USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1071 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 109 THR OG1 : rot 120:sc= -0.0582 USER MOD Set 1.2: A 111 ASN : amide:sc= 0.528 K(o=0.47,f=-3.7!) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 49:sc= 0.47 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 77:sc= 0.764 USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -123:sc= 0.257 USER MOD Single : A 37 LYS NZ :NH3+ 176:sc= 1.21 (180deg=1.18) USER MOD Single : A 39 LYS NZ :NH3+ 157:sc= 0.811 (180deg=0.452) USER MOD Single : A 41 LYS NZ :NH3+ -153:sc= 0.879 (180deg=0.588) USER MOD Single : A 46 LYS NZ :NH3+ -128:sc= -0.0241 (180deg=-1.63) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= -0.178 X(o=-0.18,f=-0.021) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0.0401 USER MOD Single : A 72 TYR OH : rot 130:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -1.91 K(o=-1.9,f=-2.4) USER MOD Single : A 75 LYS NZ :NH3+ -128:sc= 0.936 (180deg=-0.0211) USER MOD Single : A 84 MET CE :methyl -155:sc= -0.0371 (180deg=-1.03) USER MOD Single : A 87 GLN : amide:sc= -0.0322 X(o=-0.032,f=-0.012) USER MOD Single : A 89 GLN : amide:sc= -0.301 K(o=-0.3,f=-2.7!) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.0168 X(o=-0.017,f=-0.17) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 133:sc= -0.102 (180deg=-0.486) USER MOD Single : A 116 LYS NZ :NH3+ -140:sc= -0.845 (180deg=-3.04!) USER MOD Single : A 117 LYS NZ :NH3+ 177:sc= 0.473 (180deg=0.468) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 170:sc=-0.00118 (180deg=-0.117) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 2.581 12.969 -1.696 1.00 34.34 N ATOM 21 CA GLY A 2 3.369 11.734 -1.614 1.00 62.30 C ATOM 22 C GLY A 2 2.663 10.685 -0.763 1.00 30.14 C ATOM 23 O GLY A 2 3.292 10.006 0.039 1.00 14.25 O ATOM 0 HA2 GLY A 2 3.537 11.340 -2.616 1.00 62.30 H new ATOM 0 HA3 GLY A 2 4.349 11.952 -1.189 1.00 62.30 H new ATOM 27 N THR A 3 1.326 10.613 -0.928 1.00 3.44 N ATOM 28 CA THR A 3 0.452 9.645 -0.237 1.00 20.41 C ATOM 29 C THR A 3 0.854 8.187 -0.572 1.00 72.14 C ATOM 30 O THR A 3 0.668 7.737 -1.701 1.00 3.54 O ATOM 31 CB THR A 3 -1.039 9.909 -0.643 1.00 33.42 C ATOM 32 OG1 THR A 3 -1.395 11.247 -0.289 1.00 4.44 O ATOM 33 CG2 THR A 3 -2.033 8.933 0.004 1.00 43.21 C ATOM 0 H THR A 3 0.816 11.236 -1.555 1.00 3.44 H new ATOM 0 HA THR A 3 0.565 9.778 0.839 1.00 20.41 H new ATOM 0 HB THR A 3 -1.103 9.755 -1.720 1.00 33.42 H new ATOM 0 HG1 THR A 3 -2.326 11.416 -0.543 1.00 4.44 H new ATOM 0 HG21 THR A 3 -3.045 9.175 -0.322 1.00 43.21 H new ATOM 0 HG22 THR A 3 -1.789 7.914 -0.296 1.00 43.21 H new ATOM 0 HG23 THR A 3 -1.971 9.017 1.089 1.00 43.21 H new ATOM 41 N VAL A 4 1.386 7.465 0.431 1.00 64.14 N ATOM 42 CA VAL A 4 1.977 6.124 0.247 1.00 2.52 C ATOM 43 C VAL A 4 0.952 5.039 0.634 1.00 62.34 C ATOM 44 O VAL A 4 0.513 4.976 1.776 1.00 70.31 O ATOM 45 CB VAL A 4 3.295 5.948 1.101 1.00 45.51 C ATOM 46 CG1 VAL A 4 3.951 4.573 0.847 1.00 22.44 C ATOM 47 CG2 VAL A 4 4.298 7.091 0.822 1.00 71.45 C ATOM 0 H VAL A 4 1.419 7.795 1.396 1.00 64.14 H new ATOM 0 HA VAL A 4 2.242 6.017 -0.805 1.00 2.52 H new ATOM 0 HB VAL A 4 3.011 5.995 2.152 1.00 45.51 H new ATOM 0 HG11 VAL A 4 4.855 4.484 1.450 1.00 22.44 H new ATOM 0 HG12 VAL A 4 3.254 3.781 1.120 1.00 22.44 H new ATOM 0 HG13 VAL A 4 4.208 4.482 -0.208 1.00 22.44 H new ATOM 0 HG21 VAL A 4 5.195 6.943 1.424 1.00 71.45 H new ATOM 0 HG22 VAL A 4 4.566 7.090 -0.235 1.00 71.45 H new ATOM 0 HG23 VAL A 4 3.842 8.047 1.080 1.00 71.45 H new ATOM 57 N VAL A 5 0.567 4.203 -0.334 1.00 12.11 N ATOM 58 CA VAL A 5 -0.355 3.081 -0.124 1.00 35.43 C ATOM 59 C VAL A 5 0.444 1.767 -0.177 1.00 31.22 C ATOM 60 O VAL A 5 0.939 1.391 -1.232 1.00 14.54 O ATOM 61 CB VAL A 5 -1.498 3.074 -1.213 1.00 65.10 C ATOM 62 CG1 VAL A 5 -2.470 1.887 -1.009 1.00 55.44 C ATOM 63 CG2 VAL A 5 -2.255 4.426 -1.236 1.00 14.44 C ATOM 0 H VAL A 5 0.890 4.286 -1.298 1.00 12.11 H new ATOM 0 HA VAL A 5 -0.831 3.186 0.851 1.00 35.43 H new ATOM 0 HB VAL A 5 -1.025 2.941 -2.186 1.00 65.10 H new ATOM 0 HG11 VAL A 5 -3.244 1.914 -1.776 1.00 55.44 H new ATOM 0 HG12 VAL A 5 -1.919 0.949 -1.082 1.00 55.44 H new ATOM 0 HG13 VAL A 5 -2.933 1.961 -0.025 1.00 55.44 H new ATOM 0 HG21 VAL A 5 -3.036 4.393 -1.995 1.00 14.44 H new ATOM 0 HG22 VAL A 5 -2.705 4.608 -0.260 1.00 14.44 H new ATOM 0 HG23 VAL A 5 -1.557 5.230 -1.469 1.00 14.44 H new ATOM 73 N ILE A 6 0.584 1.088 0.971 1.00 13.12 N ATOM 74 CA ILE A 6 1.338 -0.172 1.076 1.00 61.03 C ATOM 75 C ILE A 6 0.383 -1.360 0.877 1.00 43.21 C ATOM 76 O ILE A 6 -0.388 -1.708 1.771 1.00 31.13 O ATOM 77 CB ILE A 6 2.074 -0.276 2.469 1.00 3.01 C ATOM 78 CG1 ILE A 6 3.050 0.927 2.661 1.00 14.14 C ATOM 79 CG2 ILE A 6 2.825 -1.625 2.624 1.00 10.21 C ATOM 80 CD1 ILE A 6 4.134 1.033 1.597 1.00 43.54 C ATOM 0 H ILE A 6 0.178 1.396 1.854 1.00 13.12 H new ATOM 0 HA ILE A 6 2.100 -0.192 0.297 1.00 61.03 H new ATOM 0 HB ILE A 6 1.313 -0.237 3.249 1.00 3.01 H new ATOM 0 HG12 ILE A 6 2.472 1.851 2.667 1.00 14.14 H new ATOM 0 HG13 ILE A 6 3.524 0.842 3.639 1.00 14.14 H new ATOM 0 HG21 ILE A 6 3.318 -1.657 3.595 1.00 10.21 H new ATOM 0 HG22 ILE A 6 2.114 -2.448 2.550 1.00 10.21 H new ATOM 0 HG23 ILE A 6 3.571 -1.719 1.835 1.00 10.21 H new ATOM 0 HD11 ILE A 6 4.767 1.895 1.807 1.00 43.54 H new ATOM 0 HD12 ILE A 6 4.741 0.127 1.604 1.00 43.54 H new ATOM 0 HD13 ILE A 6 3.672 1.152 0.617 1.00 43.54 H new ATOM 92 N VAL A 7 0.421 -1.948 -0.323 1.00 53.30 N ATOM 93 CA VAL A 7 -0.412 -3.100 -0.682 1.00 14.11 C ATOM 94 C VAL A 7 0.450 -4.365 -0.650 1.00 71.13 C ATOM 95 O VAL A 7 1.334 -4.557 -1.493 1.00 72.23 O ATOM 96 CB VAL A 7 -1.080 -2.931 -2.097 1.00 72.22 C ATOM 97 CG1 VAL A 7 -2.008 -4.125 -2.424 1.00 64.41 C ATOM 98 CG2 VAL A 7 -1.843 -1.593 -2.179 1.00 21.45 C ATOM 0 H VAL A 7 1.034 -1.636 -1.076 1.00 53.30 H new ATOM 0 HA VAL A 7 -1.222 -3.177 0.044 1.00 14.11 H new ATOM 0 HB VAL A 7 -0.289 -2.917 -2.846 1.00 72.22 H new ATOM 0 HG11 VAL A 7 -2.455 -3.980 -3.408 1.00 64.41 H new ATOM 0 HG12 VAL A 7 -1.428 -5.048 -2.422 1.00 64.41 H new ATOM 0 HG13 VAL A 7 -2.796 -4.190 -1.673 1.00 64.41 H new ATOM 0 HG21 VAL A 7 -2.298 -1.494 -3.164 1.00 21.45 H new ATOM 0 HG22 VAL A 7 -2.621 -1.570 -1.416 1.00 21.45 H new ATOM 0 HG23 VAL A 7 -1.150 -0.768 -2.015 1.00 21.45 H new ATOM 108 N VAL A 8 0.210 -5.188 0.369 1.00 72.53 N ATOM 109 CA VAL A 8 0.865 -6.479 0.561 1.00 74.21 C ATOM 110 C VAL A 8 -0.151 -7.589 0.258 1.00 71.35 C ATOM 111 O VAL A 8 -1.243 -7.602 0.833 1.00 63.04 O ATOM 112 CB VAL A 8 1.392 -6.628 2.039 1.00 5.20 C ATOM 113 CG1 VAL A 8 2.054 -8.007 2.275 1.00 13.24 C ATOM 114 CG2 VAL A 8 2.346 -5.463 2.405 1.00 3.14 C ATOM 0 H VAL A 8 -0.463 -4.969 1.103 1.00 72.53 H new ATOM 0 HA VAL A 8 1.721 -6.552 -0.110 1.00 74.21 H new ATOM 0 HB VAL A 8 0.531 -6.574 2.706 1.00 5.20 H new ATOM 0 HG11 VAL A 8 2.404 -8.071 3.305 1.00 13.24 H new ATOM 0 HG12 VAL A 8 1.326 -8.797 2.090 1.00 13.24 H new ATOM 0 HG13 VAL A 8 2.899 -8.126 1.597 1.00 13.24 H new ATOM 0 HG21 VAL A 8 2.696 -5.588 3.430 1.00 3.14 H new ATOM 0 HG22 VAL A 8 3.199 -5.465 1.727 1.00 3.14 H new ATOM 0 HG23 VAL A 8 1.814 -4.516 2.316 1.00 3.14 H new ATOM 124 N SER A 9 0.194 -8.496 -0.655 1.00 0.34 N ATOM 125 CA SER A 9 -0.602 -9.699 -0.921 1.00 51.32 C ATOM 126 C SER A 9 0.338 -10.894 -1.028 1.00 43.23 C ATOM 127 O SER A 9 1.479 -10.745 -1.446 1.00 22.44 O ATOM 128 CB SER A 9 -1.443 -9.547 -2.210 1.00 23.32 C ATOM 129 OG SER A 9 -2.236 -10.700 -2.457 1.00 4.42 O ATOM 0 H SER A 9 1.032 -8.420 -1.232 1.00 0.34 H new ATOM 0 HA SER A 9 -1.302 -9.852 -0.100 1.00 51.32 H new ATOM 0 HB2 SER A 9 -2.088 -8.673 -2.123 1.00 23.32 H new ATOM 0 HB3 SER A 9 -0.781 -9.371 -3.058 1.00 23.32 H new ATOM 0 HG SER A 9 -2.719 -10.946 -1.641 1.00 4.42 H new ATOM 135 N ARG A 10 -0.158 -12.075 -0.655 1.00 44.52 N ATOM 136 CA ARG A 10 0.620 -13.331 -0.692 1.00 33.21 C ATOM 137 C ARG A 10 0.605 -13.949 -2.115 1.00 25.43 C ATOM 138 O ARG A 10 1.172 -15.023 -2.350 1.00 52.33 O ATOM 139 CB ARG A 10 0.019 -14.297 0.360 1.00 41.13 C ATOM 140 CG ARG A 10 0.828 -15.581 0.670 1.00 30.44 C ATOM 141 CD ARG A 10 0.131 -16.445 1.732 1.00 35.02 C ATOM 142 NE ARG A 10 0.943 -17.566 2.216 1.00 70.44 N ATOM 143 CZ ARG A 10 0.583 -18.378 3.221 1.00 55.03 C ATOM 144 NH1 ARG A 10 -0.579 -18.204 3.851 1.00 40.21 N ATOM 145 NH2 ARG A 10 1.390 -19.350 3.606 1.00 13.33 N ATOM 0 H ARG A 10 -1.113 -12.196 -0.317 1.00 44.52 H new ATOM 0 HA ARG A 10 1.665 -13.137 -0.451 1.00 33.21 H new ATOM 0 HB2 ARG A 10 -0.114 -13.746 1.291 1.00 41.13 H new ATOM 0 HB3 ARG A 10 -0.973 -14.594 0.021 1.00 41.13 H new ATOM 0 HG2 ARG A 10 0.957 -16.160 -0.244 1.00 30.44 H new ATOM 0 HG3 ARG A 10 1.825 -15.309 1.018 1.00 30.44 H new ATOM 0 HD2 ARG A 10 -0.140 -15.814 2.578 1.00 35.02 H new ATOM 0 HD3 ARG A 10 -0.798 -16.836 1.316 1.00 35.02 H new ATOM 0 HE ARG A 10 1.838 -17.739 1.759 1.00 70.44 H new ATOM 0 HH11 ARG A 10 -1.203 -17.448 3.570 1.00 40.21 H new ATOM 0 HH12 ARG A 10 -0.844 -18.827 4.614 1.00 40.21 H new ATOM 0 HH21 ARG A 10 2.287 -19.483 3.139 1.00 13.33 H new ATOM 0 HH22 ARG A 10 1.116 -19.968 4.370 1.00 13.33 H new ATOM 159 N ASP A 11 -0.022 -13.234 -3.066 1.00 24.22 N ATOM 160 CA ASP A 11 -0.149 -13.666 -4.461 1.00 1.42 C ATOM 161 C ASP A 11 -0.076 -12.450 -5.411 1.00 34.52 C ATOM 162 O ASP A 11 -0.766 -11.443 -5.201 1.00 2.13 O ATOM 163 CB ASP A 11 -1.483 -14.429 -4.638 1.00 31.45 C ATOM 164 CG ASP A 11 -1.720 -14.880 -6.085 1.00 3.12 C ATOM 165 OD1 ASP A 11 -0.951 -15.731 -6.596 1.00 25.21 O ATOM 166 OD2 ASP A 11 -2.663 -14.386 -6.715 1.00 10.14 O ATOM 0 H ASP A 11 -0.458 -12.331 -2.881 1.00 24.22 H new ATOM 0 HA ASP A 11 0.676 -14.333 -4.713 1.00 1.42 H new ATOM 0 HB2 ASP A 11 -1.487 -15.301 -3.985 1.00 31.45 H new ATOM 0 HB3 ASP A 11 -2.307 -13.790 -4.321 1.00 31.45 H new ATOM 171 N GLU A 12 0.764 -12.564 -6.460 1.00 24.35 N ATOM 172 CA GLU A 12 0.995 -11.481 -7.443 1.00 14.41 C ATOM 173 C GLU A 12 -0.144 -11.342 -8.457 1.00 54.44 C ATOM 174 O GLU A 12 -0.290 -10.275 -9.070 1.00 32.44 O ATOM 175 CB GLU A 12 2.331 -11.680 -8.195 1.00 71.45 C ATOM 176 CG GLU A 12 3.577 -11.559 -7.313 1.00 55.22 C ATOM 177 CD GLU A 12 4.868 -11.453 -8.121 1.00 32.45 C ATOM 178 OE1 GLU A 12 5.249 -10.320 -8.484 1.00 2.30 O ATOM 179 OE2 GLU A 12 5.490 -12.489 -8.422 1.00 12.44 O ATOM 0 H GLU A 12 1.302 -13.409 -6.651 1.00 24.35 H new ATOM 0 HA GLU A 12 1.038 -10.560 -6.862 1.00 14.41 H new ATOM 0 HB2 GLU A 12 2.327 -12.664 -8.664 1.00 71.45 H new ATOM 0 HB3 GLU A 12 2.396 -10.945 -8.997 1.00 71.45 H new ATOM 0 HG2 GLU A 12 3.480 -10.681 -6.675 1.00 55.22 H new ATOM 0 HG3 GLU A 12 3.636 -12.426 -6.655 1.00 55.22 H new ATOM 186 N ARG A 13 -0.934 -12.414 -8.652 1.00 55.42 N ATOM 187 CA ARG A 13 -2.072 -12.386 -9.592 1.00 35.35 C ATOM 188 C ARG A 13 -3.180 -11.465 -9.037 1.00 25.04 C ATOM 189 O ARG A 13 -3.947 -10.879 -9.797 1.00 44.44 O ATOM 190 CB ARG A 13 -2.636 -13.804 -9.857 1.00 1.25 C ATOM 191 CG ARG A 13 -1.598 -14.852 -10.301 1.00 13.23 C ATOM 192 CD ARG A 13 -2.232 -16.236 -10.518 1.00 71.43 C ATOM 193 NE ARG A 13 -1.235 -17.259 -10.868 1.00 54.24 N ATOM 194 CZ ARG A 13 -1.479 -18.579 -10.951 1.00 2.31 C ATOM 195 NH1 ARG A 13 -2.699 -19.066 -10.713 1.00 2.55 N ATOM 196 NH2 ARG A 13 -0.495 -19.404 -11.275 1.00 10.10 N ATOM 0 H ARG A 13 -0.807 -13.306 -8.174 1.00 55.42 H new ATOM 0 HA ARG A 13 -1.713 -11.996 -10.544 1.00 35.35 H new ATOM 0 HB2 ARG A 13 -3.122 -14.160 -8.948 1.00 1.25 H new ATOM 0 HB3 ARG A 13 -3.407 -13.733 -10.624 1.00 1.25 H new ATOM 0 HG2 ARG A 13 -1.123 -14.522 -11.225 1.00 13.23 H new ATOM 0 HG3 ARG A 13 -0.814 -14.927 -9.548 1.00 13.23 H new ATOM 0 HD2 ARG A 13 -2.757 -16.539 -9.612 1.00 71.43 H new ATOM 0 HD3 ARG A 13 -2.977 -16.171 -11.311 1.00 71.43 H new ATOM 0 HE ARG A 13 -0.285 -16.943 -11.063 1.00 54.24 H new ATOM 0 HH11 ARG A 13 -3.461 -18.435 -10.465 1.00 2.55 H new ATOM 0 HH12 ARG A 13 -2.870 -20.069 -10.780 1.00 2.55 H new ATOM 0 HH21 ARG A 13 0.439 -19.037 -11.459 1.00 10.10 H new ATOM 0 HH22 ARG A 13 -0.671 -20.407 -11.340 1.00 10.10 H new ATOM 210 N ILE A 14 -3.253 -11.363 -7.699 1.00 55.43 N ATOM 211 CA ILE A 14 -4.114 -10.382 -7.017 1.00 34.31 C ATOM 212 C ILE A 14 -3.522 -8.962 -7.176 1.00 0.25 C ATOM 213 O ILE A 14 -4.239 -8.024 -7.533 1.00 63.41 O ATOM 214 CB ILE A 14 -4.316 -10.746 -5.491 1.00 11.14 C ATOM 215 CG1 ILE A 14 -5.006 -12.146 -5.358 1.00 42.54 C ATOM 216 CG2 ILE A 14 -5.125 -9.648 -4.751 1.00 55.12 C ATOM 217 CD1 ILE A 14 -5.291 -12.598 -3.933 1.00 23.34 C ATOM 0 H ILE A 14 -2.720 -11.955 -7.062 1.00 55.43 H new ATOM 0 HA ILE A 14 -5.098 -10.408 -7.485 1.00 34.31 H new ATOM 0 HB ILE A 14 -3.336 -10.798 -5.017 1.00 11.14 H new ATOM 0 HG12 ILE A 14 -5.946 -12.123 -5.909 1.00 42.54 H new ATOM 0 HG13 ILE A 14 -4.373 -12.892 -5.838 1.00 42.54 H new ATOM 0 HG21 ILE A 14 -5.246 -9.928 -3.705 1.00 55.12 H new ATOM 0 HG22 ILE A 14 -4.592 -8.699 -4.813 1.00 55.12 H new ATOM 0 HG23 ILE A 14 -6.106 -9.544 -5.215 1.00 55.12 H new ATOM 0 HD11 ILE A 14 -5.769 -13.578 -3.951 1.00 23.34 H new ATOM 0 HD12 ILE A 14 -4.355 -12.661 -3.377 1.00 23.34 H new ATOM 0 HD13 ILE A 14 -5.953 -11.880 -3.449 1.00 23.34 H new ATOM 229 N LEU A 15 -2.192 -8.841 -6.956 1.00 72.41 N ATOM 230 CA LEU A 15 -1.461 -7.551 -7.045 1.00 42.32 C ATOM 231 C LEU A 15 -1.575 -6.894 -8.441 1.00 12.31 C ATOM 232 O LEU A 15 -1.622 -5.667 -8.535 1.00 23.20 O ATOM 233 CB LEU A 15 0.037 -7.741 -6.668 1.00 73.14 C ATOM 234 CG LEU A 15 0.330 -8.078 -5.173 1.00 33.14 C ATOM 235 CD1 LEU A 15 1.804 -8.476 -4.969 1.00 75.42 C ATOM 236 CD2 LEU A 15 -0.059 -6.900 -4.249 1.00 42.54 C ATOM 0 H LEU A 15 -1.595 -9.631 -6.712 1.00 72.41 H new ATOM 0 HA LEU A 15 -1.933 -6.877 -6.330 1.00 42.32 H new ATOM 0 HB2 LEU A 15 0.448 -8.539 -7.287 1.00 73.14 H new ATOM 0 HB3 LEU A 15 0.574 -6.828 -6.926 1.00 73.14 H new ATOM 0 HG LEU A 15 -0.287 -8.935 -4.901 1.00 33.14 H new ATOM 0 HD11 LEU A 15 1.977 -8.705 -3.917 1.00 75.42 H new ATOM 0 HD12 LEU A 15 2.031 -9.354 -5.574 1.00 75.42 H new ATOM 0 HD13 LEU A 15 2.449 -7.651 -5.272 1.00 75.42 H new ATOM 0 HD21 LEU A 15 0.156 -7.163 -3.213 1.00 42.54 H new ATOM 0 HD22 LEU A 15 0.515 -6.016 -4.525 1.00 42.54 H new ATOM 0 HD23 LEU A 15 -1.123 -6.690 -4.356 1.00 42.54 H new ATOM 248 N GLU A 16 -1.619 -7.714 -9.517 1.00 40.44 N ATOM 249 CA GLU A 16 -1.698 -7.197 -10.903 1.00 55.22 C ATOM 250 C GLU A 16 -3.104 -6.630 -11.195 1.00 22.32 C ATOM 251 O GLU A 16 -3.230 -5.654 -11.936 1.00 43.50 O ATOM 252 CB GLU A 16 -1.316 -8.284 -11.950 1.00 64.35 C ATOM 253 CG GLU A 16 -2.322 -9.442 -12.072 1.00 62.12 C ATOM 254 CD GLU A 16 -1.926 -10.500 -13.110 1.00 63.20 C ATOM 255 OE1 GLU A 16 -2.512 -10.530 -14.211 1.00 42.04 O ATOM 256 OE2 GLU A 16 -1.028 -11.312 -12.823 1.00 31.44 O ATOM 0 H GLU A 16 -1.601 -8.732 -9.452 1.00 40.44 H new ATOM 0 HA GLU A 16 -0.971 -6.389 -10.991 1.00 55.22 H new ATOM 0 HB2 GLU A 16 -1.210 -7.808 -12.925 1.00 64.35 H new ATOM 0 HB3 GLU A 16 -0.341 -8.694 -11.688 1.00 64.35 H new ATOM 0 HG2 GLU A 16 -2.428 -9.923 -11.099 1.00 62.12 H new ATOM 0 HG3 GLU A 16 -3.299 -9.036 -12.335 1.00 62.12 H new ATOM 263 N GLU A 17 -4.148 -7.231 -10.581 1.00 63.13 N ATOM 264 CA GLU A 17 -5.531 -6.724 -10.688 1.00 63.15 C ATOM 265 C GLU A 17 -5.631 -5.361 -9.999 1.00 72.44 C ATOM 266 O GLU A 17 -6.123 -4.391 -10.580 1.00 25.55 O ATOM 267 CB GLU A 17 -6.542 -7.711 -10.052 1.00 53.35 C ATOM 268 CG GLU A 17 -6.543 -9.107 -10.685 1.00 75.31 C ATOM 269 CD GLU A 17 -6.868 -9.094 -12.188 1.00 3.53 C ATOM 270 OE1 GLU A 17 -5.966 -9.343 -13.018 1.00 41.42 O ATOM 271 OE2 GLU A 17 -8.032 -8.829 -12.545 1.00 1.14 O ATOM 0 H GLU A 17 -4.057 -8.069 -10.006 1.00 63.13 H new ATOM 0 HA GLU A 17 -5.779 -6.622 -11.745 1.00 63.15 H new ATOM 0 HB2 GLU A 17 -6.319 -7.807 -8.989 1.00 53.35 H new ATOM 0 HB3 GLU A 17 -7.544 -7.288 -10.131 1.00 53.35 H new ATOM 0 HG2 GLU A 17 -5.566 -9.567 -10.536 1.00 75.31 H new ATOM 0 HG3 GLU A 17 -7.271 -9.732 -10.168 1.00 75.31 H new ATOM 278 N LEU A 18 -5.092 -5.311 -8.765 1.00 73.31 N ATOM 279 CA LEU A 18 -5.063 -4.106 -7.921 1.00 21.33 C ATOM 280 C LEU A 18 -4.207 -2.994 -8.570 1.00 15.34 C ATOM 281 O LEU A 18 -4.469 -1.800 -8.384 1.00 65.01 O ATOM 282 CB LEU A 18 -4.508 -4.470 -6.514 1.00 51.23 C ATOM 283 CG LEU A 18 -5.287 -5.571 -5.724 1.00 42.33 C ATOM 284 CD1 LEU A 18 -4.678 -5.805 -4.323 1.00 10.21 C ATOM 285 CD2 LEU A 18 -6.785 -5.239 -5.635 1.00 21.12 C ATOM 0 H LEU A 18 -4.658 -6.121 -8.322 1.00 73.31 H new ATOM 0 HA LEU A 18 -6.079 -3.725 -7.820 1.00 21.33 H new ATOM 0 HB2 LEU A 18 -3.475 -4.798 -6.628 1.00 51.23 H new ATOM 0 HB3 LEU A 18 -4.490 -3.564 -5.909 1.00 51.23 H new ATOM 0 HG LEU A 18 -5.187 -6.503 -6.280 1.00 42.33 H new ATOM 0 HD11 LEU A 18 -5.246 -6.577 -3.804 1.00 10.21 H new ATOM 0 HD12 LEU A 18 -3.641 -6.125 -4.426 1.00 10.21 H new ATOM 0 HD13 LEU A 18 -4.717 -4.879 -3.750 1.00 10.21 H new ATOM 0 HD21 LEU A 18 -7.299 -6.024 -5.080 1.00 21.12 H new ATOM 0 HD22 LEU A 18 -6.917 -4.286 -5.123 1.00 21.12 H new ATOM 0 HD23 LEU A 18 -7.203 -5.172 -6.639 1.00 21.12 H new ATOM 297 N LEU A 19 -3.190 -3.423 -9.337 1.00 13.15 N ATOM 298 CA LEU A 19 -2.294 -2.531 -10.088 1.00 52.44 C ATOM 299 C LEU A 19 -3.071 -1.802 -11.194 1.00 23.44 C ATOM 300 O LEU A 19 -2.964 -0.574 -11.340 1.00 72.24 O ATOM 301 CB LEU A 19 -1.120 -3.345 -10.698 1.00 72.23 C ATOM 302 CG LEU A 19 -0.088 -2.547 -11.551 1.00 24.14 C ATOM 303 CD1 LEU A 19 0.566 -1.427 -10.730 1.00 50.04 C ATOM 304 CD2 LEU A 19 0.975 -3.486 -12.145 1.00 30.13 C ATOM 0 H LEU A 19 -2.966 -4.411 -9.453 1.00 13.15 H new ATOM 0 HA LEU A 19 -1.886 -1.786 -9.404 1.00 52.44 H new ATOM 0 HB2 LEU A 19 -0.584 -3.833 -9.884 1.00 72.23 H new ATOM 0 HB3 LEU A 19 -1.540 -4.134 -11.322 1.00 72.23 H new ATOM 0 HG LEU A 19 -0.628 -2.081 -12.376 1.00 24.14 H new ATOM 0 HD11 LEU A 19 1.281 -0.889 -11.353 1.00 50.04 H new ATOM 0 HD12 LEU A 19 -0.202 -0.737 -10.380 1.00 50.04 H new ATOM 0 HD13 LEU A 19 1.084 -1.859 -9.874 1.00 50.04 H new ATOM 0 HD21 LEU A 19 1.684 -2.906 -12.736 1.00 30.13 H new ATOM 0 HD22 LEU A 19 1.505 -3.993 -11.338 1.00 30.13 H new ATOM 0 HD23 LEU A 19 0.491 -4.226 -12.782 1.00 30.13 H new ATOM 316 N GLU A 20 -3.880 -2.583 -11.943 1.00 73.44 N ATOM 317 CA GLU A 20 -4.720 -2.061 -13.032 1.00 51.42 C ATOM 318 C GLU A 20 -5.752 -1.060 -12.496 1.00 65.51 C ATOM 319 O GLU A 20 -6.007 -0.046 -13.137 1.00 72.10 O ATOM 320 CB GLU A 20 -5.435 -3.215 -13.783 1.00 52.34 C ATOM 321 CG GLU A 20 -4.482 -4.190 -14.499 1.00 1.53 C ATOM 322 CD GLU A 20 -5.225 -5.314 -15.218 1.00 63.13 C ATOM 323 OE1 GLU A 20 -5.650 -6.278 -14.549 1.00 11.52 O ATOM 324 OE2 GLU A 20 -5.405 -5.229 -16.456 1.00 35.41 O ATOM 0 H GLU A 20 -3.966 -3.590 -11.806 1.00 73.44 H new ATOM 0 HA GLU A 20 -4.067 -1.543 -13.735 1.00 51.42 H new ATOM 0 HB2 GLU A 20 -6.042 -3.775 -13.072 1.00 52.34 H new ATOM 0 HB3 GLU A 20 -6.118 -2.787 -14.517 1.00 52.34 H new ATOM 0 HG2 GLU A 20 -3.878 -3.639 -15.220 1.00 1.53 H new ATOM 0 HG3 GLU A 20 -3.795 -4.621 -13.771 1.00 1.53 H new ATOM 331 N VAL A 21 -6.289 -1.345 -11.289 1.00 13.01 N ATOM 332 CA VAL A 21 -7.296 -0.497 -10.618 1.00 23.11 C ATOM 333 C VAL A 21 -6.785 0.955 -10.448 1.00 53.23 C ATOM 334 O VAL A 21 -7.540 1.918 -10.671 1.00 74.43 O ATOM 335 CB VAL A 21 -7.705 -1.097 -9.218 1.00 21.13 C ATOM 336 CG1 VAL A 21 -8.658 -0.162 -8.445 1.00 23.11 C ATOM 337 CG2 VAL A 21 -8.336 -2.501 -9.372 1.00 31.33 C ATOM 0 H VAL A 21 -6.034 -2.174 -10.752 1.00 13.01 H new ATOM 0 HA VAL A 21 -8.179 -0.477 -11.256 1.00 23.11 H new ATOM 0 HB VAL A 21 -6.788 -1.191 -8.636 1.00 21.13 H new ATOM 0 HG11 VAL A 21 -8.914 -0.615 -7.487 1.00 23.11 H new ATOM 0 HG12 VAL A 21 -8.168 0.797 -8.274 1.00 23.11 H new ATOM 0 HG13 VAL A 21 -9.566 -0.007 -9.027 1.00 23.11 H new ATOM 0 HG21 VAL A 21 -8.607 -2.888 -8.390 1.00 31.33 H new ATOM 0 HG22 VAL A 21 -9.228 -2.433 -9.994 1.00 31.33 H new ATOM 0 HG23 VAL A 21 -7.618 -3.173 -9.841 1.00 31.33 H new ATOM 347 N VAL A 22 -5.488 1.098 -10.094 1.00 31.35 N ATOM 348 CA VAL A 22 -4.833 2.418 -9.988 1.00 70.41 C ATOM 349 C VAL A 22 -4.813 3.104 -11.366 1.00 72.21 C ATOM 350 O VAL A 22 -5.201 4.264 -11.497 1.00 72.54 O ATOM 351 CB VAL A 22 -3.354 2.328 -9.457 1.00 1.24 C ATOM 352 CG1 VAL A 22 -2.728 3.741 -9.304 1.00 51.11 C ATOM 353 CG2 VAL A 22 -3.285 1.534 -8.138 1.00 31.32 C ATOM 0 H VAL A 22 -4.875 0.313 -9.877 1.00 31.35 H new ATOM 0 HA VAL A 22 -5.415 2.995 -9.269 1.00 70.41 H new ATOM 0 HB VAL A 22 -2.764 1.786 -10.197 1.00 1.24 H new ATOM 0 HG11 VAL A 22 -1.706 3.648 -8.936 1.00 51.11 H new ATOM 0 HG12 VAL A 22 -2.721 4.242 -10.272 1.00 51.11 H new ATOM 0 HG13 VAL A 22 -3.317 4.325 -8.597 1.00 51.11 H new ATOM 0 HG21 VAL A 22 -2.252 1.488 -7.795 1.00 31.32 H new ATOM 0 HG22 VAL A 22 -3.896 2.029 -7.383 1.00 31.32 H new ATOM 0 HG23 VAL A 22 -3.658 0.523 -8.302 1.00 31.32 H new ATOM 363 N LEU A 23 -4.406 2.327 -12.388 1.00 71.20 N ATOM 364 CA LEU A 23 -4.237 2.811 -13.771 1.00 13.42 C ATOM 365 C LEU A 23 -5.585 3.241 -14.396 1.00 64.01 C ATOM 366 O LEU A 23 -5.608 4.092 -15.288 1.00 34.52 O ATOM 367 CB LEU A 23 -3.557 1.713 -14.641 1.00 25.14 C ATOM 368 CG LEU A 23 -2.211 1.134 -14.085 1.00 51.44 C ATOM 369 CD1 LEU A 23 -1.659 0.015 -14.990 1.00 64.42 C ATOM 370 CD2 LEU A 23 -1.157 2.237 -13.860 1.00 60.44 C ATOM 0 H LEU A 23 -4.184 1.338 -12.276 1.00 71.20 H new ATOM 0 HA LEU A 23 -3.596 3.692 -13.742 1.00 13.42 H new ATOM 0 HB2 LEU A 23 -4.260 0.889 -14.766 1.00 25.14 H new ATOM 0 HB3 LEU A 23 -3.370 2.126 -15.632 1.00 25.14 H new ATOM 0 HG LEU A 23 -2.434 0.696 -13.112 1.00 51.44 H new ATOM 0 HD11 LEU A 23 -0.725 -0.363 -14.573 1.00 64.42 H new ATOM 0 HD12 LEU A 23 -2.384 -0.796 -15.049 1.00 64.42 H new ATOM 0 HD13 LEU A 23 -1.476 0.412 -15.989 1.00 64.42 H new ATOM 0 HD21 LEU A 23 -0.240 1.791 -13.474 1.00 60.44 H new ATOM 0 HD22 LEU A 23 -0.947 2.738 -14.805 1.00 60.44 H new ATOM 0 HD23 LEU A 23 -1.538 2.963 -13.141 1.00 60.44 H new ATOM 382 N LYS A 24 -6.701 2.646 -13.920 1.00 74.25 N ATOM 383 CA LYS A 24 -8.066 3.003 -14.374 1.00 72.34 C ATOM 384 C LYS A 24 -8.475 4.364 -13.780 1.00 34.14 C ATOM 385 O LYS A 24 -9.075 5.203 -14.464 1.00 54.21 O ATOM 386 CB LYS A 24 -9.108 1.920 -13.942 1.00 15.51 C ATOM 387 CG LYS A 24 -8.798 0.477 -14.395 1.00 60.14 C ATOM 388 CD LYS A 24 -8.655 0.315 -15.926 1.00 62.00 C ATOM 389 CE LYS A 24 -8.244 -1.118 -16.321 1.00 2.14 C ATOM 390 NZ LYS A 24 -8.265 -1.310 -17.798 1.00 34.21 N ATOM 0 H LYS A 24 -6.683 1.909 -13.215 1.00 74.25 H new ATOM 0 HA LYS A 24 -8.054 3.059 -15.462 1.00 72.34 H new ATOM 0 HB2 LYS A 24 -9.187 1.931 -12.855 1.00 15.51 H new ATOM 0 HB3 LYS A 24 -10.084 2.203 -14.336 1.00 15.51 H new ATOM 0 HG2 LYS A 24 -7.875 0.148 -13.917 1.00 60.14 H new ATOM 0 HG3 LYS A 24 -9.592 -0.182 -14.043 1.00 60.14 H new ATOM 0 HD2 LYS A 24 -9.600 0.566 -16.407 1.00 62.00 H new ATOM 0 HD3 LYS A 24 -7.911 1.020 -16.297 1.00 62.00 H new ATOM 0 HE2 LYS A 24 -7.244 -1.328 -15.941 1.00 2.14 H new ATOM 0 HE3 LYS A 24 -8.920 -1.833 -15.851 1.00 2.14 H new ATOM 0 HZ1 LYS A 24 -7.983 -2.285 -18.025 1.00 34.21 H new ATOM 0 HZ2 LYS A 24 -9.225 -1.134 -18.157 1.00 34.21 H new ATOM 0 HZ3 LYS A 24 -7.601 -0.645 -18.244 1.00 34.21 H new ATOM 404 N SER A 25 -8.121 4.559 -12.501 1.00 12.50 N ATOM 405 CA SER A 25 -8.546 5.723 -11.715 1.00 55.34 C ATOM 406 C SER A 25 -7.731 6.987 -12.075 1.00 2.04 C ATOM 407 O SER A 25 -8.301 8.010 -12.480 1.00 73.51 O ATOM 408 CB SER A 25 -8.405 5.407 -10.213 1.00 20.42 C ATOM 409 OG SER A 25 -9.103 4.219 -9.858 1.00 44.20 O ATOM 0 H SER A 25 -7.529 3.910 -11.982 1.00 12.50 H new ATOM 0 HA SER A 25 -9.589 5.931 -11.952 1.00 55.34 H new ATOM 0 HB2 SER A 25 -7.350 5.298 -9.961 1.00 20.42 H new ATOM 0 HB3 SER A 25 -8.788 6.243 -9.628 1.00 20.42 H new ATOM 0 HG SER A 25 -8.587 3.438 -10.147 1.00 44.20 H new ATOM 415 N ASP A 26 -6.392 6.898 -11.941 1.00 24.11 N ATOM 416 CA ASP A 26 -5.483 8.048 -12.119 1.00 12.21 C ATOM 417 C ASP A 26 -4.039 7.572 -12.435 1.00 53.32 C ATOM 418 O ASP A 26 -3.510 6.712 -11.719 1.00 24.14 O ATOM 419 CB ASP A 26 -5.492 8.936 -10.843 1.00 5.42 C ATOM 420 CG ASP A 26 -4.627 10.196 -10.991 1.00 0.31 C ATOM 421 OD1 ASP A 26 -3.584 10.298 -10.330 1.00 23.41 O ATOM 422 OD2 ASP A 26 -4.992 11.085 -11.789 1.00 55.11 O ATOM 0 H ASP A 26 -5.912 6.029 -11.707 1.00 24.11 H new ATOM 0 HA ASP A 26 -5.837 8.637 -12.965 1.00 12.21 H new ATOM 0 HB2 ASP A 26 -6.517 9.229 -10.616 1.00 5.42 H new ATOM 0 HB3 ASP A 26 -5.133 8.351 -9.996 1.00 5.42 H new ATOM 427 N PRO A 27 -3.375 8.128 -13.512 1.00 15.35 N ATOM 428 CA PRO A 27 -1.996 7.747 -13.890 1.00 54.52 C ATOM 429 C PRO A 27 -0.905 8.571 -13.161 1.00 33.41 C ATOM 430 O PRO A 27 0.278 8.229 -13.246 1.00 42.34 O ATOM 431 CB PRO A 27 -1.998 8.019 -15.411 1.00 35.21 C ATOM 432 CG PRO A 27 -2.876 9.230 -15.574 1.00 64.44 C ATOM 433 CD PRO A 27 -3.922 9.148 -14.465 1.00 21.51 C ATOM 0 HA PRO A 27 -1.752 6.721 -13.615 1.00 54.52 H new ATOM 0 HB2 PRO A 27 -0.990 8.206 -15.782 1.00 35.21 H new ATOM 0 HB3 PRO A 27 -2.390 7.167 -15.966 1.00 35.21 H new ATOM 0 HG2 PRO A 27 -2.293 10.148 -15.493 1.00 64.44 H new ATOM 0 HG3 PRO A 27 -3.349 9.239 -16.556 1.00 64.44 H new ATOM 0 HD2 PRO A 27 -4.061 10.113 -13.978 1.00 21.51 H new ATOM 0 HD3 PRO A 27 -4.893 8.846 -14.856 1.00 21.51 H new ATOM 441 N ASN A 28 -1.307 9.657 -12.460 1.00 51.41 N ATOM 442 CA ASN A 28 -0.366 10.531 -11.718 1.00 72.20 C ATOM 443 C ASN A 28 0.049 9.873 -10.403 1.00 30.33 C ATOM 444 O ASN A 28 1.166 10.092 -9.920 1.00 72.35 O ATOM 445 CB ASN A 28 -0.987 11.929 -11.452 1.00 64.44 C ATOM 446 CG ASN A 28 -1.112 12.760 -12.724 1.00 61.42 C ATOM 447 OD1 ASN A 28 -2.109 12.678 -13.440 1.00 33.41 O ATOM 448 ND2 ASN A 28 -0.099 13.573 -13.017 1.00 63.42 N ATOM 0 H ASN A 28 -2.282 9.950 -12.392 1.00 51.41 H new ATOM 0 HA ASN A 28 0.521 10.670 -12.336 1.00 72.20 H new ATOM 0 HB2 ASN A 28 -1.973 11.806 -11.003 1.00 64.44 H new ATOM 0 HB3 ASN A 28 -0.372 12.465 -10.730 1.00 64.44 H new ATOM 0 HD21 ASN A 28 -0.136 14.151 -13.856 1.00 63.42 H new ATOM 0 HD22 ASN A 28 0.714 13.617 -12.402 1.00 63.42 H new ATOM 455 N VAL A 29 -0.861 9.070 -9.819 1.00 70.15 N ATOM 456 CA VAL A 29 -0.517 8.200 -8.694 1.00 45.43 C ATOM 457 C VAL A 29 0.451 7.132 -9.213 1.00 32.03 C ATOM 458 O VAL A 29 0.042 6.231 -9.957 1.00 65.44 O ATOM 459 CB VAL A 29 -1.774 7.509 -8.045 1.00 22.53 C ATOM 460 CG1 VAL A 29 -1.360 6.609 -6.856 1.00 74.22 C ATOM 461 CG2 VAL A 29 -2.825 8.545 -7.604 1.00 40.34 C ATOM 0 H VAL A 29 -1.836 9.011 -10.112 1.00 70.15 H new ATOM 0 HA VAL A 29 -0.065 8.809 -7.911 1.00 45.43 H new ATOM 0 HB VAL A 29 -2.230 6.879 -8.809 1.00 22.53 H new ATOM 0 HG11 VAL A 29 -2.247 6.144 -6.426 1.00 74.22 H new ATOM 0 HG12 VAL A 29 -0.678 5.835 -7.206 1.00 74.22 H new ATOM 0 HG13 VAL A 29 -0.863 7.214 -6.097 1.00 74.22 H new ATOM 0 HG21 VAL A 29 -3.678 8.032 -7.161 1.00 40.34 H new ATOM 0 HG22 VAL A 29 -2.385 9.219 -6.869 1.00 40.34 H new ATOM 0 HG23 VAL A 29 -3.156 9.118 -8.470 1.00 40.34 H new ATOM 471 N LYS A 30 1.732 7.287 -8.862 1.00 23.22 N ATOM 472 CA LYS A 30 2.790 6.363 -9.270 1.00 15.13 C ATOM 473 C LYS A 30 2.545 4.972 -8.666 1.00 0.44 C ATOM 474 O LYS A 30 1.987 4.858 -7.588 1.00 31.30 O ATOM 475 CB LYS A 30 4.183 6.926 -8.858 1.00 75.22 C ATOM 476 CG LYS A 30 5.399 6.090 -9.335 1.00 14.33 C ATOM 477 CD LYS A 30 5.316 5.771 -10.845 1.00 41.03 C ATOM 478 CE LYS A 30 6.534 5.026 -11.387 1.00 55.34 C ATOM 479 NZ LYS A 30 7.723 5.902 -11.476 1.00 24.15 N ATOM 0 H LYS A 30 2.063 8.060 -8.285 1.00 23.22 H new ATOM 0 HA LYS A 30 2.777 6.262 -10.355 1.00 15.13 H new ATOM 0 HB2 LYS A 30 4.280 7.937 -9.253 1.00 75.22 H new ATOM 0 HB3 LYS A 30 4.219 7.003 -7.771 1.00 75.22 H new ATOM 0 HG2 LYS A 30 6.320 6.636 -9.128 1.00 14.33 H new ATOM 0 HG3 LYS A 30 5.446 5.160 -8.769 1.00 14.33 H new ATOM 0 HD2 LYS A 30 4.424 5.173 -11.032 1.00 41.03 H new ATOM 0 HD3 LYS A 30 5.197 6.703 -11.397 1.00 41.03 H new ATOM 0 HE2 LYS A 30 6.757 4.176 -10.741 1.00 55.34 H new ATOM 0 HE3 LYS A 30 6.304 4.625 -12.374 1.00 55.34 H new ATOM 0 HZ1 LYS A 30 8.528 5.358 -11.848 1.00 24.15 H new ATOM 0 HZ2 LYS A 30 7.520 6.699 -12.112 1.00 24.15 H new ATOM 0 HZ3 LYS A 30 7.958 6.265 -10.530 1.00 24.15 H new ATOM 493 N THR A 31 2.902 3.923 -9.400 1.00 13.31 N ATOM 494 CA THR A 31 2.855 2.549 -8.893 1.00 60.33 C ATOM 495 C THR A 31 4.218 1.894 -9.065 1.00 51.24 C ATOM 496 O THR A 31 4.859 2.037 -10.114 1.00 44.22 O ATOM 497 CB THR A 31 1.763 1.714 -9.620 1.00 74.32 C ATOM 498 OG1 THR A 31 1.861 1.902 -11.044 1.00 43.23 O ATOM 499 CG2 THR A 31 0.351 2.079 -9.157 1.00 72.44 C ATOM 0 H THR A 31 3.232 3.997 -10.362 1.00 13.31 H new ATOM 0 HA THR A 31 2.597 2.583 -7.834 1.00 60.33 H new ATOM 0 HB THR A 31 1.939 0.668 -9.367 1.00 74.32 H new ATOM 0 HG1 THR A 31 1.170 1.371 -11.492 1.00 43.23 H new ATOM 0 HG21 THR A 31 -0.377 1.470 -9.693 1.00 72.44 H new ATOM 0 HG22 THR A 31 0.260 1.895 -8.086 1.00 72.44 H new ATOM 0 HG23 THR A 31 0.162 3.133 -9.361 1.00 72.44 H new ATOM 507 N VAL A 32 4.658 1.191 -8.012 1.00 25.21 N ATOM 508 CA VAL A 32 5.924 0.450 -7.994 1.00 2.33 C ATOM 509 C VAL A 32 5.667 -0.960 -7.441 1.00 61.52 C ATOM 510 O VAL A 32 5.377 -1.130 -6.252 1.00 4.45 O ATOM 511 CB VAL A 32 7.030 1.184 -7.138 1.00 64.22 C ATOM 512 CG1 VAL A 32 8.334 0.353 -7.052 1.00 52.23 C ATOM 513 CG2 VAL A 32 7.306 2.596 -7.706 1.00 52.34 C ATOM 0 H VAL A 32 4.137 1.121 -7.138 1.00 25.21 H new ATOM 0 HA VAL A 32 6.303 0.390 -9.014 1.00 2.33 H new ATOM 0 HB VAL A 32 6.649 1.289 -6.122 1.00 64.22 H new ATOM 0 HG11 VAL A 32 9.070 0.892 -6.455 1.00 52.23 H new ATOM 0 HG12 VAL A 32 8.122 -0.609 -6.585 1.00 52.23 H new ATOM 0 HG13 VAL A 32 8.729 0.191 -8.055 1.00 52.23 H new ATOM 0 HG21 VAL A 32 8.070 3.087 -7.104 1.00 52.34 H new ATOM 0 HG22 VAL A 32 7.653 2.512 -8.736 1.00 52.34 H new ATOM 0 HG23 VAL A 32 6.389 3.185 -7.679 1.00 52.34 H new ATOM 523 N ARG A 33 5.767 -1.956 -8.329 1.00 22.25 N ATOM 524 CA ARG A 33 5.596 -3.369 -7.988 1.00 22.54 C ATOM 525 C ARG A 33 6.990 -3.947 -7.707 1.00 20.41 C ATOM 526 O ARG A 33 7.714 -4.359 -8.622 1.00 12.42 O ATOM 527 CB ARG A 33 4.878 -4.105 -9.148 1.00 70.33 C ATOM 528 CG ARG A 33 4.651 -5.616 -8.929 1.00 24.31 C ATOM 529 CD ARG A 33 3.911 -6.264 -10.110 1.00 70.01 C ATOM 530 NE ARG A 33 3.884 -7.730 -10.017 1.00 30.03 N ATOM 531 CZ ARG A 33 3.235 -8.536 -10.865 1.00 71.24 C ATOM 532 NH1 ARG A 33 2.525 -8.041 -11.882 1.00 3.50 N ATOM 533 NH2 ARG A 33 3.337 -9.842 -10.727 1.00 74.23 N ATOM 0 H ARG A 33 5.971 -1.799 -9.316 1.00 22.25 H new ATOM 0 HA ARG A 33 4.973 -3.496 -7.103 1.00 22.54 H new ATOM 0 HB2 ARG A 33 3.912 -3.629 -9.315 1.00 70.33 H new ATOM 0 HB3 ARG A 33 5.462 -3.970 -10.059 1.00 70.33 H new ATOM 0 HG2 ARG A 33 5.612 -6.110 -8.788 1.00 24.31 H new ATOM 0 HG3 ARG A 33 4.078 -5.768 -8.015 1.00 24.31 H new ATOM 0 HD2 ARG A 33 2.889 -5.886 -10.147 1.00 70.01 H new ATOM 0 HD3 ARG A 33 4.393 -5.971 -11.043 1.00 70.01 H new ATOM 0 HE ARG A 33 4.397 -8.165 -9.250 1.00 30.03 H new ATOM 0 HH11 ARG A 33 2.471 -7.032 -12.023 1.00 3.50 H new ATOM 0 HH12 ARG A 33 2.037 -8.672 -12.518 1.00 3.50 H new ATOM 0 HH21 ARG A 33 3.908 -10.233 -9.977 1.00 74.23 H new ATOM 0 HH22 ARG A 33 2.845 -10.463 -11.370 1.00 74.23 H new ATOM 547 N THR A 34 7.375 -3.896 -6.433 1.00 43.50 N ATOM 548 CA THR A 34 8.723 -4.239 -5.964 1.00 73.40 C ATOM 549 C THR A 34 8.668 -5.450 -5.021 1.00 43.24 C ATOM 550 O THR A 34 7.601 -5.836 -4.534 1.00 14.00 O ATOM 551 CB THR A 34 9.385 -3.003 -5.254 1.00 24.30 C ATOM 552 OG1 THR A 34 10.666 -3.353 -4.698 1.00 31.32 O ATOM 553 CG2 THR A 34 8.486 -2.416 -4.157 1.00 41.33 C ATOM 0 H THR A 34 6.749 -3.610 -5.680 1.00 43.50 H new ATOM 0 HA THR A 34 9.337 -4.506 -6.824 1.00 73.40 H new ATOM 0 HB THR A 34 9.523 -2.240 -6.020 1.00 24.30 H new ATOM 0 HG1 THR A 34 10.671 -3.156 -3.738 1.00 31.32 H new ATOM 0 HG21 THR A 34 8.985 -1.564 -3.695 1.00 41.33 H new ATOM 0 HG22 THR A 34 7.543 -2.090 -4.595 1.00 41.33 H new ATOM 0 HG23 THR A 34 8.291 -3.176 -3.401 1.00 41.33 H new ATOM 561 N ASP A 35 9.836 -6.061 -4.820 1.00 41.45 N ATOM 562 CA ASP A 35 10.031 -7.221 -3.937 1.00 1.32 C ATOM 563 C ASP A 35 10.828 -6.782 -2.686 1.00 32.24 C ATOM 564 O ASP A 35 10.713 -7.389 -1.613 1.00 51.21 O ATOM 565 CB ASP A 35 10.780 -8.328 -4.728 1.00 61.34 C ATOM 566 CG ASP A 35 10.898 -9.661 -3.972 1.00 14.00 C ATOM 567 OD1 ASP A 35 9.894 -10.402 -3.904 1.00 32.33 O ATOM 568 OD2 ASP A 35 11.990 -9.985 -3.455 1.00 53.24 O ATOM 0 H ASP A 35 10.697 -5.759 -5.276 1.00 41.45 H new ATOM 0 HA ASP A 35 9.073 -7.620 -3.604 1.00 1.32 H new ATOM 0 HB2 ASP A 35 10.262 -8.501 -5.671 1.00 61.34 H new ATOM 0 HB3 ASP A 35 11.780 -7.971 -4.975 1.00 61.34 H new ATOM 573 N ASP A 36 11.599 -5.684 -2.838 1.00 14.03 N ATOM 574 CA ASP A 36 12.529 -5.168 -1.810 1.00 23.31 C ATOM 575 C ASP A 36 11.950 -3.922 -1.096 1.00 64.41 C ATOM 576 O ASP A 36 11.364 -3.046 -1.741 1.00 53.21 O ATOM 577 CB ASP A 36 13.893 -4.834 -2.476 1.00 22.21 C ATOM 578 CG ASP A 36 14.886 -4.094 -1.558 1.00 43.22 C ATOM 579 OD1 ASP A 36 15.476 -3.084 -1.992 1.00 62.53 O ATOM 580 OD2 ASP A 36 15.076 -4.510 -0.396 1.00 54.13 O ATOM 0 H ASP A 36 11.593 -5.123 -3.690 1.00 14.03 H new ATOM 0 HA ASP A 36 12.672 -5.937 -1.051 1.00 23.31 H new ATOM 0 HB2 ASP A 36 14.354 -5.761 -2.817 1.00 22.21 H new ATOM 0 HB3 ASP A 36 13.712 -4.224 -3.361 1.00 22.21 H new ATOM 585 N LYS A 37 12.159 -3.857 0.238 1.00 61.21 N ATOM 586 CA LYS A 37 11.662 -2.762 1.105 1.00 2.34 C ATOM 587 C LYS A 37 12.520 -1.485 1.010 1.00 31.42 C ATOM 588 O LYS A 37 12.012 -0.376 1.229 1.00 52.13 O ATOM 589 CB LYS A 37 11.565 -3.247 2.576 1.00 52.20 C ATOM 590 CG LYS A 37 12.891 -3.685 3.228 1.00 15.11 C ATOM 591 CD LYS A 37 12.685 -4.274 4.642 1.00 2.04 C ATOM 592 CE LYS A 37 14.006 -4.654 5.334 1.00 33.42 C ATOM 593 NZ LYS A 37 14.899 -3.483 5.522 1.00 42.13 N ATOM 0 H LYS A 37 12.682 -4.569 0.749 1.00 61.21 H new ATOM 0 HA LYS A 37 10.669 -2.495 0.744 1.00 2.34 H new ATOM 0 HB2 LYS A 37 11.135 -2.444 3.175 1.00 52.20 H new ATOM 0 HB3 LYS A 37 10.868 -4.084 2.617 1.00 52.20 H new ATOM 0 HG2 LYS A 37 13.376 -4.428 2.595 1.00 15.11 H new ATOM 0 HG3 LYS A 37 13.563 -2.829 3.288 1.00 15.11 H new ATOM 0 HD2 LYS A 37 12.154 -3.548 5.258 1.00 2.04 H new ATOM 0 HD3 LYS A 37 12.050 -5.158 4.573 1.00 2.04 H new ATOM 0 HE2 LYS A 37 13.790 -5.103 6.303 1.00 33.42 H new ATOM 0 HE3 LYS A 37 14.521 -5.409 4.740 1.00 33.42 H new ATOM 0 HZ1 LYS A 37 15.746 -3.774 6.051 1.00 42.13 H new ATOM 0 HZ2 LYS A 37 15.182 -3.110 4.594 1.00 42.13 H new ATOM 0 HZ3 LYS A 37 14.395 -2.744 6.053 1.00 42.13 H new ATOM 607 N GLU A 38 13.811 -1.642 0.681 1.00 71.41 N ATOM 608 CA GLU A 38 14.744 -0.506 0.548 1.00 73.13 C ATOM 609 C GLU A 38 14.450 0.277 -0.737 1.00 52.14 C ATOM 610 O GLU A 38 14.590 1.510 -0.774 1.00 51.41 O ATOM 611 CB GLU A 38 16.207 -1.003 0.571 1.00 45.12 C ATOM 612 CG GLU A 38 16.583 -1.808 1.822 1.00 24.30 C ATOM 613 CD GLU A 38 16.318 -1.044 3.132 1.00 44.11 C ATOM 614 OE1 GLU A 38 17.134 -0.178 3.508 1.00 33.13 O ATOM 615 OE2 GLU A 38 15.294 -1.308 3.796 1.00 11.31 O ATOM 0 H GLU A 38 14.238 -2.551 0.500 1.00 71.41 H new ATOM 0 HA GLU A 38 14.602 0.165 1.395 1.00 73.13 H new ATOM 0 HB2 GLU A 38 16.382 -1.621 -0.310 1.00 45.12 H new ATOM 0 HB3 GLU A 38 16.872 -0.142 0.494 1.00 45.12 H new ATOM 0 HG2 GLU A 38 16.018 -2.740 1.831 1.00 24.30 H new ATOM 0 HG3 GLU A 38 17.638 -2.076 1.771 1.00 24.30 H new ATOM 622 N LYS A 39 14.044 -0.472 -1.777 1.00 54.12 N ATOM 623 CA LYS A 39 13.540 0.084 -3.033 1.00 44.01 C ATOM 624 C LYS A 39 12.339 1.007 -2.758 1.00 74.12 C ATOM 625 O LYS A 39 12.271 2.112 -3.298 1.00 15.34 O ATOM 626 CB LYS A 39 13.139 -1.071 -3.993 1.00 50.35 C ATOM 627 CG LYS A 39 12.488 -0.633 -5.327 1.00 71.21 C ATOM 628 CD LYS A 39 13.379 0.308 -6.172 1.00 63.52 C ATOM 629 CE LYS A 39 12.750 0.650 -7.533 1.00 44.44 C ATOM 630 NZ LYS A 39 13.512 1.711 -8.250 1.00 2.04 N ATOM 0 H LYS A 39 14.059 -1.492 -1.763 1.00 54.12 H new ATOM 0 HA LYS A 39 14.324 0.675 -3.507 1.00 44.01 H new ATOM 0 HB2 LYS A 39 14.029 -1.658 -4.219 1.00 50.35 H new ATOM 0 HB3 LYS A 39 12.446 -1.731 -3.470 1.00 50.35 H new ATOM 0 HG2 LYS A 39 12.251 -1.520 -5.915 1.00 71.21 H new ATOM 0 HG3 LYS A 39 11.544 -0.131 -5.113 1.00 71.21 H new ATOM 0 HD2 LYS A 39 13.558 1.229 -5.617 1.00 63.52 H new ATOM 0 HD3 LYS A 39 14.349 -0.162 -6.332 1.00 63.52 H new ATOM 0 HE2 LYS A 39 12.711 -0.248 -8.150 1.00 44.44 H new ATOM 0 HE3 LYS A 39 11.722 0.980 -7.384 1.00 44.44 H new ATOM 0 HZ1 LYS A 39 13.321 1.646 -9.270 1.00 2.04 H new ATOM 0 HZ2 LYS A 39 13.218 2.646 -7.901 1.00 2.04 H new ATOM 0 HZ3 LYS A 39 14.530 1.583 -8.080 1.00 2.04 H new ATOM 644 N VAL A 40 11.433 0.550 -1.865 1.00 41.45 N ATOM 645 CA VAL A 40 10.215 1.294 -1.505 1.00 61.22 C ATOM 646 C VAL A 40 10.563 2.662 -0.891 1.00 50.23 C ATOM 647 O VAL A 40 9.969 3.661 -1.262 1.00 20.20 O ATOM 648 CB VAL A 40 9.315 0.507 -0.490 1.00 31.13 C ATOM 649 CG1 VAL A 40 7.994 1.257 -0.215 1.00 63.31 C ATOM 650 CG2 VAL A 40 9.044 -0.923 -0.977 1.00 60.31 C ATOM 0 H VAL A 40 11.529 -0.341 -1.378 1.00 41.45 H new ATOM 0 HA VAL A 40 9.660 1.431 -2.433 1.00 61.22 H new ATOM 0 HB VAL A 40 9.863 0.440 0.450 1.00 31.13 H new ATOM 0 HG11 VAL A 40 7.392 0.686 0.492 1.00 63.31 H new ATOM 0 HG12 VAL A 40 8.214 2.239 0.205 1.00 63.31 H new ATOM 0 HG13 VAL A 40 7.442 1.376 -1.148 1.00 63.31 H new ATOM 0 HG21 VAL A 40 8.418 -1.442 -0.251 1.00 60.31 H new ATOM 0 HG22 VAL A 40 8.533 -0.889 -1.939 1.00 60.31 H new ATOM 0 HG23 VAL A 40 9.989 -1.455 -1.087 1.00 60.31 H new ATOM 660 N LYS A 41 11.546 2.675 0.035 1.00 15.00 N ATOM 661 CA LYS A 41 11.972 3.902 0.758 1.00 14.44 C ATOM 662 C LYS A 41 12.465 4.995 -0.205 1.00 71.31 C ATOM 663 O LYS A 41 12.214 6.193 0.013 1.00 44.41 O ATOM 664 CB LYS A 41 13.081 3.568 1.782 1.00 21.01 C ATOM 665 CG LYS A 41 12.620 2.639 2.915 1.00 1.34 C ATOM 666 CD LYS A 41 13.791 2.180 3.803 1.00 11.42 C ATOM 667 CE LYS A 41 13.328 1.317 4.976 1.00 3.20 C ATOM 668 NZ LYS A 41 14.480 0.746 5.721 1.00 44.50 N ATOM 0 H LYS A 41 12.067 1.841 0.305 1.00 15.00 H new ATOM 0 HA LYS A 41 11.097 4.287 1.282 1.00 14.44 H new ATOM 0 HB2 LYS A 41 13.916 3.102 1.260 1.00 21.01 H new ATOM 0 HB3 LYS A 41 13.454 4.496 2.215 1.00 21.01 H new ATOM 0 HG2 LYS A 41 11.882 3.155 3.528 1.00 1.34 H new ATOM 0 HG3 LYS A 41 12.126 1.766 2.489 1.00 1.34 H new ATOM 0 HD2 LYS A 41 14.502 1.616 3.199 1.00 11.42 H new ATOM 0 HD3 LYS A 41 14.319 3.054 4.184 1.00 11.42 H new ATOM 0 HE2 LYS A 41 12.718 1.917 5.651 1.00 3.20 H new ATOM 0 HE3 LYS A 41 12.696 0.509 4.607 1.00 3.20 H new ATOM 0 HZ1 LYS A 41 14.192 -0.143 6.178 1.00 44.50 H new ATOM 0 HZ2 LYS A 41 15.262 0.559 5.061 1.00 44.50 H new ATOM 0 HZ3 LYS A 41 14.794 1.422 6.446 1.00 44.50 H new ATOM 682 N GLU A 42 13.162 4.554 -1.271 1.00 4.12 N ATOM 683 CA GLU A 42 13.611 5.439 -2.353 1.00 33.43 C ATOM 684 C GLU A 42 12.392 5.999 -3.090 1.00 21.30 C ATOM 685 O GLU A 42 12.257 7.209 -3.229 1.00 23.54 O ATOM 686 CB GLU A 42 14.541 4.679 -3.335 1.00 43.21 C ATOM 687 CG GLU A 42 15.820 4.123 -2.682 1.00 34.33 C ATOM 688 CD GLU A 42 16.705 3.363 -3.675 1.00 31.55 C ATOM 689 OE1 GLU A 42 17.722 3.921 -4.143 1.00 12.43 O ATOM 690 OE2 GLU A 42 16.372 2.206 -4.006 1.00 75.11 O ATOM 0 H GLU A 42 13.426 3.578 -1.402 1.00 4.12 H new ATOM 0 HA GLU A 42 14.181 6.263 -1.925 1.00 33.43 H new ATOM 0 HB2 GLU A 42 13.985 3.854 -3.781 1.00 43.21 H new ATOM 0 HB3 GLU A 42 14.822 5.350 -4.147 1.00 43.21 H new ATOM 0 HG2 GLU A 42 16.389 4.945 -2.249 1.00 34.33 H new ATOM 0 HG3 GLU A 42 15.546 3.459 -1.863 1.00 34.33 H new ATOM 697 N GLU A 43 11.477 5.093 -3.487 1.00 21.42 N ATOM 698 CA GLU A 43 10.268 5.438 -4.257 1.00 64.52 C ATOM 699 C GLU A 43 9.296 6.338 -3.461 1.00 42.44 C ATOM 700 O GLU A 43 8.545 7.122 -4.060 1.00 63.11 O ATOM 701 CB GLU A 43 9.546 4.151 -4.725 1.00 33.22 C ATOM 702 CG GLU A 43 10.402 3.229 -5.609 1.00 54.45 C ATOM 703 CD GLU A 43 11.012 3.934 -6.836 1.00 32.43 C ATOM 704 OE1 GLU A 43 10.249 4.445 -7.686 1.00 34.10 O ATOM 705 OE2 GLU A 43 12.254 3.989 -6.958 1.00 4.45 O ATOM 0 H GLU A 43 11.557 4.097 -3.281 1.00 21.42 H new ATOM 0 HA GLU A 43 10.594 6.009 -5.126 1.00 64.52 H new ATOM 0 HB2 GLU A 43 9.219 3.593 -3.848 1.00 33.22 H new ATOM 0 HB3 GLU A 43 8.649 4.432 -5.276 1.00 33.22 H new ATOM 0 HG2 GLU A 43 11.207 2.808 -5.006 1.00 54.45 H new ATOM 0 HG3 GLU A 43 9.788 2.395 -5.949 1.00 54.45 H new ATOM 712 N ILE A 44 9.334 6.218 -2.118 1.00 63.40 N ATOM 713 CA ILE A 44 8.578 7.077 -1.190 1.00 44.21 C ATOM 714 C ILE A 44 9.042 8.529 -1.381 1.00 21.40 C ATOM 715 O ILE A 44 8.232 9.418 -1.624 1.00 52.44 O ATOM 716 CB ILE A 44 8.773 6.606 0.320 1.00 2.22 C ATOM 717 CG1 ILE A 44 7.994 5.274 0.587 1.00 52.44 C ATOM 718 CG2 ILE A 44 8.374 7.700 1.342 1.00 51.14 C ATOM 719 CD1 ILE A 44 8.167 4.684 1.980 1.00 72.41 C ATOM 0 H ILE A 44 9.898 5.513 -1.644 1.00 63.40 H new ATOM 0 HA ILE A 44 7.513 7.001 -1.410 1.00 44.21 H new ATOM 0 HB ILE A 44 9.838 6.423 0.462 1.00 2.22 H new ATOM 0 HG12 ILE A 44 6.933 5.453 0.416 1.00 52.44 H new ATOM 0 HG13 ILE A 44 8.314 4.533 -0.145 1.00 52.44 H new ATOM 0 HG21 ILE A 44 8.527 7.325 2.354 1.00 51.14 H new ATOM 0 HG22 ILE A 44 8.990 8.586 1.186 1.00 51.14 H new ATOM 0 HG23 ILE A 44 7.324 7.960 1.206 1.00 51.14 H new ATOM 0 HD11 ILE A 44 7.587 3.765 2.060 1.00 72.41 H new ATOM 0 HD12 ILE A 44 9.220 4.465 2.154 1.00 72.41 H new ATOM 0 HD13 ILE A 44 7.818 5.400 2.724 1.00 72.41 H new ATOM 731 N GLU A 45 10.373 8.721 -1.346 1.00 31.41 N ATOM 732 CA GLU A 45 11.007 10.037 -1.523 1.00 12.33 C ATOM 733 C GLU A 45 10.925 10.532 -2.974 1.00 44.42 C ATOM 734 O GLU A 45 10.814 11.736 -3.212 1.00 11.42 O ATOM 735 CB GLU A 45 12.486 9.990 -1.066 1.00 42.12 C ATOM 736 CG GLU A 45 12.662 9.773 0.442 1.00 34.41 C ATOM 737 CD GLU A 45 11.909 10.814 1.293 1.00 13.13 C ATOM 738 OE1 GLU A 45 12.179 12.028 1.143 1.00 41.01 O ATOM 739 OE2 GLU A 45 11.053 10.433 2.116 1.00 34.21 O ATOM 0 H GLU A 45 11.040 7.964 -1.194 1.00 31.41 H new ATOM 0 HA GLU A 45 10.455 10.743 -0.902 1.00 12.33 H new ATOM 0 HB2 GLU A 45 12.996 9.189 -1.601 1.00 42.12 H new ATOM 0 HB3 GLU A 45 12.974 10.923 -1.349 1.00 42.12 H new ATOM 0 HG2 GLU A 45 12.310 8.775 0.703 1.00 34.41 H new ATOM 0 HG3 GLU A 45 13.723 9.811 0.687 1.00 34.41 H new ATOM 746 N LYS A 46 10.973 9.596 -3.931 1.00 51.12 N ATOM 747 CA LYS A 46 11.008 9.914 -5.366 1.00 24.01 C ATOM 748 C LYS A 46 9.631 10.369 -5.866 1.00 20.51 C ATOM 749 O LYS A 46 9.550 11.169 -6.797 1.00 53.33 O ATOM 750 CB LYS A 46 11.557 8.694 -6.165 1.00 41.45 C ATOM 751 CG LYS A 46 13.082 8.482 -5.979 1.00 13.21 C ATOM 752 CD LYS A 46 13.621 7.125 -6.508 1.00 61.25 C ATOM 753 CE LYS A 46 13.545 6.954 -8.039 1.00 72.15 C ATOM 754 NZ LYS A 46 12.180 6.607 -8.511 1.00 33.31 N ATOM 0 H LYS A 46 10.989 8.596 -3.733 1.00 51.12 H new ATOM 0 HA LYS A 46 11.686 10.751 -5.530 1.00 24.01 H new ATOM 0 HB2 LYS A 46 11.030 7.794 -5.850 1.00 41.45 H new ATOM 0 HB3 LYS A 46 11.342 8.835 -7.224 1.00 41.45 H new ATOM 0 HG2 LYS A 46 13.611 9.289 -6.486 1.00 13.21 H new ATOM 0 HG3 LYS A 46 13.319 8.562 -4.918 1.00 13.21 H new ATOM 0 HD2 LYS A 46 14.659 7.015 -6.195 1.00 61.25 H new ATOM 0 HD3 LYS A 46 13.059 6.318 -6.038 1.00 61.25 H new ATOM 0 HE2 LYS A 46 13.867 7.878 -8.520 1.00 72.15 H new ATOM 0 HE3 LYS A 46 14.241 6.174 -8.348 1.00 72.15 H new ATOM 0 HZ1 LYS A 46 12.226 5.761 -9.115 1.00 33.31 H new ATOM 0 HZ2 LYS A 46 11.568 6.415 -7.692 1.00 33.31 H new ATOM 0 HZ3 LYS A 46 11.789 7.401 -9.057 1.00 33.31 H new ATOM 768 N ALA A 47 8.556 9.878 -5.232 1.00 20.14 N ATOM 769 CA ALA A 47 7.181 10.344 -5.508 1.00 35.43 C ATOM 770 C ALA A 47 6.874 11.615 -4.694 1.00 11.04 C ATOM 771 O ALA A 47 6.231 12.540 -5.190 1.00 22.11 O ATOM 772 CB ALA A 47 6.165 9.238 -5.195 1.00 2.33 C ATOM 0 H ALA A 47 8.610 9.152 -4.518 1.00 20.14 H new ATOM 0 HA ALA A 47 7.102 10.587 -6.568 1.00 35.43 H new ATOM 0 HB1 ALA A 47 5.158 9.599 -5.404 1.00 2.33 H new ATOM 0 HB2 ALA A 47 6.374 8.366 -5.815 1.00 2.33 H new ATOM 0 HB3 ALA A 47 6.240 8.962 -4.143 1.00 2.33 H new ATOM 778 N ARG A 48 7.377 11.644 -3.447 1.00 42.34 N ATOM 779 CA ARG A 48 7.196 12.769 -2.495 1.00 70.00 C ATOM 780 C ARG A 48 7.781 14.087 -3.044 1.00 44.35 C ATOM 781 O ARG A 48 7.144 15.145 -2.950 1.00 14.24 O ATOM 782 CB ARG A 48 7.871 12.398 -1.151 1.00 70.52 C ATOM 783 CG ARG A 48 7.819 13.458 -0.032 1.00 12.24 C ATOM 784 CD ARG A 48 8.604 13.005 1.211 1.00 1.43 C ATOM 785 NE ARG A 48 8.660 14.038 2.256 1.00 23.34 N ATOM 786 CZ ARG A 48 9.547 14.056 3.263 1.00 54.24 C ATOM 787 NH1 ARG A 48 10.465 13.094 3.374 1.00 60.22 N ATOM 788 NH2 ARG A 48 9.501 15.031 4.165 1.00 32.41 N ATOM 0 H ARG A 48 7.930 10.878 -3.061 1.00 42.34 H new ATOM 0 HA ARG A 48 6.128 12.932 -2.348 1.00 70.00 H new ATOM 0 HB2 ARG A 48 7.406 11.486 -0.777 1.00 70.52 H new ATOM 0 HB3 ARG A 48 8.917 12.164 -1.349 1.00 70.52 H new ATOM 0 HG2 ARG A 48 8.230 14.398 -0.400 1.00 12.24 H new ATOM 0 HG3 ARG A 48 6.781 13.649 0.241 1.00 12.24 H new ATOM 0 HD2 ARG A 48 8.142 12.106 1.619 1.00 1.43 H new ATOM 0 HD3 ARG A 48 9.619 12.737 0.917 1.00 1.43 H new ATOM 0 HE ARG A 48 7.977 14.794 2.212 1.00 23.34 H new ATOM 0 HH11 ARG A 48 10.496 12.338 2.690 1.00 60.22 H new ATOM 0 HH12 ARG A 48 11.136 13.115 4.142 1.00 60.22 H new ATOM 0 HH21 ARG A 48 8.793 15.762 4.090 1.00 32.41 H new ATOM 0 HH22 ARG A 48 10.173 15.048 4.932 1.00 32.41 H new ATOM 802 N LYS A 49 8.991 14.001 -3.634 1.00 25.23 N ATOM 803 CA LYS A 49 9.696 15.175 -4.212 1.00 71.41 C ATOM 804 C LYS A 49 9.029 15.652 -5.514 1.00 10.23 C ATOM 805 O LYS A 49 9.232 16.786 -5.945 1.00 62.31 O ATOM 806 CB LYS A 49 11.199 14.849 -4.463 1.00 20.50 C ATOM 807 CG LYS A 49 11.473 13.811 -5.579 1.00 73.22 C ATOM 808 CD LYS A 49 12.931 13.293 -5.581 1.00 72.52 C ATOM 809 CE LYS A 49 13.980 14.392 -5.827 1.00 41.41 C ATOM 810 NZ LYS A 49 15.370 13.858 -5.716 1.00 72.34 N ATOM 0 H LYS A 49 9.507 13.126 -3.725 1.00 25.23 H new ATOM 0 HA LYS A 49 9.629 15.985 -3.485 1.00 71.41 H new ATOM 0 HB2 LYS A 49 11.717 15.774 -4.715 1.00 20.50 H new ATOM 0 HB3 LYS A 49 11.635 14.482 -3.533 1.00 20.50 H new ATOM 0 HG2 LYS A 49 10.794 12.967 -5.457 1.00 73.22 H new ATOM 0 HG3 LYS A 49 11.252 14.260 -6.547 1.00 73.22 H new ATOM 0 HD2 LYS A 49 13.138 12.814 -4.624 1.00 72.52 H new ATOM 0 HD3 LYS A 49 13.034 12.527 -6.350 1.00 72.52 H new ATOM 0 HE2 LYS A 49 13.832 14.822 -6.818 1.00 41.41 H new ATOM 0 HE3 LYS A 49 13.840 15.198 -5.106 1.00 41.41 H new ATOM 0 HZ1 LYS A 49 16.051 14.625 -5.887 1.00 72.34 H new ATOM 0 HZ2 LYS A 49 15.518 13.470 -4.762 1.00 72.34 H new ATOM 0 HZ3 LYS A 49 15.510 13.106 -6.421 1.00 72.34 H new ATOM 824 N GLN A 50 8.253 14.750 -6.137 1.00 61.55 N ATOM 825 CA GLN A 50 7.436 15.052 -7.328 1.00 5.32 C ATOM 826 C GLN A 50 6.025 15.517 -6.926 1.00 12.35 C ATOM 827 O GLN A 50 5.244 15.953 -7.781 1.00 3.01 O ATOM 828 CB GLN A 50 7.353 13.792 -8.235 1.00 2.13 C ATOM 829 CG GLN A 50 8.696 13.332 -8.827 1.00 1.52 C ATOM 830 CD GLN A 50 9.318 14.358 -9.758 1.00 25.34 C ATOM 831 OE1 GLN A 50 9.102 14.333 -10.969 1.00 73.33 O ATOM 832 NE2 GLN A 50 10.063 15.289 -9.199 1.00 23.31 N ATOM 0 H GLN A 50 8.173 13.782 -5.827 1.00 61.55 H new ATOM 0 HA GLN A 50 7.910 15.864 -7.880 1.00 5.32 H new ATOM 0 HB2 GLN A 50 6.928 12.972 -7.656 1.00 2.13 H new ATOM 0 HB3 GLN A 50 6.662 13.996 -9.053 1.00 2.13 H new ATOM 0 HG2 GLN A 50 9.391 13.119 -8.015 1.00 1.52 H new ATOM 0 HG3 GLN A 50 8.546 12.400 -9.371 1.00 1.52 H new ATOM 0 HE21 GLN A 50 10.221 15.279 -8.191 1.00 23.31 H new ATOM 0 HE22 GLN A 50 10.482 16.020 -9.774 1.00 23.31 H new ATOM 841 N GLY A 51 5.694 15.370 -5.626 1.00 34.54 N ATOM 842 CA GLY A 51 4.379 15.721 -5.097 1.00 35.15 C ATOM 843 C GLY A 51 3.401 14.556 -5.175 1.00 41.44 C ATOM 844 O GLY A 51 2.659 14.299 -4.225 1.00 14.14 O ATOM 0 H GLY A 51 6.336 15.005 -4.923 1.00 34.54 H new ATOM 0 HA2 GLY A 51 4.479 16.041 -4.060 1.00 35.15 H new ATOM 0 HA3 GLY A 51 3.979 16.568 -5.654 1.00 35.15 H new ATOM 848 N ARG A 52 3.442 13.842 -6.313 1.00 75.24 N ATOM 849 CA ARG A 52 2.523 12.741 -6.654 1.00 21.33 C ATOM 850 C ARG A 52 2.449 11.630 -5.571 1.00 4.51 C ATOM 851 O ARG A 52 3.455 11.311 -4.930 1.00 74.31 O ATOM 852 CB ARG A 52 2.929 12.107 -8.011 1.00 2.41 C ATOM 853 CG ARG A 52 4.392 11.606 -8.098 1.00 30.12 C ATOM 854 CD ARG A 52 4.637 10.721 -9.327 1.00 31.40 C ATOM 855 NE ARG A 52 4.199 11.378 -10.568 1.00 32.44 N ATOM 856 CZ ARG A 52 3.922 10.753 -11.721 1.00 62.02 C ATOM 857 NH1 ARG A 52 4.038 9.427 -11.840 1.00 20.20 N ATOM 858 NH2 ARG A 52 3.498 11.469 -12.750 1.00 50.21 N ATOM 0 H ARG A 52 4.134 14.019 -7.041 1.00 75.24 H new ATOM 0 HA ARG A 52 1.531 13.188 -6.718 1.00 21.33 H new ATOM 0 HB2 ARG A 52 2.263 11.269 -8.215 1.00 2.41 H new ATOM 0 HB3 ARG A 52 2.767 12.842 -8.799 1.00 2.41 H new ATOM 0 HG2 ARG A 52 5.065 12.463 -8.131 1.00 30.12 H new ATOM 0 HG3 ARG A 52 4.635 11.045 -7.196 1.00 30.12 H new ATOM 0 HD2 ARG A 52 5.698 10.482 -9.397 1.00 31.40 H new ATOM 0 HD3 ARG A 52 4.105 9.777 -9.208 1.00 31.40 H new ATOM 0 HE ARG A 52 4.098 12.393 -10.550 1.00 32.44 H new ATOM 0 HH11 ARG A 52 4.343 8.868 -11.043 1.00 20.20 H new ATOM 0 HH12 ARG A 52 3.821 8.974 -12.728 1.00 20.20 H new ATOM 0 HH21 ARG A 52 3.387 12.479 -12.658 1.00 50.21 H new ATOM 0 HH22 ARG A 52 3.282 11.011 -13.636 1.00 50.21 H new ATOM 872 N PRO A 53 1.230 11.050 -5.339 1.00 15.44 N ATOM 873 CA PRO A 53 1.060 9.832 -4.508 1.00 15.13 C ATOM 874 C PRO A 53 1.711 8.595 -5.152 1.00 14.11 C ATOM 875 O PRO A 53 2.136 8.634 -6.317 1.00 71.22 O ATOM 876 CB PRO A 53 -0.485 9.668 -4.414 1.00 74.11 C ATOM 877 CG PRO A 53 -1.033 11.013 -4.782 1.00 74.51 C ATOM 878 CD PRO A 53 -0.086 11.551 -5.820 1.00 63.43 C ATOM 0 HA PRO A 53 1.542 9.926 -3.535 1.00 15.13 H new ATOM 0 HB2 PRO A 53 -0.843 8.895 -5.094 1.00 74.11 H new ATOM 0 HB3 PRO A 53 -0.792 9.377 -3.410 1.00 74.11 H new ATOM 0 HG2 PRO A 53 -2.046 10.932 -5.177 1.00 74.51 H new ATOM 0 HG3 PRO A 53 -1.081 11.670 -3.914 1.00 74.51 H new ATOM 0 HD2 PRO A 53 -0.322 11.180 -6.817 1.00 63.43 H new ATOM 0 HD3 PRO A 53 -0.113 12.640 -5.870 1.00 63.43 H new ATOM 886 N ILE A 54 1.753 7.491 -4.398 1.00 71.33 N ATOM 887 CA ILE A 54 2.379 6.249 -4.851 1.00 0.31 C ATOM 888 C ILE A 54 1.742 5.032 -4.153 1.00 62.33 C ATOM 889 O ILE A 54 1.453 5.075 -2.961 1.00 75.04 O ATOM 890 CB ILE A 54 3.938 6.298 -4.641 1.00 5.15 C ATOM 891 CG1 ILE A 54 4.638 5.077 -5.307 1.00 61.23 C ATOM 892 CG2 ILE A 54 4.323 6.429 -3.143 1.00 1.31 C ATOM 893 CD1 ILE A 54 6.145 5.201 -5.397 1.00 20.22 C ATOM 0 H ILE A 54 1.355 7.436 -3.460 1.00 71.33 H new ATOM 0 HA ILE A 54 2.201 6.141 -5.921 1.00 0.31 H new ATOM 0 HB ILE A 54 4.299 7.198 -5.138 1.00 5.15 H new ATOM 0 HG12 ILE A 54 4.391 4.178 -4.742 1.00 61.23 H new ATOM 0 HG13 ILE A 54 4.235 4.944 -6.311 1.00 61.23 H new ATOM 0 HG21 ILE A 54 5.408 6.459 -3.048 1.00 1.31 H new ATOM 0 HG22 ILE A 54 3.898 7.347 -2.737 1.00 1.31 H new ATOM 0 HG23 ILE A 54 3.934 5.573 -2.591 1.00 1.31 H new ATOM 0 HD11 ILE A 54 6.556 4.310 -5.873 1.00 20.22 H new ATOM 0 HD12 ILE A 54 6.403 6.080 -5.988 1.00 20.22 H new ATOM 0 HD13 ILE A 54 6.562 5.302 -4.395 1.00 20.22 H new ATOM 905 N VAL A 55 1.488 3.969 -4.934 1.00 23.33 N ATOM 906 CA VAL A 55 0.946 2.699 -4.448 1.00 14.22 C ATOM 907 C VAL A 55 1.992 1.603 -4.711 1.00 41.12 C ATOM 908 O VAL A 55 2.372 1.354 -5.859 1.00 63.41 O ATOM 909 CB VAL A 55 -0.418 2.324 -5.148 1.00 64.35 C ATOM 910 CG1 VAL A 55 -1.020 1.046 -4.531 1.00 71.11 C ATOM 911 CG2 VAL A 55 -1.433 3.485 -5.079 1.00 61.53 C ATOM 0 H VAL A 55 1.659 3.973 -5.940 1.00 23.33 H new ATOM 0 HA VAL A 55 0.736 2.792 -3.382 1.00 14.22 H new ATOM 0 HB VAL A 55 -0.201 2.134 -6.199 1.00 64.35 H new ATOM 0 HG11 VAL A 55 -1.959 0.809 -5.030 1.00 71.11 H new ATOM 0 HG12 VAL A 55 -0.323 0.218 -4.657 1.00 71.11 H new ATOM 0 HG13 VAL A 55 -1.204 1.207 -3.469 1.00 71.11 H new ATOM 0 HG21 VAL A 55 -2.359 3.188 -5.571 1.00 61.53 H new ATOM 0 HG22 VAL A 55 -1.638 3.728 -4.036 1.00 61.53 H new ATOM 0 HG23 VAL A 55 -1.020 4.360 -5.580 1.00 61.53 H new ATOM 921 N ILE A 56 2.462 0.990 -3.631 1.00 41.04 N ATOM 922 CA ILE A 56 3.500 -0.041 -3.644 1.00 52.33 C ATOM 923 C ILE A 56 2.841 -1.432 -3.586 1.00 40.21 C ATOM 924 O ILE A 56 1.946 -1.654 -2.773 1.00 33.30 O ATOM 925 CB ILE A 56 4.450 0.162 -2.406 1.00 40.22 C ATOM 926 CG1 ILE A 56 5.059 1.606 -2.395 1.00 44.44 C ATOM 927 CG2 ILE A 56 5.562 -0.907 -2.360 1.00 11.31 C ATOM 928 CD1 ILE A 56 6.024 1.912 -3.534 1.00 41.43 C ATOM 0 H ILE A 56 2.123 1.201 -2.692 1.00 41.04 H new ATOM 0 HA ILE A 56 4.086 0.035 -4.560 1.00 52.33 H new ATOM 0 HB ILE A 56 3.844 0.043 -1.508 1.00 40.22 H new ATOM 0 HG12 ILE A 56 4.243 2.328 -2.428 1.00 44.44 H new ATOM 0 HG13 ILE A 56 5.579 1.756 -1.449 1.00 44.44 H new ATOM 0 HG21 ILE A 56 6.198 -0.734 -1.492 1.00 11.31 H new ATOM 0 HG22 ILE A 56 5.112 -1.897 -2.289 1.00 11.31 H new ATOM 0 HG23 ILE A 56 6.163 -0.846 -3.267 1.00 11.31 H new ATOM 0 HD11 ILE A 56 6.389 2.934 -3.437 1.00 41.43 H new ATOM 0 HD12 ILE A 56 6.866 1.220 -3.494 1.00 41.43 H new ATOM 0 HD13 ILE A 56 5.508 1.800 -4.488 1.00 41.43 H new ATOM 940 N PHE A 57 3.288 -2.352 -4.455 1.00 14.14 N ATOM 941 CA PHE A 57 2.775 -3.736 -4.518 1.00 51.20 C ATOM 942 C PHE A 57 3.924 -4.712 -4.245 1.00 21.20 C ATOM 943 O PHE A 57 4.849 -4.819 -5.055 1.00 2.31 O ATOM 944 CB PHE A 57 2.149 -4.021 -5.912 1.00 62.05 C ATOM 945 CG PHE A 57 0.956 -3.131 -6.241 1.00 73.10 C ATOM 946 CD1 PHE A 57 -0.332 -3.492 -5.845 1.00 72.21 C ATOM 947 CD2 PHE A 57 1.120 -1.931 -6.933 1.00 44.51 C ATOM 948 CE1 PHE A 57 -1.411 -2.681 -6.126 1.00 74.30 C ATOM 949 CE2 PHE A 57 0.035 -1.126 -7.214 1.00 12.21 C ATOM 950 CZ PHE A 57 -1.228 -1.502 -6.812 1.00 11.13 C ATOM 0 H PHE A 57 4.020 -2.159 -5.139 1.00 14.14 H new ATOM 0 HA PHE A 57 1.999 -3.866 -3.763 1.00 51.20 H new ATOM 0 HB2 PHE A 57 2.913 -3.887 -6.678 1.00 62.05 H new ATOM 0 HB3 PHE A 57 1.835 -5.064 -5.953 1.00 62.05 H new ATOM 0 HD1 PHE A 57 -0.486 -4.418 -5.312 1.00 72.21 H new ATOM 0 HD2 PHE A 57 2.106 -1.629 -7.252 1.00 44.51 H new ATOM 0 HE1 PHE A 57 -2.401 -2.971 -5.807 1.00 74.30 H new ATOM 0 HE2 PHE A 57 0.176 -0.199 -7.750 1.00 12.21 H new ATOM 0 HZ PHE A 57 -2.075 -0.871 -7.035 1.00 11.13 H new ATOM 960 N ILE A 58 3.874 -5.393 -3.089 1.00 11.31 N ATOM 961 CA ILE A 58 4.883 -6.403 -2.701 1.00 32.11 C ATOM 962 C ILE A 58 4.189 -7.731 -2.358 1.00 61.32 C ATOM 963 O ILE A 58 3.172 -7.739 -1.650 1.00 23.21 O ATOM 964 CB ILE A 58 5.743 -5.960 -1.446 1.00 44.33 C ATOM 965 CG1 ILE A 58 6.264 -4.496 -1.590 1.00 44.03 C ATOM 966 CG2 ILE A 58 6.928 -6.938 -1.218 1.00 44.03 C ATOM 967 CD1 ILE A 58 7.028 -3.976 -0.382 1.00 10.21 C ATOM 0 H ILE A 58 3.137 -5.263 -2.396 1.00 11.31 H new ATOM 0 HA ILE A 58 5.552 -6.514 -3.554 1.00 32.11 H new ATOM 0 HB ILE A 58 5.089 -5.994 -0.575 1.00 44.33 H new ATOM 0 HG12 ILE A 58 6.911 -4.439 -2.465 1.00 44.03 H new ATOM 0 HG13 ILE A 58 5.415 -3.839 -1.778 1.00 44.03 H new ATOM 0 HG21 ILE A 58 7.505 -6.615 -0.352 1.00 44.03 H new ATOM 0 HG22 ILE A 58 6.542 -7.942 -1.043 1.00 44.03 H new ATOM 0 HG23 ILE A 58 7.569 -6.944 -2.099 1.00 44.03 H new ATOM 0 HD11 ILE A 58 7.352 -2.952 -0.570 1.00 10.21 H new ATOM 0 HD12 ILE A 58 6.380 -3.997 0.495 1.00 10.21 H new ATOM 0 HD13 ILE A 58 7.900 -4.606 -0.204 1.00 10.21 H new ATOM 979 N ARG A 59 4.734 -8.848 -2.875 1.00 44.33 N ATOM 980 CA ARG A 59 4.360 -10.197 -2.433 1.00 1.44 C ATOM 981 C ARG A 59 5.390 -10.686 -1.414 1.00 70.32 C ATOM 982 O ARG A 59 6.597 -10.512 -1.618 1.00 31.21 O ATOM 983 CB ARG A 59 4.271 -11.194 -3.622 1.00 14.22 C ATOM 984 CG ARG A 59 3.899 -12.644 -3.211 1.00 53.43 C ATOM 985 CD ARG A 59 3.903 -13.633 -4.387 1.00 11.22 C ATOM 986 NE ARG A 59 3.582 -15.007 -3.967 1.00 74.12 N ATOM 987 CZ ARG A 59 4.464 -16.016 -3.835 1.00 11.33 C ATOM 988 NH1 ARG A 59 5.761 -15.833 -4.086 1.00 63.34 N ATOM 989 NH2 ARG A 59 4.039 -17.208 -3.461 1.00 13.41 N ATOM 0 H ARG A 59 5.443 -8.837 -3.608 1.00 44.33 H new ATOM 0 HA ARG A 59 3.370 -10.149 -1.979 1.00 1.44 H new ATOM 0 HB2 ARG A 59 3.530 -10.829 -4.333 1.00 14.22 H new ATOM 0 HB3 ARG A 59 5.230 -11.210 -4.140 1.00 14.22 H new ATOM 0 HG2 ARG A 59 4.601 -12.990 -2.453 1.00 53.43 H new ATOM 0 HG3 ARG A 59 2.910 -12.641 -2.752 1.00 53.43 H new ATOM 0 HD2 ARG A 59 3.180 -13.307 -5.135 1.00 11.22 H new ATOM 0 HD3 ARG A 59 4.883 -13.622 -4.864 1.00 11.22 H new ATOM 0 HE ARG A 59 2.605 -15.213 -3.757 1.00 74.12 H new ATOM 0 HH11 ARG A 59 6.099 -14.918 -4.383 1.00 63.34 H new ATOM 0 HH12 ARG A 59 6.415 -16.608 -3.981 1.00 63.34 H new ATOM 0 HH21 ARG A 59 3.048 -17.361 -3.274 1.00 13.41 H new ATOM 0 HH22 ARG A 59 4.702 -17.977 -3.359 1.00 13.41 H new ATOM 1003 N GLY A 60 4.894 -11.277 -0.322 1.00 62.23 N ATOM 1004 CA GLY A 60 5.752 -11.865 0.700 1.00 35.25 C ATOM 1005 C GLY A 60 6.392 -10.837 1.615 1.00 4.05 C ATOM 1006 O GLY A 60 7.485 -11.064 2.144 1.00 43.34 O ATOM 0 H GLY A 60 3.896 -11.359 -0.127 1.00 62.23 H new ATOM 0 HA2 GLY A 60 5.165 -12.560 1.301 1.00 35.25 H new ATOM 0 HA3 GLY A 60 6.536 -12.447 0.215 1.00 35.25 H new ATOM 1010 N ALA A 61 5.715 -9.693 1.791 1.00 42.33 N ATOM 1011 CA ALA A 61 6.147 -8.662 2.728 1.00 63.45 C ATOM 1012 C ALA A 61 5.673 -9.040 4.138 1.00 22.45 C ATOM 1013 O ALA A 61 4.517 -8.802 4.507 1.00 73.25 O ATOM 1014 CB ALA A 61 5.634 -7.277 2.298 1.00 2.34 C ATOM 0 H ALA A 61 4.858 -9.463 1.288 1.00 42.33 H new ATOM 0 HA ALA A 61 7.235 -8.601 2.732 1.00 63.45 H new ATOM 0 HB1 ALA A 61 5.970 -6.526 3.013 1.00 2.34 H new ATOM 0 HB2 ALA A 61 6.023 -7.036 1.309 1.00 2.34 H new ATOM 0 HB3 ALA A 61 4.544 -7.286 2.267 1.00 2.34 H new ATOM 1020 N THR A 62 6.565 -9.722 4.876 1.00 13.21 N ATOM 1021 CA THR A 62 6.337 -10.128 6.281 1.00 43.15 C ATOM 1022 C THR A 62 6.506 -8.904 7.220 1.00 60.33 C ATOM 1023 O THR A 62 6.778 -7.800 6.734 1.00 41.25 O ATOM 1024 CB THR A 62 7.298 -11.313 6.666 1.00 10.31 C ATOM 1025 OG1 THR A 62 7.056 -11.760 8.015 1.00 53.31 O ATOM 1026 CG2 THR A 62 8.776 -10.939 6.504 1.00 73.54 C ATOM 0 H THR A 62 7.474 -10.011 4.515 1.00 13.21 H new ATOM 0 HA THR A 62 5.316 -10.490 6.397 1.00 43.15 H new ATOM 0 HB THR A 62 7.079 -12.126 5.973 1.00 10.31 H new ATOM 0 HG1 THR A 62 7.664 -12.498 8.229 1.00 53.31 H new ATOM 0 HG21 THR A 62 9.399 -11.789 6.782 1.00 73.54 H new ATOM 0 HG22 THR A 62 8.971 -10.670 5.466 1.00 73.54 H new ATOM 0 HG23 THR A 62 9.010 -10.092 7.149 1.00 73.54 H new ATOM 1034 N GLU A 63 6.348 -9.103 8.552 1.00 55.31 N ATOM 1035 CA GLU A 63 6.334 -7.999 9.546 1.00 1.03 C ATOM 1036 C GLU A 63 7.560 -7.076 9.412 1.00 35.35 C ATOM 1037 O GLU A 63 7.400 -5.863 9.288 1.00 41.53 O ATOM 1038 CB GLU A 63 6.254 -8.542 11.001 1.00 21.24 C ATOM 1039 CG GLU A 63 6.053 -7.442 12.075 1.00 35.42 C ATOM 1040 CD GLU A 63 6.249 -7.952 13.511 1.00 43.52 C ATOM 1041 OE1 GLU A 63 5.397 -8.726 13.995 1.00 74.44 O ATOM 1042 OE2 GLU A 63 7.262 -7.591 14.155 1.00 65.54 O ATOM 0 H GLU A 63 6.227 -10.027 8.966 1.00 55.31 H new ATOM 0 HA GLU A 63 5.439 -7.414 9.333 1.00 1.03 H new ATOM 0 HB2 GLU A 63 5.432 -9.254 11.067 1.00 21.24 H new ATOM 0 HB3 GLU A 63 7.169 -9.090 11.224 1.00 21.24 H new ATOM 0 HG2 GLU A 63 6.753 -6.628 11.887 1.00 35.42 H new ATOM 0 HG3 GLU A 63 5.049 -7.028 11.978 1.00 35.42 H new ATOM 1049 N GLU A 64 8.765 -7.685 9.382 1.00 52.23 N ATOM 1050 CA GLU A 64 10.058 -6.959 9.306 1.00 4.43 C ATOM 1051 C GLU A 64 10.138 -6.029 8.079 1.00 2.14 C ATOM 1052 O GLU A 64 10.835 -5.016 8.108 1.00 11.24 O ATOM 1053 CB GLU A 64 11.249 -7.956 9.272 1.00 34.42 C ATOM 1054 CG GLU A 64 11.247 -8.897 8.051 1.00 52.53 C ATOM 1055 CD GLU A 64 12.492 -9.786 7.930 1.00 10.32 C ATOM 1056 OE1 GLU A 64 12.406 -11.011 8.162 1.00 33.21 O ATOM 1057 OE2 GLU A 64 13.565 -9.260 7.574 1.00 30.15 O ATOM 0 H GLU A 64 8.872 -8.699 9.410 1.00 52.23 H new ATOM 0 HA GLU A 64 10.119 -6.342 10.203 1.00 4.43 H new ATOM 0 HB2 GLU A 64 12.182 -7.392 9.281 1.00 34.42 H new ATOM 0 HB3 GLU A 64 11.232 -8.557 10.181 1.00 34.42 H new ATOM 0 HG2 GLU A 64 10.364 -9.535 8.101 1.00 52.53 H new ATOM 0 HG3 GLU A 64 11.155 -8.297 7.146 1.00 52.53 H new ATOM 1064 N VAL A 65 9.435 -6.407 7.002 1.00 43.41 N ATOM 1065 CA VAL A 65 9.362 -5.626 5.764 1.00 13.43 C ATOM 1066 C VAL A 65 8.372 -4.455 5.943 1.00 3.12 C ATOM 1067 O VAL A 65 8.758 -3.274 5.864 1.00 55.54 O ATOM 1068 CB VAL A 65 8.911 -6.543 4.555 1.00 70.23 C ATOM 1069 CG1 VAL A 65 8.886 -5.774 3.215 1.00 53.24 C ATOM 1070 CG2 VAL A 65 9.793 -7.812 4.455 1.00 25.21 C ATOM 0 H VAL A 65 8.896 -7.273 6.968 1.00 43.41 H new ATOM 0 HA VAL A 65 10.352 -5.227 5.542 1.00 13.43 H new ATOM 0 HB VAL A 65 7.888 -6.857 4.760 1.00 70.23 H new ATOM 0 HG11 VAL A 65 8.571 -6.445 2.416 1.00 53.24 H new ATOM 0 HG12 VAL A 65 8.187 -4.941 3.286 1.00 53.24 H new ATOM 0 HG13 VAL A 65 9.883 -5.392 2.996 1.00 53.24 H new ATOM 0 HG21 VAL A 65 9.459 -8.422 3.616 1.00 25.21 H new ATOM 0 HG22 VAL A 65 10.832 -7.522 4.302 1.00 25.21 H new ATOM 0 HG23 VAL A 65 9.709 -8.387 5.377 1.00 25.21 H new ATOM 1080 N VAL A 66 7.109 -4.811 6.267 1.00 64.32 N ATOM 1081 CA VAL A 66 5.983 -3.865 6.301 1.00 70.52 C ATOM 1082 C VAL A 66 6.219 -2.752 7.338 1.00 74.33 C ATOM 1083 O VAL A 66 6.234 -1.579 6.976 1.00 53.54 O ATOM 1084 CB VAL A 66 4.611 -4.587 6.590 1.00 4.00 C ATOM 1085 CG1 VAL A 66 3.421 -3.596 6.509 1.00 44.11 C ATOM 1086 CG2 VAL A 66 4.396 -5.780 5.636 1.00 25.40 C ATOM 0 H VAL A 66 6.846 -5.766 6.512 1.00 64.32 H new ATOM 0 HA VAL A 66 5.925 -3.416 5.310 1.00 70.52 H new ATOM 0 HB VAL A 66 4.655 -4.973 7.608 1.00 4.00 H new ATOM 0 HG11 VAL A 66 2.491 -4.127 6.713 1.00 44.11 H new ATOM 0 HG12 VAL A 66 3.556 -2.804 7.246 1.00 44.11 H new ATOM 0 HG13 VAL A 66 3.378 -3.160 5.511 1.00 44.11 H new ATOM 0 HG21 VAL A 66 3.442 -6.257 5.860 1.00 25.40 H new ATOM 0 HG22 VAL A 66 4.391 -5.425 4.605 1.00 25.40 H new ATOM 0 HG23 VAL A 66 5.202 -6.501 5.768 1.00 25.40 H new ATOM 1096 N ARG A 67 6.459 -3.143 8.614 1.00 1.43 N ATOM 1097 CA ARG A 67 6.632 -2.187 9.740 1.00 35.41 C ATOM 1098 C ARG A 67 7.790 -1.188 9.475 1.00 35.14 C ATOM 1099 O ARG A 67 7.694 -0.016 9.836 1.00 31.11 O ATOM 1100 CB ARG A 67 6.861 -2.939 11.098 1.00 32.20 C ATOM 1101 CG ARG A 67 8.243 -3.622 11.238 1.00 4.41 C ATOM 1102 CD ARG A 67 8.453 -4.361 12.575 1.00 31.43 C ATOM 1103 NE ARG A 67 9.768 -5.026 12.609 1.00 55.01 N ATOM 1104 CZ ARG A 67 10.408 -5.442 13.711 1.00 35.45 C ATOM 1105 NH1 ARG A 67 9.880 -5.287 14.923 1.00 50.34 N ATOM 1106 NH2 ARG A 67 11.590 -6.016 13.587 1.00 35.24 N ATOM 0 H ARG A 67 6.538 -4.121 8.892 1.00 1.43 H new ATOM 0 HA ARG A 67 5.706 -1.616 9.814 1.00 35.41 H new ATOM 0 HB2 ARG A 67 6.738 -2.229 11.915 1.00 32.20 H new ATOM 0 HB3 ARG A 67 6.085 -3.695 11.214 1.00 32.20 H new ATOM 0 HG2 ARG A 67 8.369 -4.332 10.420 1.00 4.41 H new ATOM 0 HG3 ARG A 67 9.021 -2.867 11.127 1.00 4.41 H new ATOM 0 HD2 ARG A 67 8.377 -3.654 13.401 1.00 31.43 H new ATOM 0 HD3 ARG A 67 7.664 -5.100 12.714 1.00 31.43 H new ATOM 0 HE ARG A 67 10.232 -5.184 11.715 1.00 55.01 H new ATOM 0 HH11 ARG A 67 8.968 -4.843 15.029 1.00 50.34 H new ATOM 0 HH12 ARG A 67 10.387 -5.612 15.746 1.00 50.34 H new ATOM 0 HH21 ARG A 67 12.003 -6.137 12.663 1.00 35.24 H new ATOM 0 HH22 ARG A 67 12.090 -6.338 14.416 1.00 35.24 H new ATOM 1120 N ASP A 68 8.843 -1.682 8.792 1.00 74.31 N ATOM 1121 CA ASP A 68 10.085 -0.935 8.511 1.00 3.33 C ATOM 1122 C ASP A 68 9.859 0.151 7.432 1.00 74.34 C ATOM 1123 O ASP A 68 10.443 1.246 7.491 1.00 40.24 O ATOM 1124 CB ASP A 68 11.180 -1.946 8.090 1.00 71.02 C ATOM 1125 CG ASP A 68 12.506 -1.306 7.648 1.00 15.01 C ATOM 1126 OD1 ASP A 68 12.937 -1.521 6.498 1.00 31.45 O ATOM 1127 OD2 ASP A 68 13.149 -0.599 8.457 1.00 4.11 O ATOM 0 H ASP A 68 8.853 -2.629 8.413 1.00 74.31 H new ATOM 0 HA ASP A 68 10.408 -0.408 9.409 1.00 3.33 H new ATOM 0 HB2 ASP A 68 11.377 -2.618 8.926 1.00 71.02 H new ATOM 0 HB3 ASP A 68 10.797 -2.557 7.273 1.00 71.02 H new ATOM 1132 N ILE A 69 8.996 -0.172 6.450 1.00 1.23 N ATOM 1133 CA ILE A 69 8.575 0.782 5.408 1.00 5.41 C ATOM 1134 C ILE A 69 7.600 1.829 5.995 1.00 74.10 C ATOM 1135 O ILE A 69 7.794 3.045 5.860 1.00 54.13 O ATOM 1136 CB ILE A 69 7.845 0.050 4.225 1.00 65.52 C ATOM 1137 CG1 ILE A 69 8.764 -1.011 3.552 1.00 62.22 C ATOM 1138 CG2 ILE A 69 7.324 1.073 3.192 1.00 5.12 C ATOM 1139 CD1 ILE A 69 8.042 -1.920 2.566 1.00 43.31 C ATOM 0 H ILE A 69 8.574 -1.096 6.357 1.00 1.23 H new ATOM 0 HA ILE A 69 9.477 1.268 5.036 1.00 5.41 H new ATOM 0 HB ILE A 69 6.989 -0.483 4.640 1.00 65.52 H new ATOM 0 HG12 ILE A 69 9.573 -0.498 3.032 1.00 62.22 H new ATOM 0 HG13 ILE A 69 9.222 -1.625 4.328 1.00 62.22 H new ATOM 0 HG21 ILE A 69 6.822 0.547 2.380 1.00 5.12 H new ATOM 0 HG22 ILE A 69 6.621 1.752 3.675 1.00 5.12 H new ATOM 0 HG23 ILE A 69 8.162 1.644 2.791 1.00 5.12 H new ATOM 0 HD11 ILE A 69 8.750 -2.631 2.140 1.00 43.31 H new ATOM 0 HD12 ILE A 69 7.251 -2.462 3.083 1.00 43.31 H new ATOM 0 HD13 ILE A 69 7.608 -1.318 1.768 1.00 43.31 H new ATOM 1151 N VAL A 70 6.541 1.303 6.632 1.00 11.44 N ATOM 1152 CA VAL A 70 5.393 2.074 7.113 1.00 55.22 C ATOM 1153 C VAL A 70 5.811 3.159 8.123 1.00 71.04 C ATOM 1154 O VAL A 70 5.397 4.321 7.984 1.00 14.01 O ATOM 1155 CB VAL A 70 4.313 1.104 7.725 1.00 24.15 C ATOM 1156 CG1 VAL A 70 3.212 1.868 8.470 1.00 32.31 C ATOM 1157 CG2 VAL A 70 3.694 0.200 6.626 1.00 24.03 C ATOM 0 H VAL A 70 6.462 0.305 6.829 1.00 11.44 H new ATOM 0 HA VAL A 70 4.953 2.594 6.262 1.00 55.22 H new ATOM 0 HB VAL A 70 4.826 0.473 8.451 1.00 24.15 H new ATOM 0 HG11 VAL A 70 2.489 1.160 8.876 1.00 32.31 H new ATOM 0 HG12 VAL A 70 3.654 2.442 9.284 1.00 32.31 H new ATOM 0 HG13 VAL A 70 2.709 2.546 7.780 1.00 32.31 H new ATOM 0 HG21 VAL A 70 2.951 -0.460 7.074 1.00 24.03 H new ATOM 0 HG22 VAL A 70 3.217 0.822 5.869 1.00 24.03 H new ATOM 0 HG23 VAL A 70 4.479 -0.398 6.162 1.00 24.03 H new ATOM 1167 N GLU A 71 6.675 2.783 9.103 1.00 55.32 N ATOM 1168 CA GLU A 71 7.176 3.726 10.127 1.00 1.43 C ATOM 1169 C GLU A 71 7.851 4.938 9.456 1.00 42.34 C ATOM 1170 O GLU A 71 7.637 6.077 9.865 1.00 24.50 O ATOM 1171 CB GLU A 71 8.179 3.044 11.107 1.00 54.03 C ATOM 1172 CG GLU A 71 9.475 2.521 10.443 1.00 21.30 C ATOM 1173 CD GLU A 71 10.526 2.020 11.438 1.00 1.54 C ATOM 1174 OE1 GLU A 71 10.619 0.798 11.671 1.00 63.42 O ATOM 1175 OE2 GLU A 71 11.268 2.855 11.994 1.00 12.24 O ATOM 0 H GLU A 71 7.036 1.834 9.201 1.00 55.32 H new ATOM 0 HA GLU A 71 6.315 4.060 10.706 1.00 1.43 H new ATOM 0 HB2 GLU A 71 8.448 3.758 11.885 1.00 54.03 H new ATOM 0 HB3 GLU A 71 7.677 2.211 11.598 1.00 54.03 H new ATOM 0 HG2 GLU A 71 9.220 1.710 9.761 1.00 21.30 H new ATOM 0 HG3 GLU A 71 9.910 3.319 9.841 1.00 21.30 H new ATOM 1182 N TYR A 72 8.615 4.655 8.375 1.00 71.33 N ATOM 1183 CA TYR A 72 9.381 5.659 7.630 1.00 73.01 C ATOM 1184 C TYR A 72 8.440 6.672 6.968 1.00 12.12 C ATOM 1185 O TYR A 72 8.579 7.874 7.185 1.00 24.41 O ATOM 1186 CB TYR A 72 10.286 4.967 6.575 1.00 2.33 C ATOM 1187 CG TYR A 72 11.115 5.934 5.721 1.00 61.22 C ATOM 1188 CD1 TYR A 72 12.176 6.656 6.279 1.00 0.43 C ATOM 1189 CD2 TYR A 72 10.818 6.150 4.370 1.00 42.44 C ATOM 1190 CE1 TYR A 72 12.908 7.545 5.518 1.00 44.22 C ATOM 1191 CE2 TYR A 72 11.552 7.032 3.608 1.00 63.44 C ATOM 1192 CZ TYR A 72 12.590 7.733 4.189 1.00 74.24 C ATOM 1193 OH TYR A 72 13.314 8.632 3.444 1.00 32.31 O ATOM 0 H TYR A 72 8.712 3.712 7.999 1.00 71.33 H new ATOM 0 HA TYR A 72 10.020 6.201 8.327 1.00 73.01 H new ATOM 0 HB2 TYR A 72 10.962 4.282 7.087 1.00 2.33 H new ATOM 0 HB3 TYR A 72 9.660 4.364 5.916 1.00 2.33 H new ATOM 0 HD1 TYR A 72 12.426 6.516 7.320 1.00 0.43 H new ATOM 0 HD2 TYR A 72 9.997 5.614 3.916 1.00 42.44 H new ATOM 0 HE1 TYR A 72 13.727 8.092 5.962 1.00 44.22 H new ATOM 0 HE2 TYR A 72 11.317 7.174 2.563 1.00 63.44 H new ATOM 0 HH TYR A 72 13.606 8.206 2.611 1.00 32.31 H new ATOM 1203 N ALA A 73 7.450 6.162 6.213 1.00 50.13 N ATOM 1204 CA ALA A 73 6.487 7.000 5.477 1.00 4.44 C ATOM 1205 C ALA A 73 5.642 7.881 6.433 1.00 21.25 C ATOM 1206 O ALA A 73 5.268 9.004 6.080 1.00 21.42 O ATOM 1207 CB ALA A 73 5.597 6.115 4.590 1.00 12.44 C ATOM 0 H ALA A 73 7.296 5.161 6.096 1.00 50.13 H new ATOM 0 HA ALA A 73 7.045 7.684 4.838 1.00 4.44 H new ATOM 0 HB1 ALA A 73 4.887 6.740 4.048 1.00 12.44 H new ATOM 0 HB2 ALA A 73 6.218 5.571 3.878 1.00 12.44 H new ATOM 0 HB3 ALA A 73 5.053 5.405 5.213 1.00 12.44 H new ATOM 1213 N GLN A 74 5.378 7.372 7.657 1.00 72.00 N ATOM 1214 CA GLN A 74 4.680 8.142 8.718 1.00 50.42 C ATOM 1215 C GLN A 74 5.595 9.251 9.289 1.00 14.25 C ATOM 1216 O GLN A 74 5.136 10.361 9.569 1.00 71.32 O ATOM 1217 CB GLN A 74 4.214 7.210 9.867 1.00 50.03 C ATOM 1218 CG GLN A 74 3.206 6.129 9.444 1.00 54.31 C ATOM 1219 CD GLN A 74 2.750 5.260 10.609 1.00 15.14 C ATOM 1220 OE1 GLN A 74 3.398 4.265 10.941 1.00 2.22 O ATOM 1221 NE2 GLN A 74 1.630 5.615 11.234 1.00 60.34 N ATOM 0 H GLN A 74 5.638 6.427 7.938 1.00 72.00 H new ATOM 0 HA GLN A 74 3.804 8.605 8.263 1.00 50.42 H new ATOM 0 HB2 GLN A 74 5.088 6.724 10.300 1.00 50.03 H new ATOM 0 HB3 GLN A 74 3.766 7.819 10.652 1.00 50.03 H new ATOM 0 HG2 GLN A 74 2.337 6.606 8.991 1.00 54.31 H new ATOM 0 HG3 GLN A 74 3.658 5.497 8.680 1.00 54.31 H new ATOM 0 HE21 GLN A 74 1.119 6.445 10.933 1.00 60.34 H new ATOM 0 HE22 GLN A 74 1.283 5.057 12.014 1.00 60.34 H new ATOM 1230 N LYS A 75 6.896 8.925 9.447 1.00 72.35 N ATOM 1231 CA LYS A 75 7.923 9.865 9.953 1.00 45.41 C ATOM 1232 C LYS A 75 8.243 10.963 8.919 1.00 50.25 C ATOM 1233 O LYS A 75 8.766 12.022 9.281 1.00 42.23 O ATOM 1234 CB LYS A 75 9.219 9.097 10.363 1.00 10.31 C ATOM 1235 CG LYS A 75 9.073 8.258 11.656 1.00 72.33 C ATOM 1236 CD LYS A 75 10.367 7.493 12.052 1.00 73.03 C ATOM 1237 CE LYS A 75 10.777 6.412 11.031 1.00 31.53 C ATOM 1238 NZ LYS A 75 11.967 5.627 11.475 1.00 62.34 N ATOM 0 H LYS A 75 7.266 8.000 9.227 1.00 72.35 H new ATOM 0 HA LYS A 75 7.516 10.354 10.838 1.00 45.41 H new ATOM 0 HB2 LYS A 75 9.512 8.438 9.546 1.00 10.31 H new ATOM 0 HB3 LYS A 75 10.027 9.816 10.498 1.00 10.31 H new ATOM 0 HG2 LYS A 75 8.785 8.916 12.476 1.00 72.33 H new ATOM 0 HG3 LYS A 75 8.263 7.541 11.524 1.00 72.33 H new ATOM 0 HD2 LYS A 75 11.183 8.207 12.161 1.00 73.03 H new ATOM 0 HD3 LYS A 75 10.220 7.025 13.026 1.00 73.03 H new ATOM 0 HE2 LYS A 75 9.939 5.734 10.868 1.00 31.53 H new ATOM 0 HE3 LYS A 75 10.995 6.885 10.074 1.00 31.53 H new ATOM 0 HZ1 LYS A 75 12.683 5.626 10.721 1.00 62.34 H new ATOM 0 HZ2 LYS A 75 12.368 6.059 12.332 1.00 62.34 H new ATOM 0 HZ3 LYS A 75 11.680 4.649 11.682 1.00 62.34 H new ATOM 1252 N GLU A 76 7.934 10.698 7.634 1.00 24.13 N ATOM 1253 CA GLU A 76 8.066 11.704 6.553 1.00 73.25 C ATOM 1254 C GLU A 76 6.774 12.540 6.415 1.00 73.04 C ATOM 1255 O GLU A 76 6.713 13.456 5.587 1.00 4.14 O ATOM 1256 CB GLU A 76 8.439 11.023 5.203 1.00 1.23 C ATOM 1257 CG GLU A 76 9.685 10.101 5.249 1.00 65.00 C ATOM 1258 CD GLU A 76 10.900 10.706 5.987 1.00 12.41 C ATOM 1259 OE1 GLU A 76 11.609 11.558 5.406 1.00 54.54 O ATOM 1260 OE2 GLU A 76 11.159 10.330 7.156 1.00 63.33 O ATOM 0 H GLU A 76 7.589 9.792 7.315 1.00 24.13 H new ATOM 0 HA GLU A 76 8.876 12.383 6.821 1.00 73.25 H new ATOM 0 HB2 GLU A 76 7.586 10.437 4.863 1.00 1.23 H new ATOM 0 HB3 GLU A 76 8.609 11.800 4.458 1.00 1.23 H new ATOM 0 HG2 GLU A 76 9.411 9.164 5.734 1.00 65.00 H new ATOM 0 HG3 GLU A 76 9.980 9.858 4.228 1.00 65.00 H new ATOM 1267 N GLY A 77 5.754 12.205 7.237 1.00 1.11 N ATOM 1268 CA GLY A 77 4.498 12.964 7.313 1.00 50.51 C ATOM 1269 C GLY A 77 3.555 12.702 6.146 1.00 10.32 C ATOM 1270 O GLY A 77 2.756 13.568 5.772 1.00 32.44 O ATOM 0 H GLY A 77 5.784 11.401 7.863 1.00 1.11 H new ATOM 0 HA2 GLY A 77 3.989 12.715 8.244 1.00 50.51 H new ATOM 0 HA3 GLY A 77 4.728 14.029 7.351 1.00 50.51 H new ATOM 1274 N LEU A 78 3.658 11.497 5.567 1.00 43.24 N ATOM 1275 CA LEU A 78 2.875 11.088 4.386 1.00 73.22 C ATOM 1276 C LEU A 78 1.720 10.178 4.829 1.00 11.50 C ATOM 1277 O LEU A 78 1.886 9.397 5.771 1.00 11.21 O ATOM 1278 CB LEU A 78 3.798 10.354 3.370 1.00 13.32 C ATOM 1279 CG LEU A 78 5.156 11.062 3.044 1.00 0.50 C ATOM 1280 CD1 LEU A 78 5.965 10.278 1.997 1.00 74.34 C ATOM 1281 CD2 LEU A 78 4.945 12.524 2.607 1.00 13.20 C ATOM 0 H LEU A 78 4.291 10.772 5.905 1.00 43.24 H new ATOM 0 HA LEU A 78 2.459 11.969 3.897 1.00 73.22 H new ATOM 0 HB2 LEU A 78 4.014 9.358 3.758 1.00 13.32 H new ATOM 0 HB3 LEU A 78 3.247 10.221 2.439 1.00 13.32 H new ATOM 0 HG LEU A 78 5.739 11.078 3.965 1.00 0.50 H new ATOM 0 HD11 LEU A 78 6.901 10.799 1.796 1.00 74.34 H new ATOM 0 HD12 LEU A 78 6.180 9.279 2.377 1.00 74.34 H new ATOM 0 HD13 LEU A 78 5.388 10.199 1.076 1.00 74.34 H new ATOM 0 HD21 LEU A 78 5.910 12.982 2.389 1.00 13.20 H new ATOM 0 HD22 LEU A 78 4.321 12.550 1.713 1.00 13.20 H new ATOM 0 HD23 LEU A 78 4.454 13.076 3.408 1.00 13.20 H new ATOM 1293 N ARG A 79 0.555 10.299 4.164 1.00 54.35 N ATOM 1294 CA ARG A 79 -0.630 9.479 4.461 1.00 65.51 C ATOM 1295 C ARG A 79 -0.368 8.014 4.042 1.00 61.04 C ATOM 1296 O ARG A 79 -0.222 7.737 2.847 1.00 43.52 O ATOM 1297 CB ARG A 79 -1.867 10.040 3.703 1.00 21.44 C ATOM 1298 CG ARG A 79 -3.209 9.376 4.093 1.00 44.23 C ATOM 1299 CD ARG A 79 -4.327 9.618 3.066 1.00 10.21 C ATOM 1300 NE ARG A 79 -4.660 11.040 2.887 1.00 44.30 N ATOM 1301 CZ ARG A 79 -5.456 11.524 1.920 1.00 23.34 C ATOM 1302 NH1 ARG A 79 -6.014 10.713 1.021 1.00 34.32 N ATOM 1303 NH2 ARG A 79 -5.716 12.819 1.879 1.00 42.13 N ATOM 0 H ARG A 79 0.411 10.968 3.407 1.00 54.35 H new ATOM 0 HA ARG A 79 -0.830 9.512 5.532 1.00 65.51 H new ATOM 0 HB2 ARG A 79 -1.938 11.112 3.890 1.00 21.44 H new ATOM 0 HB3 ARG A 79 -1.710 9.913 2.632 1.00 21.44 H new ATOM 0 HG2 ARG A 79 -3.056 8.303 4.207 1.00 44.23 H new ATOM 0 HG3 ARG A 79 -3.527 9.758 5.063 1.00 44.23 H new ATOM 0 HD2 ARG A 79 -4.025 9.200 2.106 1.00 10.21 H new ATOM 0 HD3 ARG A 79 -5.221 9.080 3.380 1.00 10.21 H new ATOM 0 HE ARG A 79 -4.257 11.707 3.545 1.00 44.30 H new ATOM 0 HH11 ARG A 79 -5.839 9.709 1.062 1.00 34.32 H new ATOM 0 HH12 ARG A 79 -6.616 11.096 0.293 1.00 34.32 H new ATOM 0 HH21 ARG A 79 -5.313 13.442 2.578 1.00 42.13 H new ATOM 0 HH22 ARG A 79 -6.320 13.195 1.148 1.00 42.13 H new ATOM 1317 N VAL A 80 -0.296 7.096 5.030 1.00 61.44 N ATOM 1318 CA VAL A 80 0.036 5.673 4.793 1.00 41.32 C ATOM 1319 C VAL A 80 -1.226 4.802 4.908 1.00 65.11 C ATOM 1320 O VAL A 80 -1.793 4.665 5.993 1.00 21.12 O ATOM 1321 CB VAL A 80 1.128 5.152 5.802 1.00 50.30 C ATOM 1322 CG1 VAL A 80 1.596 3.724 5.425 1.00 32.55 C ATOM 1323 CG2 VAL A 80 2.315 6.131 5.872 1.00 70.03 C ATOM 0 H VAL A 80 -0.466 7.319 6.011 1.00 61.44 H new ATOM 0 HA VAL A 80 0.442 5.599 3.784 1.00 41.32 H new ATOM 0 HB VAL A 80 0.679 5.099 6.794 1.00 50.30 H new ATOM 0 HG11 VAL A 80 2.350 3.388 6.137 1.00 32.55 H new ATOM 0 HG12 VAL A 80 0.745 3.044 5.450 1.00 32.55 H new ATOM 0 HG13 VAL A 80 2.023 3.734 4.422 1.00 32.55 H new ATOM 0 HG21 VAL A 80 3.058 5.753 6.574 1.00 70.03 H new ATOM 0 HG22 VAL A 80 2.766 6.228 4.884 1.00 70.03 H new ATOM 0 HG23 VAL A 80 1.963 7.107 6.207 1.00 70.03 H new ATOM 1333 N LEU A 81 -1.646 4.211 3.777 1.00 21.14 N ATOM 1334 CA LEU A 81 -2.827 3.333 3.693 1.00 22.22 C ATOM 1335 C LEU A 81 -2.341 1.907 3.401 1.00 0.34 C ATOM 1336 O LEU A 81 -1.847 1.643 2.307 1.00 75.44 O ATOM 1337 CB LEU A 81 -3.794 3.785 2.552 1.00 40.52 C ATOM 1338 CG LEU A 81 -4.282 5.271 2.526 1.00 11.21 C ATOM 1339 CD1 LEU A 81 -4.864 5.716 3.877 1.00 3.55 C ATOM 1340 CD2 LEU A 81 -3.175 6.225 2.033 1.00 54.12 C ATOM 0 H LEU A 81 -1.169 4.331 2.883 1.00 21.14 H new ATOM 0 HA LEU A 81 -3.372 3.381 4.636 1.00 22.22 H new ATOM 0 HB2 LEU A 81 -3.301 3.582 1.601 1.00 40.52 H new ATOM 0 HB3 LEU A 81 -4.677 3.148 2.595 1.00 40.52 H new ATOM 0 HG LEU A 81 -5.097 5.323 1.805 1.00 11.21 H new ATOM 0 HD11 LEU A 81 -5.189 6.754 3.809 1.00 3.55 H new ATOM 0 HD12 LEU A 81 -5.716 5.085 4.132 1.00 3.55 H new ATOM 0 HD13 LEU A 81 -4.101 5.625 4.650 1.00 3.55 H new ATOM 0 HD21 LEU A 81 -3.552 7.248 2.029 1.00 54.12 H new ATOM 0 HD22 LEU A 81 -2.314 6.158 2.698 1.00 54.12 H new ATOM 0 HD23 LEU A 81 -2.876 5.944 1.023 1.00 54.12 H new ATOM 1352 N VAL A 82 -2.477 0.999 4.361 1.00 64.12 N ATOM 1353 CA VAL A 82 -1.969 -0.375 4.226 1.00 13.12 C ATOM 1354 C VAL A 82 -3.128 -1.340 3.918 1.00 30.35 C ATOM 1355 O VAL A 82 -3.986 -1.580 4.770 1.00 70.15 O ATOM 1356 CB VAL A 82 -1.188 -0.847 5.513 1.00 32.14 C ATOM 1357 CG1 VAL A 82 -0.622 -2.283 5.340 1.00 13.04 C ATOM 1358 CG2 VAL A 82 -0.070 0.160 5.871 1.00 54.02 C ATOM 0 H VAL A 82 -2.938 1.186 5.252 1.00 64.12 H new ATOM 0 HA VAL A 82 -1.262 -0.384 3.397 1.00 13.12 H new ATOM 0 HB VAL A 82 -1.894 -0.878 6.343 1.00 32.14 H new ATOM 0 HG11 VAL A 82 -0.090 -2.576 6.245 1.00 13.04 H new ATOM 0 HG12 VAL A 82 -1.442 -2.978 5.160 1.00 13.04 H new ATOM 0 HG13 VAL A 82 0.064 -2.304 4.493 1.00 13.04 H new ATOM 0 HG21 VAL A 82 0.457 -0.183 6.761 1.00 54.02 H new ATOM 0 HG22 VAL A 82 0.632 0.235 5.040 1.00 54.02 H new ATOM 0 HG23 VAL A 82 -0.510 1.138 6.064 1.00 54.02 H new ATOM 1368 N ILE A 83 -3.151 -1.854 2.675 1.00 21.55 N ATOM 1369 CA ILE A 83 -4.058 -2.935 2.260 1.00 3.23 C ATOM 1370 C ILE A 83 -3.285 -4.258 2.330 1.00 31.41 C ATOM 1371 O ILE A 83 -2.226 -4.381 1.723 1.00 73.50 O ATOM 1372 CB ILE A 83 -4.603 -2.743 0.791 1.00 72.52 C ATOM 1373 CG1 ILE A 83 -5.394 -1.415 0.663 1.00 43.13 C ATOM 1374 CG2 ILE A 83 -5.472 -3.947 0.352 1.00 64.52 C ATOM 1375 CD1 ILE A 83 -6.100 -1.218 -0.665 1.00 23.44 C ATOM 0 H ILE A 83 -2.537 -1.528 1.928 1.00 21.55 H new ATOM 0 HA ILE A 83 -4.919 -2.928 2.929 1.00 3.23 H new ATOM 0 HB ILE A 83 -3.743 -2.692 0.123 1.00 72.52 H new ATOM 0 HG12 ILE A 83 -6.135 -1.372 1.462 1.00 43.13 H new ATOM 0 HG13 ILE A 83 -4.707 -0.583 0.820 1.00 43.13 H new ATOM 0 HG21 ILE A 83 -5.832 -3.785 -0.664 1.00 64.52 H new ATOM 0 HG22 ILE A 83 -4.874 -4.858 0.384 1.00 64.52 H new ATOM 0 HG23 ILE A 83 -6.322 -4.047 1.027 1.00 64.52 H new ATOM 0 HD11 ILE A 83 -6.625 -0.263 -0.660 1.00 23.44 H new ATOM 0 HD12 ILE A 83 -5.367 -1.224 -1.471 1.00 23.44 H new ATOM 0 HD13 ILE A 83 -6.816 -2.025 -0.820 1.00 23.44 H new ATOM 1387 N MET A 84 -3.803 -5.232 3.084 1.00 21.14 N ATOM 1388 CA MET A 84 -3.230 -6.588 3.142 1.00 13.13 C ATOM 1389 C MET A 84 -4.321 -7.598 2.765 1.00 74.42 C ATOM 1390 O MET A 84 -5.378 -7.644 3.399 1.00 71.53 O ATOM 1391 CB MET A 84 -2.613 -6.851 4.542 1.00 4.23 C ATOM 1392 CG MET A 84 -1.318 -6.063 4.802 1.00 62.43 C ATOM 1393 SD MET A 84 -0.696 -6.231 6.484 1.00 72.34 S ATOM 1394 CE MET A 84 -1.941 -5.340 7.421 1.00 71.32 C ATOM 0 H MET A 84 -4.628 -5.108 3.671 1.00 21.14 H new ATOM 0 HA MET A 84 -2.415 -6.695 2.427 1.00 13.13 H new ATOM 0 HB2 MET A 84 -3.345 -6.593 5.307 1.00 4.23 H new ATOM 0 HB3 MET A 84 -2.407 -7.916 4.645 1.00 4.23 H new ATOM 0 HG2 MET A 84 -0.551 -6.401 4.105 1.00 62.43 H new ATOM 0 HG3 MET A 84 -1.497 -5.008 4.593 1.00 62.43 H new ATOM 0 HE1 MET A 84 -1.505 -4.976 8.351 1.00 71.32 H new ATOM 0 HE2 MET A 84 -2.302 -4.495 6.835 1.00 71.32 H new ATOM 0 HE3 MET A 84 -2.773 -6.007 7.647 1.00 71.32 H new ATOM 1404 N VAL A 85 -4.058 -8.369 1.688 1.00 33.22 N ATOM 1405 CA VAL A 85 -5.028 -9.297 1.073 1.00 14.32 C ATOM 1406 C VAL A 85 -4.388 -10.683 0.876 1.00 45.31 C ATOM 1407 O VAL A 85 -3.313 -10.800 0.291 1.00 74.41 O ATOM 1408 CB VAL A 85 -5.530 -8.750 -0.316 1.00 51.04 C ATOM 1409 CG1 VAL A 85 -6.492 -9.743 -1.021 1.00 71.22 C ATOM 1410 CG2 VAL A 85 -6.189 -7.369 -0.142 1.00 24.35 C ATOM 0 H VAL A 85 -3.154 -8.363 1.216 1.00 33.22 H new ATOM 0 HA VAL A 85 -5.882 -9.382 1.745 1.00 14.32 H new ATOM 0 HB VAL A 85 -4.659 -8.642 -0.962 1.00 51.04 H new ATOM 0 HG11 VAL A 85 -6.813 -9.324 -1.975 1.00 71.22 H new ATOM 0 HG12 VAL A 85 -5.977 -10.688 -1.195 1.00 71.22 H new ATOM 0 HG13 VAL A 85 -7.363 -9.916 -0.389 1.00 71.22 H new ATOM 0 HG21 VAL A 85 -6.531 -7.004 -1.111 1.00 24.35 H new ATOM 0 HG22 VAL A 85 -7.040 -7.454 0.534 1.00 24.35 H new ATOM 0 HG23 VAL A 85 -5.464 -6.670 0.274 1.00 24.35 H new ATOM 1420 N ASP A 86 -5.081 -11.709 1.375 1.00 34.33 N ATOM 1421 CA ASP A 86 -4.714 -13.130 1.232 1.00 44.54 C ATOM 1422 C ASP A 86 -5.879 -13.985 1.745 1.00 22.20 C ATOM 1423 O ASP A 86 -6.615 -13.534 2.612 1.00 54.11 O ATOM 1424 CB ASP A 86 -3.408 -13.480 2.005 1.00 31.32 C ATOM 1425 CG ASP A 86 -3.070 -14.982 2.008 1.00 13.23 C ATOM 1426 OD1 ASP A 86 -2.831 -15.555 3.088 1.00 23.02 O ATOM 1427 OD2 ASP A 86 -3.072 -15.612 0.920 1.00 72.44 O ATOM 0 H ASP A 86 -5.941 -11.575 1.907 1.00 34.33 H new ATOM 0 HA ASP A 86 -4.521 -13.336 0.179 1.00 44.54 H new ATOM 0 HB2 ASP A 86 -2.577 -12.931 1.562 1.00 31.32 H new ATOM 0 HB3 ASP A 86 -3.504 -13.137 3.035 1.00 31.32 H new ATOM 1432 N GLN A 87 -6.006 -15.223 1.228 1.00 33.33 N ATOM 1433 CA GLN A 87 -7.094 -16.162 1.595 1.00 3.13 C ATOM 1434 C GLN A 87 -7.075 -16.509 3.094 1.00 33.02 C ATOM 1435 O GLN A 87 -8.097 -16.914 3.653 1.00 45.12 O ATOM 1436 CB GLN A 87 -6.993 -17.452 0.742 1.00 61.43 C ATOM 1437 CG GLN A 87 -6.930 -17.210 -0.778 1.00 72.35 C ATOM 1438 CD GLN A 87 -8.053 -16.313 -1.324 1.00 14.34 C ATOM 1439 OE1 GLN A 87 -9.134 -16.788 -1.675 1.00 73.41 O ATOM 1440 NE2 GLN A 87 -7.786 -15.018 -1.441 1.00 41.21 N ATOM 0 H GLN A 87 -5.356 -15.605 0.541 1.00 33.33 H new ATOM 0 HA GLN A 87 -8.042 -15.665 1.389 1.00 3.13 H new ATOM 0 HB2 GLN A 87 -6.104 -18.005 1.046 1.00 61.43 H new ATOM 0 HB3 GLN A 87 -7.853 -18.085 0.961 1.00 61.43 H new ATOM 0 HG2 GLN A 87 -5.969 -16.758 -1.022 1.00 72.35 H new ATOM 0 HG3 GLN A 87 -6.969 -18.172 -1.289 1.00 72.35 H new ATOM 0 HE21 GLN A 87 -6.881 -14.655 -1.141 1.00 41.21 H new ATOM 0 HE22 GLN A 87 -8.486 -14.386 -1.831 1.00 41.21 H new ATOM 1449 N ASP A 88 -5.899 -16.359 3.724 1.00 51.23 N ATOM 1450 CA ASP A 88 -5.732 -16.509 5.175 1.00 24.10 C ATOM 1451 C ASP A 88 -5.811 -15.120 5.827 1.00 11.53 C ATOM 1452 O ASP A 88 -4.933 -14.274 5.604 1.00 54.20 O ATOM 1453 CB ASP A 88 -4.380 -17.193 5.512 1.00 51.11 C ATOM 1454 CG ASP A 88 -4.248 -17.529 7.007 1.00 41.21 C ATOM 1455 OD1 ASP A 88 -4.752 -18.591 7.432 1.00 12.32 O ATOM 1456 OD2 ASP A 88 -3.663 -16.733 7.764 1.00 33.13 O ATOM 0 H ASP A 88 -5.033 -16.129 3.236 1.00 51.23 H new ATOM 0 HA ASP A 88 -6.526 -17.145 5.565 1.00 24.10 H new ATOM 0 HB2 ASP A 88 -4.283 -18.108 4.927 1.00 51.11 H new ATOM 0 HB3 ASP A 88 -3.561 -16.537 5.216 1.00 51.11 H new ATOM 1461 N GLN A 89 -6.869 -14.898 6.624 1.00 75.24 N ATOM 1462 CA GLN A 89 -7.137 -13.603 7.262 1.00 21.21 C ATOM 1463 C GLN A 89 -6.187 -13.359 8.454 1.00 74.51 C ATOM 1464 O GLN A 89 -5.858 -12.215 8.752 1.00 1.04 O ATOM 1465 CB GLN A 89 -8.624 -13.519 7.712 1.00 5.21 C ATOM 1466 CG GLN A 89 -9.054 -12.158 8.309 1.00 51.24 C ATOM 1467 CD GLN A 89 -8.900 -10.981 7.335 1.00 44.43 C ATOM 1468 OE1 GLN A 89 -7.860 -10.333 7.287 1.00 13.34 O ATOM 1469 NE2 GLN A 89 -9.924 -10.702 6.546 1.00 14.22 N ATOM 0 H GLN A 89 -7.562 -15.614 6.843 1.00 75.24 H new ATOM 0 HA GLN A 89 -6.952 -12.819 6.528 1.00 21.21 H new ATOM 0 HB2 GLN A 89 -9.260 -13.739 6.854 1.00 5.21 H new ATOM 0 HB3 GLN A 89 -8.808 -14.297 8.453 1.00 5.21 H new ATOM 0 HG2 GLN A 89 -10.095 -12.223 8.625 1.00 51.24 H new ATOM 0 HG3 GLN A 89 -8.461 -11.959 9.202 1.00 51.24 H new ATOM 0 HE21 GLN A 89 -10.779 -11.256 6.605 1.00 14.22 H new ATOM 0 HE22 GLN A 89 -9.859 -9.933 5.879 1.00 14.22 H new ATOM 1478 N GLU A 90 -5.730 -14.445 9.111 1.00 32.23 N ATOM 1479 CA GLU A 90 -4.860 -14.356 10.308 1.00 0.43 C ATOM 1480 C GLU A 90 -3.467 -13.790 9.964 1.00 42.22 C ATOM 1481 O GLU A 90 -2.853 -13.110 10.788 1.00 23.03 O ATOM 1482 CB GLU A 90 -4.722 -15.741 10.987 1.00 54.54 C ATOM 1483 CG GLU A 90 -6.042 -16.311 11.540 1.00 44.10 C ATOM 1484 CD GLU A 90 -5.861 -17.677 12.211 1.00 33.40 C ATOM 1485 OE1 GLU A 90 -5.620 -17.730 13.436 1.00 35.34 O ATOM 1486 OE2 GLU A 90 -5.954 -18.710 11.518 1.00 1.24 O ATOM 0 H GLU A 90 -5.950 -15.401 8.832 1.00 32.23 H new ATOM 0 HA GLU A 90 -5.336 -13.666 11.004 1.00 0.43 H new ATOM 0 HB2 GLU A 90 -4.309 -16.446 10.266 1.00 54.54 H new ATOM 0 HB3 GLU A 90 -4.004 -15.662 11.803 1.00 54.54 H new ATOM 0 HG2 GLU A 90 -6.462 -15.610 12.261 1.00 44.10 H new ATOM 0 HG3 GLU A 90 -6.762 -16.403 10.727 1.00 44.10 H new ATOM 1493 N GLU A 91 -2.998 -14.074 8.737 1.00 11.41 N ATOM 1494 CA GLU A 91 -1.723 -13.558 8.208 1.00 4.42 C ATOM 1495 C GLU A 91 -1.772 -12.021 8.120 1.00 25.41 C ATOM 1496 O GLU A 91 -0.834 -11.313 8.515 1.00 51.14 O ATOM 1497 CB GLU A 91 -1.467 -14.169 6.801 1.00 64.11 C ATOM 1498 CG GLU A 91 -0.129 -13.759 6.150 1.00 15.04 C ATOM 1499 CD GLU A 91 1.092 -14.146 7.004 1.00 31.33 C ATOM 1500 OE1 GLU A 91 1.660 -13.271 7.696 1.00 24.15 O ATOM 1501 OE2 GLU A 91 1.468 -15.338 7.013 1.00 52.51 O ATOM 0 H GLU A 91 -3.497 -14.673 8.079 1.00 11.41 H new ATOM 0 HA GLU A 91 -0.910 -13.841 8.877 1.00 4.42 H new ATOM 0 HB2 GLU A 91 -1.498 -15.256 6.881 1.00 64.11 H new ATOM 0 HB3 GLU A 91 -2.282 -13.875 6.139 1.00 64.11 H new ATOM 0 HG2 GLU A 91 -0.047 -14.231 5.171 1.00 15.04 H new ATOM 0 HG3 GLU A 91 -0.125 -12.681 5.986 1.00 15.04 H new ATOM 1508 N LEU A 92 -2.918 -11.542 7.630 1.00 22.02 N ATOM 1509 CA LEU A 92 -3.195 -10.121 7.413 1.00 43.44 C ATOM 1510 C LEU A 92 -3.417 -9.421 8.765 1.00 60.51 C ATOM 1511 O LEU A 92 -2.909 -8.331 9.008 1.00 3.35 O ATOM 1512 CB LEU A 92 -4.461 -9.994 6.526 1.00 64.31 C ATOM 1513 CG LEU A 92 -4.506 -10.912 5.271 1.00 13.05 C ATOM 1514 CD1 LEU A 92 -5.845 -10.756 4.516 1.00 52.10 C ATOM 1515 CD2 LEU A 92 -3.283 -10.667 4.361 1.00 41.11 C ATOM 0 H LEU A 92 -3.697 -12.146 7.367 1.00 22.02 H new ATOM 0 HA LEU A 92 -2.350 -9.646 6.915 1.00 43.44 H new ATOM 0 HB2 LEU A 92 -5.335 -10.209 7.141 1.00 64.31 H new ATOM 0 HB3 LEU A 92 -4.549 -8.958 6.198 1.00 64.31 H new ATOM 0 HG LEU A 92 -4.450 -11.949 5.602 1.00 13.05 H new ATOM 0 HD11 LEU A 92 -5.849 -11.409 3.643 1.00 52.10 H new ATOM 0 HD12 LEU A 92 -6.669 -11.028 5.176 1.00 52.10 H new ATOM 0 HD13 LEU A 92 -5.963 -9.721 4.195 1.00 52.10 H new ATOM 0 HD21 LEU A 92 -3.340 -11.322 3.491 1.00 41.11 H new ATOM 0 HD22 LEU A 92 -3.276 -9.628 4.033 1.00 41.11 H new ATOM 0 HD23 LEU A 92 -2.369 -10.879 4.915 1.00 41.11 H new ATOM 1527 N GLU A 93 -4.161 -10.126 9.636 1.00 11.34 N ATOM 1528 CA GLU A 93 -4.574 -9.672 10.976 1.00 21.44 C ATOM 1529 C GLU A 93 -3.365 -9.541 11.922 1.00 32.41 C ATOM 1530 O GLU A 93 -3.353 -8.678 12.814 1.00 10.21 O ATOM 1531 CB GLU A 93 -5.608 -10.681 11.545 1.00 12.11 C ATOM 1532 CG GLU A 93 -6.073 -10.417 12.989 1.00 44.15 C ATOM 1533 CD GLU A 93 -7.018 -11.505 13.518 1.00 52.20 C ATOM 1534 OE1 GLU A 93 -6.540 -12.631 13.780 1.00 74.13 O ATOM 1535 OE2 GLU A 93 -8.229 -11.241 13.688 1.00 3.02 O ATOM 0 H GLU A 93 -4.504 -11.062 9.418 1.00 11.34 H new ATOM 0 HA GLU A 93 -5.026 -8.683 10.895 1.00 21.44 H new ATOM 0 HB2 GLU A 93 -6.483 -10.682 10.895 1.00 12.11 H new ATOM 0 HB3 GLU A 93 -5.176 -11.681 11.499 1.00 12.11 H new ATOM 0 HG2 GLU A 93 -5.201 -10.351 13.640 1.00 44.15 H new ATOM 0 HG3 GLU A 93 -6.577 -9.452 13.033 1.00 44.15 H new ATOM 1542 N ARG A 94 -2.346 -10.397 11.698 1.00 35.03 N ATOM 1543 CA ARG A 94 -1.116 -10.409 12.506 1.00 11.31 C ATOM 1544 C ARG A 94 -0.360 -9.083 12.325 1.00 64.11 C ATOM 1545 O ARG A 94 -0.041 -8.394 13.302 1.00 32.15 O ATOM 1546 CB ARG A 94 -0.197 -11.601 12.106 1.00 61.30 C ATOM 1547 CG ARG A 94 1.052 -11.767 13.002 1.00 31.13 C ATOM 1548 CD ARG A 94 0.687 -12.075 14.467 1.00 3.12 C ATOM 1549 NE ARG A 94 1.863 -12.148 15.345 1.00 21.10 N ATOM 1550 CZ ARG A 94 1.826 -12.470 16.653 1.00 52.43 C ATOM 1551 NH1 ARG A 94 0.668 -12.762 17.251 1.00 54.40 N ATOM 1552 NH2 ARG A 94 2.941 -12.489 17.361 1.00 54.23 N ATOM 0 H ARG A 94 -2.356 -11.095 10.954 1.00 35.03 H new ATOM 0 HA ARG A 94 -1.395 -10.529 13.553 1.00 11.31 H new ATOM 0 HB2 ARG A 94 -0.780 -12.522 12.140 1.00 61.30 H new ATOM 0 HB3 ARG A 94 0.126 -11.466 11.074 1.00 61.30 H new ATOM 0 HG2 ARG A 94 1.674 -12.571 12.609 1.00 31.13 H new ATOM 0 HG3 ARG A 94 1.648 -10.855 12.963 1.00 31.13 H new ATOM 0 HD2 ARG A 94 0.010 -11.305 14.837 1.00 3.12 H new ATOM 0 HD3 ARG A 94 0.148 -13.021 14.511 1.00 3.12 H new ATOM 0 HE ARG A 94 2.773 -11.940 14.935 1.00 21.10 H new ATOM 0 HH11 ARG A 94 -0.201 -12.743 16.717 1.00 54.40 H new ATOM 0 HH12 ARG A 94 0.652 -13.004 18.242 1.00 54.40 H new ATOM 0 HH21 ARG A 94 3.831 -12.260 16.918 1.00 54.23 H new ATOM 0 HH22 ARG A 94 2.912 -12.733 18.351 1.00 54.23 H new ATOM 1566 N ILE A 95 -0.111 -8.730 11.051 1.00 31.51 N ATOM 1567 CA ILE A 95 0.608 -7.499 10.686 1.00 25.43 C ATOM 1568 C ILE A 95 -0.261 -6.262 11.013 1.00 52.05 C ATOM 1569 O ILE A 95 0.248 -5.242 11.482 1.00 64.41 O ATOM 1570 CB ILE A 95 0.998 -7.499 9.158 1.00 64.22 C ATOM 1571 CG1 ILE A 95 1.587 -8.883 8.714 1.00 52.41 C ATOM 1572 CG2 ILE A 95 1.982 -6.350 8.831 1.00 50.32 C ATOM 1573 CD1 ILE A 95 2.817 -9.354 9.481 1.00 52.01 C ATOM 0 H ILE A 95 -0.402 -9.289 10.249 1.00 31.51 H new ATOM 0 HA ILE A 95 1.528 -7.457 11.269 1.00 25.43 H new ATOM 0 HB ILE A 95 0.083 -7.331 8.590 1.00 64.22 H new ATOM 0 HG12 ILE A 95 0.807 -9.638 8.815 1.00 52.41 H new ATOM 0 HG13 ILE A 95 1.841 -8.826 7.656 1.00 52.41 H new ATOM 0 HG21 ILE A 95 2.232 -6.376 7.770 1.00 50.32 H new ATOM 0 HG22 ILE A 95 1.517 -5.394 9.071 1.00 50.32 H new ATOM 0 HG23 ILE A 95 2.890 -6.470 9.421 1.00 50.32 H new ATOM 0 HD11 ILE A 95 3.140 -10.320 9.093 1.00 52.01 H new ATOM 0 HD12 ILE A 95 3.621 -8.628 9.361 1.00 52.01 H new ATOM 0 HD13 ILE A 95 2.571 -9.452 10.538 1.00 52.01 H new ATOM 1585 N TYR A 96 -1.583 -6.410 10.778 1.00 52.23 N ATOM 1586 CA TYR A 96 -2.620 -5.386 11.057 1.00 11.22 C ATOM 1587 C TYR A 96 -2.526 -4.869 12.498 1.00 23.34 C ATOM 1588 O TYR A 96 -2.518 -3.657 12.724 1.00 41.45 O ATOM 1589 CB TYR A 96 -4.020 -6.023 10.810 1.00 2.32 C ATOM 1590 CG TYR A 96 -5.267 -5.145 11.050 1.00 30.31 C ATOM 1591 CD1 TYR A 96 -5.966 -4.585 9.984 1.00 54.41 C ATOM 1592 CD2 TYR A 96 -5.774 -4.922 12.337 1.00 74.30 C ATOM 1593 CE1 TYR A 96 -7.111 -3.835 10.183 1.00 62.45 C ATOM 1594 CE2 TYR A 96 -6.917 -4.165 12.540 1.00 32.00 C ATOM 1595 CZ TYR A 96 -7.581 -3.625 11.460 1.00 3.22 C ATOM 1596 OH TYR A 96 -8.717 -2.867 11.656 1.00 41.23 O ATOM 0 H TYR A 96 -1.971 -7.265 10.379 1.00 52.23 H new ATOM 0 HA TYR A 96 -2.465 -4.534 10.394 1.00 11.22 H new ATOM 0 HB2 TYR A 96 -4.051 -6.372 9.778 1.00 2.32 H new ATOM 0 HB3 TYR A 96 -4.104 -6.903 11.447 1.00 2.32 H new ATOM 0 HD1 TYR A 96 -5.606 -4.740 8.978 1.00 54.41 H new ATOM 0 HD2 TYR A 96 -5.264 -5.349 13.188 1.00 74.30 H new ATOM 0 HE1 TYR A 96 -7.636 -3.415 9.338 1.00 62.45 H new ATOM 0 HE2 TYR A 96 -7.286 -3.999 13.541 1.00 32.00 H new ATOM 0 HH TYR A 96 -8.915 -2.816 12.614 1.00 41.23 H new ATOM 1606 N GLU A 97 -2.459 -5.824 13.450 1.00 54.44 N ATOM 1607 CA GLU A 97 -2.441 -5.542 14.895 1.00 72.21 C ATOM 1608 C GLU A 97 -1.218 -4.692 15.280 1.00 33.00 C ATOM 1609 O GLU A 97 -1.339 -3.722 16.036 1.00 3.15 O ATOM 1610 CB GLU A 97 -2.424 -6.866 15.700 1.00 45.22 C ATOM 1611 CG GLU A 97 -2.492 -6.680 17.231 1.00 52.33 C ATOM 1612 CD GLU A 97 -2.255 -7.978 18.010 1.00 72.41 C ATOM 1613 OE1 GLU A 97 -3.084 -8.905 17.904 1.00 51.42 O ATOM 1614 OE2 GLU A 97 -1.241 -8.080 18.736 1.00 3.41 O ATOM 0 H GLU A 97 -2.416 -6.819 13.232 1.00 54.44 H new ATOM 0 HA GLU A 97 -3.344 -4.981 15.136 1.00 72.21 H new ATOM 0 HB2 GLU A 97 -3.266 -7.481 15.383 1.00 45.22 H new ATOM 0 HB3 GLU A 97 -1.516 -7.416 15.453 1.00 45.22 H new ATOM 0 HG2 GLU A 97 -1.749 -5.942 17.534 1.00 52.33 H new ATOM 0 HG3 GLU A 97 -3.469 -6.277 17.498 1.00 52.33 H new ATOM 1621 N GLN A 98 -0.052 -5.068 14.720 1.00 15.04 N ATOM 1622 CA GLN A 98 1.231 -4.389 14.988 1.00 1.12 C ATOM 1623 C GLN A 98 1.219 -2.941 14.467 1.00 32.33 C ATOM 1624 O GLN A 98 1.639 -2.020 15.167 1.00 35.13 O ATOM 1625 CB GLN A 98 2.410 -5.183 14.352 1.00 51.43 C ATOM 1626 CG GLN A 98 3.797 -4.522 14.535 1.00 75.35 C ATOM 1627 CD GLN A 98 4.153 -4.249 16.004 1.00 14.10 C ATOM 1628 OE1 GLN A 98 3.779 -4.998 16.905 1.00 23.23 O ATOM 1629 NE2 GLN A 98 4.824 -3.141 16.266 1.00 22.01 N ATOM 0 H GLN A 98 0.027 -5.850 14.070 1.00 15.04 H new ATOM 0 HA GLN A 98 1.370 -4.355 16.069 1.00 1.12 H new ATOM 0 HB2 GLN A 98 2.437 -6.182 14.788 1.00 51.43 H new ATOM 0 HB3 GLN A 98 2.217 -5.305 13.286 1.00 51.43 H new ATOM 0 HG2 GLN A 98 4.559 -5.167 14.098 1.00 75.35 H new ATOM 0 HG3 GLN A 98 3.819 -3.583 13.983 1.00 75.35 H new ATOM 0 HE21 GLN A 98 5.125 -2.534 15.503 1.00 22.01 H new ATOM 0 HE22 GLN A 98 5.041 -2.893 17.231 1.00 22.01 H new ATOM 1638 N LEU A 99 0.717 -2.758 13.244 1.00 0.22 N ATOM 1639 CA LEU A 99 0.587 -1.434 12.625 1.00 35.54 C ATOM 1640 C LEU A 99 -0.493 -0.597 13.349 1.00 51.41 C ATOM 1641 O LEU A 99 -0.424 0.631 13.387 1.00 75.11 O ATOM 1642 CB LEU A 99 0.241 -1.603 11.133 1.00 32.33 C ATOM 1643 CG LEU A 99 1.257 -2.422 10.278 1.00 64.11 C ATOM 1644 CD1 LEU A 99 0.752 -2.609 8.834 1.00 42.51 C ATOM 1645 CD2 LEU A 99 2.660 -1.791 10.302 1.00 4.43 C ATOM 0 H LEU A 99 0.389 -3.522 12.654 1.00 0.22 H new ATOM 0 HA LEU A 99 1.533 -0.900 12.714 1.00 35.54 H new ATOM 0 HB2 LEU A 99 -0.734 -2.084 11.060 1.00 32.33 H new ATOM 0 HB3 LEU A 99 0.141 -0.612 10.690 1.00 32.33 H new ATOM 0 HG LEU A 99 1.338 -3.410 10.731 1.00 64.11 H new ATOM 0 HD11 LEU A 99 1.483 -3.183 8.265 1.00 42.51 H new ATOM 0 HD12 LEU A 99 -0.199 -3.142 8.847 1.00 42.51 H new ATOM 0 HD13 LEU A 99 0.614 -1.634 8.368 1.00 42.51 H new ATOM 0 HD21 LEU A 99 3.339 -2.390 9.695 1.00 4.43 H new ATOM 0 HD22 LEU A 99 2.611 -0.779 9.900 1.00 4.43 H new ATOM 0 HD23 LEU A 99 3.026 -1.756 11.328 1.00 4.43 H new ATOM 1657 N LYS A 100 -1.477 -1.290 13.946 1.00 64.32 N ATOM 1658 CA LYS A 100 -2.543 -0.658 14.738 1.00 32.34 C ATOM 1659 C LYS A 100 -1.926 -0.083 16.039 1.00 5.11 C ATOM 1660 O LYS A 100 -2.334 0.983 16.508 1.00 13.11 O ATOM 1661 CB LYS A 100 -3.699 -1.688 15.000 1.00 53.51 C ATOM 1662 CG LYS A 100 -5.079 -1.095 15.409 1.00 12.15 C ATOM 1663 CD LYS A 100 -5.153 -0.652 16.888 1.00 74.20 C ATOM 1664 CE LYS A 100 -6.534 -0.108 17.281 1.00 63.41 C ATOM 1665 NZ LYS A 100 -6.588 0.271 18.721 1.00 64.24 N ATOM 0 H LYS A 100 -1.555 -2.306 13.892 1.00 64.32 H new ATOM 0 HA LYS A 100 -2.992 0.173 14.195 1.00 32.34 H new ATOM 0 HB2 LYS A 100 -3.837 -2.282 14.097 1.00 53.51 H new ATOM 0 HB3 LYS A 100 -3.375 -2.372 15.785 1.00 53.51 H new ATOM 0 HG2 LYS A 100 -5.300 -0.239 14.771 1.00 12.15 H new ATOM 0 HG3 LYS A 100 -5.853 -1.839 15.223 1.00 12.15 H new ATOM 0 HD2 LYS A 100 -4.906 -1.499 17.528 1.00 74.20 H new ATOM 0 HD3 LYS A 100 -4.401 0.115 17.070 1.00 74.20 H new ATOM 0 HE2 LYS A 100 -6.771 0.761 16.667 1.00 63.41 H new ATOM 0 HE3 LYS A 100 -7.294 -0.861 17.074 1.00 63.41 H new ATOM 0 HZ1 LYS A 100 -7.536 0.634 18.949 1.00 64.24 H new ATOM 0 HZ2 LYS A 100 -6.386 -0.564 19.308 1.00 64.24 H new ATOM 0 HZ3 LYS A 100 -5.880 1.008 18.913 1.00 64.24 H new ATOM 1679 N LYS A 101 -0.902 -0.788 16.570 1.00 34.31 N ATOM 1680 CA LYS A 101 -0.086 -0.317 17.714 1.00 31.25 C ATOM 1681 C LYS A 101 0.669 0.985 17.349 1.00 71.25 C ATOM 1682 O LYS A 101 0.800 1.896 18.177 1.00 15.04 O ATOM 1683 CB LYS A 101 0.947 -1.402 18.142 1.00 74.21 C ATOM 1684 CG LYS A 101 0.364 -2.759 18.597 1.00 10.44 C ATOM 1685 CD LYS A 101 -0.393 -2.680 19.940 1.00 51.25 C ATOM 1686 CE LYS A 101 -0.676 -4.069 20.543 1.00 3.52 C ATOM 1687 NZ LYS A 101 0.581 -4.835 20.783 1.00 41.13 N ATOM 0 H LYS A 101 -0.617 -1.702 16.217 1.00 34.31 H new ATOM 0 HA LYS A 101 -0.765 -0.121 18.544 1.00 31.25 H new ATOM 0 HB2 LYS A 101 1.621 -1.582 17.304 1.00 74.21 H new ATOM 0 HB3 LYS A 101 1.550 -0.999 18.955 1.00 74.21 H new ATOM 0 HG2 LYS A 101 -0.313 -3.132 17.828 1.00 10.44 H new ATOM 0 HG3 LYS A 101 1.174 -3.483 18.687 1.00 10.44 H new ATOM 0 HD2 LYS A 101 0.191 -2.093 20.648 1.00 51.25 H new ATOM 0 HD3 LYS A 101 -1.336 -2.154 19.791 1.00 51.25 H new ATOM 0 HE2 LYS A 101 -1.217 -3.954 21.482 1.00 3.52 H new ATOM 0 HE3 LYS A 101 -1.322 -4.633 19.870 1.00 3.52 H new ATOM 0 HZ1 LYS A 101 0.559 -5.248 21.737 1.00 41.13 H new ATOM 0 HZ2 LYS A 101 0.664 -5.596 20.079 1.00 41.13 H new ATOM 0 HZ3 LYS A 101 1.398 -4.196 20.701 1.00 41.13 H new ATOM 1701 N ASP A 102 1.162 1.045 16.093 1.00 42.32 N ATOM 1702 CA ASP A 102 1.899 2.214 15.553 1.00 51.01 C ATOM 1703 C ASP A 102 0.942 3.299 15.006 1.00 72.13 C ATOM 1704 O ASP A 102 1.403 4.353 14.551 1.00 71.04 O ATOM 1705 CB ASP A 102 2.899 1.761 14.449 1.00 0.21 C ATOM 1706 CG ASP A 102 4.000 0.825 14.981 1.00 63.20 C ATOM 1707 OD1 ASP A 102 3.994 -0.383 14.660 1.00 21.52 O ATOM 1708 OD2 ASP A 102 4.868 1.296 15.756 1.00 41.12 O ATOM 0 H ASP A 102 1.061 0.284 15.422 1.00 42.32 H new ATOM 0 HA ASP A 102 2.457 2.659 16.377 1.00 51.01 H new ATOM 0 HB2 ASP A 102 2.350 1.253 13.656 1.00 0.21 H new ATOM 0 HB3 ASP A 102 3.362 2.641 14.003 1.00 0.21 H new ATOM 1713 N GLY A 103 -0.378 3.023 15.045 1.00 1.32 N ATOM 1714 CA GLY A 103 -1.405 3.991 14.647 1.00 70.44 C ATOM 1715 C GLY A 103 -1.414 4.268 13.147 1.00 21.00 C ATOM 1716 O GLY A 103 -1.306 5.419 12.716 1.00 71.31 O ATOM 0 H GLY A 103 -0.754 2.126 15.352 1.00 1.32 H new ATOM 0 HA2 GLY A 103 -2.384 3.618 14.948 1.00 70.44 H new ATOM 0 HA3 GLY A 103 -1.242 4.926 15.183 1.00 70.44 H new ATOM 1720 N VAL A 104 -1.508 3.198 12.353 1.00 74.45 N ATOM 1721 CA VAL A 104 -1.512 3.273 10.874 1.00 32.23 C ATOM 1722 C VAL A 104 -2.923 2.993 10.335 1.00 23.31 C ATOM 1723 O VAL A 104 -3.718 2.319 10.999 1.00 25.30 O ATOM 1724 CB VAL A 104 -0.509 2.226 10.255 1.00 12.02 C ATOM 1725 CG1 VAL A 104 -0.312 2.452 8.739 1.00 25.43 C ATOM 1726 CG2 VAL A 104 0.842 2.241 11.004 1.00 74.31 C ATOM 0 H VAL A 104 -1.584 2.246 12.712 1.00 74.45 H new ATOM 0 HA VAL A 104 -1.199 4.277 10.588 1.00 32.23 H new ATOM 0 HB VAL A 104 -0.950 1.237 10.380 1.00 12.02 H new ATOM 0 HG11 VAL A 104 0.386 1.711 8.348 1.00 25.43 H new ATOM 0 HG12 VAL A 104 -1.270 2.353 8.229 1.00 25.43 H new ATOM 0 HG13 VAL A 104 0.087 3.452 8.569 1.00 25.43 H new ATOM 0 HG21 VAL A 104 1.514 1.509 10.556 1.00 74.31 H new ATOM 0 HG22 VAL A 104 1.286 3.234 10.933 1.00 74.31 H new ATOM 0 HG23 VAL A 104 0.680 1.990 12.052 1.00 74.31 H new ATOM 1736 N ASP A 105 -3.237 3.507 9.128 1.00 44.14 N ATOM 1737 CA ASP A 105 -4.437 3.087 8.399 1.00 60.12 C ATOM 1738 C ASP A 105 -4.201 1.654 7.909 1.00 32.41 C ATOM 1739 O ASP A 105 -3.286 1.412 7.120 1.00 52.41 O ATOM 1740 CB ASP A 105 -4.734 4.002 7.194 1.00 64.23 C ATOM 1741 CG ASP A 105 -6.036 3.609 6.467 1.00 1.31 C ATOM 1742 OD1 ASP A 105 -5.986 2.839 5.481 1.00 60.31 O ATOM 1743 OD2 ASP A 105 -7.121 4.057 6.891 1.00 71.01 O ATOM 0 H ASP A 105 -2.676 4.209 8.645 1.00 44.14 H new ATOM 0 HA ASP A 105 -5.298 3.148 9.065 1.00 60.12 H new ATOM 0 HB2 ASP A 105 -4.808 5.035 7.535 1.00 64.23 H new ATOM 0 HB3 ASP A 105 -3.901 3.957 6.492 1.00 64.23 H new ATOM 1748 N VAL A 106 -4.991 0.718 8.422 1.00 30.52 N ATOM 1749 CA VAL A 106 -4.877 -0.705 8.090 1.00 72.10 C ATOM 1750 C VAL A 106 -6.256 -1.282 7.763 1.00 41.30 C ATOM 1751 O VAL A 106 -7.216 -1.105 8.519 1.00 21.31 O ATOM 1752 CB VAL A 106 -4.177 -1.517 9.251 1.00 62.35 C ATOM 1753 CG1 VAL A 106 -2.652 -1.340 9.202 1.00 64.04 C ATOM 1754 CG2 VAL A 106 -4.725 -1.117 10.651 1.00 54.14 C ATOM 0 H VAL A 106 -5.737 0.923 9.087 1.00 30.52 H new ATOM 0 HA VAL A 106 -4.244 -0.799 7.208 1.00 72.10 H new ATOM 0 HB VAL A 106 -4.412 -2.570 9.093 1.00 62.35 H new ATOM 0 HG11 VAL A 106 -2.194 -1.909 10.011 1.00 64.04 H new ATOM 0 HG12 VAL A 106 -2.274 -1.701 8.245 1.00 64.04 H new ATOM 0 HG13 VAL A 106 -2.404 -0.284 9.315 1.00 64.04 H new ATOM 0 HG21 VAL A 106 -4.217 -1.699 11.420 1.00 54.14 H new ATOM 0 HG22 VAL A 106 -4.547 -0.055 10.822 1.00 54.14 H new ATOM 0 HG23 VAL A 106 -5.796 -1.316 10.693 1.00 54.14 H new ATOM 1764 N ARG A 107 -6.330 -1.957 6.615 1.00 31.31 N ATOM 1765 CA ARG A 107 -7.553 -2.564 6.091 1.00 12.31 C ATOM 1766 C ARG A 107 -7.194 -3.924 5.489 1.00 64.42 C ATOM 1767 O ARG A 107 -6.296 -4.033 4.636 1.00 0.03 O ATOM 1768 CB ARG A 107 -8.214 -1.613 5.054 1.00 74.12 C ATOM 1769 CG ARG A 107 -7.296 -1.170 3.886 1.00 71.03 C ATOM 1770 CD ARG A 107 -7.869 0.008 3.094 1.00 64.53 C ATOM 1771 NE ARG A 107 -7.984 1.210 3.935 1.00 41.41 N ATOM 1772 CZ ARG A 107 -9.005 2.072 3.923 1.00 33.33 C ATOM 1773 NH1 ARG A 107 -10.035 1.887 3.102 1.00 75.41 N ATOM 1774 NH2 ARG A 107 -8.977 3.121 4.727 1.00 75.21 N ATOM 0 H ARG A 107 -5.521 -2.100 6.010 1.00 31.31 H new ATOM 0 HA ARG A 107 -8.283 -2.720 6.885 1.00 12.31 H new ATOM 0 HB2 ARG A 107 -9.091 -2.109 4.638 1.00 74.12 H new ATOM 0 HB3 ARG A 107 -8.568 -0.723 5.575 1.00 74.12 H new ATOM 0 HG2 ARG A 107 -6.319 -0.894 4.283 1.00 71.03 H new ATOM 0 HG3 ARG A 107 -7.140 -2.013 3.213 1.00 71.03 H new ATOM 0 HD2 ARG A 107 -7.228 0.220 2.238 1.00 64.53 H new ATOM 0 HD3 ARG A 107 -8.850 -0.258 2.700 1.00 64.53 H new ATOM 0 HE ARG A 107 -7.219 1.402 4.582 1.00 41.41 H new ATOM 0 HH11 ARG A 107 -10.050 1.082 2.475 1.00 75.41 H new ATOM 0 HH12 ARG A 107 -10.810 2.550 3.099 1.00 75.41 H new ATOM 0 HH21 ARG A 107 -8.181 3.266 5.348 1.00 75.21 H new ATOM 0 HH22 ARG A 107 -9.751 3.785 4.726 1.00 75.21 H new ATOM 1788 N VAL A 108 -7.871 -4.968 5.974 1.00 62.02 N ATOM 1789 CA VAL A 108 -7.603 -6.357 5.592 1.00 14.22 C ATOM 1790 C VAL A 108 -8.903 -7.042 5.148 1.00 63.24 C ATOM 1791 O VAL A 108 -9.972 -6.820 5.738 1.00 31.03 O ATOM 1792 CB VAL A 108 -6.929 -7.151 6.774 1.00 71.55 C ATOM 1793 CG1 VAL A 108 -5.525 -6.586 7.075 1.00 71.34 C ATOM 1794 CG2 VAL A 108 -7.809 -7.162 8.051 1.00 12.34 C ATOM 0 H VAL A 108 -8.629 -4.872 6.650 1.00 62.02 H new ATOM 0 HA VAL A 108 -6.905 -6.354 4.755 1.00 14.22 H new ATOM 0 HB VAL A 108 -6.826 -8.187 6.452 1.00 71.55 H new ATOM 0 HG11 VAL A 108 -5.075 -7.147 7.894 1.00 71.34 H new ATOM 0 HG12 VAL A 108 -4.899 -6.675 6.187 1.00 71.34 H new ATOM 0 HG13 VAL A 108 -5.608 -5.536 7.357 1.00 71.34 H new ATOM 0 HG21 VAL A 108 -7.302 -7.721 8.837 1.00 12.34 H new ATOM 0 HG22 VAL A 108 -7.978 -6.138 8.385 1.00 12.34 H new ATOM 0 HG23 VAL A 108 -8.766 -7.634 7.829 1.00 12.34 H new ATOM 1804 N THR A 109 -8.803 -7.847 4.081 1.00 3.12 N ATOM 1805 CA THR A 109 -9.924 -8.630 3.556 1.00 55.35 C ATOM 1806 C THR A 109 -9.370 -9.910 2.905 1.00 42.25 C ATOM 1807 O THR A 109 -8.428 -9.849 2.095 1.00 5.22 O ATOM 1808 CB THR A 109 -10.800 -7.797 2.546 1.00 55.14 C ATOM 1809 OG1 THR A 109 -11.922 -8.574 2.099 1.00 40.20 O ATOM 1810 CG2 THR A 109 -10.008 -7.291 1.322 1.00 41.33 C ATOM 0 H THR A 109 -7.937 -7.972 3.557 1.00 3.12 H new ATOM 0 HA THR A 109 -10.587 -8.900 4.378 1.00 55.35 H new ATOM 0 HB THR A 109 -11.141 -6.919 3.094 1.00 55.14 H new ATOM 0 HG1 THR A 109 -12.754 -8.119 2.345 1.00 40.20 H new ATOM 0 HG21 THR A 109 -10.671 -6.725 0.668 1.00 41.33 H new ATOM 0 HG22 THR A 109 -9.193 -6.648 1.656 1.00 41.33 H new ATOM 0 HG23 THR A 109 -9.599 -8.141 0.776 1.00 41.33 H new ATOM 1818 N ASP A 110 -9.916 -11.071 3.298 1.00 42.12 N ATOM 1819 CA ASP A 110 -9.497 -12.357 2.730 1.00 51.24 C ATOM 1820 C ASP A 110 -10.378 -12.694 1.507 1.00 14.21 C ATOM 1821 O ASP A 110 -11.383 -13.409 1.614 1.00 31.34 O ATOM 1822 CB ASP A 110 -9.517 -13.475 3.833 1.00 40.43 C ATOM 1823 CG ASP A 110 -10.890 -13.710 4.503 1.00 51.31 C ATOM 1824 OD1 ASP A 110 -11.434 -12.771 5.125 1.00 63.04 O ATOM 1825 OD2 ASP A 110 -11.422 -14.837 4.418 1.00 11.33 O ATOM 0 H ASP A 110 -10.647 -11.143 4.006 1.00 42.12 H new ATOM 0 HA ASP A 110 -8.468 -12.294 2.377 1.00 51.24 H new ATOM 0 HB2 ASP A 110 -9.183 -14.411 3.386 1.00 40.43 H new ATOM 0 HB3 ASP A 110 -8.793 -13.215 4.605 1.00 40.43 H new ATOM 1830 N ASN A 111 -9.968 -12.105 0.356 1.00 45.24 N ATOM 1831 CA ASN A 111 -10.565 -12.278 -0.997 1.00 34.34 C ATOM 1832 C ASN A 111 -10.112 -11.100 -1.888 1.00 45.25 C ATOM 1833 O ASN A 111 -9.749 -10.030 -1.381 1.00 12.32 O ATOM 1834 CB ASN A 111 -12.131 -12.366 -1.016 1.00 3.44 C ATOM 1835 CG ASN A 111 -12.850 -11.078 -0.611 1.00 72.32 C ATOM 1836 OD1 ASN A 111 -13.235 -10.280 -1.454 1.00 21.13 O ATOM 1837 ND2 ASN A 111 -13.006 -10.853 0.686 1.00 73.01 N ATOM 0 H ASN A 111 -9.174 -11.465 0.343 1.00 45.24 H new ATOM 0 HA ASN A 111 -10.210 -13.238 -1.370 1.00 34.34 H new ATOM 0 HB2 ASN A 111 -12.453 -12.645 -2.019 1.00 3.44 H new ATOM 0 HB3 ASN A 111 -12.444 -13.167 -0.346 1.00 3.44 H new ATOM 0 HD21 ASN A 111 -13.458 -9.996 1.004 1.00 73.01 H new ATOM 0 HD22 ASN A 111 -12.675 -11.537 1.366 1.00 73.01 H new ATOM 1844 N GLU A 112 -10.165 -11.308 -3.212 1.00 52.21 N ATOM 1845 CA GLU A 112 -9.696 -10.329 -4.216 1.00 54.42 C ATOM 1846 C GLU A 112 -10.791 -9.295 -4.579 1.00 33.53 C ATOM 1847 O GLU A 112 -10.465 -8.151 -4.918 1.00 33.14 O ATOM 1848 CB GLU A 112 -9.220 -11.072 -5.485 1.00 62.43 C ATOM 1849 CG GLU A 112 -8.731 -10.161 -6.629 1.00 22.34 C ATOM 1850 CD GLU A 112 -8.350 -10.953 -7.878 1.00 70.10 C ATOM 1851 OE1 GLU A 112 -7.176 -11.317 -8.023 1.00 33.33 O ATOM 1852 OE2 GLU A 112 -9.240 -11.248 -8.703 1.00 61.53 O ATOM 0 H GLU A 112 -10.536 -12.164 -3.623 1.00 52.21 H new ATOM 0 HA GLU A 112 -8.864 -9.777 -3.779 1.00 54.42 H new ATOM 0 HB2 GLU A 112 -8.412 -11.749 -5.209 1.00 62.43 H new ATOM 0 HB3 GLU A 112 -10.039 -11.688 -5.856 1.00 62.43 H new ATOM 0 HG2 GLU A 112 -9.514 -9.445 -6.880 1.00 22.34 H new ATOM 0 HG3 GLU A 112 -7.870 -9.586 -6.289 1.00 22.34 H new ATOM 1859 N ASP A 113 -12.082 -9.698 -4.492 1.00 2.02 N ATOM 1860 CA ASP A 113 -13.221 -8.831 -4.888 1.00 53.30 C ATOM 1861 C ASP A 113 -13.216 -7.518 -4.079 1.00 54.02 C ATOM 1862 O ASP A 113 -13.025 -6.437 -4.643 1.00 44.24 O ATOM 1863 CB ASP A 113 -14.577 -9.568 -4.708 1.00 53.34 C ATOM 1864 CG ASP A 113 -15.796 -8.677 -5.051 1.00 0.22 C ATOM 1865 OD1 ASP A 113 -16.095 -8.491 -6.254 1.00 23.41 O ATOM 1866 OD2 ASP A 113 -16.454 -8.144 -4.133 1.00 71.13 O ATOM 0 H ASP A 113 -12.362 -10.618 -4.151 1.00 2.02 H new ATOM 0 HA ASP A 113 -13.102 -8.590 -5.944 1.00 53.30 H new ATOM 0 HB2 ASP A 113 -14.591 -10.454 -5.343 1.00 53.34 H new ATOM 0 HB3 ASP A 113 -14.664 -9.913 -3.678 1.00 53.34 H new ATOM 1871 N GLU A 114 -13.369 -7.656 -2.747 1.00 11.00 N ATOM 1872 CA GLU A 114 -13.406 -6.528 -1.799 1.00 61.13 C ATOM 1873 C GLU A 114 -12.087 -5.734 -1.841 1.00 53.33 C ATOM 1874 O GLU A 114 -12.083 -4.518 -1.641 1.00 40.42 O ATOM 1875 CB GLU A 114 -13.680 -7.051 -0.361 1.00 25.54 C ATOM 1876 CG GLU A 114 -13.899 -5.953 0.707 1.00 10.52 C ATOM 1877 CD GLU A 114 -15.148 -5.089 0.456 1.00 12.23 C ATOM 1878 OE1 GLU A 114 -16.273 -5.610 0.604 1.00 54.24 O ATOM 1879 OE2 GLU A 114 -15.013 -3.891 0.129 1.00 1.12 O ATOM 0 H GLU A 114 -13.471 -8.565 -2.295 1.00 11.00 H new ATOM 0 HA GLU A 114 -14.214 -5.857 -2.091 1.00 61.13 H new ATOM 0 HB2 GLU A 114 -14.561 -7.692 -0.386 1.00 25.54 H new ATOM 0 HB3 GLU A 114 -12.841 -7.674 -0.052 1.00 25.54 H new ATOM 0 HG2 GLU A 114 -13.984 -6.423 1.687 1.00 10.52 H new ATOM 0 HG3 GLU A 114 -13.021 -5.308 0.738 1.00 10.52 H new ATOM 1886 N ALA A 115 -10.978 -6.442 -2.131 1.00 11.12 N ATOM 1887 CA ALA A 115 -9.642 -5.841 -2.274 1.00 62.13 C ATOM 1888 C ALA A 115 -9.618 -4.758 -3.362 1.00 61.12 C ATOM 1889 O ALA A 115 -9.054 -3.681 -3.158 1.00 14.40 O ATOM 1890 CB ALA A 115 -8.616 -6.923 -2.601 1.00 45.43 C ATOM 0 H ALA A 115 -10.986 -7.452 -2.273 1.00 11.12 H new ATOM 0 HA ALA A 115 -9.389 -5.368 -1.325 1.00 62.13 H new ATOM 0 HB1 ALA A 115 -7.630 -6.470 -2.705 1.00 45.43 H new ATOM 0 HB2 ALA A 115 -8.594 -7.659 -1.797 1.00 45.43 H new ATOM 0 HB3 ALA A 115 -8.890 -7.414 -3.535 1.00 45.43 H new ATOM 1896 N LYS A 116 -10.250 -5.070 -4.511 1.00 3.11 N ATOM 1897 CA LYS A 116 -10.324 -4.163 -5.676 1.00 72.15 C ATOM 1898 C LYS A 116 -11.191 -2.926 -5.374 1.00 33.23 C ATOM 1899 O LYS A 116 -10.909 -1.828 -5.870 1.00 31.51 O ATOM 1900 CB LYS A 116 -10.867 -4.919 -6.923 1.00 21.22 C ATOM 1901 CG LYS A 116 -9.983 -6.100 -7.393 1.00 62.11 C ATOM 1902 CD LYS A 116 -10.478 -6.788 -8.697 1.00 30.31 C ATOM 1903 CE LYS A 116 -10.276 -5.932 -9.970 1.00 11.12 C ATOM 1904 NZ LYS A 116 -11.232 -4.788 -10.079 1.00 31.31 N ATOM 0 H LYS A 116 -10.725 -5.960 -4.658 1.00 3.11 H new ATOM 0 HA LYS A 116 -9.313 -3.815 -5.890 1.00 72.15 H new ATOM 0 HB2 LYS A 116 -11.865 -5.296 -6.698 1.00 21.22 H new ATOM 0 HB3 LYS A 116 -10.972 -4.210 -7.745 1.00 21.22 H new ATOM 0 HG2 LYS A 116 -8.967 -5.738 -7.550 1.00 62.11 H new ATOM 0 HG3 LYS A 116 -9.938 -6.844 -6.598 1.00 62.11 H new ATOM 0 HD2 LYS A 116 -9.952 -7.735 -8.820 1.00 30.31 H new ATOM 0 HD3 LYS A 116 -11.537 -7.023 -8.593 1.00 30.31 H new ATOM 0 HE2 LYS A 116 -9.257 -5.545 -9.980 1.00 11.12 H new ATOM 0 HE3 LYS A 116 -10.384 -6.570 -10.847 1.00 11.12 H new ATOM 0 HZ1 LYS A 116 -11.543 -4.688 -11.066 1.00 31.31 H new ATOM 0 HZ2 LYS A 116 -12.058 -4.967 -9.473 1.00 31.31 H new ATOM 0 HZ3 LYS A 116 -10.761 -3.912 -9.774 1.00 31.31 H new ATOM 1918 N LYS A 117 -12.236 -3.122 -4.547 1.00 30.43 N ATOM 1919 CA LYS A 117 -13.126 -2.032 -4.095 1.00 23.20 C ATOM 1920 C LYS A 117 -12.353 -1.068 -3.175 1.00 2.51 C ATOM 1921 O LYS A 117 -12.436 0.151 -3.343 1.00 0.34 O ATOM 1922 CB LYS A 117 -14.388 -2.594 -3.358 1.00 24.22 C ATOM 1923 CG LYS A 117 -15.532 -3.099 -4.274 1.00 25.13 C ATOM 1924 CD LYS A 117 -15.121 -4.260 -5.202 1.00 10.15 C ATOM 1925 CE LYS A 117 -16.291 -4.824 -6.017 1.00 1.52 C ATOM 1926 NZ LYS A 117 -17.308 -5.477 -5.153 1.00 15.13 N ATOM 0 H LYS A 117 -12.488 -4.037 -4.174 1.00 30.43 H new ATOM 0 HA LYS A 117 -13.470 -1.489 -4.975 1.00 23.20 H new ATOM 0 HB2 LYS A 117 -14.074 -3.415 -2.714 1.00 24.22 H new ATOM 0 HB3 LYS A 117 -14.785 -1.813 -2.709 1.00 24.22 H new ATOM 0 HG2 LYS A 117 -16.367 -3.422 -3.652 1.00 25.13 H new ATOM 0 HG3 LYS A 117 -15.890 -2.269 -4.883 1.00 25.13 H new ATOM 0 HD2 LYS A 117 -14.345 -3.914 -5.884 1.00 10.15 H new ATOM 0 HD3 LYS A 117 -14.685 -5.059 -4.602 1.00 10.15 H new ATOM 0 HE2 LYS A 117 -16.759 -4.019 -6.583 1.00 1.52 H new ATOM 0 HE3 LYS A 117 -15.914 -5.546 -6.741 1.00 1.52 H new ATOM 0 HZ1 LYS A 117 -18.105 -5.799 -5.738 1.00 15.13 H new ATOM 0 HZ2 LYS A 117 -16.881 -6.293 -4.670 1.00 15.13 H new ATOM 0 HZ3 LYS A 117 -17.651 -4.796 -4.445 1.00 15.13 H new ATOM 1940 N ARG A 118 -11.593 -1.639 -2.216 1.00 12.13 N ATOM 1941 CA ARG A 118 -10.815 -0.867 -1.221 1.00 53.33 C ATOM 1942 C ARG A 118 -9.599 -0.190 -1.872 1.00 24.11 C ATOM 1943 O ARG A 118 -9.147 0.861 -1.411 1.00 3.30 O ATOM 1944 CB ARG A 118 -10.373 -1.787 -0.044 1.00 44.31 C ATOM 1945 CG ARG A 118 -11.550 -2.421 0.732 1.00 11.22 C ATOM 1946 CD ARG A 118 -12.483 -1.376 1.373 1.00 74.22 C ATOM 1947 NE ARG A 118 -13.678 -1.987 1.973 1.00 72.30 N ATOM 1948 CZ ARG A 118 -14.654 -1.315 2.608 1.00 20.12 C ATOM 1949 NH1 ARG A 118 -14.610 0.011 2.741 1.00 2.30 N ATOM 1950 NH2 ARG A 118 -15.679 -1.977 3.105 1.00 62.33 N ATOM 0 H ARG A 118 -11.501 -2.649 -2.109 1.00 12.13 H new ATOM 0 HA ARG A 118 -11.458 -0.082 -0.823 1.00 53.33 H new ATOM 0 HB2 ARG A 118 -9.739 -2.582 -0.436 1.00 44.31 H new ATOM 0 HB3 ARG A 118 -9.764 -1.206 0.649 1.00 44.31 H new ATOM 0 HG2 ARG A 118 -12.128 -3.049 0.054 1.00 11.22 H new ATOM 0 HG3 ARG A 118 -11.155 -3.073 1.511 1.00 11.22 H new ATOM 0 HD2 ARG A 118 -11.936 -0.825 2.138 1.00 74.22 H new ATOM 0 HD3 ARG A 118 -12.788 -0.653 0.617 1.00 74.22 H new ATOM 0 HE ARG A 118 -13.774 -3.000 1.902 1.00 72.30 H new ATOM 0 HH11 ARG A 118 -13.825 0.536 2.357 1.00 2.30 H new ATOM 0 HH12 ARG A 118 -15.362 0.500 3.227 1.00 2.30 H new ATOM 0 HH21 ARG A 118 -15.727 -2.991 3.006 1.00 62.33 H new ATOM 0 HH22 ARG A 118 -16.424 -1.475 3.588 1.00 62.33 H new ATOM 1964 N LEU A 119 -9.089 -0.805 -2.953 1.00 71.21 N ATOM 1965 CA LEU A 119 -7.974 -0.261 -3.748 1.00 43.13 C ATOM 1966 C LEU A 119 -8.465 1.025 -4.439 1.00 13.34 C ATOM 1967 O LEU A 119 -7.891 2.104 -4.252 1.00 3.23 O ATOM 1968 CB LEU A 119 -7.481 -1.323 -4.796 1.00 63.30 C ATOM 1969 CG LEU A 119 -5.981 -1.242 -5.251 1.00 64.22 C ATOM 1970 CD1 LEU A 119 -5.620 0.105 -5.904 1.00 12.43 C ATOM 1971 CD2 LEU A 119 -5.024 -1.565 -4.084 1.00 63.44 C ATOM 0 H LEU A 119 -9.440 -1.697 -3.301 1.00 71.21 H new ATOM 0 HA LEU A 119 -7.125 -0.027 -3.106 1.00 43.13 H new ATOM 0 HB2 LEU A 119 -7.654 -2.315 -4.378 1.00 63.30 H new ATOM 0 HB3 LEU A 119 -8.108 -1.237 -5.684 1.00 63.30 H new ATOM 0 HG LEU A 119 -5.856 -2.003 -6.022 1.00 64.22 H new ATOM 0 HD11 LEU A 119 -4.570 0.098 -6.196 1.00 12.43 H new ATOM 0 HD12 LEU A 119 -6.241 0.260 -6.786 1.00 12.43 H new ATOM 0 HD13 LEU A 119 -5.793 0.912 -5.192 1.00 12.43 H new ATOM 0 HD21 LEU A 119 -3.993 -1.501 -4.431 1.00 63.44 H new ATOM 0 HD22 LEU A 119 -5.181 -0.850 -3.276 1.00 63.44 H new ATOM 0 HD23 LEU A 119 -5.222 -2.573 -3.719 1.00 63.44 H new ATOM 1983 N LYS A 120 -9.576 0.877 -5.192 1.00 22.11 N ATOM 1984 CA LYS A 120 -10.215 1.972 -5.943 1.00 43.01 C ATOM 1985 C LYS A 120 -10.658 3.106 -5.004 1.00 51.13 C ATOM 1986 O LYS A 120 -10.597 4.288 -5.365 1.00 22.32 O ATOM 1987 CB LYS A 120 -11.444 1.427 -6.714 1.00 73.31 C ATOM 1988 CG LYS A 120 -12.096 2.443 -7.679 1.00 4.51 C ATOM 1989 CD LYS A 120 -13.433 1.941 -8.268 1.00 21.05 C ATOM 1990 CE LYS A 120 -14.505 1.721 -7.185 1.00 21.00 C ATOM 1991 NZ LYS A 120 -15.822 1.358 -7.773 1.00 42.30 N ATOM 0 H LYS A 120 -10.057 -0.016 -5.295 1.00 22.11 H new ATOM 0 HA LYS A 120 -9.485 2.375 -6.645 1.00 43.01 H new ATOM 0 HB2 LYS A 120 -11.140 0.548 -7.283 1.00 73.31 H new ATOM 0 HB3 LYS A 120 -12.192 1.097 -5.993 1.00 73.31 H new ATOM 0 HG2 LYS A 120 -12.267 3.380 -7.150 1.00 4.51 H new ATOM 0 HG3 LYS A 120 -11.404 2.658 -8.493 1.00 4.51 H new ATOM 0 HD2 LYS A 120 -13.800 2.663 -8.997 1.00 21.05 H new ATOM 0 HD3 LYS A 120 -13.263 1.006 -8.803 1.00 21.05 H new ATOM 0 HE2 LYS A 120 -14.180 0.931 -6.508 1.00 21.00 H new ATOM 0 HE3 LYS A 120 -14.611 2.628 -6.590 1.00 21.00 H new ATOM 0 HZ1 LYS A 120 -16.516 1.219 -7.011 1.00 42.30 H new ATOM 0 HZ2 LYS A 120 -16.145 2.123 -8.400 1.00 42.30 H new ATOM 0 HZ3 LYS A 120 -15.727 0.479 -8.320 1.00 42.30 H new ATOM 2005 N GLU A 121 -11.082 2.708 -3.788 1.00 22.33 N ATOM 2006 CA GLU A 121 -11.528 3.626 -2.735 1.00 21.34 C ATOM 2007 C GLU A 121 -10.405 4.602 -2.355 1.00 41.45 C ATOM 2008 O GLU A 121 -10.631 5.801 -2.244 1.00 31.43 O ATOM 2009 CB GLU A 121 -11.961 2.839 -1.474 1.00 34.21 C ATOM 2010 CG GLU A 121 -12.623 3.710 -0.386 1.00 3.20 C ATOM 2011 CD GLU A 121 -12.668 3.046 0.994 1.00 72.21 C ATOM 2012 OE1 GLU A 121 -12.033 3.561 1.937 1.00 22.31 O ATOM 2013 OE2 GLU A 121 -13.319 1.995 1.137 1.00 25.54 O ATOM 0 H GLU A 121 -11.123 1.727 -3.512 1.00 22.33 H new ATOM 0 HA GLU A 121 -12.378 4.187 -3.122 1.00 21.34 H new ATOM 0 HB2 GLU A 121 -12.657 2.054 -1.770 1.00 34.21 H new ATOM 0 HB3 GLU A 121 -11.087 2.346 -1.048 1.00 34.21 H new ATOM 0 HG2 GLU A 121 -12.081 4.652 -0.308 1.00 3.20 H new ATOM 0 HG3 GLU A 121 -13.640 3.952 -0.696 1.00 3.20 H new ATOM 2020 N LEU A 122 -9.184 4.062 -2.190 1.00 32.10 N ATOM 2021 CA LEU A 122 -8.004 4.850 -1.792 1.00 22.41 C ATOM 2022 C LEU A 122 -7.556 5.796 -2.911 1.00 60.21 C ATOM 2023 O LEU A 122 -6.974 6.848 -2.638 1.00 63.35 O ATOM 2024 CB LEU A 122 -6.845 3.918 -1.370 1.00 74.41 C ATOM 2025 CG LEU A 122 -7.137 3.025 -0.129 1.00 55.12 C ATOM 2026 CD1 LEU A 122 -5.918 2.168 0.228 1.00 63.20 C ATOM 2027 CD2 LEU A 122 -7.617 3.869 1.073 1.00 51.24 C ATOM 0 H LEU A 122 -8.988 3.071 -2.328 1.00 32.10 H new ATOM 0 HA LEU A 122 -8.288 5.462 -0.936 1.00 22.41 H new ATOM 0 HB2 LEU A 122 -6.593 3.273 -2.212 1.00 74.41 H new ATOM 0 HB3 LEU A 122 -5.966 4.528 -1.161 1.00 74.41 H new ATOM 0 HG LEU A 122 -7.950 2.347 -0.387 1.00 55.12 H new ATOM 0 HD11 LEU A 122 -6.148 1.553 1.098 1.00 63.20 H new ATOM 0 HD12 LEU A 122 -5.666 1.524 -0.615 1.00 63.20 H new ATOM 0 HD13 LEU A 122 -5.071 2.816 0.455 1.00 63.20 H new ATOM 0 HD21 LEU A 122 -7.812 3.214 1.922 1.00 51.24 H new ATOM 0 HD22 LEU A 122 -6.846 4.592 1.341 1.00 51.24 H new ATOM 0 HD23 LEU A 122 -8.532 4.397 0.805 1.00 51.24 H new ATOM 2039 N LEU A 123 -7.844 5.417 -4.163 1.00 40.20 N ATOM 2040 CA LEU A 123 -7.648 6.296 -5.328 1.00 1.42 C ATOM 2041 C LEU A 123 -8.628 7.486 -5.279 1.00 10.22 C ATOM 2042 O LEU A 123 -8.275 8.597 -5.662 1.00 45.31 O ATOM 2043 CB LEU A 123 -7.790 5.498 -6.657 1.00 3.10 C ATOM 2044 CG LEU A 123 -6.487 4.814 -7.187 1.00 32.00 C ATOM 2045 CD1 LEU A 123 -5.408 5.867 -7.535 1.00 31.51 C ATOM 2046 CD2 LEU A 123 -5.943 3.749 -6.205 1.00 73.34 C ATOM 0 H LEU A 123 -8.218 4.498 -4.398 1.00 40.20 H new ATOM 0 HA LEU A 123 -6.634 6.695 -5.292 1.00 1.42 H new ATOM 0 HB2 LEU A 123 -8.549 4.729 -6.517 1.00 3.10 H new ATOM 0 HB3 LEU A 123 -8.160 6.175 -7.427 1.00 3.10 H new ATOM 0 HG LEU A 123 -6.751 4.288 -8.104 1.00 32.00 H new ATOM 0 HD11 LEU A 123 -4.513 5.364 -7.901 1.00 31.51 H new ATOM 0 HD12 LEU A 123 -5.789 6.537 -8.306 1.00 31.51 H new ATOM 0 HD13 LEU A 123 -5.161 6.443 -6.643 1.00 31.51 H new ATOM 0 HD21 LEU A 123 -5.038 3.303 -6.617 1.00 73.34 H new ATOM 0 HD22 LEU A 123 -5.713 4.219 -5.249 1.00 73.34 H new ATOM 0 HD23 LEU A 123 -6.695 2.974 -6.056 1.00 73.34 H new ATOM 2058 N GLU A 124 -9.842 7.231 -4.767 1.00 60.54 N ATOM 2059 CA GLU A 124 -10.866 8.270 -4.542 1.00 44.33 C ATOM 2060 C GLU A 124 -10.491 9.147 -3.326 1.00 31.10 C ATOM 2061 O GLU A 124 -10.816 10.329 -3.298 1.00 51.54 O ATOM 2062 CB GLU A 124 -12.254 7.607 -4.341 1.00 13.43 C ATOM 2063 CG GLU A 124 -12.756 6.823 -5.570 1.00 4.35 C ATOM 2064 CD GLU A 124 -13.982 5.944 -5.283 1.00 32.02 C ATOM 2065 OE1 GLU A 124 -15.043 6.488 -4.917 1.00 75.13 O ATOM 2066 OE2 GLU A 124 -13.900 4.704 -5.440 1.00 53.42 O ATOM 0 H GLU A 124 -10.145 6.296 -4.495 1.00 60.54 H new ATOM 0 HA GLU A 124 -10.914 8.917 -5.418 1.00 44.33 H new ATOM 0 HB2 GLU A 124 -12.203 6.931 -3.487 1.00 13.43 H new ATOM 0 HB3 GLU A 124 -12.982 8.379 -4.093 1.00 13.43 H new ATOM 0 HG2 GLU A 124 -13.003 7.528 -6.364 1.00 4.35 H new ATOM 0 HG3 GLU A 124 -11.948 6.194 -5.943 1.00 4.35 H new ATOM 2073 N LYS A 125 -9.789 8.543 -2.338 1.00 21.22 N ATOM 2074 CA LYS A 125 -9.247 9.257 -1.156 1.00 60.22 C ATOM 2075 C LYS A 125 -8.116 10.215 -1.579 1.00 2.33 C ATOM 2076 O LYS A 125 -7.952 11.295 -0.993 1.00 60.55 O ATOM 2077 CB LYS A 125 -8.752 8.248 -0.054 1.00 42.42 C ATOM 2078 CG LYS A 125 -9.799 7.862 1.026 1.00 43.31 C ATOM 2079 CD LYS A 125 -11.100 7.274 0.437 1.00 53.23 C ATOM 2080 CE LYS A 125 -12.165 6.979 1.500 1.00 20.01 C ATOM 2081 NZ LYS A 125 -12.593 8.203 2.229 1.00 51.23 N ATOM 0 H LYS A 125 -9.582 7.544 -2.338 1.00 21.22 H new ATOM 0 HA LYS A 125 -10.052 9.847 -0.719 1.00 60.22 H new ATOM 0 HB2 LYS A 125 -8.414 7.337 -0.548 1.00 42.42 H new ATOM 0 HB3 LYS A 125 -7.885 8.681 0.445 1.00 42.42 H new ATOM 0 HG2 LYS A 125 -9.356 7.135 1.707 1.00 43.31 H new ATOM 0 HG3 LYS A 125 -10.043 8.745 1.617 1.00 43.31 H new ATOM 0 HD2 LYS A 125 -11.509 7.972 -0.293 1.00 53.23 H new ATOM 0 HD3 LYS A 125 -10.866 6.354 -0.098 1.00 53.23 H new ATOM 0 HE2 LYS A 125 -13.032 6.521 1.024 1.00 20.01 H new ATOM 0 HE3 LYS A 125 -11.772 6.254 2.213 1.00 20.01 H new ATOM 0 HZ1 LYS A 125 -13.426 7.986 2.813 1.00 51.23 H new ATOM 0 HZ2 LYS A 125 -11.818 8.532 2.840 1.00 51.23 H new ATOM 0 HZ3 LYS A 125 -12.834 8.948 1.545 1.00 51.23 H new ATOM 2095 N VAL A 126 -7.334 9.793 -2.589 1.00 35.24 N ATOM 2096 CA VAL A 126 -6.337 10.651 -3.244 1.00 15.24 C ATOM 2097 C VAL A 126 -7.060 11.822 -3.945 1.00 1.31 C ATOM 2098 O VAL A 126 -6.725 12.990 -3.722 1.00 53.24 O ATOM 2099 CB VAL A 126 -5.469 9.831 -4.278 1.00 52.52 C ATOM 2100 CG1 VAL A 126 -4.643 10.751 -5.208 1.00 31.11 C ATOM 2101 CG2 VAL A 126 -4.557 8.812 -3.545 1.00 40.24 C ATOM 0 H VAL A 126 -7.377 8.849 -2.972 1.00 35.24 H new ATOM 0 HA VAL A 126 -5.656 11.044 -2.489 1.00 15.24 H new ATOM 0 HB VAL A 126 -6.161 9.278 -4.914 1.00 52.52 H new ATOM 0 HG11 VAL A 126 -4.063 10.142 -5.901 1.00 31.11 H new ATOM 0 HG12 VAL A 126 -5.316 11.399 -5.770 1.00 31.11 H new ATOM 0 HG13 VAL A 126 -3.968 11.362 -4.609 1.00 31.11 H new ATOM 0 HG21 VAL A 126 -3.968 8.259 -4.277 1.00 40.24 H new ATOM 0 HG22 VAL A 126 -3.888 9.344 -2.868 1.00 40.24 H new ATOM 0 HG23 VAL A 126 -5.173 8.117 -2.974 1.00 40.24 H new