0 HG22 ILE A 107 -11.275 -2.402 4.511 1.00 13.23 H new ATOM 0 HG23 ILE A 107 -10.116 -1.392 3.613 1.00 13.23 H new ATOM 0 HD11 ILE A 107 -12.156 1.598 1.751 1.00 72.41 H new ATOM 0 HD12 ILE A 107 -13.327 0.667 2.714 1.00 72.41 H new ATOM 0 HD13 ILE A 107 -11.672 0.911 3.319 1.00 72.41 H new ATOM 1395 N GLU A 108 -11.903 -2.553 -0.513 1.00 23.14 N ATOM 1396 CA GLU A 108 -12.525 -2.785 -1.820 1.00 72.44 C ATOM 1397 C GLU A 108 -12.009 -4.110 -2.354 1.00 41.04 C ATOM 1398 O GLU A 108 -12.733 -5.107 -2.388 1.00 22.25 O ATOM 1399 CB GLU A 108 -12.174 -1.628 -2.778 1.00 61.21 C ATOM 1400 CG GLU A 108 -12.689 -1.768 -4.207 1.00 2.23 C ATOM 1401 CD GLU A 108 -14.187 -1.848 -4.292 1.00 34.43 C ATOM 1402 OE1 GLU A 108 -14.844 -0.797 -4.282 1.00 3.22 O ATOM 1403 OE2 GLU A 108 -14.726 -2.968 -4.392 1.00 12.25 O ATOM 0 H GLU A 108 -11.196 -1.818 -0.510 1.00 23.14 H new ATOM 0 HA GLU A 108 -13.611 -2.824 -1.731 1.00 72.44 H new ATOM 0 HB2 GLU A 108 -12.569 -0.702 -2.359 1.00 61.21 H new ATOM 0 HB3 GLU A 108 -11.089 -1.526 -2.811 1.00 61.21 H new ATOM 0 HG2 GLU A 108 -12.343 -0.918 -4.796 1.00 2.23 H new ATOM 0 HG3 GLU A 108 -12.258 -2.663 -4.655 1.00 2.23 H new ATOM 1410 N GLY A 109 -10.753 -4.089 -2.751 1.00 4.40 N ATOM 1411 CA GLY A 109 -10.027 -5.265 -3.115 1.00 73.30 C ATOM 1412 C GLY A 109 -10.481 -6.004 -4.340 1.00 13.42 C ATOM 1413 O GLY A 109 -11.535 -6.628 -4.354 1.00 42.34 O ATOM 0 H GLY A 109 -10.207 -3.231 -2.827 1.00 4.40 H new ATOM 0 HA2 GLY A 109 -8.983 -4.986 -3.257 1.00 73.30 H new ATOM 0 HA3 GLY A 109 -10.060 -5.956 -2.273 1.00 73.30 H new ATOM 1417 N ASP A 110 -9.665 -5.949 -5.369 1.00 23.24 N ATOM 1418 CA ASP A 110 -9.835 -6.833 -6.526 1.00 31.44 C ATOM 1419 C ASP A 110 -9.504 -8.235 -6.033 1.00 4.45 C ATOM 1420 O ASP A 110 -10.046 -9.239 -6.482 1.00 24.32 O ATOM 1421 CB ASP A 110 -8.863 -6.425 -7.639 1.00 62.53 C ATOM 1422 CG ASP A 110 -8.951 -7.307 -8.872 1.00 43.14 C ATOM 1423 OD1 ASP A 110 -9.863 -7.091 -9.710 1.00 51.12 O ATOM 1424 OD2 ASP A 110 -8.085 -8.192 -9.050 1.00 42.32 O ATOM 0 H ASP A 110 -8.876 -5.307 -5.439 1.00 23.24 H new ATOM 0 HA ASP A 110 -10.846 -6.779 -6.930 1.00 31.44 H new ATOM 0 HB2 ASP A 110 -9.063 -5.393 -7.925 1.00 62.53 H new ATOM 0 HB3 ASP A 110 -7.845 -6.456 -7.251 1.00 62.53 H new ATOM 1429 N LEU A 111 -8.633 -8.240 -5.023 1.00 72.44 N ATOM 1430 CA LEU A 111 -8.165 -9.418 -4.338 1.00 12.24 C ATOM 1431 C LEU A 111 -9.330 -10.097 -3.605 1.00 20.41 C ATOM 1432 O LEU A 111 -9.352 -11.299 -3.458 1.00 21.32 O ATOM 1433 CB LEU A 111 -7.055 -9.049 -3.304 1.00 43.42 C ATOM 1434 CG LEU A 111 -5.763 -8.338 -3.810 1.00 62.22 C ATOM 1435 CD1 LEU A 111 -5.137 -9.069 -4.979 1.00 22.52 C ATOM 1436 CD2 LEU A 111 -5.986 -6.856 -4.125 1.00 63.12 C ATOM 0 H LEU A 111 -8.225 -7.381 -4.654 1.00 72.44 H new ATOM 0 HA LEU A 111 -7.749 -10.100 -5.079 1.00 12.24 H new ATOM 0 HB2 LEU A 111 -7.509 -8.409 -2.547 1.00 43.42 H new ATOM 0 HB3 LEU A 111 -6.751 -9.969 -2.804 1.00 43.42 H new ATOM 0 HG LEU A 111 -5.053 -8.375 -2.984 1.00 62.22 H new ATOM 0 HD11 LEU A 111 -4.240 -8.540 -5.300 1.00 22.52 H new ATOM 0 HD12 LEU A 111 -4.872 -10.082 -4.675 1.00 22.52 H new ATOM 0 HD13 LEU A 111 -5.848 -9.112 -5.804 1.00 22.52 H new ATOM 0 HD21 LEU A 111 -5.053 -6.413 -4.473 1.00 63.12 H new ATOM 0 HD22 LEU A 111 -6.745 -6.759 -4.901 1.00 63.12 H new ATOM 0 HD23 LEU A 111 -6.320 -6.339 -3.225 1.00 63.12 H new ATOM 1448 N MET A 112 -10.315 -9.297 -3.186 1.00 1.30 N ATOM 1449 CA MET A 112 -11.496 -9.782 -2.435 1.00 65.54 C ATOM 1450 C MET A 112 -12.364 -10.738 -3.221 1.00 61.01 C ATOM 1451 O MET A 112 -13.276 -11.351 -2.666 1.00 24.50 O ATOM 1452 CB MET A 112 -12.358 -8.631 -1.931 1.00 23.31 C ATOM 1453 CG MET A 112 -11.981 -7.959 -0.585 1.00 42.23 C ATOM 1454 SD MET A 112 -10.261 -7.424 -0.398 1.00 11.44 S ATOM 1455 CE MET A 112 -9.460 -8.959 0.059 1.00 2.13 C ATOM 0 H MET A 112 -10.324 -8.291 -3.354 1.00 1.30 H new ATOM 0 HA MET A 112 -11.080 -10.329 -1.589 1.00 65.54 H new ATOM 0 HB2 MET A 112 -12.360 -7.857 -2.699 1.00 23.31 H new ATOM 0 HB3 MET A 112 -13.381 -8.996 -1.844 1.00 23.31 H new ATOM 0 HG2 MET A 112 -12.625 -7.090 -0.446 1.00 42.23 H new ATOM 0 HG3 MET A 112 -12.210 -8.657 0.220 1.00 42.23 H new ATOM 0 HE1 MET A 112 -8.754 -8.774 0.869 1.00 2.13 H new ATOM 0 HE2 MET A 112 -10.211 -9.677 0.389 1.00 2.13 H new ATOM 0 HE3 MET A 112 -8.927 -9.362 -0.802 1.00 2.13 H new ATOM 1465 N LYS A 113 -12.115 -10.864 -4.493 1.00 15.35 N ATOM 1466 CA LYS A 113 -12.892 -11.771 -5.286 1.00 1.34 C ATOM 1467 C LYS A 113 -12.277 -13.165 -5.235 1.00 64.25 C ATOM 1468 O LYS A 113 -12.946 -14.170 -5.494 1.00 31.53 O ATOM 1469 CB LYS A 113 -13.023 -11.263 -6.720 1.00 25.22 C ATOM 1470 CG LYS A 113 -13.616 -9.849 -6.828 1.00 33.44 C ATOM 1471 CD LYS A 113 -14.992 -9.726 -6.151 1.00 42.34 C ATOM 1472 CE LYS A 113 -16.033 -10.650 -6.767 1.00 12.34 C ATOM 1473 NZ LYS A 113 -17.338 -10.524 -6.091 1.00 21.20 N ATOM 0 H LYS A 113 -11.389 -10.356 -4.998 1.00 15.35 H new ATOM 0 HA LYS A 113 -13.899 -11.831 -4.873 1.00 1.34 H new ATOM 0 HB2 LYS A 113 -12.039 -11.271 -7.189 1.00 25.22 H new ATOM 0 HB3 LYS A 113 -13.650 -11.953 -7.284 1.00 25.22 H new ATOM 0 HG2 LYS A 113 -12.928 -9.136 -6.374 1.00 33.44 H new ATOM 0 HG3 LYS A 113 -13.708 -9.578 -7.880 1.00 33.44 H new ATOM 0 HD2 LYS A 113 -14.892 -9.954 -5.090 1.00 42.34 H new ATOM 0 HD3 LYS A 113 -15.338 -8.695 -6.225 1.00 42.34 H new ATOM 0 HE2 LYS A 113 -16.147 -10.417 -7.826 1.00 12.34 H new ATOM 0 HE3 LYS A 113 -15.688 -11.682 -6.703 1.00 12.34 H new ATOM 0 HZ1 LYS A 113 -18.023 -11.167 -6.536 1.00 21.20 H new ATOM 0 HZ2 LYS A 113 -17.234 -10.771 -5.086 1.00 21.20 H new ATOM 0 HZ3 LYS A 113 -17.679 -9.545 -6.173 1.00 21.20 H new ATOM 1487 N GLU A 114 -11.015 -13.219 -4.873 1.00 11.02 N ATOM 1488 CA GLU A 114 -10.306 -14.485 -4.750 1.00 41.42 C ATOM 1489 C GLU A 114 -10.026 -14.809 -3.286 1.00 4.31 C ATOM 1490 O GLU A 114 -10.025 -15.978 -2.872 1.00 62.51 O ATOM 1491 CB GLU A 114 -8.977 -14.502 -5.544 1.00 70.20 C ATOM 1492 CG GLU A 114 -9.086 -14.508 -7.078 1.00 44.41 C ATOM 1493 CD GLU A 114 -9.675 -13.257 -7.686 1.00 43.12 C ATOM 1494 OE1 GLU A 114 -8.935 -12.265 -7.837 1.00 10.54 O ATOM 1495 OE2 GLU A 114 -10.858 -13.272 -8.075 1.00 71.25 O ATOM 0 H GLU A 114 -10.450 -12.398 -4.656 1.00 11.02 H new ATOM 0 HA GLU A 114 -10.960 -15.246 -5.177 1.00 41.42 H new ATOM 0 HB2 GLU A 114 -8.393 -13.630 -5.248 1.00 70.20 H new ATOM 0 HB3 GLU A 114 -8.411 -15.383 -5.240 1.00 70.20 H new ATOM 0 HG2 GLU A 114 -8.091 -14.662 -7.496 1.00 44.41 H new ATOM 0 HG3 GLU A 114 -9.695 -15.361 -7.380 1.00 44.41 H new ATOM 1502 N TYR A 115 -9.793 -13.778 -2.509 1.00 43.31 N ATOM 1503 CA TYR A 115 -9.469 -13.913 -1.111 1.00 43.24 C ATOM 1504 C TYR A 115 -10.499 -13.159 -0.340 1.00 3.20 C ATOM 1505 O TYR A 115 -10.842 -12.052 -0.693 1.00 30.50 O ATOM 1506 CB TYR A 115 -8.080 -13.311 -0.840 1.00 74.42 C ATOM 1507 CG TYR A 115 -7.094 -13.722 -1.880 1.00 71.41 C ATOM 1508 CD1 TYR A 115 -6.578 -14.998 -1.913 1.00 3.34 C ATOM 1509 CD2 TYR A 115 -6.736 -12.844 -2.877 1.00 30.50 C ATOM 1510 CE1 TYR A 115 -5.724 -15.378 -2.915 1.00 11.14 C ATOM 1511 CE2 TYR A 115 -5.903 -13.217 -3.886 1.00 31.15 C ATOM 1512 CZ TYR A 115 -5.397 -14.482 -3.901 1.00 23.35 C ATOM 1513 OH TYR A 115 -4.577 -14.860 -4.914 1.00 62.13 O ATOM 0 H TYR A 115 -9.824 -12.812 -2.834 1.00 43.31 H new ATOM 0 HA TYR A 115 -9.456 -14.963 -0.818 1.00 43.24 H new ATOM 0 HB2 TYR A 115 -8.152 -12.224 -0.815 1.00 74.42 H new ATOM 0 HB3 TYR A 115 -7.729 -13.630 0.142 1.00 74.42 H new ATOM 0 HD1 TYR A 115 -6.849 -15.705 -1.143 1.00 3.34 H new ATOM 0 HD2 TYR A 115 -7.125 -11.837 -2.858 1.00 30.50 H new ATOM 0 HE1 TYR A 115 -5.311 -16.376 -2.928 1.00 11.14 H new ATOM 0 HE2 TYR A 115 -5.645 -12.517 -4.667 1.00 31.15 H new ATOM 0 HH TYR A 115 -4.383 -14.087 -5.484 1.00 62.13 H new ATOM 1523 N LYS A 116 -10.974 -13.731 0.715 1.00 72.11 N ATOM 1524 CA LYS A 116 -12.036 -13.110 1.489 1.00 53.43 C ATOM 1525 C LYS A 116 -11.519 -12.031 2.432 1.00 11.21 C ATOM 1526 O LYS A 116 -12.288 -11.397 3.148 1.00 44.52 O ATOM 1527 CB LYS A 116 -12.885 -14.175 2.178 1.00 72.35 C ATOM 1528 CG LYS A 116 -12.095 -15.184 2.982 1.00 33.35 C ATOM 1529 CD LYS A 116 -12.944 -16.391 3.355 1.00 3.22 C ATOM 1530 CE LYS A 116 -14.116 -16.034 4.250 1.00 64.54 C ATOM 1531 NZ LYS A 116 -14.943 -17.225 4.550 1.00 50.25 N ATOM 0 H LYS A 116 -10.653 -14.630 1.075 1.00 72.11 H new ATOM 0 HA LYS A 116 -12.693 -12.577 0.801 1.00 53.43 H new ATOM 0 HB2 LYS A 116 -13.598 -13.682 2.838 1.00 72.35 H new ATOM 0 HB3 LYS A 116 -13.464 -14.705 1.422 1.00 72.35 H new ATOM 0 HG2 LYS A 116 -11.229 -15.511 2.406 1.00 33.35 H new ATOM 0 HG3 LYS A 116 -11.715 -14.711 3.888 1.00 33.35 H new ATOM 0 HD2 LYS A 116 -13.318 -16.861 2.445 1.00 3.22 H new ATOM 0 HD3 LYS A 116 -12.318 -17.127 3.860 1.00 3.22 H new ATOM 0 HE2 LYS A 116 -13.748 -15.600 5.180 1.00 64.54 H new ATOM 0 HE3 LYS A 116 -14.729 -15.275 3.765 1.00 64.54 H new ATOM 0 HZ1 LYS A 116 -15.737 -16.951 5.164 1.00 50.25 H new ATOM 0 HZ2 LYS A 116 -15.312 -17.623 3.663 1.00 50.25 H new ATOM 0 HZ3 LYS A 116 -14.361 -17.938 5.034 1.00 50.25 H new ATOM 1545 N SER A 117 -10.218 -11.825 2.399 1.00 11.43 N ATOM 1546 CA SER A 117 -9.550 -10.775 3.125 1.00 1.33 C ATOM 1547 C SER A 117 -8.089 -10.782 2.751 1.00 64.23 C ATOM 1548 O SER A 117 -7.523 -11.850 2.473 1.00 2.01 O ATOM 1549 CB SER A 117 -9.732 -10.932 4.625 1.00 74.11 C ATOM 1550 OG SER A 117 -9.121 -9.871 5.352 1.00 15.33 O ATOM 0 H SER A 117 -9.582 -12.403 1.849 1.00 11.43 H new ATOM 0 HA SER A 117 -9.992 -9.816 2.855 1.00 1.33 H new ATOM 0 HB2 SER A 117 -10.796 -10.966 4.859 1.00 74.11 H new ATOM 0 HB3 SER A 117 -9.305 -11.883 4.944 1.00 74.11 H new ATOM 0 HG SER A 117 -9.262 -10.008 6.312 1.00 15.33 H new ATOM 1556 N PHE A 118 -7.504 -9.611 2.703 1.00 22.23 N ATOM 1557 CA PHE A 118 -6.120 -9.438 2.360 1.00 50.12 C ATOM 1558 C PHE A 118 -5.541 -8.320 3.211 1.00 64.25 C ATOM 1559 O PHE A 118 -5.927 -7.146 3.077 1.00 44.50 O ATOM 1560 CB PHE A 118 -5.974 -9.146 0.848 1.00 71.43 C ATOM 1561 CG PHE A 118 -4.572 -8.903 0.382 1.00 74.14 C ATOM 1562 CD1 PHE A 118 -3.698 -9.947 0.199 1.00 2.11 C ATOM 1563 CD2 PHE A 118 -4.135 -7.625 0.131 1.00 41.11 C ATOM 1564 CE1 PHE A 118 -2.405 -9.716 -0.220 1.00 10.53 C ATOM 1565 CE2 PHE A 118 -2.850 -7.386 -0.289 1.00 74.51 C ATOM 1566 CZ PHE A 118 -1.983 -8.429 -0.465 1.00 13.30 C ATOM 0 H PHE A 118 -7.988 -8.737 2.906 1.00 22.23 H new ATOM 0 HA PHE A 118 -5.564 -10.353 2.563 1.00 50.12 H new ATOM 0 HB2 PHE A 118 -6.386 -9.987 0.290 1.00 71.43 H new ATOM 0 HB3 PHE A 118 -6.579 -8.273 0.602 1.00 71.43 H new ATOM 0 HD1 PHE A 118 -4.027 -10.959 0.385 1.00 2.11 H new ATOM 0 HD2 PHE A 118 -4.813 -6.795 0.266 1.00 41.11 H new ATOM 0 HE1 PHE A 118 -1.724 -10.543 -0.356 1.00 10.53 H new ATOM 0 HE2 PHE A 118 -2.524 -6.374 -0.480 1.00 74.51 H new ATOM 0 HZ PHE A 118 -0.971 -8.244 -0.795 1.00 13.30 H new ATOM 1576 N LEU A 119 -4.663 -8.692 4.098 1.00 42.13 N ATOM 1577 CA LEU A 119 -4.034 -7.778 5.006 1.00 54.21 C ATOM 1578 C LEU A 119 -2.543 -7.794 4.709 1.00 50.33 C ATOM 1579 O LEU A 119 -1.927 -8.858 4.660 1.00 53.15 O ATOM 1580 CB LEU A 119 -4.283 -8.275 6.442 1.00 41.41 C ATOM 1581 CG LEU A 119 -3.827 -7.371 7.591 1.00 51.21 C ATOM 1582 CD1 LEU A 119 -4.642 -6.090 7.622 1.00 51.34 C ATOM 1583 CD2 LEU A 119 -3.925 -8.107 8.920 1.00 64.23 C ATOM 0 H LEU A 119 -4.359 -9.659 4.212 1.00 42.13 H new ATOM 0 HA LEU A 119 -4.430 -6.768 4.898 1.00 54.21 H new ATOM 0 HB2 LEU A 119 -5.353 -8.451 6.556 1.00 41.41 H new ATOM 0 HB3 LEU A 119 -3.787 -9.239 6.555 1.00 41.41 H new ATOM 0 HG LEU A 119 -2.783 -7.104 7.425 1.00 51.21 H new ATOM 0 HD11 LEU A 119 -4.302 -5.462 8.446 1.00 51.34 H new ATOM 0 HD12 LEU A 119 -4.514 -5.555 6.681 1.00 51.34 H new ATOM 0 HD13 LEU A 119 -5.696 -6.332 7.762 1.00 51.34 H new ATOM 0 HD21 LEU A 119 -3.597 -7.449 9.725 1.00 64.23 H new ATOM 0 HD22 LEU A 119 -4.958 -8.407 9.095 1.00 64.23 H new ATOM 0 HD23 LEU A 119 -3.290 -8.992 8.893 1.00 64.23 H new ATOM 1595 N LEU A 120 -1.959 -6.656 4.523 1.00 14.21 N ATOM 1596 CA LEU A 120 -0.550 -6.610 4.205 1.00 11.13 C ATOM 1597 C LEU A 120 0.151 -5.581 5.038 1.00 20.11 C ATOM 1598 O LEU A 120 -0.316 -4.462 5.178 1.00 21.14 O ATOM 1599 CB LEU A 120 -0.269 -6.378 2.691 1.00 55.13 C ATOM 1600 CG LEU A 120 -0.721 -5.042 2.053 1.00 0.33 C ATOM 1601 CD1 LEU A 120 -0.175 -4.932 0.646 1.00 30.04 C ATOM 1602 CD2 LEU A 120 -2.239 -4.921 2.012 1.00 1.15 C ATOM 0 H LEU A 120 -2.421 -5.748 4.582 1.00 14.21 H new ATOM 0 HA LEU A 120 -0.150 -7.595 4.445 1.00 11.13 H new ATOM 0 HB2 LEU A 120 0.806 -6.473 2.535 1.00 55.13 H new ATOM 0 HB3 LEU A 120 -0.745 -7.188 2.138 1.00 55.13 H new ATOM 0 HG LEU A 120 -0.330 -4.234 2.672 1.00 0.33 H new ATOM 0 HD11 LEU A 120 -0.497 -3.989 0.203 1.00 30.04 H new ATOM 0 HD12 LEU A 120 0.914 -4.966 0.675 1.00 30.04 H new ATOM 0 HD13 LEU A 120 -0.548 -5.761 0.045 1.00 30.04 H new ATOM 0 HD21 LEU A 120 -2.516 -3.970 1.557 1.00 1.15 H new ATOM 0 HD22 LEU A 120 -2.653 -5.739 1.423 1.00 1.15 H new ATOM 0 HD23 LEU A 120 -2.635 -4.967 3.026 1.00 1.15 H new ATOM 1614 N THR A 121 1.246 -5.958 5.600 1.00 3.34 N ATOM 1615 CA THR A 121 2.004 -5.072 6.396 1.00 33.04 C ATOM 1616 C THR A 121 3.348 -4.846 5.741 1.00 12.42 C ATOM 1617 O THR A 121 4.059 -5.806 5.425 1.00 71.21 O ATOM 1618 CB THR A 121 2.196 -5.646 7.804 1.00 24.14 C ATOM 1619 OG1 THR A 121 0.914 -5.952 8.374 1.00 40.25 O ATOM 1620 CG2 THR A 121 2.897 -4.646 8.687 1.00 73.21 C ATOM 0 H THR A 121 1.639 -6.896 5.517 1.00 3.34 H new ATOM 0 HA THR A 121 1.473 -4.124 6.483 1.00 33.04 H new ATOM 0 HB THR A 121 2.802 -6.550 7.734 1.00 24.14 H new ATOM 0 HG1 THR A 121 0.678 -5.267 9.034 1.00 40.25 H new ATOM 0 HG21 THR A 121 3.026 -5.068 9.684 1.00 73.21 H new ATOM 0 HG22 THR A 121 3.873 -4.409 8.264 1.00 73.21 H new ATOM 0 HG23 THR A 121 2.299 -3.737 8.753 1.00 73.21 H new ATOM 1628 N ILE A 122 3.688 -3.607 5.522 1.00 3.34 N ATOM 1629 CA ILE A 122 4.944 -3.285 4.921 1.00 51.24 C ATOM 1630 C ILE A 122 5.765 -2.486 5.891 1.00 73.13 C ATOM 1631 O ILE A 122 5.220 -1.769 6.741 1.00 52.43 O ATOM 1632 CB ILE A 122 4.804 -2.479 3.596 1.00 75.31 C ATOM 1633 CG1 ILE A 122 4.191 -1.110 3.828 1.00 40.34 C ATOM 1634 CG2 ILE A 122 3.971 -3.241 2.594 1.00 1.33 C ATOM 1635 CD1 ILE A 122 4.162 -0.230 2.587 1.00 73.32 C ATOM 0 H ILE A 122 3.106 -2.802 5.754 1.00 3.34 H new ATOM 0 HA ILE A 122 5.427 -4.230 4.674 1.00 51.24 H new ATOM 0 HB ILE A 122 5.810 -2.339 3.201 1.00 75.31 H new ATOM 0 HG12 ILE A 122 3.173 -1.236 4.196 1.00 40.34 H new ATOM 0 HG13 ILE A 122 4.752 -0.599 4.611 1.00 40.34 H new ATOM 0 HG21 ILE A 122 3.885 -2.660 1.675 1.00 1.33 H new ATOM 0 HG22 ILE A 122 4.448 -4.197 2.376 1.00 1.33 H new ATOM 0 HG23 ILE A 122 2.977 -3.417 3.006 1.00 1.33 H new ATOM 0 HD11 ILE A 122 3.710 0.731 2.833 1.00 73.32 H new ATOM 0 HD12 ILE A 122 5.179 -0.072 2.229 1.00 73.32 H new ATOM 0 HD13 ILE A 122 3.576 -0.718 1.808 1.00 73.32 H new ATOM 1647 N GLN A 123 7.045 -2.636 5.807 1.00 60.14 N ATOM 1648 CA GLN A 123 7.933 -1.876 6.617 1.00 63.24 C ATOM 1649 C GLN A 123 9.159 -1.553 5.827 1.00 11.44 C ATOM 1650 O GLN A 123 9.791 -2.450 5.247 1.00 51.21 O ATOM 1651 CB GLN A 123 8.281 -2.618 7.899 1.00 52.34 C ATOM 1652 CG GLN A 123 9.100 -1.792 8.869 1.00 51.01 C ATOM 1653 CD GLN A 123 9.268 -2.460 10.203 1.00 51.41 C ATOM 1654 OE1 GLN A 123 9.304 -3.683 10.306 1.00 15.24 O ATOM 1655 NE2 GLN A 123 9.353 -1.670 11.237 1.00 54.10 N ATOM 0 H GLN A 123 7.504 -3.290 5.173 1.00 60.14 H new ATOM 0 HA GLN A 123 7.443 -0.948 6.912 1.00 63.24 H new ATOM 0 HB2 GLN A 123 7.360 -2.933 8.389 1.00 52.34 H new ATOM 0 HB3 GLN A 123 8.834 -3.523 7.647 1.00 52.34 H new ATOM 0 HG2 GLN A 123 10.082 -1.601 8.437 1.00 51.01 H new ATOM 0 HG3 GLN A 123 8.620 -0.824 9.010 1.00 51.01 H new ATOM 0 HE21 GLN A 123 9.319 -0.658 11.110 1.00 54.10 H new ATOM 0 HE22 GLN A 123 9.453 -2.064 12.173 1.00 54.10 H new ATOM 1664 N VAL A 124 9.494 -0.301 5.779 1.00 1.01 N ATOM 1665 CA VAL A 124 10.615 0.135 5.008 1.00 62.34 C ATOM 1666 C VAL A 124 11.831 0.225 5.914 1.00 43.35 C ATOM 1667 O VAL A 124 11.903 1.064 6.815 1.00 54.43 O ATOM 1668 CB VAL A 124 10.338 1.493 4.318 1.00 42.24 C ATOM 1669 CG1 VAL A 124 11.484 1.871 3.405 1.00 3.42 C ATOM 1670 CG2 VAL A 124 9.034 1.438 3.532 1.00 71.21 C ATOM 0 H VAL A 124 9.000 0.444 6.271 1.00 1.01 H new ATOM 0 HA VAL A 124 10.802 -0.590 4.215 1.00 62.34 H new ATOM 0 HB VAL A 124 10.246 2.255 5.092 1.00 42.24 H new ATOM 0 HG11 VAL A 124 11.270 2.828 2.930 1.00 3.42 H new ATOM 0 HG12 VAL A 124 12.402 1.952 3.988 1.00 3.42 H new ATOM 0 HG13 VAL A 124 11.607 1.105 2.639 1.00 3.42 H new ATOM 0 HG21 VAL A 124 8.856 2.401 3.054 1.00 71.21 H new ATOM 0 HG22 VAL A 124 9.101 0.662 2.770 1.00 71.21 H new ATOM 0 HG23 VAL A 124 8.210 1.211 4.209 1.00 71.21 H new ATOM 1680 N THR A 125 12.757 -0.646 5.678 1.00 5.24 N ATOM 1681 CA THR A 125 13.919 -0.780 6.496 1.00 41.12 C ATOM 1682 C THR A 125 15.176 -0.649 5.617 1.00 70.44 C ATOM 1683 O THR A 125 15.223 -1.202 4.510 1.00 14.30 O ATOM 1684 CB THR A 125 13.883 -2.180 7.172 1.00 14.25 C ATOM 1685 OG1 THR A 125 12.640 -2.334 7.891 1.00 74.20 O ATOM 1686 CG2 THR A 125 15.031 -2.374 8.141 1.00 71.31 C ATOM 0 H THR A 125 12.727 -1.298 4.895 1.00 5.24 H new ATOM 0 HA THR A 125 13.941 -0.003 7.260 1.00 41.12 H new ATOM 0 HB THR A 125 13.972 -2.927 6.383 1.00 14.25 H new ATOM 0 HG1 THR A 125 12.615 -3.217 8.316 1.00 74.20 H new ATOM 0 HG21 THR A 125 14.965 -3.365 8.589 1.00 71.31 H new ATOM 0 HG22 THR A 125 15.977 -2.279 7.608 1.00 71.31 H new ATOM 0 HG23 THR A 125 14.978 -1.618 8.924 1.00 71.31 H new ATOM 1694 N PRO A 126 16.180 0.127 6.062 1.00 62.30 N ATOM 1695 CA PRO A 126 17.442 0.278 5.335 1.00 22.33 C ATOM 1696 C PRO A 126 18.199 -1.050 5.247 1.00 3.31 C ATOM 1697 O PRO A 126 18.015 -1.950 6.098 1.00 21.32 O ATOM 1698 CB PRO A 126 18.230 1.290 6.176 1.00 24.04 C ATOM 1699 CG PRO A 126 17.610 1.229 7.524 1.00 12.41 C ATOM 1700 CD PRO A 126 16.162 0.932 7.296 1.00 45.35 C ATOM 0 HA PRO A 126 17.289 0.602 4.305 1.00 22.33 H new ATOM 0 HB2 PRO A 126 19.288 1.032 6.216 1.00 24.04 H new ATOM 0 HB3 PRO A 126 18.162 2.293 5.754 1.00 24.04 H new ATOM 0 HG2 PRO A 126 18.076 0.455 8.134 1.00 12.41 H new ATOM 0 HG3 PRO A 126 17.736 2.172 8.055 1.00 12.41 H new ATOM 0 HD2 PRO A 126 15.726 0.382 8.130 1.00 45.35 H new ATOM 0 HD3 PRO A 126 15.577 1.844 7.175 1.00 45.35 H new ATOM 1708 N LYS A 127 19.023 -1.186 4.235 1.00 72.11 N ATOM 1709 CA LYS A 127 19.763 -2.414 4.021 1.00 51.42 C ATOM 1710 C LYS A 127 21.156 -2.144 3.393 1.00 10.21 C ATOM 1711 O LYS A 127 22.170 -2.466 4.013 1.00 45.42 O ATOM 1712 CB LYS A 127 18.917 -3.410 3.215 1.00 42.10 C ATOM 1713 CG LYS A 127 19.572 -4.725 2.877 1.00 62.30 C ATOM 1714 CD LYS A 127 18.626 -5.573 2.044 1.00 32.45 C ATOM 1715 CE LYS A 127 19.241 -6.905 1.693 1.00 71.45 C ATOM 1716 NZ LYS A 127 18.346 -7.724 0.863 1.00 24.43 N ATOM 0 H LYS A 127 19.201 -0.459 3.542 1.00 72.11 H new ATOM 0 HA LYS A 127 19.965 -2.874 4.988 1.00 51.42 H new ATOM 0 HB2 LYS A 127 18.005 -3.616 3.776 1.00 42.10 H new ATOM 0 HB3 LYS A 127 18.617 -2.929 2.284 1.00 42.10 H new ATOM 0 HG2 LYS A 127 20.497 -4.550 2.328 1.00 62.30 H new ATOM 0 HG3 LYS A 127 19.839 -5.254 3.792 1.00 62.30 H new ATOM 0 HD2 LYS A 127 17.699 -5.733 2.594 1.00 32.45 H new ATOM 0 HD3 LYS A 127 18.366 -5.039 1.130 1.00 32.45 H new ATOM 0 HE2 LYS A 127 20.179 -6.742 1.163 1.00 71.45 H new ATOM 0 HE3 LYS A 127 19.482 -7.445 2.608 1.00 71.45 H new ATOM 0 HZ1 LYS A 127 18.807 -8.630 0.645 1.00 24.43 H new ATOM 0 HZ2 LYS A 127 17.460 -7.902 1.378 1.00 24.43 H new ATOM 0 HZ3 LYS A 127 18.136 -7.220 -0.022 1.00 24.43 H new ATOM 1730 N PRO A 128 21.252 -1.528 2.168 1.00 3.53 N ATOM 1731 CA PRO A 128 22.547 -1.199 1.582 1.00 24.04 C ATOM 1732 C PRO A 128 22.971 0.225 1.965 1.00 51.32 C ATOM 1733 O PRO A 128 23.977 0.752 1.471 1.00 73.45 O ATOM 1734 CB PRO A 128 22.256 -1.283 0.088 1.00 71.45 C ATOM 1735 CG PRO A 128 20.847 -0.802 -0.049 1.00 12.43 C ATOM 1736 CD PRO A 128 20.141 -1.138 1.244 1.00 13.22 C ATOM 0 HA PRO A 128 23.355 -1.851 1.913 1.00 24.04 H new ATOM 0 HB2 PRO A 128 22.944 -0.662 -0.486 1.00 71.45 H new ATOM 0 HB3 PRO A 128 22.364 -2.303 -0.280 1.00 71.45 H new ATOM 0 HG2 PRO A 128 20.822 0.272 -0.235 1.00 12.43 H new ATOM 0 HG3 PRO A 128 20.355 -1.284 -0.894 1.00 12.43 H new ATOM 0 HD2 PRO A 128 19.583 -0.284 1.628 1.00 13.22 H new ATOM 0 HD3 PRO A 128 19.428 -1.951 1.110 1.00 13.22 H new ATOM 1744 N GLY A 129 22.191 0.818 2.839 1.00 2.44 N ATOM 1745 CA GLY A 129 22.395 2.157 3.288 1.00 3.33 C ATOM 1746 C GLY A 129 21.063 2.785 3.590 1.00 31.23 C ATOM 1747 O GLY A 129 20.053 2.061 3.664 1.00 4.34 O ATOM 0 H GLY A 129 21.381 0.364 3.261 1.00 2.44 H new ATOM 0 HA2 GLY A 129 23.024 2.163 4.178 1.00 3.33 H new ATOM 0 HA3 GLY A 129 22.918 2.734 2.525 1.00 3.33 H new ATOM 1751 N GLY A 130 21.042 4.094 3.759 1.00 4.32 N ATOM 1752 CA GLY A 130 19.806 4.806 4.034 1.00 51.04 C ATOM 1753 C GLY A 130 18.970 4.986 2.773 1.00 50.41 C ATOM 1754 O GLY A 130 17.949 4.310 2.610 1.00 23.23 O ATOM 0 H GLY A 130 21.870 4.688 3.711 1.00 4.32 H new ATOM 0 HA2 GLY A 130 19.228 4.259 4.779 1.00 51.04 H new ATOM 0 HA3 GLY A 130 20.035 5.782 4.462 1.00 51.04 H new ATOM 1758 N PRO A 131 19.365 5.923 1.871 1.00 2.14 N ATOM 1759 CA PRO A 131 18.709 6.109 0.571 1.00 64.24 C ATOM 1760 C PRO A 131 18.669 4.799 -0.201 1.00 44.01 C ATOM 1761 O PRO A 131 19.692 4.125 -0.345 1.00 20.22 O ATOM 1762 CB PRO A 131 19.610 7.129 -0.159 1.00 0.51 C ATOM 1763 CG PRO A 131 20.855 7.213 0.660 1.00 34.22 C ATOM 1764 CD PRO A 131 20.452 6.889 2.061 1.00 23.03 C ATOM 0 HA PRO A 131 17.677 6.446 0.668 1.00 64.24 H new ATOM 0 HB2 PRO A 131 19.829 6.803 -1.176 1.00 0.51 H new ATOM 0 HB3 PRO A 131 19.123 8.101 -0.234 1.00 0.51 H new ATOM 0 HG2 PRO A 131 21.607 6.512 0.299 1.00 34.22 H new ATOM 0 HG3 PRO A 131 21.294 8.209 0.601 1.00 34.22 H new ATOM 0 HD2 PRO A 131 21.277 6.462 2.631 1.00 23.03 H new ATOM 0 HD3 PRO A 131 20.116 7.775 2.600 1.00 23.03 H new ATOM 1772 N GLY A 132 17.503 4.436 -0.683 1.00 2.23 N ATOM 1773 CA GLY A 132 17.365 3.169 -1.336 1.00 41.11 C ATOM 1774 C GLY A 132 17.155 2.102 -0.305 1.00 23.35 C ATOM 1775 O GLY A 132 18.048 1.294 -0.029 1.00 44.42 O ATOM 0 H GLY A 132 16.652 4.995 -0.634 1.00 2.23 H new ATOM 0 HA2 GLY A 132 16.523 3.193 -2.028 1.00 41.11 H new ATOM 0 HA3 GLY A 132 18.256 2.951 -1.925 1.00 41.11 H new ATOM 1779 N SER A 133 15.985 2.093 0.263 1.00 73.31 N ATOM 1780 CA SER A 133 15.678 1.214 1.346 1.00 5.11 C ATOM 1781 C SER A 133 14.922 -0.030 0.849 1.00 23.43 C ATOM 1782 O SER A 133 14.563 -0.129 -0.331 1.00 2.40 O ATOM 1783 CB SER A 133 14.835 1.978 2.357 1.00 70.11 C ATOM 1784 OG SER A 133 15.477 3.197 2.750 1.00 62.40 O ATOM 0 H SER A 133 15.214 2.700 -0.016 1.00 73.31 H new ATOM 0 HA SER A 133 16.602 0.870 1.810 1.00 5.11 H new ATOM 0 HB2 SER A 133 13.859 2.200 1.926 1.00 70.11 H new ATOM 0 HB3 SER A 133 14.662 1.355 3.235 1.00 70.11 H new ATOM 0 HG SER A 133 16.417 3.175 2.475 1.00 62.40 H new ATOM 1790 N ILE A 134 14.699 -0.971 1.738 1.00 51.30 N ATOM 1791 CA ILE A 134 14.013 -2.188 1.407 1.00 12.41 C ATOM 1792 C ILE A 134 12.645 -2.181 2.039 1.00 5.53 C ATOM 1793 O ILE A 134 12.493 -1.795 3.198 1.00 41.32 O ATOM 1794 CB ILE A 134 14.769 -3.388 1.974 1.00 65.14 C ATOM 1795 CG1 ILE A 134 16.152 -3.414 1.407 1.00 34.11 C ATOM 1796 CG2 ILE A 134 14.044 -4.706 1.682 1.00 32.31 C ATOM 1797 CD1 ILE A 134 16.233 -3.570 -0.089 1.00 23.13 C ATOM 0 H ILE A 134 14.991 -0.909 2.713 1.00 51.30 H new ATOM 0 HA ILE A 134 13.944 -2.259 0.322 1.00 12.41 H new ATOM 0 HB ILE A 134 14.818 -3.282 3.058 1.00 65.14 H new ATOM 0 HG12 ILE A 134 16.659 -2.491 1.687 1.00 34.11 H new ATOM 0 HG13 ILE A 134 16.702 -4.233 1.871 1.00 34.11 H new ATOM 0 HG21 ILE A 134 14.614 -5.535 2.102 1.00 32.31 H new ATOM 0 HG22 ILE A 134 13.052 -4.683 2.132 1.00 32.31 H new ATOM 0 HG23 ILE A 134 13.950 -4.839 0.604 1.00 32.31 H new ATOM 0 HD11 ILE A 134 17.278 -3.577 -0.398 1.00 23.13 H new ATOM 0 HD12 ILE A 134 15.761 -4.508 -0.383 1.00 23.13 H new ATOM 0 HD13 ILE A 134 15.718 -2.738 -0.570 1.00 23.13 H new ATOM 1809 N VAL A 135 11.677 -2.599 1.315 1.00 31.15 N ATOM 1810 CA VAL A 135 10.342 -2.688 1.840 1.00 44.23 C ATOM 1811 C VAL A 135 10.068 -4.127 2.142 1.00 42.05 C ATOM 1812 O VAL A 135 10.080 -4.968 1.240 1.00 41.40 O ATOM 1813 CB VAL A 135 9.263 -2.222 0.848 1.00 10.33 C ATOM 1814 CG1 VAL A 135 7.916 -2.071 1.548 1.00 44.21 C ATOM 1815 CG2 VAL A 135 9.651 -0.964 0.143 1.00 42.52 C ATOM 0 H VAL A 135 11.773 -2.892 0.343 1.00 31.15 H new ATOM 0 HA VAL A 135 10.294 -2.041 2.716 1.00 44.23 H new ATOM 0 HB VAL A 135 9.168 -2.994 0.084 1.00 10.33 H new ATOM 0 HG11 VAL A 135 7.167 -1.741 0.828 1.00 44.21 H new ATOM 0 HG12 VAL A 135 7.616 -3.030 1.970 1.00 44.21 H new ATOM 0 HG13 VAL A 135 8.002 -1.334 2.347 1.00 44.21 H new ATOM 0 HG21 VAL A 135 8.858 -0.674 -0.547 1.00 42.52 H new ATOM 0 HG22 VAL A 135 9.805 -0.170 0.874 1.00 42.52 H new ATOM 0 HG23 VAL A 135 10.574 -1.128 -0.413 1.00 42.52 H new ATOM 1825 N HIS A 136 9.857 -4.427 3.374 1.00 2.34 N ATOM 1826 CA HIS A 136 9.534 -5.767 3.755 1.00 3.33 C ATOM 1827 C HIS A 136 8.030 -5.924 3.709 1.00 41.35 C ATOM 1828 O HIS A 136 7.312 -5.321 4.506 1.00 75.24 O ATOM 1829 CB HIS A 136 10.098 -6.100 5.150 1.00 74.13 C ATOM 1830 CG HIS A 136 11.605 -6.052 5.223 1.00 41.32 C ATOM 1831 ND1 HIS A 136 12.402 -7.129 4.932 1.00 3.33 N ATOM 1832 CD2 HIS A 136 12.456 -5.039 5.542 1.00 5.45 C ATOM 1833 CE1 HIS A 136 13.668 -6.794 5.062 1.00 70.32 C ATOM 1834 NE2 HIS A 136 13.728 -5.534 5.428 1.00 41.44 N ATOM 0 H HIS A 136 9.901 -3.761 4.145 1.00 2.34 H new ATOM 0 HA HIS A 136 9.993 -6.471 3.061 1.00 3.33 H new ATOM 0 HB2 HIS A 136 9.686 -5.399 5.876 1.00 74.13 H new ATOM 0 HB3 HIS A 136 9.761 -7.095 5.440 1.00 74.13 H new ATOM 0 HD2 HIS A 136 12.181 -4.035 5.830 1.00 5.45 H new ATOM 0 HE1 HIS A 136 14.514 -7.445 4.896 1.00 70.32 H new ATOM 0 HE2 HIS A 136 14.585 -5.008 5.600 1.00 41.44 H new ATOM 1843 N TRP A 137 7.567 -6.696 2.765 1.00 20.21 N ATOM 1844 CA TRP A 137 6.157 -6.907 2.539 1.00 31.51 C ATOM 1845 C TRP A 137 5.710 -8.199 3.182 1.00 41.44 C ATOM 1846 O TRP A 137 6.265 -9.264 2.907 1.00 43.34 O ATOM 1847 CB TRP A 137 5.856 -6.996 1.035 1.00 45.34 C ATOM 1848 CG TRP A 137 6.038 -5.738 0.228 1.00 3.34 C ATOM 1849 CD1 TRP A 137 7.211 -5.128 -0.142 1.00 21.21 C ATOM 1850 CD2 TRP A 137 4.990 -4.961 -0.361 1.00 71.24 C ATOM 1851 NE1 TRP A 137 6.941 -4.031 -0.901 1.00 15.04 N ATOM 1852 CE2 TRP A 137 5.595 -3.898 -1.047 1.00 3.42 C ATOM 1853 CE3 TRP A 137 3.595 -5.056 -0.368 1.00 73.25 C ATOM 1854 CZ2 TRP A 137 4.860 -2.939 -1.734 1.00 41.13 C ATOM 1855 CZ3 TRP A 137 2.869 -4.102 -1.050 1.00 30.42 C ATOM 1856 CH2 TRP A 137 3.505 -3.058 -1.721 1.00 33.50 C ATOM 0 H TRP A 137 8.167 -7.207 2.117 1.00 20.21 H new ATOM 0 HA TRP A 137 5.623 -6.063 2.976 1.00 31.51 H new ATOM 0 HB2 TRP A 137 6.494 -7.769 0.607 1.00 45.34 H new ATOM 0 HB3 TRP A 137 4.826 -7.330 0.915 1.00 45.34 H new ATOM 0 HD1 TRP A 137 8.200 -5.468 0.129 1.00 21.21 H new ATOM 0 HE1 TRP A 137 7.641 -3.405 -1.299 1.00 15.04 H new ATOM 0 HE3 TRP A 137 3.096 -5.861 0.151 1.00 73.25 H new ATOM 0 HZ2 TRP A 137 5.346 -2.130 -2.258 1.00 41.13 H new ATOM 0 HZ3 TRP A 137 1.791 -4.165 -1.065 1.00 30.42 H new ATOM 0 HH2 TRP A 137 2.907 -2.326 -2.243 1.00 33.50 H new ATOM 1867 N HIS A 138 4.732 -8.117 4.034 1.00 32.04 N ATOM 1868 CA HIS A 138 4.166 -9.301 4.642 1.00 11.03 C ATOM 1869 C HIS A 138 2.718 -9.358 4.233 1.00 21.41 C ATOM 1870 O HIS A 138 1.930 -8.503 4.629 1.00 14.24 O ATOM 1871 CB HIS A 138 4.266 -9.250 6.176 1.00 63.30 C ATOM 1872 CG HIS A 138 5.643 -8.986 6.698 1.00 62.44 C ATOM 1873 ND1 HIS A 138 6.584 -9.964 6.937 1.00 12.44 N ATOM 1874 CD2 HIS A 138 6.231 -7.823 7.019 1.00 21.14 C ATOM 1875 CE1 HIS A 138 7.685 -9.410 7.380 1.00 14.10 C ATOM 1876 NE2 HIS A 138 7.501 -8.113 7.439 1.00 62.34 N ATOM 0 H HIS A 138 4.302 -7.241 4.330 1.00 32.04 H new ATOM 0 HA HIS A 138 4.714 -10.183 4.311 1.00 11.03 H new ATOM 0 HB2 HIS A 138 3.596 -8.474 6.546 1.00 63.30 H new ATOM 0 HB3 HIS A 138 3.912 -10.197 6.583 1.00 63.30 H new ATOM 0 HD1 HIS A 138 6.445 -10.964 6.792 1.00 12.44 H new ATOM 0 HD2 HIS A 138 5.785 -6.841 6.957 1.00 21.14 H new ATOM 0 HE1 HIS A 138 8.591 -9.933 7.651 1.00 14.10 H new ATOM 1885 N LEU A 139 2.375 -10.323 3.434 1.00 3.03 N ATOM 1886 CA LEU A 139 1.039 -10.440 2.908 1.00 42.23 C ATOM 1887 C LEU A 139 0.338 -11.599 3.574 1.00 43.34 C ATOM 1888 O LEU A 139 0.829 -12.718 3.540 1.00 14.32 O ATOM 1889 CB LEU A 139 1.057 -10.658 1.367 1.00 31.25 C ATOM 1890 CG LEU A 139 1.735 -9.572 0.480 1.00 12.24 C ATOM 1891 CD1 LEU A 139 3.245 -9.520 0.653 1.00 63.43 C ATOM 1892 CD2 LEU A 139 1.390 -9.770 -0.969 1.00 65.35 C ATOM 0 H LEU A 139 3.013 -11.056 3.125 1.00 3.03 H new ATOM 0 HA LEU A 139 0.506 -9.512 3.114 1.00 42.23 H new ATOM 0 HB2 LEU A 139 1.555 -11.607 1.170 1.00 31.25 H new ATOM 0 HB3 LEU A 139 0.025 -10.764 1.033 1.00 31.25 H new ATOM 0 HG LEU A 139 1.340 -8.614 0.819 1.00 12.24 H new ATOM 0 HD11 LEU A 139 3.659 -8.744 0.009 1.00 63.43 H new ATOM 0 HD12 LEU A 139 3.485 -9.295 1.692 1.00 63.43 H new ATOM 0 HD13 LEU A 139 3.676 -10.484 0.382 1.00 63.43 H new ATOM 0 HD21 LEU A 139 1.876 -8.999 -1.567 1.00 65.35 H new ATOM 0 HD22 LEU A 139 1.734 -10.752 -1.294 1.00 65.35 H new ATOM 0 HD23 LEU A 139 0.310 -9.703 -1.098 1.00 65.35 H new ATOM 1904 N GLU A 140 -0.787 -11.333 4.170 1.00 24.24 N ATOM 1905 CA GLU A 140 -1.552 -12.336 4.879 1.00 13.12 C ATOM 1906 C GLU A 140 -2.986 -12.287 4.390 1.00 44.13 C ATOM 1907 O GLU A 140 -3.611 -11.230 4.372 1.00 51.01 O ATOM 1908 CB GLU A 140 -1.465 -12.075 6.390 1.00 54.12 C ATOM 1909 CG GLU A 140 -0.033 -12.123 6.910 1.00 74.53 C ATOM 1910 CD GLU A 140 0.101 -11.772 8.369 1.00 32.15 C ATOM 1911 OE1 GLU A 140 0.261 -10.566 8.697 1.00 22.35 O ATOM 1912 OE2 GLU A 140 0.081 -12.680 9.214 1.00 22.32 O ATOM 0 H GLU A 140 -1.210 -10.405 4.182 1.00 24.24 H new ATOM 0 HA GLU A 140 -1.151 -13.332 4.689 1.00 13.12 H new ATOM 0 HB2 GLU A 140 -1.896 -11.099 6.612 1.00 54.12 H new ATOM 0 HB3 GLU A 140 -2.065 -12.816 6.918 1.00 54.12 H new ATOM 0 HG2 GLU A 140 0.368 -13.124 6.749 1.00 74.53 H new ATOM 0 HG3 GLU A 140 0.579 -11.437 6.324 1.00 74.53 H new ATOM 1919 N TYR A 141 -3.501 -13.412 3.996 1.00 73.04 N ATOM 1920 CA TYR A 141 -4.814 -13.460 3.381 1.00 75.51 C ATOM 1921 C TYR A 141 -5.533 -14.780 3.614 1.00 40.41 C ATOM 1922 O TYR A 141 -4.918 -15.797 3.896 1.00 3.31 O ATOM 1923 CB TYR A 141 -4.710 -13.114 1.880 1.00 72.40 C ATOM 1924 CG TYR A 141 -3.658 -13.899 1.109 1.00 72.42 C ATOM 1925 CD1 TYR A 141 -2.325 -13.489 1.110 1.00 64.04 C ATOM 1926 CD2 TYR A 141 -3.989 -15.028 0.393 1.00 1.24 C ATOM 1927 CE1 TYR A 141 -1.359 -14.189 0.422 1.00 42.43 C ATOM 1928 CE2 TYR A 141 -3.029 -15.737 -0.305 1.00 24.42 C ATOM 1929 CZ TYR A 141 -1.718 -15.318 -0.287 1.00 21.21 C ATOM 1930 OH TYR A 141 -0.770 -16.029 -0.988 1.00 40.01 O ATOM 0 H TYR A 141 -3.039 -14.317 4.085 1.00 73.04 H new ATOM 0 HA TYR A 141 -5.431 -12.706 3.869 1.00 75.51 H new ATOM 0 HB2 TYR A 141 -5.681 -13.284 1.415 1.00 72.40 H new ATOM 0 HB3 TYR A 141 -4.492 -12.051 1.782 1.00 72.40 H new ATOM 0 HD1 TYR A 141 -2.044 -12.604 1.662 1.00 64.04 H new ATOM 0 HD2 TYR A 141 -5.015 -15.365 0.377 1.00 1.24 H new ATOM 0 HE1 TYR A 141 -0.331 -13.858 0.437 1.00 42.43 H new ATOM 0 HE2 TYR A 141 -3.307 -16.618 -0.864 1.00 24.42 H new ATOM 0 HH TYR A 141 -1.195 -16.795 -1.428 1.00 40.01 H new ATOM 1940 N GLU A 142 -6.832 -14.744 3.474 1.00 42.04 N ATOM 1941 CA GLU A 142 -7.676 -15.891 3.734 1.00 24.32 C ATOM 1942 C GLU A 142 -8.246 -16.401 2.407 1.00 3.25 C ATOM 1943 O GLU A 142 -8.809 -15.611 1.619 1.00 45.21 O ATOM 1944 CB GLU A 142 -8.822 -15.453 4.656 1.00 72.43 C ATOM 1945 CG GLU A 142 -9.706 -16.579 5.172 1.00 73.43 C ATOM 1946 CD GLU A 142 -8.977 -17.506 6.102 1.00 35.25 C ATOM 1947 OE1 GLU A 142 -8.858 -17.171 7.308 1.00 74.21 O ATOM 1948 OE2 GLU A 142 -8.544 -18.564 5.664 1.00 24.53 O ATOM 0 H GLU A 142 -7.343 -13.913 3.174 1.00 42.04 H new ATOM 0 HA GLU A 142 -7.103 -16.687 4.210 1.00 24.32 H new ATOM 0 HB2 GLU A 142 -8.398 -14.925 5.510 1.00 72.43 H new ATOM 0 HB3 GLU A 142 -9.447 -14.740 4.119 1.00 72.43 H new ATOM 0 HG2 GLU A 142 -10.565 -16.153 5.690 1.00 73.43 H new ATOM 0 HG3 GLU A 142 -10.093 -17.148 4.327 1.00 73.43 H new ATOM 1955 N LYS A 143 -8.102 -17.687 2.156 1.00 70.14 N ATOM 1956 CA LYS A 143 -8.610 -18.306 0.931 1.00 54.43 C ATOM 1957 C LYS A 143 -10.116 -18.506 0.972 1.00 44.20 C ATOM 1958 O LYS A 143 -10.667 -18.980 1.966 1.00 32.14 O ATOM 1959 CB LYS A 143 -7.945 -19.681 0.652 1.00 25.24 C ATOM 1960 CG LYS A 143 -6.585 -19.682 -0.059 1.00 30.33 C ATOM 1961 CD LYS A 143 -5.495 -18.890 0.633 1.00 30.41 C ATOM 1962 CE LYS A 143 -4.175 -19.037 -0.125 1.00 61.35 C ATOM 1963 NZ LYS A 143 -3.684 -20.428 -0.117 1.00 54.41 N ATOM 0 H LYS A 143 -7.633 -18.336 2.787 1.00 70.14 H new ATOM 0 HA LYS A 143 -8.358 -17.611 0.130 1.00 54.43 H new ATOM 0 HB2 LYS A 143 -7.826 -20.196 1.605 1.00 25.24 H new ATOM 0 HB3 LYS A 143 -8.637 -20.274 0.054 1.00 25.24 H new ATOM 0 HG2 LYS A 143 -6.250 -20.714 -0.166 1.00 30.33 H new ATOM 0 HG3 LYS A 143 -6.719 -19.284 -1.065 1.00 30.33 H new ATOM 0 HD2 LYS A 143 -5.777 -17.839 0.686 1.00 30.41 H new ATOM 0 HD3 LYS A 143 -5.375 -19.240 1.658 1.00 30.41 H new ATOM 0 HE2 LYS A 143 -4.310 -18.706 -1.155 1.00 61.35 H new ATOM 0 HE3 LYS A 143 -3.425 -18.385 0.324 1.00 61.35 H new ATOM 0 HZ1 LYS A 143 -2.669 -20.439 -0.343 1.00 54.41 H new ATOM 0 HZ2 LYS A 143 -3.833 -20.843 0.825 1.00 54.41 H new ATOM 0 HZ3 LYS A 143 -4.203 -20.983 -0.827 1.00 54.41 H new ATOM 1977 N ILE A 144 -10.783 -18.125 -0.108 1.00 25.43 N ATOM 1978 CA ILE A 144 -12.189 -18.444 -0.258 1.00 2.11 C ATOM 1979 C ILE A 144 -12.281 -19.913 -0.625 1.00 72.11 C ATOM 1980 O ILE A 144 -13.099 -20.662 -0.091 1.00 61.34 O ATOM 1981 CB ILE A 144 -12.872 -17.581 -1.360 1.00 23.20 C ATOM 1982 CG1 ILE A 144 -12.834 -16.106 -0.966 1.00 54.44 C ATOM 1983 CG2 ILE A 144 -14.317 -18.038 -1.609 1.00 14.14 C ATOM 1984 CD1 ILE A 144 -13.461 -15.174 -1.978 1.00 72.13 C ATOM 0 H ILE A 144 -10.376 -17.601 -0.883 1.00 25.43 H new ATOM 0 HA ILE A 144 -12.709 -18.230 0.676 1.00 2.11 H new ATOM 0 HB ILE A 144 -12.319 -17.713 -2.290 1.00 23.20 H new ATOM 0 HG12 ILE A 144 -13.346 -15.984 -0.011 1.00 54.44 H new ATOM 0 HG13 ILE A 144 -11.796 -15.810 -0.811 1.00 54.44 H new ATOM 0 HG21 ILE A 144 -14.767 -17.416 -2.383 1.00 14.14 H new ATOM 0 HG22 ILE A 144 -14.319 -19.079 -1.933 1.00 14.14 H new ATOM 0 HG23 ILE A 144 -14.892 -17.943 -0.688 1.00 14.14 H new ATOM 0 HD11 ILE A 144 -13.391 -14.147 -1.619 1.00 72.13 H new ATOM 0 HD12 ILE A 144 -12.936 -15.263 -2.929 1.00 72.13 H new ATOM 0 HD13 ILE A 144 -14.509 -15.439 -2.116 1.00 72.13 H new ATOM 1996 N SER A 145 -11.400 -20.307 -1.515 1.00 25.10 N ATOM 1997 CA SER A 145 -11.292 -21.653 -1.970 1.00 54.41 C ATOM 1998 C SER A 145 -9.868 -21.857 -2.490 1.00 24.30 C ATOM 1999 O SER A 145 -9.141 -20.871 -2.717 1.00 65.51 O ATOM 2000 CB SER A 145 -12.341 -21.920 -3.058 1.00 44.34 C ATOM 2001 OG SER A 145 -12.275 -23.246 -3.559 1.00 52.31 O ATOM 0 H SER A 145 -10.726 -19.675 -1.947 1.00 25.10 H new ATOM 0 HA SER A 145 -11.482 -22.359 -1.162 1.00 54.41 H new ATOM 0 HB2 SER A 145 -13.336 -21.737 -2.652 1.00 44.34 H new ATOM 0 HB3 SER A 145 -12.197 -21.217 -3.878 1.00 44.34 H new ATOM 0 HG SER A 145 -12.962 -23.370 -4.247 1.00 52.31 H new ATOM 2007 N GLU A 146 -9.484 -23.100 -2.685 1.00 54.03 N ATOM 2008 CA GLU A 146 -8.128 -23.458 -3.098 1.00 71.31 C ATOM 2009 C GLU A 146 -7.826 -22.982 -4.502 1.00 30.44 C ATOM 2010 O GLU A 146 -6.907 -22.192 -4.723 1.00 0.04 O ATOM 2011 CB GLU A 146 -7.957 -24.957 -3.083 1.00 3.23 C ATOM 2012 CG GLU A 146 -8.066 -25.615 -1.723 1.00 42.14 C ATOM 2013 CD GLU A 146 -7.914 -27.115 -1.823 1.00 62.32 C ATOM 2014 OE1 GLU A 146 -6.784 -27.600 -1.994 1.00 64.55 O ATOM 2015 OE2 GLU A 146 -8.934 -27.828 -1.756 1.00 24.45 O ATOM 0 H GLU A 146 -10.102 -23.902 -2.563 1.00 54.03 H new ATOM 0 HA GLU A 146 -7.448 -22.978 -2.395 1.00 71.31 H new ATOM 0 HB2 GLU A 146 -8.707 -25.397 -3.741 1.00 3.23 H new ATOM 0 HB3 GLU A 146 -6.982 -25.198 -3.506 1.00 3.23 H new ATOM 0 HG2 GLU A 146 -7.299 -25.213 -1.060 1.00 42.14 H new ATOM 0 HG3 GLU A 146 -9.031 -25.374 -1.277 1.00 42.14 H new ATOM 2022 N GLU A 147 -8.625 -23.468 -5.436 1.00 75.33 N ATOM 2023 CA GLU A 147 -8.460 -23.221 -6.874 1.00 0.03 C ATOM 2024 C GLU A 147 -8.678 -21.759 -7.222 1.00 52.34 C ATOM 2025 O GLU A 147 -8.233 -21.274 -8.266 1.00 42.43 O ATOM 2026 CB GLU A 147 -9.477 -24.065 -7.632 1.00 34.23 C ATOM 2027 CG GLU A 147 -10.917 -23.765 -7.232 1.00 71.42 C ATOM 2028 CD GLU A 147 -11.913 -24.551 -8.005 1.00 51.43 C ATOM 2029 OE1 GLU A 147 -12.253 -24.141 -9.122 1.00 35.53 O ATOM 2030 OE2 GLU A 147 -12.381 -25.589 -7.498 1.00 13.03 O ATOM 0 H GLU A 147 -9.427 -24.060 -5.220 1.00 75.33 H new ATOM 0 HA GLU A 147 -7.440 -23.487 -7.153 1.00 0.03 H new ATOM 0 HB2 GLU A 147 -9.359 -23.892 -8.702 1.00 34.23 H new ATOM 0 HB3 GLU A 147 -9.269 -25.120 -7.455 1.00 34.23 H new ATOM 0 HG2 GLU A 147 -11.044 -23.974 -6.170 1.00 71.42 H new ATOM 0 HG3 GLU A 147 -11.113 -22.702 -7.373 1.00 71.42 H new ATOM 2037 N VAL A 148 -9.360 -21.079 -6.347 1.00 65.11 N ATOM 2038 CA VAL A 148 -9.723 -19.696 -6.569 1.00 10.10 C ATOM 2039 C VAL A 148 -8.547 -18.779 -6.266 1.00 52.23 C ATOM 2040 O VAL A 148 -8.364 -17.748 -6.911 1.00 2.33 O ATOM 2041 CB VAL A 148 -10.959 -19.308 -5.710 1.00 11.01 C ATOM 2042 CG1 VAL A 148 -11.362 -17.858 -5.927 1.00 33.43 C ATOM 2043 CG2 VAL A 148 -12.122 -20.228 -6.034 1.00 75.34 C ATOM 0 H VAL A 148 -9.683 -21.460 -5.458 1.00 65.11 H new ATOM 0 HA VAL A 148 -9.988 -19.576 -7.619 1.00 10.10 H new ATOM 0 HB VAL A 148 -10.686 -19.421 -4.661 1.00 11.01 H new ATOM 0 HG11 VAL A 148 -12.229 -17.625 -5.309 1.00 33.43 H new ATOM 0 HG12 VAL A 148 -10.534 -17.205 -5.651 1.00 33.43 H new ATOM 0 HG13 VAL A 148 -11.612 -17.703 -6.977 1.00 33.43 H new ATOM 0 HG21 VAL A 148 -12.985 -19.951 -5.429 1.00 75.34 H new ATOM 0 HG22 VAL A 148 -12.375 -20.136 -7.090 1.00 75.34 H new ATOM 0 HG23 VAL A 148 -11.842 -21.259 -5.816 1.00 75.34 H new ATOM 2053 N ALA A 149 -7.739 -19.182 -5.323 1.00 54.22 N ATOM 2054 CA ALA A 149 -6.605 -18.398 -4.907 1.00 34.14 C ATOM 2055 C ALA A 149 -5.449 -18.569 -5.873 1.00 22.41 C ATOM 2056 O ALA A 149 -5.143 -19.684 -6.299 1.00 70.43 O ATOM 2057 CB ALA A 149 -6.192 -18.814 -3.526 1.00 2.14 C ATOM 0 H ALA A 149 -7.847 -20.063 -4.821 1.00 54.22 H new ATOM 0 HA ALA A 149 -6.887 -17.345 -4.901 1.00 34.14 H new ATOM 0 HB1 ALA A 149 -5.334 -18.222 -3.209 1.00 2.14 H new ATOM 0 HB2 ALA A 149 -7.019 -18.653 -2.835 1.00 2.14 H new ATOM 0 HB3 ALA A 149 -5.923 -19.870 -3.529 1.00 2.14 H new ATOM 2063 N HIS A 150 -4.817 -17.470 -6.221 1.00 1.32 N ATOM 2064 CA HIS A 150 -3.665 -17.474 -7.113 1.00 52.12 C ATOM 2065 C HIS A 150 -2.612 -16.528 -6.587 1.00 73.53 C ATOM 2066 O HIS A 150 -2.643 -15.344 -6.900 1.00 52.11 O ATOM 2067 CB HIS A 150 -4.036 -17.112 -8.574 1.00 51.41 C ATOM 2068 CG HIS A 150 -4.844 -18.156 -9.294 1.00 33.24 C ATOM 2069 ND1 HIS A 150 -4.300 -19.011 -10.213 1.00 11.00 N ATOM 2070 CD2 HIS A 150 -6.160 -18.470 -9.232 1.00 31.41 C ATOM 2071 CE1 HIS A 150 -5.231 -19.805 -10.685 1.00 72.24 C ATOM 2072 NE2 HIS A 150 -6.373 -19.499 -10.107 1.00 23.11 N ATOM 0 H HIS A 150 -5.084 -16.541 -5.895 1.00 1.32 H new ATOM 0 HA HIS A 150 -3.273 -18.491 -7.134 1.00 52.12 H new ATOM 0 HB2 HIS A 150 -4.596 -16.177 -8.571 1.00 51.41 H new ATOM 0 HB3 HIS A 150 -3.118 -16.932 -9.134 1.00 51.41 H new ATOM 0 HD2 HIS A 150 -6.903 -17.996 -8.608 1.00 31.41 H new ATOM 0 HE1 HIS A 150 -5.085 -20.579 -11.424 1.00 72.24 H new ATOM 0 HE2 HIS A 150 -7.269 -19.954 -10.283 1.00 23.11 H new ATOM 2081 N PRO A 151 -1.688 -17.037 -5.731 1.00 44.13 N ATOM 2082 CA PRO A 151 -0.617 -16.238 -5.063 1.00 73.40 C ATOM 2083 C PRO A 151 0.144 -15.240 -5.968 1.00 0.13 C ATOM 2084 O PRO A 151 0.704 -14.250 -5.478 1.00 30.22 O ATOM 2085 CB PRO A 151 0.311 -17.313 -4.519 1.00 31.13 C ATOM 2086 CG PRO A 151 -0.625 -18.414 -4.167 1.00 52.04 C ATOM 2087 CD PRO A 151 -1.626 -18.456 -5.291 1.00 72.24 C ATOM 0 HA PRO A 151 -1.046 -15.574 -4.312 1.00 73.40 H new ATOM 0 HB2 PRO A 151 1.044 -17.628 -5.262 1.00 31.13 H new ATOM 0 HB3 PRO A 151 0.868 -16.963 -3.650 1.00 31.13 H new ATOM 0 HG2 PRO A 151 -0.098 -19.364 -4.073 1.00 52.04 H new ATOM 0 HG3 PRO A 151 -1.114 -18.225 -3.211 1.00 52.04 H new ATOM 0 HD2 PRO A 151 -1.302 -19.115 -6.096 1.00 72.24 H new ATOM 0 HD3 PRO A 151 -2.597 -18.818 -4.954 1.00 72.24 H new ATOM 2095 N GLU A 152 0.131 -15.491 -7.264 1.00 4.24 N ATOM 2096 CA GLU A 152 0.780 -14.630 -8.259 1.00 74.22 C ATOM 2097 C GLU A 152 0.238 -13.214 -8.155 1.00 31.12 C ATOM 2098 O GLU A 152 0.979 -12.232 -8.162 1.00 72.13 O ATOM 2099 CB GLU A 152 0.426 -15.118 -9.653 1.00 41.14 C ATOM 2100 CG GLU A 152 0.619 -16.586 -9.873 1.00 44.44 C ATOM 2101 CD GLU A 152 2.025 -17.037 -9.619 1.00 61.32 C ATOM 2102 OE1 GLU A 152 2.908 -16.747 -10.446 1.00 60.40 O ATOM 2103 OE2 GLU A 152 2.275 -17.684 -8.593 1.00 22.11 O ATOM 0 H GLU A 152 -0.333 -16.304 -7.669 1.00 4.24 H new ATOM 0 HA GLU A 152 1.855 -14.655 -8.081 1.00 74.22 H new ATOM 0 HB2 GLU A 152 -0.615 -14.868 -9.856 1.00 41.14 H new ATOM 0 HB3 GLU A 152 1.032 -14.574 -10.378 1.00 41.14 H new ATOM 0 HG2 GLU A 152 -0.057 -17.137 -9.220 1.00 44.44 H new ATOM 0 HG3 GLU A 152 0.344 -16.833 -10.898 1.00 44.44 H new ATOM 2110 N THR A 153 -1.067 -13.143 -8.027 1.00 61.21 N ATOM 2111 CA THR A 153 -1.813 -11.907 -8.043 1.00 52.42 C ATOM 2112 C THR A 153 -1.382 -10.942 -6.928 1.00 3.05 C ATOM 2113 O THR A 153 -1.395 -9.717 -7.111 1.00 44.11 O ATOM 2114 CB THR A 153 -3.324 -12.213 -7.955 1.00 55.31 C ATOM 2115 OG1 THR A 153 -3.593 -12.913 -6.727 1.00 54.54 O ATOM 2116 CG2 THR A 153 -3.738 -13.110 -9.123 1.00 51.31 C ATOM 0 H THR A 153 -1.655 -13.968 -7.905 1.00 61.21 H new ATOM 0 HA THR A 153 -1.598 -11.402 -8.985 1.00 52.42 H new ATOM 0 HB THR A 153 -3.881 -11.277 -7.990 1.00 55.31 H new ATOM 0 HG1 THR A 153 -3.045 -13.725 -6.686 1.00 54.54 H new ATOM 0 HG21 THR A 153 -4.805 -13.324 -9.057 1.00 51.31 H new ATOM 0 HG22 THR A 153 -3.527 -12.602 -10.064 1.00 51.31 H new ATOM 0 HG23 THR A 153 -3.178 -14.044 -9.081 1.00 51.31 H new ATOM 2124 N LEU A 154 -0.970 -11.489 -5.795 1.00 55.30 N ATOM 2125 CA LEU A 154 -0.548 -10.672 -4.679 1.00 33.00 C ATOM 2126 C LEU A 154 0.806 -10.056 -4.961 1.00 14.35 C ATOM 2127 O LEU A 154 1.066 -8.911 -4.606 1.00 73.22 O ATOM 2128 CB LEU A 154 -0.509 -11.460 -3.362 1.00 51.44 C ATOM 2129 CG LEU A 154 -1.803 -12.151 -2.906 1.00 42.41 C ATOM 2130 CD1 LEU A 154 -3.015 -11.262 -3.060 1.00 2.03 C ATOM 2131 CD2 LEU A 154 -1.996 -13.487 -3.556 1.00 43.32 C ATOM 0 H LEU A 154 -0.921 -12.494 -5.629 1.00 55.30 H new ATOM 0 HA LEU A 154 -1.288 -9.881 -4.561 1.00 33.00 H new ATOM 0 HB2 LEU A 154 0.265 -12.222 -3.450 1.00 51.44 H new ATOM 0 HB3 LEU A 154 -0.197 -10.777 -2.572 1.00 51.44 H new ATOM 0 HG LEU A 154 -1.689 -12.339 -1.838 1.00 42.41 H new ATOM 0 HD11 LEU A 154 -3.903 -11.797 -2.724 1.00 2.03 H new ATOM 0 HD12 LEU A 154 -2.885 -10.362 -2.459 1.00 2.03 H new ATOM 0 HD13 LEU A 154 -3.133 -10.985 -4.108 1.00 2.03 H new ATOM 0 HD21 LEU A 154 -2.924 -13.934 -3.200 1.00 43.32 H new ATOM 0 HD22 LEU A 154 -2.045 -13.362 -4.638 1.00 43.32 H new ATOM 0 HD23 LEU A 154 -1.160 -14.139 -3.303 1.00 43.32 H new ATOM 2143 N LEU A 155 1.659 -10.810 -5.632 1.00 2.13 N ATOM 2144 CA LEU A 155 2.977 -10.324 -5.994 1.00 40.42 C ATOM 2145 C LEU A 155 2.875 -9.292 -7.091 1.00 74.32 C ATOM 2146 O LEU A 155 3.714 -8.393 -7.202 1.00 72.53 O ATOM 2147 CB LEU A 155 3.895 -11.466 -6.391 1.00 24.31 C ATOM 2148 CG LEU A 155 4.244 -12.439 -5.273 1.00 22.53 C ATOM 2149 CD1 LEU A 155 5.146 -13.527 -5.791 1.00 44.10 C ATOM 2150 CD2 LEU A 155 4.912 -11.707 -4.112 1.00 54.20 C ATOM 0 H LEU A 155 1.461 -11.763 -5.937 1.00 2.13 H new ATOM 0 HA LEU A 155 3.417 -9.846 -5.119 1.00 40.42 H new ATOM 0 HB2 LEU A 155 3.425 -12.023 -7.202 1.00 24.31 H new ATOM 0 HB3 LEU A 155 4.820 -11.046 -6.787 1.00 24.31 H new ATOM 0 HG LEU A 155 3.321 -12.891 -4.910 1.00 22.53 H new ATOM 0 HD11 LEU A 155 5.388 -14.216 -4.981 1.00 44.10 H new ATOM 0 HD12 LEU A 155 4.640 -14.069 -6.590 1.00 44.10 H new ATOM 0 HD13 LEU A 155 6.064 -13.085 -6.178 1.00 44.10 H new ATOM 0 HD21 LEU A 155 5.154 -12.420 -3.323 1.00 54.20 H new ATOM 0 HD22 LEU A 155 5.827 -11.229 -4.462 1.00 54.20 H new ATOM 0 HD23 LEU A 155 4.233 -10.949 -3.721 1.00 54.20 H new ATOM 2162 N GLN A 156 1.839 -9.411 -7.896 1.00 72.14 N ATOM 2163 CA GLN A 156 1.571 -8.435 -8.916 1.00 14.24 C ATOM 2164 C GLN A 156 1.077 -7.149 -8.281 1.00 31.33 C ATOM 2165 O GLN A 156 1.512 -6.068 -8.641 1.00 61.35 O ATOM 2166 CB GLN A 156 0.581 -8.960 -9.932 1.00 20.20 C ATOM 2167 CG GLN A 156 1.076 -10.199 -10.629 1.00 23.41 C ATOM 2168 CD GLN A 156 0.197 -10.611 -11.756 1.00 64.30 C ATOM 2169 OE1 GLN A 156 -0.749 -11.393 -11.594 1.00 3.22 O ATOM 2170 NE2 GLN A 156 0.497 -10.094 -12.906 1.00 21.30 N ATOM 0 H GLN A 156 1.170 -10.180 -7.858 1.00 72.14 H new ATOM 0 HA GLN A 156 2.498 -8.226 -9.450 1.00 14.24 H new ATOM 0 HB2 GLN A 156 -0.364 -9.179 -9.435 1.00 20.20 H new ATOM 0 HB3 GLN A 156 0.380 -8.186 -10.672 1.00 20.20 H new ATOM 0 HG2 GLN A 156 2.084 -10.022 -11.005 1.00 23.41 H new ATOM 0 HG3 GLN A 156 1.143 -11.014 -9.909 1.00 23.41 H new ATOM 0 HE21 GLN A 156 1.287 -9.454 -12.987 1.00 21.30 H new ATOM 0 HE22 GLN A 156 -0.057 -10.327 -13.730 1.00 21.30 H new ATOM 2179 N PHE A 157 0.181 -7.283 -7.303 1.00 44.52 N ATOM 2180 CA PHE A 157 -0.306 -6.130 -6.545 1.00 54.24 C ATOM 2181 C PHE A 157 0.885 -5.451 -5.863 1.00 63.34 C ATOM 2182 O PHE A 157 1.017 -4.233 -5.877 1.00 73.31 O ATOM 2183 CB PHE A 157 -1.361 -6.586 -5.501 1.00 12.24 C ATOM 2184 CG PHE A 157 -1.955 -5.477 -4.652 1.00 44.24 C ATOM 2185 CD1 PHE A 157 -2.814 -4.547 -5.211 1.00 61.40 C ATOM 2186 CD2 PHE A 157 -1.664 -5.382 -3.291 1.00 32.02 C ATOM 2187 CE1 PHE A 157 -3.374 -3.541 -4.441 1.00 2.04 C ATOM 2188 CE2 PHE A 157 -2.225 -4.368 -2.511 1.00 12.11 C ATOM 2189 CZ PHE A 157 -3.076 -3.451 -3.094 1.00 13.31 C ATOM 0 H PHE A 157 -0.221 -8.176 -7.017 1.00 44.52 H new ATOM 0 HA PHE A 157 -0.787 -5.417 -7.215 1.00 54.24 H new ATOM 0 HB2 PHE A 157 -2.171 -7.093 -6.025 1.00 12.24 H new ATOM 0 HB3 PHE A 157 -0.900 -7.320 -4.840 1.00 12.24 H new ATOM 0 HD1 PHE A 157 -3.051 -4.607 -6.263 1.00 61.40 H new ATOM 0 HD2 PHE A 157 -0.998 -6.100 -2.836 1.00 32.02 H new ATOM 0 HE1 PHE A 157 -4.045 -2.826 -4.894 1.00 2.04 H new ATOM 0 HE2 PHE A 157 -1.994 -4.302 -1.458 1.00 12.11 H new ATOM 0 HZ PHE A 157 -3.510 -2.662 -2.497 1.00 13.31 H new ATOM 2199 N CYS A 158 1.761 -6.272 -5.322 1.00 33.24 N ATOM 2200 CA CYS A 158 2.967 -5.826 -4.661 1.00 0.22 C ATOM 2201 C CYS A 158 3.873 -5.001 -5.590 1.00 63.50 C ATOM 2202 O CYS A 158 4.262 -3.883 -5.244 1.00 43.31 O ATOM 2203 CB CYS A 158 3.726 -7.040 -4.113 1.00 44.21 C ATOM 2204 SG CYS A 158 5.325 -6.672 -3.372 1.00 71.42 S ATOM 0 H CYS A 158 1.652 -7.286 -5.330 1.00 33.24 H new ATOM 0 HA CYS A 158 2.676 -5.169 -3.841 1.00 0.22 H new ATOM 0 HB2 CYS A 158 3.102 -7.532 -3.367 1.00 44.21 H new ATOM 0 HB3 CYS A 158 3.875 -7.752 -4.924 1.00 44.21 H new ATOM 0 HG CYS A 158 5.157 -5.903 -2.338 1.00 71.42 H new ATOM 2210 N VAL A 159 4.180 -5.530 -6.772 1.00 13.34 N ATOM 2211 CA VAL A 159 5.108 -4.857 -7.686 1.00 73.01 C ATOM 2212 C VAL A 159 4.540 -3.540 -8.209 1.00 32.43 C ATOM 2213 O VAL A 159 5.264 -2.532 -8.333 1.00 22.43 O ATOM 2214 CB VAL A 159 5.551 -5.776 -8.869 1.00 31.42 C ATOM 2215 CG1 VAL A 159 4.400 -6.159 -9.791 1.00 5.10 C ATOM 2216 CG2 VAL A 159 6.707 -5.170 -9.640 1.00 52.31 C ATOM 0 H VAL A 159 3.806 -6.413 -7.120 1.00 13.34 H new ATOM 0 HA VAL A 159 5.997 -4.629 -7.099 1.00 73.01 H new ATOM 0 HB VAL A 159 5.900 -6.706 -8.419 1.00 31.42 H new ATOM 0 HG11 VAL A 159 4.772 -6.797 -10.592 1.00 5.10 H new ATOM 0 HG12 VAL A 159 3.641 -6.696 -9.222 1.00 5.10 H new ATOM 0 HG13 VAL A 159 3.962 -5.258 -10.219 1.00 5.10 H new ATOM 0 HG21 VAL A 159 6.989 -5.836 -10.456 1.00 52.31 H new ATOM 0 HG22 VAL A 159 6.406 -4.205 -10.047 1.00 52.31 H new ATOM 0 HG23 VAL A 159 7.558 -5.033 -8.972 1.00 52.31 H new ATOM 2226 N GLU A 160 3.259 -3.538 -8.481 1.00 64.30 N ATOM 2227 CA GLU A 160 2.593 -2.349 -8.997 1.00 10.22 C ATOM 2228 C GLU A 160 2.543 -1.250 -7.937 1.00 43.54 C ATOM 2229 O GLU A 160 2.695 -0.069 -8.244 1.00 31.42 O ATOM 2230 CB GLU A 160 1.194 -2.664 -9.535 1.00 23.44 C ATOM 2231 CG GLU A 160 1.173 -3.717 -10.643 1.00 42.55 C ATOM 2232 CD GLU A 160 2.073 -3.386 -11.821 1.00 12.50 C ATOM 2233 OE1 GLU A 160 1.670 -2.573 -12.683 1.00 41.23 O ATOM 2234 OE2 GLU A 160 3.181 -3.965 -11.919 1.00 55.14 O ATOM 0 H GLU A 160 2.647 -4.345 -8.356 1.00 64.30 H new ATOM 0 HA GLU A 160 3.183 -1.984 -9.838 1.00 10.22 H new ATOM 0 HB2 GLU A 160 0.568 -3.007 -8.711 1.00 23.44 H new ATOM 0 HB3 GLU A 160 0.747 -1.745 -9.914 1.00 23.44 H new ATOM 0 HG2 GLU A 160 1.476 -4.677 -10.225 1.00 42.55 H new ATOM 0 HG3 GLU A 160 0.150 -3.834 -11.001 1.00 42.55 H new ATOM 2241 N VAL A 161 2.356 -1.638 -6.690 1.00 70.14 N ATOM 2242 CA VAL A 161 2.358 -0.673 -5.610 1.00 4.15 C ATOM 2243 C VAL A 161 3.792 -0.212 -5.299 1.00 22.34 C ATOM 2244 O VAL A 161 4.023 0.975 -5.069 1.00 4.02 O ATOM 2245 CB VAL A 161 1.648 -1.210 -4.330 1.00 14.35 C ATOM 2246 CG1 VAL A 161 1.733 -0.200 -3.187 1.00 75.43 C ATOM 2247 CG2 VAL A 161 0.186 -1.515 -4.628 1.00 14.54 C ATOM 0 H VAL A 161 2.202 -2.605 -6.403 1.00 70.14 H new ATOM 0 HA VAL A 161 1.782 0.189 -5.946 1.00 4.15 H new ATOM 0 HB VAL A 161 2.158 -2.124 -4.025 1.00 14.35 H new ATOM 0 HG11 VAL A 161 1.229 -0.602 -2.308 1.00 75.43 H new ATOM 0 HG12 VAL A 161 2.779 -0.007 -2.949 1.00 75.43 H new ATOM 0 HG13 VAL A 161 1.251 0.731 -3.487 1.00 75.43 H new ATOM 0 HG21 VAL A 161 -0.299 -1.889 -3.726 1.00 14.54 H new ATOM 0 HG22 VAL A 161 -0.315 -0.605 -4.959 1.00 14.54 H new ATOM 0 HG23 VAL A 161 0.124 -2.269 -5.413 1.00 14.54 H new ATOM 2257 N SER A 162 4.758 -1.147 -5.336 1.00 52.20 N ATOM 2258 CA SER A 162 6.164 -0.827 -5.070 1.00 11.44 C ATOM 2259 C SER A 162 6.678 0.280 -5.989 1.00 20.25 C ATOM 2260 O SER A 162 7.328 1.215 -5.540 1.00 35.31 O ATOM 2261 CB SER A 162 7.030 -2.065 -5.236 1.00 22.05 C ATOM 2262 OG SER A 162 6.650 -3.081 -4.331 1.00 32.42 O ATOM 0 H SER A 162 4.586 -2.130 -5.548 1.00 52.20 H new ATOM 0 HA SER A 162 6.225 -0.472 -4.041 1.00 11.44 H new ATOM 0 HB2 SER A 162 6.947 -2.435 -6.258 1.00 22.05 H new ATOM 0 HB3 SER A 162 8.076 -1.804 -5.075 1.00 22.05 H new ATOM 0 HG SER A 162 5.698 -3.282 -4.446 1.00 32.42 H new ATOM 2268 N LYS A 163 6.356 0.179 -7.269 1.00 14.52 N ATOM 2269 CA LYS A 163 6.806 1.165 -8.236 1.00 62.43 C ATOM 2270 C LYS A 163 6.086 2.503 -8.025 1.00 70.34 C ATOM 2271 O LYS A 163 6.683 3.566 -8.168 1.00 54.50 O ATOM 2272 CB LYS A 163 6.609 0.653 -9.684 1.00 12.12 C ATOM 2273 CG LYS A 163 5.154 0.397 -10.069 1.00 33.34 C ATOM 2274 CD LYS A 163 4.963 -0.140 -11.498 1.00 53.05 C ATOM 2275 CE LYS A 163 5.394 -1.610 -11.692 1.00 3.34 C ATOM 2276 NZ LYS A 163 6.841 -1.855 -11.521 1.00 71.24 N ATOM 0 H LYS A 163 5.788 -0.572 -7.660 1.00 14.52 H new ATOM 0 HA LYS A 163 7.873 1.327 -8.081 1.00 62.43 H new ATOM 0 HB2 LYS A 163 7.032 1.382 -10.375 1.00 12.12 H new ATOM 0 HB3 LYS A 163 7.174 -0.271 -9.810 1.00 12.12 H new ATOM 0 HG2 LYS A 163 4.724 -0.315 -9.365 1.00 33.34 H new ATOM 0 HG3 LYS A 163 4.594 1.326 -9.964 1.00 33.34 H new ATOM 0 HD2 LYS A 163 3.912 -0.043 -11.772 1.00 53.05 H new ATOM 0 HD3 LYS A 163 5.531 0.486 -12.187 1.00 53.05 H new ATOM 0 HE2 LYS A 163 4.847 -2.232 -10.983 1.00 3.34 H new ATOM 0 HE3 LYS A 163 5.100 -1.932 -12.691 1.00 3.34 H new ATOM 0 HZ1 LYS A 163 7.148 -2.596 -12.183 1.00 71.24 H new ATOM 0 HZ2 LYS A 163 7.367 -0.979 -11.715 1.00 71.24 H new ATOM 0 HZ3 LYS A 163 7.028 -2.163 -10.545 1.00 71.24 H new ATOM 2290 N GLU A 164 4.819 2.424 -7.649 1.00 41.45 N ATOM 2291 CA GLU A 164 3.981 3.592 -7.447 1.00 20.03 C ATOM 2292 C GLU A 164 4.496 4.421 -6.268 1.00 63.44 C ATOM 2293 O GLU A 164 4.737 5.628 -6.395 1.00 34.24 O ATOM 2294 CB GLU A 164 2.540 3.131 -7.165 1.00 40.24 C ATOM 2295 CG GLU A 164 1.509 4.247 -7.046 1.00 30.32 C ATOM 2296 CD GLU A 164 1.312 5.002 -8.338 1.00 10.12 C ATOM 2297 OE1 GLU A 164 0.542 4.524 -9.206 1.00 62.41 O ATOM 2298 OE2 GLU A 164 1.915 6.080 -8.515 1.00 51.21 O ATOM 0 H GLU A 164 4.341 1.540 -7.475 1.00 41.45 H new ATOM 0 HA GLU A 164 4.006 4.211 -8.344 1.00 20.03 H new ATOM 0 HB2 GLU A 164 2.230 2.456 -7.963 1.00 40.24 H new ATOM 0 HB3 GLU A 164 2.535 2.555 -6.240 1.00 40.24 H new ATOM 0 HG2 GLU A 164 0.556 3.823 -6.730 1.00 30.32 H new ATOM 0 HG3 GLU A 164 1.822 4.943 -6.268 1.00 30.32 H new ATOM 2305 N ILE A 165 4.698 3.753 -5.141 1.00 21.11 N ATOM 2306 CA ILE A 165 5.100 4.413 -3.908 1.00 40.30 C ATOM 2307 C ILE A 165 6.551 4.930 -4.015 1.00 5.03 C ATOM 2308 O ILE A 165 6.845 6.060 -3.595 1.00 2.10 O ATOM 2309 CB ILE A 165 4.875 3.442 -2.659 1.00 73.50 C ATOM 2310 CG1 ILE A 165 4.970 4.147 -1.265 1.00 24.25 C ATOM 2311 CG2 ILE A 165 5.791 2.219 -2.706 1.00 4.24 C ATOM 2312 CD1 ILE A 165 6.348 4.620 -0.837 1.00 71.11 C ATOM 0 H ILE A 165 4.588 2.742 -5.056 1.00 21.11 H new ATOM 0 HA ILE A 165 4.470 5.288 -3.745 1.00 40.30 H new ATOM 0 HB ILE A 165 3.842 3.109 -2.760 1.00 73.50 H new ATOM 0 HG12 ILE A 165 4.301 5.007 -1.272 1.00 24.25 H new ATOM 0 HG13 ILE A 165 4.596 3.458 -0.508 1.00 24.25 H new ATOM 0 HG21 ILE A 165 5.602 1.589 -1.837 1.00 4.24 H new ATOM 0 HG22 ILE A 165 5.594 1.652 -3.615 1.00 4.24 H new ATOM 0 HG23 ILE A 165 6.832 2.543 -2.699 1.00 4.24 H new ATOM 0 HD11 ILE A 165 6.283 5.091 0.144 1.00 71.11 H new ATOM 0 HD12 ILE A 165 7.026 3.768 -0.786 1.00 71.11 H new ATOM 0 HD13 ILE A 165 6.726 5.341 -1.561 1.00 71.11 H new ATOM 2324 N ASP A 166 7.424 4.128 -4.625 1.00 60.33 N ATOM 2325 CA ASP A 166 8.852 4.477 -4.746 1.00 41.24 C ATOM 2326 C ASP A 166 9.072 5.787 -5.472 1.00 72.14 C ATOM 2327 O ASP A 166 9.713 6.703 -4.944 1.00 40.53 O ATOM 2328 CB ASP A 166 9.622 3.367 -5.451 1.00 12.32 C ATOM 2329 CG ASP A 166 11.060 3.739 -5.726 1.00 64.44 C ATOM 2330 OD1 ASP A 166 11.832 3.868 -4.780 1.00 1.23 O ATOM 2331 OD2 ASP A 166 11.426 3.874 -6.908 1.00 11.11 O ATOM 0 H ASP A 166 7.174 3.232 -5.044 1.00 60.33 H new ATOM 0 HA ASP A 166 9.227 4.595 -3.729 1.00 41.24 H new ATOM 0 HB2 ASP A 166 9.595 2.466 -4.838 1.00 12.32 H new ATOM 0 HB3 ASP A 166 9.127 3.128 -6.392 1.00 12.32 H new ATOM 2336 N GLU A 167 8.497 5.919 -6.651 1.00 30.02 N ATOM 2337 CA GLU A 167 8.683 7.135 -7.396 1.00 51.10 C ATOM 2338 C GLU A 167 7.901 8.279 -6.808 1.00 45.52 C ATOM 2339 O GLU A 167 8.307 9.410 -6.916 1.00 3.40 O ATOM 2340 CB GLU A 167 8.496 6.984 -8.904 1.00 21.51 C ATOM 2341 CG GLU A 167 7.150 6.511 -9.369 1.00 71.44 C ATOM 2342 CD GLU A 167 7.136 6.379 -10.862 1.00 24.44 C ATOM 2343 OE1 GLU A 167 7.500 5.302 -11.378 1.00 22.45 O ATOM 2344 OE2 GLU A 167 6.791 7.361 -11.549 1.00 23.31 O ATOM 0 H GLU A 167 7.912 5.215 -7.100 1.00 30.02 H new ATOM 0 HA GLU A 167 9.738 7.387 -7.288 1.00 51.10 H new ATOM 0 HB2 GLU A 167 8.699 7.948 -9.371 1.00 21.51 H new ATOM 0 HB3 GLU A 167 9.248 6.287 -9.273 1.00 21.51 H new ATOM 0 HG2 GLU A 167 6.915 5.551 -8.909 1.00 71.44 H new ATOM 0 HG3 GLU A 167 6.380 7.214 -9.051 1.00 71.44 H new ATOM 2351 N HIS A 168 6.766 7.972 -6.176 1.00 12.22 N ATOM 2352 CA HIS A 168 5.952 8.994 -5.499 1.00 32.43 C ATOM 2353 C HIS A 168 6.810 9.787 -4.494 1.00 55.43 C ATOM 2354 O HIS A 168 6.652 10.993 -4.358 1.00 4.20 O ATOM 2355 CB HIS A 168 4.730 8.347 -4.784 1.00 23.30 C ATOM 2356 CG HIS A 168 3.803 9.313 -4.067 1.00 14.55 C ATOM 2357 ND1 HIS A 168 2.614 9.757 -4.598 1.00 13.34 N ATOM 2358 CD2 HIS A 168 3.896 9.894 -2.846 1.00 50.22 C ATOM 2359 CE1 HIS A 168 2.024 10.570 -3.743 1.00 3.31 C ATOM 2360 NE2 HIS A 168 2.783 10.664 -2.676 1.00 55.11 N ATOM 0 H HIS A 168 6.387 7.027 -6.117 1.00 12.22 H new ATOM 0 HA HIS A 168 5.575 9.684 -6.254 1.00 32.43 H new ATOM 0 HB2 HIS A 168 4.149 7.795 -5.523 1.00 23.30 H new ATOM 0 HB3 HIS A 168 5.098 7.620 -4.060 1.00 23.30 H new ATOM 0 HD2 HIS A 168 4.702 9.770 -2.138 1.00 50.22 H new ATOM 0 HE1 HIS A 168 1.080 11.072 -3.895 1.00 3.31 H new ATOM 0 HE2 HIS A 168 2.573 11.225 -1.850 1.00 55.11 H new ATOM 2369 N LEU A 169 7.729 9.108 -3.821 1.00 43.11 N ATOM 2370 CA LEU A 169 8.588 9.769 -2.836 1.00 44.21 C ATOM 2371 C LEU A 169 9.672 10.609 -3.500 1.00 61.13 C ATOM 2372 O LEU A 169 10.107 11.626 -2.952 1.00 21.01 O ATOM 2373 CB LEU A 169 9.223 8.761 -1.874 1.00 72.22 C ATOM 2374 CG LEU A 169 8.266 7.920 -1.031 1.00 73.42 C ATOM 2375 CD1 LEU A 169 9.037 6.998 -0.103 1.00 14.32 C ATOM 2376 CD2 LEU A 169 7.341 8.807 -0.234 1.00 64.13 C ATOM 0 H LEU A 169 7.902 8.109 -3.934 1.00 43.11 H new ATOM 0 HA LEU A 169 7.944 10.436 -2.263 1.00 44.21 H new ATOM 0 HB2 LEU A 169 9.849 8.084 -2.455 1.00 72.22 H new ATOM 0 HB3 LEU A 169 9.883 9.305 -1.198 1.00 72.22 H new ATOM 0 HG LEU A 169 7.667 7.309 -1.706 1.00 73.42 H new ATOM 0 HD11 LEU A 169 8.337 6.408 0.488 1.00 14.32 H new ATOM 0 HD12 LEU A 169 9.666 6.331 -0.693 1.00 14.32 H new ATOM 0 HD13 LEU A 169 9.663 7.592 0.563 1.00 14.32 H new ATOM 0 HD21 LEU A 169 6.667 8.190 0.360 1.00 64.13 H new ATOM 0 HD22 LEU A 169 7.928 9.444 0.428 1.00 64.13 H new ATOM 0 HD23 LEU A 169 6.759 9.429 -0.913 1.00 64.13 H new ATOM 2388 N LEU A 170 10.099 10.188 -4.667 1.00 41.23 N ATOM 2389 CA LEU A 170 11.133 10.899 -5.409 1.00 62.14 C ATOM 2390 C LEU A 170 10.529 12.055 -6.203 1.00 51.41 C ATOM 2391 O LEU A 170 11.195 13.052 -6.487 1.00 32.04 O ATOM 2392 CB LEU A 170 11.872 9.931 -6.339 1.00 75.32 C ATOM 2393 CG LEU A 170 12.612 8.771 -5.653 1.00 11.42 C ATOM 2394 CD1 LEU A 170 13.254 7.865 -6.677 1.00 15.31 C ATOM 2395 CD2 LEU A 170 13.658 9.294 -4.687 1.00 72.23 C ATOM 0 H LEU A 170 9.748 9.351 -5.132 1.00 41.23 H new ATOM 0 HA LEU A 170 11.848 11.315 -4.699 1.00 62.14 H new ATOM 0 HB2 LEU A 170 11.152 9.512 -7.041 1.00 75.32 H new ATOM 0 HB3 LEU A 170 12.594 10.501 -6.925 1.00 75.32 H new ATOM 0 HG LEU A 170 11.879 8.193 -5.089 1.00 11.42 H new ATOM 0 HD11 LEU A 170 13.772 7.051 -6.169 1.00 15.31 H new ATOM 0 HD12 LEU A 170 12.486 7.453 -7.331 1.00 15.31 H new ATOM 0 HD13 LEU A 170 13.968 8.435 -7.270 1.00 15.31 H new ATOM 0 HD21 LEU A 170 14.168 8.455 -4.214 1.00 72.23 H new ATOM 0 HD22 LEU A 170 14.383 9.901 -5.229 1.00 72.23 H new ATOM 0 HD23 LEU A 170 13.175 9.903 -3.923 1.00 72.23 H new ATOM 2407 N ALA A 171 9.259 11.910 -6.526 1.00 21.21 N ATOM 2408 CA ALA A 171 8.495 12.893 -7.288 1.00 71.10 C ATOM 2409 C ALA A 171 8.277 14.178 -6.504 1.00 24.01 C ATOM 2410 O ALA A 171 7.974 15.224 -7.079 1.00 73.34 O ATOM 2411 CB ALA A 171 7.154 12.299 -7.678 1.00 22.30 C ATOM 0 H ALA A 171 8.713 11.090 -6.263 1.00 21.21 H new ATOM 0 HA ALA A 171 9.070 13.144 -8.179 1.00 71.10 H new ATOM 0 HB1 ALA A 171 6.583 13.032 -8.247 1.00 22.30 H new ATOM 0 HB2 ALA A 171 7.313 11.410 -8.289 1.00 22.30 H new ATOM 0 HB3 ALA A 171 6.601 12.027 -6.779 1.00 22.30 H new ATOM 2417 N GLU A 172 8.429 14.104 -5.208 1.00 30.13 N ATOM 2418 CA GLU A 172 8.229 15.249 -4.359 1.00 32.42 C ATOM 2419 C GLU A 172 9.475 15.548 -3.572 1.00 15.11 C ATOM 2420 O GLU A 172 10.360 14.695 -3.441 1.00 62.13 O ATOM 2421 CB GLU A 172 7.062 15.018 -3.401 1.00 52.44 C ATOM 2422 CG GLU A 172 7.217 13.779 -2.538 1.00 72.34 C ATOM 2423 CD GLU A 172 6.102 13.621 -1.552 1.00 52.45 C ATOM 2424 OE1 GLU A 172 4.962 13.328 -1.969 1.00 2.33 O ATOM 2425 OE2 GLU A 172 6.349 13.790 -0.345 1.00 22.40 O ATOM 0 H GLU A 172 8.694 13.253 -4.713 1.00 30.13 H new ATOM 0 HA GLU A 172 7.997 16.101 -4.998 1.00 32.42 H new ATOM 0 HB2 GLU A 172 6.956 15.889 -2.755 1.00 52.44 H new ATOM 0 HB3 GLU A 172 6.141 14.935 -3.978 1.00 52.44 H new ATOM 0 HG2 GLU A 172 7.259 12.898 -3.178 1.00 72.34 H new ATOM 0 HG3 GLU A 172 8.165 13.830 -2.003 1.00 72.34 H new ATOM 2432 N GLU A 173 9.544 16.736 -3.060 1.00 74.54 N ATOM 2433 CA GLU A 173 10.630 17.133 -2.223 1.00 30.12 C ATOM 2434 C GLU A 173 10.186 16.974 -0.795 1.00 33.44 C ATOM 2435 O GLU A 173 9.600 17.919 -0.238 1.00 37.75 O ATOM 2436 CB GLU A 173 11.077 18.591 -2.488 1.00 13.14 C ATOM 2437 CG GLU A 173 11.675 18.881 -3.872 1.00 45.05 C ATOM 2438 CD GLU A 173 10.709 18.686 -5.012 1.00 71.50 C ATOM 2439 OE1 GLU A 173 9.823 19.537 -5.206 1.00 15.51 O ATOM 2440 OE2 GLU A 173 10.815 17.680 -5.736 1.00 22.43 O ATOM 2441 OXT GLU A 173 10.366 15.872 -0.242 1.00 37.75 O ATOM 0 H GLU A 173 8.844 17.462 -3.212 1.00 74.54 H new ATOM 0 HA GLU A 173 11.494 16.505 -2.439 1.00 30.12 H new ATOM 0 HB2 GLU A 173 10.216 19.244 -2.344 1.00 13.14 H new ATOM 0 HB3 GLU A 173 11.814 18.865 -1.733 1.00 13.14 H new ATOM 0 HG2 GLU A 173 12.040 19.908 -3.891 1.00 45.05 H new ATOM 0 HG3 GLU A 173 12.538 18.233 -4.026 1.00 45.05 H new TER 2448 GLU A 173