USER MOD reduce.3.24.130724 H: found=0, std=0, add=1123, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1118 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 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 106 ASN : amide:sc= -0.359 X(o=-0.36,f=-0.38) USER MOD Set 2.1: A 90 MET CE :methyl -114:sc= -0.0259 (180deg=-0.19) USER MOD Set 2.2: A 93 GLN : amide:sc= -0.359 X(o=-0.39,f=-0.72) USER MOD Set 3.1: A 63 SER OG : rot 122:sc= -0.862 USER MOD Set 3.2: A 87 GLN : amide:sc= 0.124 X(o=-4,f=-4.4) USER MOD Set 3.3: A 88 ASN : amide:sc= -3.25! C(o=-4!,f=-7.5!) USER MOD Set 4.1: A 71 THR OG1 : rot 123:sc= 1.27 USER MOD Set 4.2: A 77 THR OG1 : rot 180:sc= 1.04 USER MOD Set 5.1: A 26 TYR OH : rot -168:sc= 0.0558 USER MOD Set 5.2: A 118 THR OG1 : rot -177:sc= -0.0514 USER MOD Set 6.1: A 5 HIS : no HD1:sc= 0.551 K(o=0.55,f=-12!) USER MOD Set 6.2: A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -153:sc= -0.0314 (180deg=-0.351) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= -0.0287 USER MOD Single : A 10 GLN : amide:sc= -1.16 K(o=-1.2,f=-3.2!) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -1.56 K(o=-1.6,f=-6.9!) USER MOD Single : A 16 CYS SG : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.216 K(o=-0.22,f=-1.6) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 27 MET CE :methyl 160:sc= -1.65 (180deg=-2.24) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -60:sc= 1.07 USER MOD Single : A 35 LYS NZ :NH3+ 173:sc= -0.976 (180deg=-1.28) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= -0.0584 USER MOD Single : A 42 LYS NZ :NH3+ -164:sc= 0.413 (180deg=0.273) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0.22) USER MOD Single : A 45 GLN : amide:sc= -0.286 X(o=-0.29,f=-0.27) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 130:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HE2:sc= 0.0399 K(o=0.04,f=-0.71) USER MOD Single : A 70 MET CE :methyl -157:sc= -6.06! (180deg=-8.53!) USER MOD Single : A 73 MET CE :methyl -104:sc= -1.11 (180deg=-2.59!) USER MOD Single : A 74 TYR OH : rot -133:sc= 0.264 USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00829) USER MOD Single : A 85 ASN :FLIP amide:sc= -0.0119 F(o=-1.3,f=-0.012) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 MET CE :methyl 152:sc= -3.83! (180deg=-8.11!) USER MOD Single : A 98 LYS NZ :NH3+ 175:sc= -0.8! (180deg=-0.954!) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0223) USER MOD Single : A 105 HIS : no HE2:sc= -1.24 K(o=-1.2,f=-4.4!) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 130:sc= 0 USER MOD Single : A 111 GLN : amide:sc= -0.139 K(o=-0.14,f=-0.67) USER MOD Single : A 119 SER OG : rot 90:sc= 0.167 USER MOD Single : A 121 THR OG1 : rot -78:sc= 0.714 USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 GLN : amide:sc= -4.29! C(o=-4.3!,f=-14!) USER MOD Single : A 130 ASN : amide:sc= -0.207 K(o=-0.21,f=-1.8!) USER MOD Single : A 133 ASN : amide:sc= 0.245 X(o=0.24,f=0) USER MOD Single : A 134 THR OG1 : rot 47:sc= 0.867 USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.097 19.684 -5.075 1.00 20.14 N ATOM 2 CA MET A 1 -10.966 19.260 -4.258 1.00 3.44 C ATOM 3 C MET A 1 -10.043 18.334 -5.044 1.00 54.54 C ATOM 4 O MET A 1 -10.289 17.132 -5.138 1.00 61.14 O ATOM 5 CB MET A 1 -11.458 18.554 -2.993 1.00 14.40 C ATOM 6 CG MET A 1 -12.333 19.429 -2.110 1.00 54.52 C ATOM 7 SD MET A 1 -13.956 18.705 -1.804 1.00 23.42 S ATOM 8 CE MET A 1 -14.825 20.105 -1.103 1.00 54.15 C ATOM 0 H1 MET A 1 -12.440 20.607 -4.741 1.00 20.14 H new ATOM 0 H2 MET A 1 -11.797 19.764 -6.068 1.00 20.14 H new ATOM 0 H3 MET A 1 -12.862 18.983 -5.000 1.00 20.14 H new ATOM 0 HA MET A 1 -10.403 20.149 -3.974 1.00 3.44 H new ATOM 0 HB2 MET A 1 -12.019 17.664 -3.278 1.00 14.40 H new ATOM 0 HB3 MET A 1 -10.597 18.217 -2.417 1.00 14.40 H new ATOM 0 HG2 MET A 1 -11.829 19.597 -1.158 1.00 54.52 H new ATOM 0 HG3 MET A 1 -12.457 20.404 -2.581 1.00 54.52 H new ATOM 0 HE1 MET A 1 -15.847 19.814 -0.861 1.00 54.15 H new ATOM 0 HE2 MET A 1 -14.316 20.432 -0.196 1.00 54.15 H new ATOM 0 HE3 MET A 1 -14.841 20.922 -1.825 1.00 54.15 H new ATOM 18 N SER A 2 -8.982 18.903 -5.608 1.00 72.30 N ATOM 19 CA SER A 2 -8.026 18.128 -6.390 1.00 44.42 C ATOM 20 C SER A 2 -6.730 17.919 -5.612 1.00 12.42 C ATOM 21 O SER A 2 -5.783 18.696 -5.740 1.00 63.00 O ATOM 22 CB SER A 2 -7.729 18.833 -7.716 1.00 35.05 C ATOM 23 OG SER A 2 -6.964 18.005 -8.573 1.00 65.13 O ATOM 0 H SER A 2 -8.763 19.897 -5.538 1.00 72.30 H new ATOM 0 HA SER A 2 -8.468 17.153 -6.595 1.00 44.42 H new ATOM 0 HB2 SER A 2 -8.665 19.103 -8.206 1.00 35.05 H new ATOM 0 HB3 SER A 2 -7.190 19.761 -7.525 1.00 35.05 H new ATOM 0 HG SER A 2 -6.789 18.477 -9.414 1.00 65.13 H new ATOM 29 N LEU A 3 -6.696 16.865 -4.804 1.00 55.13 N ATOM 30 CA LEU A 3 -5.518 16.552 -4.004 1.00 22.02 C ATOM 31 C LEU A 3 -4.972 15.172 -4.355 1.00 31.41 C ATOM 32 O LEU A 3 -5.472 14.508 -5.263 1.00 51.02 O ATOM 33 CB LEU A 3 -5.858 16.615 -2.514 1.00 23.44 C ATOM 34 CG LEU A 3 -6.047 18.014 -1.926 1.00 64.25 C ATOM 35 CD1 LEU A 3 -7.467 18.190 -1.412 1.00 61.43 C ATOM 36 CD2 LEU A 3 -5.040 18.266 -0.814 1.00 25.32 C ATOM 0 H LEU A 3 -7.471 16.213 -4.686 1.00 55.13 H new ATOM 0 HA LEU A 3 -4.750 17.293 -4.227 1.00 22.02 H new ATOM 0 HB2 LEU A 3 -6.772 16.046 -2.346 1.00 23.44 H new ATOM 0 HB3 LEU A 3 -5.065 16.114 -1.959 1.00 23.44 H new ATOM 0 HG LEU A 3 -5.876 18.745 -2.716 1.00 64.25 H new ATOM 0 HD11 LEU A 3 -7.582 19.191 -0.997 1.00 61.43 H new ATOM 0 HD12 LEU A 3 -8.171 18.054 -2.233 1.00 61.43 H new ATOM 0 HD13 LEU A 3 -7.667 17.451 -0.636 1.00 61.43 H new ATOM 0 HD21 LEU A 3 -5.190 19.266 -0.408 1.00 25.32 H new ATOM 0 HD22 LEU A 3 -5.179 17.529 -0.023 1.00 25.32 H new ATOM 0 HD23 LEU A 3 -4.029 18.184 -1.213 1.00 25.32 H new ATOM 48 N SER A 4 -3.945 14.744 -3.628 1.00 3.53 N ATOM 49 CA SER A 4 -3.330 13.443 -3.863 1.00 42.44 C ATOM 50 C SER A 4 -3.605 12.494 -2.701 1.00 71.02 C ATOM 51 O SER A 4 -3.244 12.773 -1.557 1.00 51.24 O ATOM 52 CB SER A 4 -1.821 13.598 -4.064 1.00 71.44 C ATOM 53 OG SER A 4 -1.517 13.930 -5.408 1.00 61.41 O ATOM 0 H SER A 4 -3.521 15.280 -2.871 1.00 3.53 H new ATOM 0 HA SER A 4 -3.768 13.019 -4.767 1.00 42.44 H new ATOM 0 HB2 SER A 4 -1.440 14.374 -3.399 1.00 71.44 H new ATOM 0 HB3 SER A 4 -1.318 12.670 -3.792 1.00 71.44 H new ATOM 0 HG SER A 4 -0.547 14.025 -5.510 1.00 61.41 H new ATOM 59 N HIS A 5 -4.247 11.370 -3.003 1.00 34.01 N ATOM 60 CA HIS A 5 -4.571 10.378 -1.984 1.00 74.42 C ATOM 61 C HIS A 5 -3.359 9.507 -1.669 1.00 70.42 C ATOM 62 O HIS A 5 -2.946 8.680 -2.484 1.00 53.43 O ATOM 63 CB HIS A 5 -5.736 9.502 -2.447 1.00 54.22 C ATOM 64 CG HIS A 5 -6.105 8.430 -1.469 1.00 73.30 C ATOM 65 ND1 HIS A 5 -6.074 7.086 -1.778 1.00 5.22 N ATOM 66 CD2 HIS A 5 -6.514 8.509 -0.181 1.00 72.31 C ATOM 67 CE1 HIS A 5 -6.449 6.385 -0.723 1.00 4.33 C ATOM 68 NE2 HIS A 5 -6.721 7.225 0.260 1.00 71.21 N ATOM 0 H HIS A 5 -4.553 11.123 -3.944 1.00 34.01 H new ATOM 0 HA HIS A 5 -4.862 10.907 -1.077 1.00 74.42 H new ATOM 0 HB2 HIS A 5 -6.606 10.134 -2.626 1.00 54.22 H new ATOM 0 HB3 HIS A 5 -5.476 9.040 -3.399 1.00 54.22 H new ATOM 0 HD2 HIS A 5 -6.652 9.413 0.393 1.00 72.31 H new ATOM 0 HE1 HIS A 5 -6.521 5.309 -0.673 1.00 4.33 H new ATOM 0 HE2 HIS A 5 -7.034 6.962 1.195 1.00 71.21 H new ATOM 76 N LEU A 6 -2.792 9.697 -0.483 1.00 51.10 N ATOM 77 CA LEU A 6 -1.626 8.929 -0.060 1.00 40.22 C ATOM 78 C LEU A 6 -1.531 8.876 1.461 1.00 15.03 C ATOM 79 O LEU A 6 -1.357 7.807 2.047 1.00 65.21 O ATOM 80 CB LEU A 6 -0.350 9.541 -0.641 1.00 1.33 C ATOM 81 CG LEU A 6 0.227 8.846 -1.874 1.00 71.14 C ATOM 82 CD1 LEU A 6 0.481 9.853 -2.985 1.00 3.41 C ATOM 83 CD2 LEU A 6 1.508 8.106 -1.519 1.00 63.02 C ATOM 0 H LEU A 6 -3.121 10.376 0.203 1.00 51.10 H new ATOM 0 HA LEU A 6 -1.737 7.911 -0.434 1.00 40.22 H new ATOM 0 HB2 LEU A 6 -0.554 10.581 -0.897 1.00 1.33 H new ATOM 0 HB3 LEU A 6 0.413 9.548 0.138 1.00 1.33 H new ATOM 0 HG LEU A 6 -0.502 8.118 -2.231 1.00 71.14 H new ATOM 0 HD11 LEU A 6 0.892 9.340 -3.854 1.00 3.41 H new ATOM 0 HD12 LEU A 6 -0.457 10.337 -3.259 1.00 3.41 H new ATOM 0 HD13 LEU A 6 1.190 10.605 -2.639 1.00 3.41 H new ATOM 0 HD21 LEU A 6 1.904 7.617 -2.409 1.00 63.02 H new ATOM 0 HD22 LEU A 6 2.243 8.814 -1.136 1.00 63.02 H new ATOM 0 HD23 LEU A 6 1.296 7.356 -0.757 1.00 63.02 H new ATOM 95 N THR A 7 -1.650 10.037 2.098 1.00 55.35 N ATOM 96 CA THR A 7 -1.580 10.123 3.551 1.00 44.43 C ATOM 97 C THR A 7 -2.946 9.884 4.183 1.00 41.01 C ATOM 98 O THR A 7 -3.975 9.969 3.512 1.00 74.10 O ATOM 99 CB THR A 7 -1.049 11.496 4.007 1.00 62.51 C ATOM 100 OG1 THR A 7 -0.742 11.462 5.405 1.00 34.03 O ATOM 101 CG2 THR A 7 -2.070 12.589 3.732 1.00 2.34 C ATOM 0 H THR A 7 -1.795 10.931 1.629 1.00 55.35 H new ATOM 0 HA THR A 7 -0.890 9.346 3.881 1.00 44.43 H new ATOM 0 HB THR A 7 -0.143 11.717 3.442 1.00 62.51 H new ATOM 0 HG1 THR A 7 -0.404 12.337 5.687 1.00 34.03 H new ATOM 0 HG21 THR A 7 -1.673 13.549 4.062 1.00 2.34 H new ATOM 0 HG22 THR A 7 -2.279 12.631 2.663 1.00 2.34 H new ATOM 0 HG23 THR A 7 -2.991 12.371 4.273 1.00 2.34 H new ATOM 109 N LEU A 8 -2.949 9.585 5.477 1.00 13.12 N ATOM 110 CA LEU A 8 -4.191 9.334 6.201 1.00 23.02 C ATOM 111 C LEU A 8 -5.011 10.613 6.336 1.00 60.14 C ATOM 112 O LEU A 8 -6.235 10.567 6.458 1.00 11.11 O ATOM 113 CB LEU A 8 -3.889 8.760 7.587 1.00 40.13 C ATOM 114 CG LEU A 8 -3.077 7.464 7.614 1.00 14.54 C ATOM 115 CD1 LEU A 8 -3.099 6.851 9.006 1.00 61.24 C ATOM 116 CD2 LEU A 8 -3.612 6.478 6.586 1.00 1.31 C ATOM 0 H LEU A 8 -2.106 9.510 6.047 1.00 13.12 H new ATOM 0 HA LEU A 8 -4.774 8.609 5.633 1.00 23.02 H new ATOM 0 HB2 LEU A 8 -3.351 9.514 8.161 1.00 40.13 H new ATOM 0 HB3 LEU A 8 -4.835 8.584 8.099 1.00 40.13 H new ATOM 0 HG LEU A 8 -2.044 7.699 7.358 1.00 14.54 H new ATOM 0 HD11 LEU A 8 -2.516 5.930 9.007 1.00 61.24 H new ATOM 0 HD12 LEU A 8 -2.668 7.553 9.720 1.00 61.24 H new ATOM 0 HD13 LEU A 8 -4.128 6.630 9.290 1.00 61.24 H new ATOM 0 HD21 LEU A 8 -3.022 5.562 6.619 1.00 1.31 H new ATOM 0 HD22 LEU A 8 -4.653 6.248 6.810 1.00 1.31 H new ATOM 0 HD23 LEU A 8 -3.544 6.917 5.591 1.00 1.31 H new ATOM 128 N ASP A 9 -4.329 11.752 6.310 1.00 42.54 N ATOM 129 CA ASP A 9 -4.994 13.045 6.425 1.00 33.11 C ATOM 130 C ASP A 9 -6.162 13.144 5.449 1.00 73.12 C ATOM 131 O ASP A 9 -7.179 13.771 5.745 1.00 42.12 O ATOM 132 CB ASP A 9 -4.001 14.179 6.168 1.00 61.01 C ATOM 133 CG ASP A 9 -4.652 15.382 5.515 1.00 13.44 C ATOM 134 OD1 ASP A 9 -5.571 15.964 6.128 1.00 13.35 O ATOM 135 OD2 ASP A 9 -4.244 15.742 4.391 1.00 23.11 O ATOM 0 H ASP A 9 -3.315 11.807 6.210 1.00 42.54 H new ATOM 0 HA ASP A 9 -5.382 13.136 7.439 1.00 33.11 H new ATOM 0 HB2 ASP A 9 -3.548 14.482 7.112 1.00 61.01 H new ATOM 0 HB3 ASP A 9 -3.195 13.815 5.531 1.00 61.01 H new ATOM 140 N GLN A 10 -6.008 12.521 4.285 1.00 51.54 N ATOM 141 CA GLN A 10 -7.050 12.542 3.264 1.00 23.54 C ATOM 142 C GLN A 10 -8.272 11.750 3.719 1.00 41.44 C ATOM 143 O GLN A 10 -9.410 12.152 3.473 1.00 22.34 O ATOM 144 CB GLN A 10 -6.517 11.969 1.950 1.00 45.12 C ATOM 145 CG GLN A 10 -5.156 12.519 1.554 1.00 3.23 C ATOM 146 CD GLN A 10 -5.168 14.022 1.359 1.00 53.52 C ATOM 147 OE1 GLN A 10 -5.274 14.784 2.321 1.00 42.35 O ATOM 148 NE2 GLN A 10 -5.060 14.458 0.109 1.00 12.21 N ATOM 0 H GLN A 10 -5.173 11.996 4.025 1.00 51.54 H new ATOM 0 HA GLN A 10 -7.349 13.578 3.106 1.00 23.54 H new ATOM 0 HB2 GLN A 10 -6.450 10.885 2.037 1.00 45.12 H new ATOM 0 HB3 GLN A 10 -7.231 12.182 1.154 1.00 45.12 H new ATOM 0 HG2 GLN A 10 -4.427 12.262 2.323 1.00 3.23 H new ATOM 0 HG3 GLN A 10 -4.829 12.039 0.631 1.00 3.23 H new ATOM 0 HE21 GLN A 10 -4.974 13.791 -0.658 1.00 12.21 H new ATOM 0 HE22 GLN A 10 -5.063 15.460 -0.084 1.00 12.21 H new ATOM 157 N TYR A 11 -8.029 10.625 4.381 1.00 70.10 N ATOM 158 CA TYR A 11 -9.110 9.776 4.867 1.00 30.31 C ATOM 159 C TYR A 11 -10.019 10.544 5.821 1.00 15.10 C ATOM 160 O TYR A 11 -11.204 10.236 5.951 1.00 33.50 O ATOM 161 CB TYR A 11 -8.541 8.542 5.570 1.00 41.11 C ATOM 162 CG TYR A 11 -7.886 7.557 4.628 1.00 32.22 C ATOM 163 CD1 TYR A 11 -8.488 7.212 3.424 1.00 43.42 C ATOM 164 CD2 TYR A 11 -6.667 6.970 4.943 1.00 70.41 C ATOM 165 CE1 TYR A 11 -7.894 6.312 2.561 1.00 43.15 C ATOM 166 CE2 TYR A 11 -6.065 6.070 4.085 1.00 31.30 C ATOM 167 CZ TYR A 11 -6.682 5.744 2.895 1.00 33.13 C ATOM 168 OH TYR A 11 -6.087 4.847 2.039 1.00 64.33 O ATOM 0 H TYR A 11 -7.093 10.280 4.594 1.00 70.10 H new ATOM 0 HA TYR A 11 -9.701 9.457 4.008 1.00 30.31 H new ATOM 0 HB2 TYR A 11 -7.811 8.862 6.313 1.00 41.11 H new ATOM 0 HB3 TYR A 11 -9.344 8.038 6.108 1.00 41.11 H new ATOM 0 HD1 TYR A 11 -9.436 7.655 3.159 1.00 43.42 H new ATOM 0 HD2 TYR A 11 -6.182 7.221 5.874 1.00 70.41 H new ATOM 0 HE1 TYR A 11 -8.376 6.054 1.629 1.00 43.15 H new ATOM 0 HE2 TYR A 11 -5.116 5.624 4.345 1.00 31.30 H new ATOM 0 HH TYR A 11 -5.239 4.542 2.423 1.00 64.33 H new ATOM 178 N TYR A 12 -9.456 11.547 6.486 1.00 72.33 N ATOM 179 CA TYR A 12 -10.214 12.359 7.430 1.00 53.55 C ATOM 180 C TYR A 12 -11.374 13.064 6.733 1.00 74.12 C ATOM 181 O TYR A 12 -12.456 13.210 7.300 1.00 13.04 O ATOM 182 CB TYR A 12 -9.302 13.391 8.094 1.00 4.42 C ATOM 183 CG TYR A 12 -9.018 13.100 9.550 1.00 25.23 C ATOM 184 CD1 TYR A 12 -10.045 12.772 10.427 1.00 40.24 C ATOM 185 CD2 TYR A 12 -7.722 13.153 10.050 1.00 33.12 C ATOM 186 CE1 TYR A 12 -9.790 12.506 11.758 1.00 35.31 C ATOM 187 CE2 TYR A 12 -7.458 12.886 11.380 1.00 54.43 C ATOM 188 CZ TYR A 12 -8.496 12.564 12.230 1.00 64.53 C ATOM 189 OH TYR A 12 -8.237 12.299 13.555 1.00 21.10 O ATOM 0 H TYR A 12 -8.477 11.817 6.389 1.00 72.33 H new ATOM 0 HA TYR A 12 -10.621 11.697 8.195 1.00 53.55 H new ATOM 0 HB2 TYR A 12 -8.358 13.433 7.550 1.00 4.42 H new ATOM 0 HB3 TYR A 12 -9.762 14.376 8.012 1.00 4.42 H new ATOM 0 HD1 TYR A 12 -11.060 12.724 10.061 1.00 40.24 H new ATOM 0 HD2 TYR A 12 -6.908 13.407 9.388 1.00 33.12 H new ATOM 0 HE1 TYR A 12 -10.600 12.254 12.426 1.00 35.31 H new ATOM 0 HE2 TYR A 12 -6.445 12.929 11.752 1.00 54.43 H new ATOM 0 HH TYR A 12 -7.275 12.382 13.723 1.00 21.10 H new ATOM 199 N GLU A 13 -11.139 13.498 5.498 1.00 33.33 N ATOM 200 CA GLU A 13 -12.164 14.187 4.723 1.00 13.15 C ATOM 201 C GLU A 13 -13.401 13.309 4.554 1.00 22.10 C ATOM 202 O GLU A 13 -14.531 13.778 4.690 1.00 72.12 O ATOM 203 CB GLU A 13 -11.616 14.585 3.352 1.00 53.45 C ATOM 204 CG GLU A 13 -10.344 15.413 3.421 1.00 22.12 C ATOM 205 CD GLU A 13 -10.538 16.826 2.908 1.00 52.33 C ATOM 206 OE1 GLU A 13 -11.630 17.392 3.125 1.00 4.44 O ATOM 207 OE2 GLU A 13 -9.598 17.366 2.288 1.00 2.31 O ATOM 0 H GLU A 13 -10.249 13.385 5.014 1.00 33.33 H new ATOM 0 HA GLU A 13 -12.451 15.087 5.267 1.00 13.15 H new ATOM 0 HB2 GLU A 13 -11.421 13.683 2.772 1.00 53.45 H new ATOM 0 HB3 GLU A 13 -12.378 15.150 2.816 1.00 53.45 H new ATOM 0 HG2 GLU A 13 -9.995 15.450 4.453 1.00 22.12 H new ATOM 0 HG3 GLU A 13 -9.564 14.923 2.838 1.00 22.12 H new ATOM 214 N ILE A 14 -13.177 12.034 4.256 1.00 20.51 N ATOM 215 CA ILE A 14 -14.272 11.090 4.069 1.00 60.14 C ATOM 216 C ILE A 14 -15.032 10.864 5.371 1.00 22.41 C ATOM 217 O ILE A 14 -16.262 10.825 5.384 1.00 22.42 O ATOM 218 CB ILE A 14 -13.763 9.735 3.542 1.00 75.11 C ATOM 219 CG1 ILE A 14 -13.276 9.875 2.098 1.00 22.44 C ATOM 220 CG2 ILE A 14 -14.860 8.684 3.637 1.00 1.51 C ATOM 221 CD1 ILE A 14 -11.772 9.980 1.976 1.00 22.42 C ATOM 0 H ILE A 14 -12.247 11.631 4.139 1.00 20.51 H new ATOM 0 HA ILE A 14 -14.944 11.528 3.331 1.00 60.14 H new ATOM 0 HB ILE A 14 -12.924 9.414 4.159 1.00 75.11 H new ATOM 0 HG12 ILE A 14 -13.620 9.016 1.522 1.00 22.44 H new ATOM 0 HG13 ILE A 14 -13.731 10.760 1.654 1.00 22.44 H new ATOM 0 HG21 ILE A 14 -14.485 7.732 3.261 1.00 1.51 H new ATOM 0 HG22 ILE A 14 -15.164 8.569 4.677 1.00 1.51 H new ATOM 0 HG23 ILE A 14 -15.717 8.998 3.041 1.00 1.51 H new ATOM 0 HD11 ILE A 14 -11.498 10.077 0.925 1.00 22.42 H new ATOM 0 HD12 ILE A 14 -11.423 10.855 2.524 1.00 22.42 H new ATOM 0 HD13 ILE A 14 -11.310 9.084 2.390 1.00 22.42 H new ATOM 233 N GLN A 15 -14.291 10.717 6.464 1.00 25.15 N ATOM 234 CA GLN A 15 -14.895 10.496 7.773 1.00 71.32 C ATOM 235 C GLN A 15 -15.754 11.687 8.184 1.00 3.21 C ATOM 236 O GLN A 15 -16.852 11.519 8.716 1.00 5.35 O ATOM 237 CB GLN A 15 -13.812 10.246 8.823 1.00 5.02 C ATOM 238 CG GLN A 15 -12.897 9.079 8.488 1.00 21.11 C ATOM 239 CD GLN A 15 -11.821 8.861 9.534 1.00 15.22 C ATOM 240 OE1 GLN A 15 -12.014 9.164 10.712 1.00 55.30 O ATOM 241 NE2 GLN A 15 -10.680 8.333 9.109 1.00 62.00 N ATOM 0 H GLN A 15 -13.271 10.747 6.470 1.00 25.15 H new ATOM 0 HA GLN A 15 -15.535 9.616 7.706 1.00 71.32 H new ATOM 0 HB2 GLN A 15 -13.210 11.148 8.934 1.00 5.02 H new ATOM 0 HB3 GLN A 15 -14.287 10.059 9.786 1.00 5.02 H new ATOM 0 HG2 GLN A 15 -13.493 8.171 8.391 1.00 21.11 H new ATOM 0 HG3 GLN A 15 -12.427 9.257 7.521 1.00 21.11 H new ATOM 0 HE21 GLN A 15 -10.563 8.097 8.124 1.00 62.00 H new ATOM 0 HE22 GLN A 15 -9.920 8.163 9.768 1.00 62.00 H new ATOM 250 N CYS A 16 -15.247 12.889 7.935 1.00 42.45 N ATOM 251 CA CYS A 16 -15.967 14.110 8.280 1.00 31.32 C ATOM 252 C CYS A 16 -17.297 14.185 7.538 1.00 73.23 C ATOM 253 O CYS A 16 -18.317 14.567 8.109 1.00 54.10 O ATOM 254 CB CYS A 16 -15.117 15.338 7.954 1.00 41.43 C ATOM 255 SG CYS A 16 -15.209 16.651 9.194 1.00 32.30 S ATOM 0 H CYS A 16 -14.340 13.045 7.495 1.00 42.45 H new ATOM 0 HA CYS A 16 -16.170 14.092 9.351 1.00 31.32 H new ATOM 0 HB2 CYS A 16 -14.078 15.028 7.845 1.00 41.43 H new ATOM 0 HB3 CYS A 16 -15.433 15.740 6.991 1.00 41.43 H new ATOM 0 HG CYS A 16 -14.455 17.645 8.830 1.00 32.30 H new ATOM 261 N ASN A 17 -17.277 13.818 6.260 1.00 14.52 N ATOM 262 CA ASN A 17 -18.482 13.846 5.438 1.00 2.53 C ATOM 263 C ASN A 17 -19.566 12.952 6.031 1.00 31.05 C ATOM 264 O ASN A 17 -20.755 13.251 5.929 1.00 12.35 O ATOM 265 CB ASN A 17 -18.161 13.399 4.011 1.00 43.43 C ATOM 266 CG ASN A 17 -18.307 14.525 3.005 1.00 10.35 C ATOM 267 OD1 ASN A 17 -19.148 15.410 3.165 1.00 35.44 O ATOM 268 ND2 ASN A 17 -17.486 14.497 1.962 1.00 11.11 N ATOM 0 H ASN A 17 -16.441 13.498 5.772 1.00 14.52 H new ATOM 0 HA ASN A 17 -18.853 14.871 5.416 1.00 2.53 H new ATOM 0 HB2 ASN A 17 -17.142 13.013 3.975 1.00 43.43 H new ATOM 0 HB3 ASN A 17 -18.823 12.579 3.733 1.00 43.43 H new ATOM 0 HD21 ASN A 17 -17.537 15.228 1.253 1.00 11.11 H new ATOM 0 HD22 ASN A 17 -16.804 13.744 1.870 1.00 11.11 H new ATOM 275 N GLU A 18 -19.146 11.854 6.652 1.00 60.34 N ATOM 276 CA GLU A 18 -20.082 10.916 7.261 1.00 63.11 C ATOM 277 C GLU A 18 -20.829 11.569 8.420 1.00 20.22 C ATOM 278 O GLU A 18 -22.019 11.325 8.623 1.00 73.24 O ATOM 279 CB GLU A 18 -19.342 9.670 7.753 1.00 0.44 C ATOM 280 CG GLU A 18 -18.913 8.735 6.635 1.00 12.23 C ATOM 281 CD GLU A 18 -19.505 7.346 6.777 1.00 13.41 C ATOM 282 OE1 GLU A 18 -20.748 7.226 6.758 1.00 21.23 O ATOM 283 OE2 GLU A 18 -18.725 6.380 6.907 1.00 62.15 O ATOM 0 H GLU A 18 -18.165 11.592 6.747 1.00 60.34 H new ATOM 0 HA GLU A 18 -20.808 10.622 6.503 1.00 63.11 H new ATOM 0 HB2 GLU A 18 -18.461 9.979 8.315 1.00 0.44 H new ATOM 0 HB3 GLU A 18 -19.985 9.125 8.444 1.00 0.44 H new ATOM 0 HG2 GLU A 18 -19.214 9.158 5.677 1.00 12.23 H new ATOM 0 HG3 GLU A 18 -17.825 8.663 6.624 1.00 12.23 H new ATOM 290 N LEU A 19 -20.122 12.399 9.179 1.00 52.10 N ATOM 291 CA LEU A 19 -20.717 13.088 10.319 1.00 31.32 C ATOM 292 C LEU A 19 -21.778 14.083 9.861 1.00 11.21 C ATOM 293 O LEU A 19 -22.907 14.070 10.351 1.00 42.41 O ATOM 294 CB LEU A 19 -19.636 13.811 11.124 1.00 40.32 C ATOM 295 CG LEU A 19 -18.901 12.971 12.169 1.00 73.33 C ATOM 296 CD1 LEU A 19 -18.436 11.655 11.564 1.00 10.12 C ATOM 297 CD2 LEU A 19 -17.722 13.743 12.741 1.00 0.34 C ATOM 0 H LEU A 19 -19.136 12.611 9.026 1.00 52.10 H new ATOM 0 HA LEU A 19 -21.196 12.342 10.954 1.00 31.32 H new ATOM 0 HB2 LEU A 19 -18.900 14.213 10.427 1.00 40.32 H new ATOM 0 HB3 LEU A 19 -20.095 14.661 11.628 1.00 40.32 H new ATOM 0 HG LEU A 19 -19.593 12.750 12.982 1.00 73.33 H new ATOM 0 HD11 LEU A 19 -17.915 11.070 12.322 1.00 10.12 H new ATOM 0 HD12 LEU A 19 -19.299 11.095 11.203 1.00 10.12 H new ATOM 0 HD13 LEU A 19 -17.760 11.855 10.732 1.00 10.12 H new ATOM 0 HD21 LEU A 19 -17.211 13.130 13.483 1.00 0.34 H new ATOM 0 HD22 LEU A 19 -17.029 13.995 11.939 1.00 0.34 H new ATOM 0 HD23 LEU A 19 -18.080 14.658 13.212 1.00 0.34 H new ATOM 309 N GLU A 20 -21.407 14.943 8.917 1.00 34.12 N ATOM 310 CA GLU A 20 -22.329 15.944 8.392 1.00 4.14 C ATOM 311 C GLU A 20 -23.439 15.288 7.577 1.00 63.52 C ATOM 312 O GLU A 20 -24.574 15.763 7.558 1.00 23.43 O ATOM 313 CB GLU A 20 -21.577 16.958 7.528 1.00 65.35 C ATOM 314 CG GLU A 20 -20.375 16.370 6.807 1.00 41.02 C ATOM 315 CD GLU A 20 -19.920 17.224 5.639 1.00 73.52 C ATOM 316 OE1 GLU A 20 -20.649 17.278 4.626 1.00 41.21 O ATOM 317 OE2 GLU A 20 -18.837 17.836 5.737 1.00 3.22 O ATOM 0 H GLU A 20 -20.476 14.967 8.501 1.00 34.12 H new ATOM 0 HA GLU A 20 -22.782 16.462 9.237 1.00 4.14 H new ATOM 0 HB2 GLU A 20 -22.264 17.375 6.791 1.00 65.35 H new ATOM 0 HB3 GLU A 20 -21.245 17.783 8.157 1.00 65.35 H new ATOM 0 HG2 GLU A 20 -19.552 16.258 7.513 1.00 41.02 H new ATOM 0 HG3 GLU A 20 -20.624 15.372 6.447 1.00 41.02 H new ATOM 324 N ALA A 21 -23.101 14.193 6.903 1.00 34.31 N ATOM 325 CA ALA A 21 -24.069 13.470 6.087 1.00 63.32 C ATOM 326 C ALA A 21 -25.156 12.841 6.952 1.00 63.33 C ATOM 327 O ALA A 21 -26.347 13.009 6.688 1.00 3.42 O ATOM 328 CB ALA A 21 -23.368 12.403 5.258 1.00 2.32 C ATOM 0 H ALA A 21 -22.165 13.788 6.906 1.00 34.31 H new ATOM 0 HA ALA A 21 -24.545 14.184 5.414 1.00 63.32 H new ATOM 0 HB1 ALA A 21 -24.103 11.871 4.654 1.00 2.32 H new ATOM 0 HB2 ALA A 21 -22.633 12.874 4.605 1.00 2.32 H new ATOM 0 HB3 ALA A 21 -22.865 11.699 5.921 1.00 2.32 H new ATOM 334 N ILE A 22 -24.738 12.115 7.984 1.00 53.14 N ATOM 335 CA ILE A 22 -25.677 11.462 8.887 1.00 72.52 C ATOM 336 C ILE A 22 -26.358 12.475 9.800 1.00 3.42 C ATOM 337 O ILE A 22 -27.542 12.349 10.112 1.00 61.51 O ATOM 338 CB ILE A 22 -24.978 10.397 9.752 1.00 65.41 C ATOM 339 CG1 ILE A 22 -25.012 9.037 9.052 1.00 65.53 C ATOM 340 CG2 ILE A 22 -25.636 10.310 11.121 1.00 43.32 C ATOM 341 CD1 ILE A 22 -24.939 9.131 7.544 1.00 52.32 C ATOM 0 H ILE A 22 -23.756 11.965 8.215 1.00 53.14 H new ATOM 0 HA ILE A 22 -26.428 10.977 8.263 1.00 72.52 H new ATOM 0 HB ILE A 22 -23.937 10.689 9.889 1.00 65.41 H new ATOM 0 HG12 ILE A 22 -24.179 8.432 9.411 1.00 65.53 H new ATOM 0 HG13 ILE A 22 -25.928 8.516 9.331 1.00 65.53 H new ATOM 0 HG21 ILE A 22 -25.130 9.553 11.720 1.00 43.32 H new ATOM 0 HG22 ILE A 22 -25.565 11.276 11.621 1.00 43.32 H new ATOM 0 HG23 ILE A 22 -26.685 10.039 11.004 1.00 43.32 H new ATOM 0 HD11 ILE A 22 -24.968 8.129 7.115 1.00 52.32 H new ATOM 0 HD12 ILE A 22 -25.786 9.709 7.174 1.00 52.32 H new ATOM 0 HD13 ILE A 22 -24.010 9.623 7.255 1.00 52.32 H new ATOM 353 N ARG A 23 -25.601 13.482 10.225 1.00 54.54 N ATOM 354 CA ARG A 23 -26.132 14.519 11.102 1.00 44.22 C ATOM 355 C ARG A 23 -27.403 15.128 10.518 1.00 70.15 C ATOM 356 O ARG A 23 -28.319 15.500 11.251 1.00 71.40 O ATOM 357 CB ARG A 23 -25.085 15.613 11.324 1.00 34.15 C ATOM 358 CG ARG A 23 -24.160 15.340 12.499 1.00 41.31 C ATOM 359 CD ARG A 23 -22.870 16.139 12.389 1.00 35.01 C ATOM 360 NE ARG A 23 -23.033 17.509 12.869 1.00 64.15 N ATOM 361 CZ ARG A 23 -22.070 18.423 12.820 1.00 12.20 C ATOM 362 NH1 ARG A 23 -20.883 18.115 12.316 1.00 54.12 N ATOM 363 NH2 ARG A 23 -22.294 19.649 13.276 1.00 34.12 N ATOM 0 H ARG A 23 -24.619 13.602 9.976 1.00 54.54 H new ATOM 0 HA ARG A 23 -26.377 14.059 12.059 1.00 44.22 H new ATOM 0 HB2 ARG A 23 -24.487 15.721 10.419 1.00 34.15 H new ATOM 0 HB3 ARG A 23 -25.593 16.564 11.486 1.00 34.15 H new ATOM 0 HG2 ARG A 23 -24.668 15.593 13.430 1.00 41.31 H new ATOM 0 HG3 ARG A 23 -23.928 14.276 12.541 1.00 41.31 H new ATOM 0 HD2 ARG A 23 -22.087 15.644 12.963 1.00 35.01 H new ATOM 0 HD3 ARG A 23 -22.541 16.155 11.350 1.00 35.01 H new ATOM 0 HE ARG A 23 -23.934 17.778 13.263 1.00 64.15 H new ATOM 0 HH11 ARG A 23 -20.707 17.174 11.964 1.00 54.12 H new ATOM 0 HH12 ARG A 23 -20.146 18.819 12.280 1.00 54.12 H new ATOM 0 HH21 ARG A 23 -23.206 19.890 13.664 1.00 34.12 H new ATOM 0 HH22 ARG A 23 -21.554 20.350 13.238 1.00 34.12 H new ATOM 377 N SER A 24 -27.451 15.227 9.193 1.00 41.11 N ATOM 378 CA SER A 24 -28.608 15.795 8.510 1.00 24.32 C ATOM 379 C SER A 24 -29.833 14.902 8.683 1.00 23.04 C ATOM 380 O SER A 24 -30.965 15.384 8.718 1.00 33.05 O ATOM 381 CB SER A 24 -28.306 15.983 7.022 1.00 13.31 C ATOM 382 OG SER A 24 -28.272 17.358 6.679 1.00 61.20 O ATOM 0 H SER A 24 -26.702 14.921 8.571 1.00 41.11 H new ATOM 0 HA SER A 24 -28.822 16.766 8.956 1.00 24.32 H new ATOM 0 HB2 SER A 24 -27.349 15.521 6.781 1.00 13.31 H new ATOM 0 HB3 SER A 24 -29.065 15.475 6.427 1.00 13.31 H new ATOM 0 HG SER A 24 -28.076 17.452 5.724 1.00 61.20 H new ATOM 388 N ILE A 25 -29.597 13.599 8.791 1.00 23.20 N ATOM 389 CA ILE A 25 -30.680 12.638 8.962 1.00 41.44 C ATOM 390 C ILE A 25 -31.067 12.502 10.430 1.00 34.01 C ATOM 391 O ILE A 25 -32.250 12.485 10.772 1.00 51.11 O ATOM 392 CB ILE A 25 -30.294 11.252 8.413 1.00 35.11 C ATOM 393 CG1 ILE A 25 -29.984 11.339 6.917 1.00 15.23 C ATOM 394 CG2 ILE A 25 -31.411 10.251 8.671 1.00 52.34 C ATOM 395 CD1 ILE A 25 -28.630 10.777 6.547 1.00 3.52 C ATOM 0 H ILE A 25 -28.666 13.184 8.763 1.00 23.20 H new ATOM 0 HA ILE A 25 -31.532 13.018 8.398 1.00 41.44 H new ATOM 0 HB ILE A 25 -29.398 10.909 8.930 1.00 35.11 H new ATOM 0 HG12 ILE A 25 -30.755 10.803 6.363 1.00 15.23 H new ATOM 0 HG13 ILE A 25 -30.033 12.382 6.604 1.00 15.23 H new ATOM 0 HG21 ILE A 25 -31.124 9.276 8.277 1.00 52.34 H new ATOM 0 HG22 ILE A 25 -31.588 10.172 9.744 1.00 52.34 H new ATOM 0 HG23 ILE A 25 -32.322 10.588 8.177 1.00 52.34 H new ATOM 0 HD11 ILE A 25 -28.478 10.872 5.472 1.00 3.52 H new ATOM 0 HD12 ILE A 25 -27.851 11.328 7.074 1.00 3.52 H new ATOM 0 HD13 ILE A 25 -28.583 9.725 6.829 1.00 3.52 H new ATOM 407 N TYR A 26 -30.063 12.407 11.295 1.00 74.34 N ATOM 408 CA TYR A 26 -30.299 12.271 12.727 1.00 4.32 C ATOM 409 C TYR A 26 -29.959 13.566 13.460 1.00 72.22 C ATOM 410 O TYR A 26 -29.345 13.546 14.526 1.00 34.32 O ATOM 411 CB TYR A 26 -29.469 11.118 13.295 1.00 40.42 C ATOM 412 CG TYR A 26 -29.829 9.770 12.714 1.00 74.31 C ATOM 413 CD1 TYR A 26 -31.154 9.360 12.629 1.00 34.32 C ATOM 414 CD2 TYR A 26 -28.845 8.905 12.251 1.00 54.11 C ATOM 415 CE1 TYR A 26 -31.489 8.128 12.100 1.00 45.11 C ATOM 416 CE2 TYR A 26 -29.170 7.672 11.719 1.00 53.53 C ATOM 417 CZ TYR A 26 -30.493 7.288 11.646 1.00 51.44 C ATOM 418 OH TYR A 26 -30.821 6.061 11.117 1.00 22.35 O ATOM 0 H TYR A 26 -29.078 12.422 11.029 1.00 74.34 H new ATOM 0 HA TYR A 26 -31.357 12.056 12.876 1.00 4.32 H new ATOM 0 HB2 TYR A 26 -28.413 11.315 13.108 1.00 40.42 H new ATOM 0 HB3 TYR A 26 -29.600 11.085 14.377 1.00 40.42 H new ATOM 0 HD1 TYR A 26 -31.936 10.016 12.983 1.00 34.32 H new ATOM 0 HD2 TYR A 26 -27.808 9.202 12.308 1.00 54.11 H new ATOM 0 HE1 TYR A 26 -32.524 7.825 12.042 1.00 45.11 H new ATOM 0 HE2 TYR A 26 -28.393 7.013 11.362 1.00 53.53 H new ATOM 0 HH TYR A 26 -30.010 5.519 11.021 1.00 22.35 H new ATOM 428 N MET A 27 -30.364 14.690 12.879 1.00 53.41 N ATOM 429 CA MET A 27 -30.105 15.995 13.477 1.00 52.14 C ATOM 430 C MET A 27 -30.323 15.955 14.986 1.00 61.51 C ATOM 431 O MET A 27 -29.505 16.460 15.754 1.00 2.43 O ATOM 432 CB MET A 27 -31.010 17.057 12.848 1.00 65.35 C ATOM 433 CG MET A 27 -30.955 17.079 11.329 1.00 44.14 C ATOM 434 SD MET A 27 -32.592 17.050 10.574 1.00 42.21 S ATOM 435 CE MET A 27 -33.120 15.386 10.975 1.00 52.42 C ATOM 0 H MET A 27 -30.872 14.724 11.995 1.00 53.41 H new ATOM 0 HA MET A 27 -29.064 16.254 13.285 1.00 52.14 H new ATOM 0 HB2 MET A 27 -32.038 16.880 13.164 1.00 65.35 H new ATOM 0 HB3 MET A 27 -30.724 18.038 13.228 1.00 65.35 H new ATOM 0 HG2 MET A 27 -30.424 17.973 11.002 1.00 44.14 H new ATOM 0 HG3 MET A 27 -30.382 16.221 10.978 1.00 44.14 H new ATOM 0 HE1 MET A 27 -34.206 15.322 10.903 1.00 52.42 H new ATOM 0 HE2 MET A 27 -32.668 14.682 10.276 1.00 52.42 H new ATOM 0 HE3 MET A 27 -32.808 15.140 11.990 1.00 52.42 H new ATOM 445 N ASP A 28 -31.430 15.350 15.403 1.00 1.33 N ATOM 446 CA ASP A 28 -31.754 15.243 16.821 1.00 54.30 C ATOM 447 C ASP A 28 -31.430 13.849 17.349 1.00 2.41 C ATOM 448 O ASP A 28 -31.382 13.629 18.559 1.00 34.24 O ATOM 449 CB ASP A 28 -33.233 15.558 17.053 1.00 51.43 C ATOM 450 CG ASP A 28 -33.478 17.033 17.305 1.00 51.22 C ATOM 451 OD1 ASP A 28 -32.955 17.862 16.531 1.00 70.20 O ATOM 452 OD2 ASP A 28 -34.192 17.359 18.276 1.00 33.24 O ATOM 0 H ASP A 28 -32.118 14.927 14.780 1.00 1.33 H new ATOM 0 HA ASP A 28 -31.146 15.968 17.363 1.00 54.30 H new ATOM 0 HB2 ASP A 28 -33.810 15.240 16.185 1.00 51.43 H new ATOM 0 HB3 ASP A 28 -33.595 14.982 17.904 1.00 51.43 H new ATOM 457 N ASP A 29 -31.208 12.913 16.434 1.00 72.52 N ATOM 458 CA ASP A 29 -30.888 11.540 16.807 1.00 71.40 C ATOM 459 C ASP A 29 -29.382 11.303 16.767 1.00 24.21 C ATOM 460 O ASP A 29 -28.924 10.164 16.666 1.00 10.31 O ATOM 461 CB ASP A 29 -31.596 10.556 15.874 1.00 53.54 C ATOM 462 CG ASP A 29 -32.899 10.042 16.455 1.00 42.54 C ATOM 463 OD1 ASP A 29 -33.490 10.747 17.299 1.00 53.02 O ATOM 464 OD2 ASP A 29 -33.326 8.935 16.066 1.00 54.24 O ATOM 0 H ASP A 29 -31.244 13.079 15.428 1.00 72.52 H new ATOM 0 HA ASP A 29 -31.237 11.377 17.827 1.00 71.40 H new ATOM 0 HB2 ASP A 29 -31.795 11.044 14.920 1.00 53.54 H new ATOM 0 HB3 ASP A 29 -30.935 9.714 15.670 1.00 53.54 H new ATOM 469 N PHE A 30 -28.615 12.386 16.846 1.00 73.31 N ATOM 470 CA PHE A 30 -27.160 12.296 16.817 1.00 51.23 C ATOM 471 C PHE A 30 -26.567 12.633 18.182 1.00 60.03 C ATOM 472 O PHE A 30 -26.996 13.580 18.842 1.00 44.21 O ATOM 473 CB PHE A 30 -26.591 13.239 15.754 1.00 12.03 C ATOM 474 CG PHE A 30 -25.113 13.469 15.886 1.00 22.43 C ATOM 475 CD1 PHE A 30 -24.617 14.348 16.835 1.00 41.30 C ATOM 476 CD2 PHE A 30 -24.219 12.805 15.061 1.00 1.13 C ATOM 477 CE1 PHE A 30 -23.257 14.562 16.959 1.00 21.45 C ATOM 478 CE2 PHE A 30 -22.858 13.014 15.181 1.00 0.14 C ATOM 479 CZ PHE A 30 -22.376 13.894 16.131 1.00 55.33 C ATOM 0 H PHE A 30 -28.977 13.336 16.931 1.00 73.31 H new ATOM 0 HA PHE A 30 -26.889 11.271 16.566 1.00 51.23 H new ATOM 0 HB2 PHE A 30 -26.800 12.828 14.766 1.00 12.03 H new ATOM 0 HB3 PHE A 30 -27.107 14.197 15.816 1.00 12.03 H new ATOM 0 HD1 PHE A 30 -25.301 14.872 17.486 1.00 41.30 H new ATOM 0 HD2 PHE A 30 -24.590 12.117 14.316 1.00 1.13 H new ATOM 0 HE1 PHE A 30 -22.884 15.251 17.702 1.00 21.45 H new ATOM 0 HE2 PHE A 30 -22.172 12.490 14.533 1.00 0.14 H new ATOM 0 HZ PHE A 30 -21.313 14.059 16.226 1.00 55.33 H new ATOM 489 N THR A 31 -25.578 11.850 18.600 1.00 65.30 N ATOM 490 CA THR A 31 -24.926 12.062 19.886 1.00 10.22 C ATOM 491 C THR A 31 -23.455 12.417 19.705 1.00 24.12 C ATOM 492 O THR A 31 -22.746 11.786 18.921 1.00 70.31 O ATOM 493 CB THR A 31 -25.035 10.815 20.784 1.00 12.41 C ATOM 494 OG1 THR A 31 -26.408 10.559 21.102 1.00 43.13 O ATOM 495 CG2 THR A 31 -24.239 11.001 22.067 1.00 63.12 C ATOM 0 H THR A 31 -25.211 11.062 18.066 1.00 65.30 H new ATOM 0 HA THR A 31 -25.441 12.893 20.368 1.00 10.22 H new ATOM 0 HB THR A 31 -24.624 9.965 20.239 1.00 12.41 H new ATOM 0 HG1 THR A 31 -26.469 9.764 21.672 1.00 43.13 H new ATOM 0 HG21 THR A 31 -24.331 10.108 22.685 1.00 63.12 H new ATOM 0 HG22 THR A 31 -23.190 11.167 21.823 1.00 63.12 H new ATOM 0 HG23 THR A 31 -24.625 11.862 22.613 1.00 63.12 H new ATOM 503 N ASP A 32 -23.001 13.430 20.436 1.00 61.54 N ATOM 504 CA ASP A 32 -21.612 13.867 20.357 1.00 50.12 C ATOM 505 C ASP A 32 -20.796 13.296 21.513 1.00 51.54 C ATOM 506 O ASP A 32 -21.063 13.589 22.679 1.00 40.00 O ATOM 507 CB ASP A 32 -21.535 15.395 20.367 1.00 21.41 C ATOM 508 CG ASP A 32 -21.119 15.944 21.717 1.00 2.33 C ATOM 509 OD1 ASP A 32 -22.004 16.146 22.575 1.00 74.42 O ATOM 510 OD2 ASP A 32 -19.908 16.172 21.917 1.00 44.31 O ATOM 0 H ASP A 32 -23.575 13.963 21.089 1.00 61.54 H new ATOM 0 HA ASP A 32 -21.192 13.496 19.422 1.00 50.12 H new ATOM 0 HB2 ASP A 32 -20.825 15.725 19.609 1.00 21.41 H new ATOM 0 HB3 ASP A 32 -22.507 15.807 20.094 1.00 21.41 H new ATOM 515 N LEU A 33 -19.802 12.480 21.182 1.00 43.35 N ATOM 516 CA LEU A 33 -18.947 11.867 22.192 1.00 44.00 C ATOM 517 C LEU A 33 -17.486 12.248 21.973 1.00 0.35 C ATOM 518 O LEU A 33 -16.670 12.180 22.894 1.00 53.13 O ATOM 519 CB LEU A 33 -19.098 10.345 22.161 1.00 14.24 C ATOM 520 CG LEU A 33 -17.930 9.566 21.557 1.00 41.14 C ATOM 521 CD1 LEU A 33 -18.169 8.069 21.673 1.00 33.23 C ATOM 522 CD2 LEU A 33 -17.720 9.963 20.103 1.00 71.24 C ATOM 0 H LEU A 33 -19.568 12.227 20.222 1.00 43.35 H new ATOM 0 HA LEU A 33 -19.258 12.238 23.169 1.00 44.00 H new ATOM 0 HB2 LEU A 33 -19.253 9.995 23.181 1.00 14.24 H new ATOM 0 HB3 LEU A 33 -20.000 10.101 21.600 1.00 14.24 H new ATOM 0 HG LEU A 33 -17.027 9.813 22.115 1.00 41.14 H new ATOM 0 HD11 LEU A 33 -17.327 7.531 21.238 1.00 33.23 H new ATOM 0 HD12 LEU A 33 -18.269 7.797 22.724 1.00 33.23 H new ATOM 0 HD13 LEU A 33 -19.083 7.804 21.141 1.00 33.23 H new ATOM 0 HD21 LEU A 33 -16.884 9.399 19.689 1.00 71.24 H new ATOM 0 HD22 LEU A 33 -18.623 9.746 19.532 1.00 71.24 H new ATOM 0 HD23 LEU A 33 -17.502 11.029 20.045 1.00 71.24 H new ATOM 534 N THR A 34 -17.162 12.652 20.749 1.00 2.30 N ATOM 535 CA THR A 34 -15.800 13.046 20.409 1.00 32.34 C ATOM 536 C THR A 34 -15.213 13.967 21.473 1.00 63.25 C ATOM 537 O THR A 34 -15.942 14.677 22.165 1.00 3.14 O ATOM 538 CB THR A 34 -15.745 13.756 19.044 1.00 63.24 C ATOM 539 OG1 THR A 34 -16.770 13.246 18.184 1.00 31.52 O ATOM 540 CG2 THR A 34 -14.385 13.564 18.389 1.00 71.12 C ATOM 0 H THR A 34 -17.824 12.715 19.976 1.00 2.30 H new ATOM 0 HA THR A 34 -15.209 12.131 20.358 1.00 32.34 H new ATOM 0 HB THR A 34 -15.906 14.822 19.207 1.00 63.24 H new ATOM 0 HG1 THR A 34 -16.638 12.284 18.053 1.00 31.52 H new ATOM 0 HG21 THR A 34 -14.370 14.074 17.426 1.00 71.12 H new ATOM 0 HG22 THR A 34 -13.609 13.980 19.032 1.00 71.12 H new ATOM 0 HG23 THR A 34 -14.200 12.500 18.239 1.00 71.12 H new ATOM 548 N LYS A 35 -13.890 13.951 21.597 1.00 41.33 N ATOM 549 CA LYS A 35 -13.203 14.787 22.574 1.00 22.23 C ATOM 550 C LYS A 35 -12.811 16.128 21.964 1.00 43.44 C ATOM 551 O LYS A 35 -11.627 16.418 21.787 1.00 54.32 O ATOM 552 CB LYS A 35 -11.957 14.071 23.102 1.00 73.02 C ATOM 553 CG LYS A 35 -12.230 12.661 23.597 1.00 42.11 C ATOM 554 CD LYS A 35 -11.850 11.621 22.556 1.00 5.42 C ATOM 555 CE LYS A 35 -13.044 10.769 22.158 1.00 73.51 C ATOM 556 NZ LYS A 35 -12.634 9.572 21.371 1.00 13.34 N ATOM 0 H LYS A 35 -13.272 13.368 21.033 1.00 41.33 H new ATOM 0 HA LYS A 35 -13.888 14.971 23.402 1.00 22.23 H new ATOM 0 HB2 LYS A 35 -11.209 14.031 22.311 1.00 73.02 H new ATOM 0 HB3 LYS A 35 -11.529 14.656 23.916 1.00 73.02 H new ATOM 0 HG2 LYS A 35 -11.669 12.481 24.514 1.00 42.11 H new ATOM 0 HG3 LYS A 35 -13.287 12.560 23.845 1.00 42.11 H new ATOM 0 HD2 LYS A 35 -11.446 12.118 21.674 1.00 5.42 H new ATOM 0 HD3 LYS A 35 -11.061 10.981 22.951 1.00 5.42 H new ATOM 0 HE2 LYS A 35 -13.577 10.450 23.054 1.00 73.51 H new ATOM 0 HE3 LYS A 35 -13.739 11.369 21.571 1.00 73.51 H new ATOM 0 HZ1 LYS A 35 -13.459 8.956 21.220 1.00 13.34 H new ATOM 0 HZ2 LYS A 35 -12.255 9.875 20.451 1.00 13.34 H new ATOM 0 HZ3 LYS A 35 -11.902 9.048 21.892 1.00 13.34 H new ATOM 570 N ARG A 36 -13.811 16.943 21.645 1.00 40.32 N ATOM 571 CA ARG A 36 -13.570 18.254 21.054 1.00 1.34 C ATOM 572 C ARG A 36 -14.063 19.365 21.977 1.00 10.10 C ATOM 573 O ARG A 36 -14.986 19.167 22.767 1.00 21.15 O ATOM 574 CB ARG A 36 -14.263 18.360 19.695 1.00 54.30 C ATOM 575 CG ARG A 36 -15.065 17.124 19.322 1.00 65.32 C ATOM 576 CD ARG A 36 -16.415 17.103 20.020 1.00 53.41 C ATOM 577 NE ARG A 36 -17.486 16.667 19.128 1.00 70.22 N ATOM 578 CZ ARG A 36 -17.975 17.415 18.145 1.00 11.34 C ATOM 579 NH1 ARG A 36 -17.492 18.631 17.930 1.00 24.01 N ATOM 580 NH2 ARG A 36 -18.950 16.948 17.376 1.00 63.13 N ATOM 0 H ARG A 36 -14.796 16.719 21.786 1.00 40.32 H new ATOM 0 HA ARG A 36 -12.495 18.370 20.915 1.00 1.34 H new ATOM 0 HB2 ARG A 36 -14.926 19.225 19.701 1.00 54.30 H new ATOM 0 HB3 ARG A 36 -13.511 18.541 18.927 1.00 54.30 H new ATOM 0 HG2 ARG A 36 -15.212 17.097 18.242 1.00 65.32 H new ATOM 0 HG3 ARG A 36 -14.502 16.230 19.589 1.00 65.32 H new ATOM 0 HD2 ARG A 36 -16.367 16.437 20.882 1.00 53.41 H new ATOM 0 HD3 ARG A 36 -16.642 18.099 20.399 1.00 53.41 H new ATOM 0 HE ARG A 36 -17.880 15.737 19.267 1.00 70.22 H new ATOM 0 HH11 ARG A 36 -16.743 18.994 18.520 1.00 24.01 H new ATOM 0 HH12 ARG A 36 -17.869 19.203 17.175 1.00 24.01 H new ATOM 0 HH21 ARG A 36 -19.325 16.014 17.539 1.00 63.13 H new ATOM 0 HH22 ARG A 36 -19.325 17.523 16.622 1.00 63.13 H new ATOM 594 N LYS A 37 -13.441 20.535 21.871 1.00 32.53 N ATOM 595 CA LYS A 37 -13.816 21.678 22.695 1.00 41.14 C ATOM 596 C LYS A 37 -13.771 21.320 24.177 1.00 73.45 C ATOM 597 O LYS A 37 -12.727 21.427 24.820 1.00 52.33 O ATOM 598 CB LYS A 37 -15.217 22.166 22.319 1.00 71.20 C ATOM 599 CG LYS A 37 -15.286 22.825 20.952 1.00 23.22 C ATOM 600 CD LYS A 37 -15.258 24.340 21.062 1.00 44.13 C ATOM 601 CE LYS A 37 -13.893 24.900 20.691 1.00 10.50 C ATOM 602 NZ LYS A 37 -14.006 26.157 19.900 1.00 2.10 N ATOM 0 H LYS A 37 -12.675 20.716 21.222 1.00 32.53 H new ATOM 0 HA LYS A 37 -13.098 22.477 22.511 1.00 41.14 H new ATOM 0 HB2 LYS A 37 -15.905 21.321 22.340 1.00 71.20 H new ATOM 0 HB3 LYS A 37 -15.560 22.875 23.072 1.00 71.20 H new ATOM 0 HG2 LYS A 37 -14.448 22.488 20.342 1.00 23.22 H new ATOM 0 HG3 LYS A 37 -16.197 22.513 20.442 1.00 23.22 H new ATOM 0 HD2 LYS A 37 -16.018 24.768 20.408 1.00 44.13 H new ATOM 0 HD3 LYS A 37 -15.510 24.637 22.080 1.00 44.13 H new ATOM 0 HE2 LYS A 37 -13.320 25.092 21.598 1.00 10.50 H new ATOM 0 HE3 LYS A 37 -13.340 24.157 20.116 1.00 10.50 H new ATOM 0 HZ1 LYS A 37 -13.055 26.507 19.667 1.00 2.10 H new ATOM 0 HZ2 LYS A 37 -14.531 25.969 19.022 1.00 2.10 H new ATOM 0 HZ3 LYS A 37 -14.512 26.874 20.458 1.00 2.10 H new ATOM 616 N SER A 38 -14.910 20.892 24.712 1.00 72.21 N ATOM 617 CA SER A 38 -15.001 20.519 26.119 1.00 51.42 C ATOM 618 C SER A 38 -13.916 19.511 26.485 1.00 11.31 C ATOM 619 O SER A 38 -13.032 19.215 25.682 1.00 45.41 O ATOM 620 CB SER A 38 -16.381 19.934 26.425 1.00 11.42 C ATOM 621 OG SER A 38 -16.873 20.411 27.666 1.00 53.34 O ATOM 0 H SER A 38 -15.782 20.795 24.193 1.00 72.21 H new ATOM 0 HA SER A 38 -14.854 21.418 26.718 1.00 51.42 H new ATOM 0 HB2 SER A 38 -17.076 20.199 25.628 1.00 11.42 H new ATOM 0 HB3 SER A 38 -16.321 18.846 26.448 1.00 11.42 H new ATOM 0 HG SER A 38 -17.757 20.024 27.838 1.00 53.34 H new ATOM 627 N SER A 39 -13.991 18.987 27.704 1.00 14.34 N ATOM 628 CA SER A 39 -13.014 18.015 28.180 1.00 13.12 C ATOM 629 C SER A 39 -11.698 18.698 28.537 1.00 44.30 C ATOM 630 O SER A 39 -11.597 19.925 28.518 1.00 14.13 O ATOM 631 CB SER A 39 -12.773 16.941 27.118 1.00 71.01 C ATOM 632 OG SER A 39 -13.991 16.534 26.519 1.00 71.41 O ATOM 0 H SER A 39 -14.718 19.219 28.380 1.00 14.34 H new ATOM 0 HA SER A 39 -13.414 17.544 29.078 1.00 13.12 H new ATOM 0 HB2 SER A 39 -12.099 17.326 26.353 1.00 71.01 H new ATOM 0 HB3 SER A 39 -12.282 16.080 27.572 1.00 71.01 H new ATOM 0 HG SER A 39 -13.810 15.848 25.843 1.00 71.41 H new ATOM 638 N TRP A 40 -10.691 17.895 28.861 1.00 0.14 N ATOM 639 CA TRP A 40 -9.380 18.421 29.223 1.00 45.32 C ATOM 640 C TRP A 40 -8.328 18.015 28.196 1.00 31.12 C ATOM 641 O TRP A 40 -7.170 18.423 28.285 1.00 11.31 O ATOM 642 CB TRP A 40 -8.973 17.925 30.611 1.00 11.04 C ATOM 643 CG TRP A 40 -8.758 16.443 30.673 1.00 11.00 C ATOM 644 CD1 TRP A 40 -7.620 15.765 30.339 1.00 13.44 C ATOM 645 CD2 TRP A 40 -9.707 15.456 31.092 1.00 1.21 C ATOM 646 NE1 TRP A 40 -7.805 14.417 30.526 1.00 63.42 N ATOM 647 CE2 TRP A 40 -9.076 14.201 30.988 1.00 70.01 C ATOM 648 CE3 TRP A 40 -11.027 15.511 31.547 1.00 20.42 C ATOM 649 CZ2 TRP A 40 -9.722 13.014 31.321 1.00 32.50 C ATOM 650 CZ3 TRP A 40 -11.667 14.331 31.877 1.00 0.12 C ATOM 651 CH2 TRP A 40 -11.014 13.096 31.764 1.00 54.44 C ATOM 0 H TRP A 40 -10.757 16.877 28.880 1.00 0.14 H new ATOM 0 HA TRP A 40 -9.445 19.509 29.239 1.00 45.32 H new ATOM 0 HB2 TRP A 40 -8.057 18.431 30.915 1.00 11.04 H new ATOM 0 HB3 TRP A 40 -9.744 18.203 31.329 1.00 11.04 H new ATOM 0 HD1 TRP A 40 -6.709 16.222 29.981 1.00 13.44 H new ATOM 0 HE1 TRP A 40 -7.108 13.693 30.349 1.00 63.42 H new ATOM 0 HE3 TRP A 40 -11.538 16.458 31.639 1.00 20.42 H new ATOM 0 HZ2 TRP A 40 -9.221 12.061 31.233 1.00 32.50 H new ATOM 0 HZ3 TRP A 40 -12.688 14.361 32.228 1.00 0.12 H new ATOM 0 HH2 TRP A 40 -11.541 12.192 32.032 1.00 54.44 H new ATOM 662 N ASP A 41 -8.738 17.209 27.223 1.00 53.21 N ATOM 663 CA ASP A 41 -7.831 16.749 26.178 1.00 30.32 C ATOM 664 C ASP A 41 -8.465 16.907 24.800 1.00 61.54 C ATOM 665 O ASP A 41 -9.688 16.966 24.670 1.00 62.15 O ATOM 666 CB ASP A 41 -7.449 15.287 26.413 1.00 23.51 C ATOM 667 CG ASP A 41 -6.016 14.991 26.014 1.00 12.43 C ATOM 668 OD1 ASP A 41 -5.781 14.689 24.825 1.00 11.43 O ATOM 669 OD2 ASP A 41 -5.130 15.063 26.891 1.00 41.21 O ATOM 0 H ASP A 41 -9.693 16.861 27.136 1.00 53.21 H new ATOM 0 HA ASP A 41 -6.931 17.362 26.216 1.00 30.32 H new ATOM 0 HB2 ASP A 41 -7.587 15.043 27.466 1.00 23.51 H new ATOM 0 HB3 ASP A 41 -8.121 14.643 25.846 1.00 23.51 H new ATOM 674 N LYS A 42 -7.625 16.975 23.772 1.00 31.03 N ATOM 675 CA LYS A 42 -8.102 17.126 22.403 1.00 63.24 C ATOM 676 C LYS A 42 -7.627 15.968 21.531 1.00 61.24 C ATOM 677 O LYS A 42 -6.742 16.134 20.691 1.00 14.02 O ATOM 678 CB LYS A 42 -7.616 18.453 21.815 1.00 32.11 C ATOM 679 CG LYS A 42 -7.443 19.550 22.851 1.00 22.35 C ATOM 680 CD LYS A 42 -8.115 20.841 22.415 1.00 61.31 C ATOM 681 CE LYS A 42 -9.599 20.837 22.747 1.00 31.54 C ATOM 682 NZ LYS A 42 -9.998 22.047 23.517 1.00 15.11 N ATOM 0 H LYS A 42 -6.610 16.928 23.862 1.00 31.03 H new ATOM 0 HA LYS A 42 -9.192 17.121 22.422 1.00 63.24 H new ATOM 0 HB2 LYS A 42 -6.665 18.290 21.309 1.00 32.11 H new ATOM 0 HB3 LYS A 42 -8.326 18.788 21.059 1.00 32.11 H new ATOM 0 HG2 LYS A 42 -7.864 19.223 23.802 1.00 22.35 H new ATOM 0 HG3 LYS A 42 -6.381 19.730 23.017 1.00 22.35 H new ATOM 0 HD2 LYS A 42 -7.634 21.687 22.906 1.00 61.31 H new ATOM 0 HD3 LYS A 42 -7.982 20.977 21.342 1.00 61.31 H new ATOM 0 HE2 LYS A 42 -10.177 20.786 21.825 1.00 31.54 H new ATOM 0 HE3 LYS A 42 -9.840 19.944 23.324 1.00 31.54 H new ATOM 0 HZ1 LYS A 42 -10.928 21.889 23.954 1.00 15.11 H new ATOM 0 HZ2 LYS A 42 -9.294 22.234 24.259 1.00 15.11 H new ATOM 0 HZ3 LYS A 42 -10.051 22.865 22.876 1.00 15.11 H new ATOM 696 N GLN A 43 -8.221 14.797 21.735 1.00 73.31 N ATOM 697 CA GLN A 43 -7.859 13.612 20.966 1.00 5.10 C ATOM 698 C GLN A 43 -9.063 13.067 20.205 1.00 3.21 C ATOM 699 O GLN A 43 -9.354 11.871 20.230 1.00 13.31 O ATOM 700 CB GLN A 43 -7.293 12.532 21.890 1.00 43.21 C ATOM 701 CG GLN A 43 -5.829 12.214 21.629 1.00 12.32 C ATOM 702 CD GLN A 43 -5.154 11.558 22.817 1.00 31.32 C ATOM 703 OE1 GLN A 43 -4.653 12.236 23.714 1.00 1.22 O ATOM 704 NE2 GLN A 43 -5.137 10.230 22.830 1.00 75.13 N ATOM 0 H GLN A 43 -8.955 14.643 22.426 1.00 73.31 H new ATOM 0 HA GLN A 43 -7.095 13.899 20.243 1.00 5.10 H new ATOM 0 HB2 GLN A 43 -7.407 12.855 22.925 1.00 43.21 H new ATOM 0 HB3 GLN A 43 -7.880 11.621 21.773 1.00 43.21 H new ATOM 0 HG2 GLN A 43 -5.753 11.556 20.763 1.00 12.32 H new ATOM 0 HG3 GLN A 43 -5.301 13.134 21.378 1.00 12.32 H new ATOM 0 HE21 GLN A 43 -5.564 9.707 22.066 1.00 75.13 H new ATOM 0 HE22 GLN A 43 -4.697 9.733 23.604 1.00 75.13 H new ATOM 713 N PRO A 44 -9.780 13.964 19.512 1.00 34.40 N ATOM 714 CA PRO A 44 -10.965 13.596 18.730 1.00 22.45 C ATOM 715 C PRO A 44 -10.612 12.776 17.494 1.00 43.10 C ATOM 716 O PRO A 44 -9.756 13.170 16.702 1.00 74.24 O ATOM 717 CB PRO A 44 -11.556 14.948 18.325 1.00 74.22 C ATOM 718 CG PRO A 44 -10.400 15.887 18.341 1.00 13.32 C ATOM 719 CD PRO A 44 -9.491 15.405 19.437 1.00 3.44 C ATOM 0 HA PRO A 44 -11.651 12.969 19.300 1.00 22.45 H new ATOM 0 HB2 PRO A 44 -12.013 14.900 17.337 1.00 74.22 H new ATOM 0 HB3 PRO A 44 -12.333 15.265 19.021 1.00 74.22 H new ATOM 0 HG2 PRO A 44 -9.886 15.889 17.380 1.00 13.32 H new ATOM 0 HG3 PRO A 44 -10.730 16.909 18.528 1.00 13.32 H new ATOM 0 HD2 PRO A 44 -8.443 15.593 19.202 1.00 3.44 H new ATOM 0 HD3 PRO A 44 -9.700 15.906 20.382 1.00 3.44 H new ATOM 727 N GLN A 45 -11.276 11.636 17.336 1.00 70.12 N ATOM 728 CA GLN A 45 -11.031 10.761 16.195 1.00 50.50 C ATOM 729 C GLN A 45 -12.195 10.811 15.211 1.00 13.12 C ATOM 730 O GLN A 45 -12.281 9.994 14.294 1.00 22.32 O ATOM 731 CB GLN A 45 -10.807 9.324 16.666 1.00 31.44 C ATOM 732 CG GLN A 45 -10.726 8.317 15.530 1.00 24.35 C ATOM 733 CD GLN A 45 -9.998 7.047 15.927 1.00 45.42 C ATOM 734 OE1 GLN A 45 -8.844 6.837 15.551 1.00 21.33 O ATOM 735 NE2 GLN A 45 -10.669 6.193 16.690 1.00 0.22 N ATOM 0 H GLN A 45 -11.988 11.296 17.983 1.00 70.12 H new ATOM 0 HA GLN A 45 -10.134 11.112 15.686 1.00 50.50 H new ATOM 0 HB2 GLN A 45 -9.885 9.280 17.246 1.00 31.44 H new ATOM 0 HB3 GLN A 45 -11.619 9.039 17.336 1.00 31.44 H new ATOM 0 HG2 GLN A 45 -11.734 8.066 15.200 1.00 24.35 H new ATOM 0 HG3 GLN A 45 -10.217 8.773 14.681 1.00 24.35 H new ATOM 0 HE21 GLN A 45 -11.624 6.408 16.978 1.00 0.22 H new ATOM 0 HE22 GLN A 45 -10.230 5.322 16.988 1.00 0.22 H new ATOM 744 N ILE A 46 -13.089 11.774 15.408 1.00 13.12 N ATOM 745 CA ILE A 46 -14.248 11.930 14.538 1.00 41.03 C ATOM 746 C ILE A 46 -15.382 11.002 14.960 1.00 1.23 C ATOM 747 O ILE A 46 -16.557 11.313 14.764 1.00 32.05 O ATOM 748 CB ILE A 46 -13.889 11.647 13.067 1.00 72.11 C ATOM 749 CG1 ILE A 46 -14.474 12.731 12.159 1.00 60.31 C ATOM 750 CG2 ILE A 46 -14.394 10.273 12.654 1.00 73.44 C ATOM 751 CD1 ILE A 46 -13.486 13.820 11.804 1.00 62.51 C ATOM 0 H ILE A 46 -13.033 12.458 16.163 1.00 13.12 H new ATOM 0 HA ILE A 46 -14.576 12.965 14.632 1.00 41.03 H new ATOM 0 HB ILE A 46 -12.804 11.660 12.964 1.00 72.11 H new ATOM 0 HG12 ILE A 46 -14.837 12.268 11.241 1.00 60.31 H new ATOM 0 HG13 ILE A 46 -15.336 13.180 12.652 1.00 60.31 H new ATOM 0 HG21 ILE A 46 -14.133 10.087 11.612 1.00 73.44 H new ATOM 0 HG22 ILE A 46 -13.934 9.512 13.284 1.00 73.44 H new ATOM 0 HG23 ILE A 46 -15.477 10.234 12.769 1.00 73.44 H new ATOM 0 HD11 ILE A 46 -13.969 14.553 11.159 1.00 62.51 H new ATOM 0 HD12 ILE A 46 -13.141 14.309 12.715 1.00 62.51 H new ATOM 0 HD13 ILE A 46 -12.635 13.383 11.282 1.00 62.51 H new ATOM 763 N ILE A 47 -15.021 9.863 15.542 1.00 14.42 N ATOM 764 CA ILE A 47 -16.009 8.892 15.995 1.00 21.35 C ATOM 765 C ILE A 47 -17.149 9.575 16.742 1.00 34.45 C ATOM 766 O ILE A 47 -16.944 10.572 17.434 1.00 44.42 O ATOM 767 CB ILE A 47 -15.374 7.829 16.912 1.00 43.14 C ATOM 768 CG1 ILE A 47 -15.222 8.375 18.333 1.00 63.20 C ATOM 769 CG2 ILE A 47 -14.025 7.391 16.359 1.00 13.44 C ATOM 770 CD1 ILE A 47 -14.156 9.441 18.460 1.00 33.12 C ATOM 0 H ILE A 47 -14.053 9.590 15.711 1.00 14.42 H new ATOM 0 HA ILE A 47 -16.403 8.404 15.104 1.00 21.35 H new ATOM 0 HB ILE A 47 -16.031 6.960 16.946 1.00 43.14 H new ATOM 0 HG12 ILE A 47 -16.177 8.787 18.659 1.00 63.20 H new ATOM 0 HG13 ILE A 47 -14.983 7.552 19.006 1.00 63.20 H new ATOM 0 HG21 ILE A 47 -13.588 6.640 17.017 1.00 13.44 H new ATOM 0 HG22 ILE A 47 -14.160 6.967 15.364 1.00 13.44 H new ATOM 0 HG23 ILE A 47 -13.359 8.252 16.299 1.00 13.44 H new ATOM 0 HD11 ILE A 47 -14.104 9.782 19.494 1.00 33.12 H new ATOM 0 HD12 ILE A 47 -13.191 9.028 18.165 1.00 33.12 H new ATOM 0 HD13 ILE A 47 -14.404 10.282 17.813 1.00 33.12 H new ATOM 782 N PHE A 48 -18.353 9.029 16.600 1.00 1.40 N ATOM 783 CA PHE A 48 -19.527 9.585 17.262 1.00 13.31 C ATOM 784 C PHE A 48 -20.553 8.494 17.557 1.00 42.52 C ATOM 785 O PHE A 48 -20.495 7.405 16.988 1.00 33.22 O ATOM 786 CB PHE A 48 -20.160 10.675 16.394 1.00 33.02 C ATOM 787 CG PHE A 48 -20.659 10.172 15.070 1.00 55.01 C ATOM 788 CD1 PHE A 48 -19.773 9.711 14.110 1.00 40.41 C ATOM 789 CD2 PHE A 48 -22.015 10.160 14.785 1.00 54.41 C ATOM 790 CE1 PHE A 48 -20.229 9.248 12.890 1.00 30.44 C ATOM 791 CE2 PHE A 48 -22.477 9.697 13.567 1.00 13.44 C ATOM 792 CZ PHE A 48 -21.583 9.242 12.618 1.00 31.45 C ATOM 0 H PHE A 48 -18.541 8.202 16.033 1.00 1.40 H new ATOM 0 HA PHE A 48 -19.207 10.023 18.207 1.00 13.31 H new ATOM 0 HB2 PHE A 48 -20.990 11.126 16.939 1.00 33.02 H new ATOM 0 HB3 PHE A 48 -19.427 11.463 16.221 1.00 33.02 H new ATOM 0 HD1 PHE A 48 -18.713 9.713 14.317 1.00 40.41 H new ATOM 0 HD2 PHE A 48 -22.719 10.516 15.523 1.00 54.41 H new ATOM 0 HE1 PHE A 48 -19.527 8.891 12.150 1.00 30.44 H new ATOM 0 HE2 PHE A 48 -23.537 9.691 13.358 1.00 13.44 H new ATOM 0 HZ PHE A 48 -21.942 8.882 11.665 1.00 31.45 H new ATOM 802 N GLU A 49 -21.490 8.797 18.450 1.00 3.12 N ATOM 803 CA GLU A 49 -22.527 7.842 18.822 1.00 60.14 C ATOM 804 C GLU A 49 -23.883 8.267 18.264 1.00 24.14 C ATOM 805 O GLU A 49 -24.154 9.457 18.105 1.00 51.33 O ATOM 806 CB GLU A 49 -22.608 7.709 20.344 1.00 41.32 C ATOM 807 CG GLU A 49 -21.313 7.236 20.983 1.00 12.32 C ATOM 808 CD GLU A 49 -21.304 7.422 22.488 1.00 20.21 C ATOM 809 OE1 GLU A 49 -21.062 8.558 22.945 1.00 43.30 O ATOM 810 OE2 GLU A 49 -21.540 6.429 23.209 1.00 44.41 O ATOM 0 H GLU A 49 -21.552 9.695 18.929 1.00 3.12 H new ATOM 0 HA GLU A 49 -22.264 6.874 18.394 1.00 60.14 H new ATOM 0 HB2 GLU A 49 -22.883 8.674 20.771 1.00 41.32 H new ATOM 0 HB3 GLU A 49 -23.405 7.010 20.597 1.00 41.32 H new ATOM 0 HG2 GLU A 49 -21.161 6.182 20.750 1.00 12.32 H new ATOM 0 HG3 GLU A 49 -20.476 7.783 20.548 1.00 12.32 H new ATOM 817 N ILE A 50 -24.729 7.285 17.970 1.00 4.51 N ATOM 818 CA ILE A 50 -26.055 7.557 17.431 1.00 15.25 C ATOM 819 C ILE A 50 -27.125 6.772 18.183 1.00 12.31 C ATOM 820 O ILE A 50 -26.954 5.588 18.472 1.00 33.54 O ATOM 821 CB ILE A 50 -26.137 7.209 15.933 1.00 0.34 C ATOM 822 CG1 ILE A 50 -25.358 8.234 15.106 1.00 24.04 C ATOM 823 CG2 ILE A 50 -27.589 7.150 15.482 1.00 65.23 C ATOM 824 CD1 ILE A 50 -26.129 9.507 14.839 1.00 0.54 C ATOM 0 H ILE A 50 -24.519 6.295 18.096 1.00 4.51 H new ATOM 0 HA ILE A 50 -26.234 8.625 17.557 1.00 15.25 H new ATOM 0 HB ILE A 50 -25.688 6.228 15.778 1.00 0.34 H new ATOM 0 HG12 ILE A 50 -24.433 8.482 15.627 1.00 24.04 H new ATOM 0 HG13 ILE A 50 -25.077 7.783 14.154 1.00 24.04 H new ATOM 0 HG21 ILE A 50 -27.631 6.903 14.421 1.00 65.23 H new ATOM 0 HG22 ILE A 50 -28.117 6.386 16.053 1.00 65.23 H new ATOM 0 HG23 ILE A 50 -28.061 8.118 15.648 1.00 65.23 H new ATOM 0 HD11 ILE A 50 -25.515 10.187 14.248 1.00 0.54 H new ATOM 0 HD12 ILE A 50 -27.041 9.272 14.290 1.00 0.54 H new ATOM 0 HD13 ILE A 50 -26.387 9.981 15.786 1.00 0.54 H new ATOM 836 N THR A 51 -28.231 7.440 18.496 1.00 54.21 N ATOM 837 CA THR A 51 -29.330 6.806 19.213 1.00 31.11 C ATOM 838 C THR A 51 -30.246 6.049 18.258 1.00 51.30 C ATOM 839 O THR A 51 -30.669 6.585 17.232 1.00 32.45 O ATOM 840 CB THR A 51 -30.163 7.840 19.994 1.00 41.23 C ATOM 841 OG1 THR A 51 -29.315 8.593 20.868 1.00 23.21 O ATOM 842 CG2 THR A 51 -31.255 7.156 20.803 1.00 41.54 C ATOM 0 H THR A 51 -28.389 8.421 18.264 1.00 54.21 H new ATOM 0 HA THR A 51 -28.884 6.104 19.917 1.00 31.11 H new ATOM 0 HB THR A 51 -30.632 8.512 19.276 1.00 41.23 H new ATOM 0 HG1 THR A 51 -29.852 9.249 21.359 1.00 23.21 H new ATOM 0 HG21 THR A 51 -31.830 7.906 21.346 1.00 41.54 H new ATOM 0 HG22 THR A 51 -31.916 6.608 20.132 1.00 41.54 H new ATOM 0 HG23 THR A 51 -30.802 6.463 21.512 1.00 41.54 H new ATOM 850 N LEU A 52 -30.550 4.802 18.601 1.00 41.35 N ATOM 851 CA LEU A 52 -31.418 3.971 17.773 1.00 4.30 C ATOM 852 C LEU A 52 -32.471 3.269 18.623 1.00 30.43 C ATOM 853 O LEU A 52 -32.282 3.069 19.823 1.00 31.24 O ATOM 854 CB LEU A 52 -30.589 2.937 17.009 1.00 31.23 C ATOM 855 CG LEU A 52 -29.933 3.424 15.717 1.00 73.23 C ATOM 856 CD1 LEU A 52 -29.332 2.256 14.950 1.00 20.03 C ATOM 857 CD2 LEU A 52 -30.943 4.167 14.854 1.00 45.31 C ATOM 0 H LEU A 52 -30.209 4.344 19.446 1.00 41.35 H new ATOM 0 HA LEU A 52 -31.927 4.618 17.059 1.00 4.30 H new ATOM 0 HB2 LEU A 52 -29.807 2.566 17.672 1.00 31.23 H new ATOM 0 HB3 LEU A 52 -31.232 2.090 16.769 1.00 31.23 H new ATOM 0 HG LEU A 52 -29.130 4.113 15.977 1.00 73.23 H new ATOM 0 HD11 LEU A 52 -28.870 2.622 14.033 1.00 20.03 H new ATOM 0 HD12 LEU A 52 -28.578 1.766 15.566 1.00 20.03 H new ATOM 0 HD13 LEU A 52 -30.117 1.542 14.700 1.00 20.03 H new ATOM 0 HD21 LEU A 52 -30.459 4.507 13.938 1.00 45.31 H new ATOM 0 HD22 LEU A 52 -31.767 3.500 14.603 1.00 45.31 H new ATOM 0 HD23 LEU A 52 -31.327 5.027 15.402 1.00 45.31 H new ATOM 869 N ARG A 53 -33.579 2.894 17.993 1.00 55.11 N ATOM 870 CA ARG A 53 -34.663 2.213 18.691 1.00 25.54 C ATOM 871 C ARG A 53 -35.757 1.789 17.716 1.00 11.41 C ATOM 872 O ARG A 53 -35.771 2.214 16.561 1.00 62.33 O ATOM 873 CB ARG A 53 -35.251 3.120 19.773 1.00 13.20 C ATOM 874 CG ARG A 53 -35.880 4.391 19.226 1.00 44.44 C ATOM 875 CD ARG A 53 -35.140 5.630 19.706 1.00 1.02 C ATOM 876 NE ARG A 53 -35.525 6.005 21.064 1.00 53.41 N ATOM 877 CZ ARG A 53 -36.698 6.547 21.372 1.00 55.45 C ATOM 878 NH1 ARG A 53 -37.596 6.776 20.423 1.00 71.31 N ATOM 879 NH2 ARG A 53 -36.976 6.862 22.631 1.00 62.35 N ATOM 0 H ARG A 53 -33.750 3.050 17.000 1.00 55.11 H new ATOM 0 HA ARG A 53 -34.253 1.319 19.160 1.00 25.54 H new ATOM 0 HB2 ARG A 53 -36.003 2.564 20.332 1.00 13.20 H new ATOM 0 HB3 ARG A 53 -34.464 3.388 20.478 1.00 13.20 H new ATOM 0 HG2 ARG A 53 -35.874 4.362 18.136 1.00 44.44 H new ATOM 0 HG3 ARG A 53 -36.923 4.445 19.538 1.00 44.44 H new ATOM 0 HD2 ARG A 53 -34.066 5.447 19.671 1.00 1.02 H new ATOM 0 HD3 ARG A 53 -35.344 6.459 19.029 1.00 1.02 H new ATOM 0 HE ARG A 53 -34.857 5.842 21.817 1.00 53.41 H new ATOM 0 HH11 ARG A 53 -37.387 6.536 19.454 1.00 71.31 H new ATOM 0 HH12 ARG A 53 -38.496 7.192 20.662 1.00 71.31 H new ATOM 0 HH21 ARG A 53 -36.288 6.688 23.364 1.00 62.35 H new ATOM 0 HH22 ARG A 53 -37.877 7.278 22.866 1.00 62.35 H new ATOM 893 N SER A 54 -36.673 0.950 18.190 1.00 44.32 N ATOM 894 CA SER A 54 -37.769 0.466 17.359 1.00 43.22 C ATOM 895 C SER A 54 -38.636 1.624 16.875 1.00 51.20 C ATOM 896 O SER A 54 -38.512 2.751 17.355 1.00 32.15 O ATOM 897 CB SER A 54 -38.623 -0.535 18.138 1.00 74.53 C ATOM 898 OG SER A 54 -38.149 -1.859 17.958 1.00 11.33 O ATOM 0 H SER A 54 -36.678 0.592 19.145 1.00 44.32 H new ATOM 0 HA SER A 54 -37.341 -0.032 16.489 1.00 43.22 H new ATOM 0 HB2 SER A 54 -38.610 -0.282 19.198 1.00 74.53 H new ATOM 0 HB3 SER A 54 -39.659 -0.468 17.807 1.00 74.53 H new ATOM 0 HG SER A 54 -38.046 -2.291 18.832 1.00 11.33 H new ATOM 904 N VAL A 55 -39.515 1.338 15.920 1.00 52.12 N ATOM 905 CA VAL A 55 -40.405 2.354 15.370 1.00 0.14 C ATOM 906 C VAL A 55 -41.605 2.584 16.282 1.00 53.43 C ATOM 907 O VAL A 55 -42.159 3.683 16.330 1.00 74.31 O ATOM 908 CB VAL A 55 -40.907 1.962 13.968 1.00 22.30 C ATOM 909 CG1 VAL A 55 -39.741 1.836 12.999 1.00 22.24 C ATOM 910 CG2 VAL A 55 -41.701 0.666 14.030 1.00 33.02 C ATOM 0 H VAL A 55 -39.630 0.411 15.511 1.00 52.12 H new ATOM 0 HA VAL A 55 -39.827 3.275 15.295 1.00 0.14 H new ATOM 0 HB VAL A 55 -41.567 2.749 13.604 1.00 22.30 H new ATOM 0 HG11 VAL A 55 -40.115 1.558 12.014 1.00 22.24 H new ATOM 0 HG12 VAL A 55 -39.218 2.790 12.933 1.00 22.24 H new ATOM 0 HG13 VAL A 55 -39.053 1.069 13.355 1.00 22.24 H new ATOM 0 HG21 VAL A 55 -42.048 0.404 13.031 1.00 33.02 H new ATOM 0 HG22 VAL A 55 -41.066 -0.132 14.414 1.00 33.02 H new ATOM 0 HG23 VAL A 55 -42.559 0.796 14.690 1.00 33.02 H new ATOM 920 N ASP A 56 -42.002 1.542 17.003 1.00 24.13 N ATOM 921 CA ASP A 56 -43.136 1.630 17.915 1.00 10.35 C ATOM 922 C ASP A 56 -42.685 1.453 19.362 1.00 12.51 C ATOM 923 O ASP A 56 -41.490 1.455 19.656 1.00 44.20 O ATOM 924 CB ASP A 56 -44.185 0.575 17.562 1.00 31.25 C ATOM 925 CG ASP A 56 -45.600 1.059 17.812 1.00 20.53 C ATOM 926 OD1 ASP A 56 -46.170 1.714 16.915 1.00 25.10 O ATOM 927 OD2 ASP A 56 -46.137 0.783 18.905 1.00 34.55 O ATOM 0 H ASP A 56 -41.555 0.626 16.974 1.00 24.13 H new ATOM 0 HA ASP A 56 -43.579 2.620 17.810 1.00 10.35 H new ATOM 0 HB2 ASP A 56 -44.079 0.298 16.513 1.00 31.25 H new ATOM 0 HB3 ASP A 56 -44.003 -0.325 18.149 1.00 31.25 H new ATOM 932 N LYS A 57 -43.650 1.302 20.263 1.00 52.02 N ATOM 933 CA LYS A 57 -43.354 1.124 21.679 1.00 32.23 C ATOM 934 C LYS A 57 -43.805 -0.251 22.161 1.00 73.53 C ATOM 935 O LYS A 57 -43.312 -0.759 23.168 1.00 53.44 O ATOM 936 CB LYS A 57 -44.039 2.215 22.506 1.00 63.03 C ATOM 937 CG LYS A 57 -43.693 3.624 22.057 1.00 11.43 C ATOM 938 CD LYS A 57 -42.203 3.898 22.176 1.00 71.33 C ATOM 939 CE LYS A 57 -41.918 5.014 23.168 1.00 13.42 C ATOM 940 NZ LYS A 57 -40.657 5.737 22.844 1.00 71.42 N ATOM 0 H LYS A 57 -44.645 1.299 20.037 1.00 52.02 H new ATOM 0 HA LYS A 57 -42.275 1.200 21.810 1.00 32.23 H new ATOM 0 HB2 LYS A 57 -45.119 2.079 22.448 1.00 63.03 H new ATOM 0 HB3 LYS A 57 -43.758 2.097 23.553 1.00 63.03 H new ATOM 0 HG2 LYS A 57 -44.008 3.765 21.023 1.00 11.43 H new ATOM 0 HG3 LYS A 57 -44.246 4.345 22.660 1.00 11.43 H new ATOM 0 HD2 LYS A 57 -41.689 2.990 22.491 1.00 71.33 H new ATOM 0 HD3 LYS A 57 -41.803 4.168 21.199 1.00 71.33 H new ATOM 0 HE2 LYS A 57 -42.750 5.718 23.171 1.00 13.42 H new ATOM 0 HE3 LYS A 57 -41.850 4.598 24.173 1.00 13.42 H new ATOM 0 HZ1 LYS A 57 -40.499 6.490 23.544 1.00 71.42 H new ATOM 0 HZ2 LYS A 57 -39.859 5.070 22.866 1.00 71.42 H new ATOM 0 HZ3 LYS A 57 -40.731 6.156 21.895 1.00 71.42 H new ATOM 954 N GLU A 58 -44.744 -0.850 21.434 1.00 41.55 N ATOM 955 CA GLU A 58 -45.260 -2.167 21.787 1.00 1.45 C ATOM 956 C GLU A 58 -44.877 -3.202 20.734 1.00 54.03 C ATOM 957 O GLU A 58 -44.824 -2.917 19.537 1.00 11.43 O ATOM 958 CB GLU A 58 -46.781 -2.118 21.942 1.00 34.20 C ATOM 959 CG GLU A 58 -47.483 -1.368 20.823 1.00 53.43 C ATOM 960 CD GLU A 58 -48.993 -1.392 20.961 1.00 31.12 C ATOM 961 OE1 GLU A 58 -49.522 -2.370 21.530 1.00 44.11 O ATOM 962 OE2 GLU A 58 -49.646 -0.432 20.500 1.00 30.25 O ATOM 0 H GLU A 58 -45.162 -0.444 20.597 1.00 41.55 H new ATOM 0 HA GLU A 58 -44.815 -2.461 22.738 1.00 1.45 H new ATOM 0 HB2 GLU A 58 -47.167 -3.137 21.983 1.00 34.20 H new ATOM 0 HB3 GLU A 58 -47.026 -1.646 22.894 1.00 34.20 H new ATOM 0 HG2 GLU A 58 -47.139 -0.334 20.813 1.00 53.43 H new ATOM 0 HG3 GLU A 58 -47.203 -1.806 19.865 1.00 53.43 H new ATOM 969 N PRO A 59 -44.604 -4.434 21.187 1.00 21.25 N ATOM 970 CA PRO A 59 -44.664 -4.785 22.609 1.00 24.54 C ATOM 971 C PRO A 59 -43.544 -4.134 23.415 1.00 75.31 C ATOM 972 O PRO A 59 -43.524 -4.212 24.643 1.00 0.34 O ATOM 973 CB PRO A 59 -44.504 -6.308 22.606 1.00 43.22 C ATOM 974 CG PRO A 59 -43.765 -6.608 21.348 1.00 63.05 C ATOM 975 CD PRO A 59 -44.215 -5.579 20.347 1.00 21.34 C ATOM 0 HA PRO A 59 -45.587 -4.440 23.075 1.00 24.54 H new ATOM 0 HB2 PRO A 59 -43.951 -6.650 23.481 1.00 43.22 H new ATOM 0 HB3 PRO A 59 -45.472 -6.808 22.625 1.00 43.22 H new ATOM 0 HG2 PRO A 59 -42.688 -6.554 21.506 1.00 63.05 H new ATOM 0 HG3 PRO A 59 -43.985 -7.616 20.997 1.00 63.05 H new ATOM 0 HD2 PRO A 59 -43.416 -5.316 19.654 1.00 21.34 H new ATOM 0 HD3 PRO A 59 -45.051 -5.940 19.748 1.00 21.34 H new ATOM 983 N VAL A 60 -42.615 -3.492 22.715 1.00 5.22 N ATOM 984 CA VAL A 60 -41.493 -2.825 23.366 1.00 63.43 C ATOM 985 C VAL A 60 -40.954 -1.689 22.504 1.00 10.11 C ATOM 986 O VAL A 60 -41.459 -1.432 21.412 1.00 74.31 O ATOM 987 CB VAL A 60 -40.350 -3.814 23.665 1.00 0.34 C ATOM 988 CG1 VAL A 60 -40.871 -5.012 24.444 1.00 62.33 C ATOM 989 CG2 VAL A 60 -39.677 -4.257 22.375 1.00 53.00 C ATOM 0 H VAL A 60 -42.617 -3.419 21.698 1.00 5.22 H new ATOM 0 HA VAL A 60 -41.868 -2.418 24.305 1.00 63.43 H new ATOM 0 HB VAL A 60 -39.606 -3.307 24.280 1.00 0.34 H new ATOM 0 HG11 VAL A 60 -40.050 -5.700 24.646 1.00 62.33 H new ATOM 0 HG12 VAL A 60 -41.301 -4.674 25.387 1.00 62.33 H new ATOM 0 HG13 VAL A 60 -41.636 -5.522 23.858 1.00 62.33 H new ATOM 0 HG21 VAL A 60 -38.872 -4.955 22.606 1.00 53.00 H new ATOM 0 HG22 VAL A 60 -40.409 -4.746 21.732 1.00 53.00 H new ATOM 0 HG23 VAL A 60 -39.267 -3.387 21.861 1.00 53.00 H new ATOM 999 N GLU A 61 -39.925 -1.012 23.003 1.00 2.44 N ATOM 1000 CA GLU A 61 -39.318 0.098 22.278 1.00 2.44 C ATOM 1001 C GLU A 61 -37.899 -0.250 21.838 1.00 60.40 C ATOM 1002 O GLU A 61 -37.325 0.412 20.973 1.00 14.05 O ATOM 1003 CB GLU A 61 -39.298 1.356 23.150 1.00 54.02 C ATOM 1004 CG GLU A 61 -38.061 1.472 24.024 1.00 61.22 C ATOM 1005 CD GLU A 61 -38.376 1.984 25.416 1.00 62.20 C ATOM 1006 OE1 GLU A 61 -39.026 1.246 26.186 1.00 62.32 O ATOM 1007 OE2 GLU A 61 -37.973 3.122 25.736 1.00 60.44 O ATOM 0 H GLU A 61 -39.494 -1.212 23.906 1.00 2.44 H new ATOM 0 HA GLU A 61 -39.919 0.289 21.389 1.00 2.44 H new ATOM 0 HB2 GLU A 61 -39.362 2.234 22.507 1.00 54.02 H new ATOM 0 HB3 GLU A 61 -40.183 1.361 23.786 1.00 54.02 H new ATOM 0 HG2 GLU A 61 -37.582 0.496 24.100 1.00 61.22 H new ATOM 0 HG3 GLU A 61 -37.346 2.142 23.548 1.00 61.22 H new ATOM 1014 N SER A 62 -37.339 -1.295 22.440 1.00 42.13 N ATOM 1015 CA SER A 62 -35.986 -1.730 22.114 1.00 42.14 C ATOM 1016 C SER A 62 -35.106 -0.539 21.746 1.00 0.11 C ATOM 1017 O SER A 62 -35.042 -0.135 20.585 1.00 12.01 O ATOM 1018 CB SER A 62 -36.014 -2.733 20.959 1.00 52.03 C ATOM 1019 OG SER A 62 -35.063 -3.765 21.156 1.00 40.43 O ATOM 0 H SER A 62 -37.801 -1.856 23.156 1.00 42.13 H new ATOM 0 HA SER A 62 -35.564 -2.213 22.995 1.00 42.14 H new ATOM 0 HB2 SER A 62 -37.011 -3.165 20.872 1.00 52.03 H new ATOM 0 HB3 SER A 62 -35.807 -2.218 20.021 1.00 52.03 H new ATOM 0 HG SER A 62 -35.102 -4.394 20.405 1.00 40.43 H new ATOM 1025 N SER A 63 -34.429 0.019 22.745 1.00 41.03 N ATOM 1026 CA SER A 63 -33.555 1.166 22.529 1.00 53.42 C ATOM 1027 C SER A 63 -32.091 0.739 22.516 1.00 43.24 C ATOM 1028 O SER A 63 -31.598 0.144 23.474 1.00 30.23 O ATOM 1029 CB SER A 63 -33.782 2.218 23.616 1.00 4.43 C ATOM 1030 OG SER A 63 -35.164 2.403 23.868 1.00 60.42 O ATOM 0 H SER A 63 -34.469 -0.305 23.711 1.00 41.03 H new ATOM 0 HA SER A 63 -33.797 1.599 21.558 1.00 53.42 H new ATOM 0 HB2 SER A 63 -33.280 1.911 24.534 1.00 4.43 H new ATOM 0 HB3 SER A 63 -33.336 3.164 23.309 1.00 4.43 H new ATOM 0 HG SER A 63 -35.353 2.213 24.811 1.00 60.42 H new ATOM 1036 N ILE A 64 -31.401 1.047 21.423 1.00 41.44 N ATOM 1037 CA ILE A 64 -29.993 0.697 21.284 1.00 21.22 C ATOM 1038 C ILE A 64 -29.201 1.840 20.659 1.00 63.34 C ATOM 1039 O ILE A 64 -29.736 2.628 19.878 1.00 32.50 O ATOM 1040 CB ILE A 64 -29.810 -0.570 20.427 1.00 43.51 C ATOM 1041 CG1 ILE A 64 -30.785 -1.660 20.874 1.00 30.23 C ATOM 1042 CG2 ILE A 64 -28.374 -1.066 20.516 1.00 73.04 C ATOM 1043 CD1 ILE A 64 -30.619 -2.964 20.125 1.00 2.22 C ATOM 0 H ILE A 64 -31.794 1.538 20.620 1.00 41.44 H new ATOM 0 HA ILE A 64 -29.615 0.504 22.288 1.00 21.22 H new ATOM 0 HB ILE A 64 -30.025 -0.322 19.387 1.00 43.51 H new ATOM 0 HG12 ILE A 64 -30.649 -1.843 21.940 1.00 30.23 H new ATOM 0 HG13 ILE A 64 -31.805 -1.301 20.740 1.00 30.23 H new ATOM 0 HG21 ILE A 64 -28.260 -1.962 19.905 1.00 73.04 H new ATOM 0 HG22 ILE A 64 -27.698 -0.291 20.154 1.00 73.04 H new ATOM 0 HG23 ILE A 64 -28.134 -1.301 21.553 1.00 73.04 H new ATOM 0 HD11 ILE A 64 -31.343 -3.690 20.494 1.00 2.22 H new ATOM 0 HD12 ILE A 64 -30.784 -2.796 19.061 1.00 2.22 H new ATOM 0 HD13 ILE A 64 -29.610 -3.346 20.280 1.00 2.22 H new ATOM 1055 N THR A 65 -27.920 1.924 21.005 1.00 61.10 N ATOM 1056 CA THR A 65 -27.053 2.970 20.477 1.00 24.43 C ATOM 1057 C THR A 65 -25.867 2.374 19.727 1.00 71.03 C ATOM 1058 O THR A 65 -25.020 1.702 20.317 1.00 45.44 O ATOM 1059 CB THR A 65 -26.528 3.884 21.600 1.00 23.14 C ATOM 1060 OG1 THR A 65 -27.624 4.403 22.362 1.00 44.12 O ATOM 1061 CG2 THR A 65 -25.713 5.033 21.026 1.00 0.12 C ATOM 0 H THR A 65 -27.460 1.280 21.649 1.00 61.10 H new ATOM 0 HA THR A 65 -27.655 3.562 19.788 1.00 24.43 H new ATOM 0 HB THR A 65 -25.883 3.291 22.249 1.00 23.14 H new ATOM 0 HG1 THR A 65 -27.282 4.982 23.075 1.00 44.12 H new ATOM 0 HG21 THR A 65 -25.353 5.665 21.838 1.00 0.12 H new ATOM 0 HG22 THR A 65 -24.863 4.635 20.472 1.00 0.12 H new ATOM 0 HG23 THR A 65 -26.338 5.624 20.357 1.00 0.12 H new ATOM 1069 N LEU A 66 -25.812 2.624 18.423 1.00 32.02 N ATOM 1070 CA LEU A 66 -24.729 2.113 17.591 1.00 23.40 C ATOM 1071 C LEU A 66 -23.579 3.112 17.519 1.00 2.22 C ATOM 1072 O LEU A 66 -23.706 4.178 16.916 1.00 42.21 O ATOM 1073 CB LEU A 66 -25.242 1.806 16.183 1.00 43.11 C ATOM 1074 CG LEU A 66 -25.906 0.442 15.993 1.00 54.22 C ATOM 1075 CD1 LEU A 66 -26.617 0.377 14.650 1.00 53.41 C ATOM 1076 CD2 LEU A 66 -24.878 -0.673 16.108 1.00 24.11 C ATOM 0 H LEU A 66 -26.505 3.178 17.919 1.00 32.02 H new ATOM 0 HA LEU A 66 -24.359 1.194 18.045 1.00 23.40 H new ATOM 0 HB2 LEU A 66 -25.958 2.578 15.902 1.00 43.11 H new ATOM 0 HB3 LEU A 66 -24.405 1.880 15.489 1.00 43.11 H new ATOM 0 HG LEU A 66 -26.647 0.308 16.781 1.00 54.22 H new ATOM 0 HD11 LEU A 66 -27.084 -0.601 14.532 1.00 53.41 H new ATOM 0 HD12 LEU A 66 -27.382 1.152 14.606 1.00 53.41 H new ATOM 0 HD13 LEU A 66 -25.895 0.533 13.848 1.00 53.41 H new ATOM 0 HD21 LEU A 66 -25.369 -1.636 15.970 1.00 24.11 H new ATOM 0 HD22 LEU A 66 -24.113 -0.543 15.343 1.00 24.11 H new ATOM 0 HD23 LEU A 66 -24.414 -0.640 17.094 1.00 24.11 H new ATOM 1088 N HIS A 67 -22.456 2.760 18.137 1.00 2.00 N ATOM 1089 CA HIS A 67 -21.282 3.625 18.141 1.00 44.32 C ATOM 1090 C HIS A 67 -20.256 3.153 17.115 1.00 43.52 C ATOM 1091 O HIS A 67 -19.688 2.069 17.243 1.00 22.43 O ATOM 1092 CB HIS A 67 -20.650 3.658 19.533 1.00 72.40 C ATOM 1093 CG HIS A 67 -19.252 4.195 19.544 1.00 14.34 C ATOM 1094 ND1 HIS A 67 -18.892 5.369 18.917 1.00 14.31 N ATOM 1095 CD2 HIS A 67 -18.123 3.713 20.114 1.00 41.04 C ATOM 1096 CE1 HIS A 67 -17.602 5.585 19.098 1.00 2.04 C ATOM 1097 NE2 HIS A 67 -17.111 4.595 19.822 1.00 74.33 N ATOM 0 H HIS A 67 -22.334 1.882 18.641 1.00 2.00 H new ATOM 0 HA HIS A 67 -21.603 4.632 17.872 1.00 44.32 H new ATOM 0 HB2 HIS A 67 -21.270 4.268 20.190 1.00 72.40 H new ATOM 0 HB3 HIS A 67 -20.646 2.649 19.945 1.00 72.40 H new ATOM 0 HD1 HIS A 67 -19.524 5.976 18.395 1.00 14.31 H new ATOM 0 HD2 HIS A 67 -18.034 2.804 20.691 1.00 41.04 H new ATOM 0 HE1 HIS A 67 -17.043 6.428 18.719 1.00 2.04 H new ATOM 1105 N PHE A 68 -20.024 3.975 16.096 1.00 5.04 N ATOM 1106 CA PHE A 68 -19.067 3.641 15.047 1.00 34.13 C ATOM 1107 C PHE A 68 -17.783 4.449 15.205 1.00 63.02 C ATOM 1108 O PHE A 68 -17.818 5.629 15.552 1.00 23.02 O ATOM 1109 CB PHE A 68 -19.680 3.899 13.669 1.00 63.21 C ATOM 1110 CG PHE A 68 -21.125 4.306 13.721 1.00 24.54 C ATOM 1111 CD1 PHE A 68 -21.485 5.578 14.135 1.00 33.43 C ATOM 1112 CD2 PHE A 68 -22.122 3.415 13.357 1.00 11.53 C ATOM 1113 CE1 PHE A 68 -22.814 5.955 14.184 1.00 10.34 C ATOM 1114 CE2 PHE A 68 -23.452 3.788 13.404 1.00 73.40 C ATOM 1115 CZ PHE A 68 -23.799 5.059 13.819 1.00 22.42 C ATOM 0 H PHE A 68 -20.485 4.877 15.975 1.00 5.04 H new ATOM 0 HA PHE A 68 -18.822 2.583 15.136 1.00 34.13 H new ATOM 0 HB2 PHE A 68 -19.109 4.680 13.167 1.00 63.21 H new ATOM 0 HB3 PHE A 68 -19.587 2.997 13.064 1.00 63.21 H new ATOM 0 HD1 PHE A 68 -20.719 6.283 14.423 1.00 33.43 H new ATOM 0 HD2 PHE A 68 -21.857 2.419 13.033 1.00 11.53 H new ATOM 0 HE1 PHE A 68 -23.082 6.950 14.508 1.00 10.34 H new ATOM 0 HE2 PHE A 68 -24.220 3.086 13.116 1.00 73.40 H new ATOM 0 HZ PHE A 68 -24.838 5.351 13.858 1.00 22.42 H new ATOM 1125 N ALA A 69 -16.650 3.804 14.947 1.00 23.11 N ATOM 1126 CA ALA A 69 -15.354 4.462 15.059 1.00 63.35 C ATOM 1127 C ALA A 69 -14.611 4.440 13.727 1.00 2.10 C ATOM 1128 O ALA A 69 -14.277 3.375 13.209 1.00 24.14 O ATOM 1129 CB ALA A 69 -14.517 3.799 16.143 1.00 40.02 C ATOM 0 H ALA A 69 -16.603 2.827 14.659 1.00 23.11 H new ATOM 0 HA ALA A 69 -15.525 5.503 15.333 1.00 63.35 H new ATOM 0 HB1 ALA A 69 -13.552 4.301 16.215 1.00 40.02 H new ATOM 0 HB2 ALA A 69 -15.036 3.871 17.099 1.00 40.02 H new ATOM 0 HB3 ALA A 69 -14.362 2.750 15.892 1.00 40.02 H new ATOM 1135 N MET A 70 -14.356 5.623 13.178 1.00 52.15 N ATOM 1136 CA MET A 70 -13.652 5.739 11.906 1.00 70.13 C ATOM 1137 C MET A 70 -12.142 5.690 12.114 1.00 3.02 C ATOM 1138 O MET A 70 -11.507 6.713 12.375 1.00 23.50 O ATOM 1139 CB MET A 70 -14.039 7.040 11.200 1.00 14.04 C ATOM 1140 CG MET A 70 -15.537 7.302 11.189 1.00 43.35 C ATOM 1141 SD MET A 70 -16.287 6.970 9.583 1.00 34.53 S ATOM 1142 CE MET A 70 -17.998 7.382 9.917 1.00 1.44 C ATOM 0 H MET A 70 -14.626 6.514 13.594 1.00 52.15 H new ATOM 0 HA MET A 70 -13.943 4.895 11.281 1.00 70.13 H new ATOM 0 HB2 MET A 70 -13.536 7.874 11.690 1.00 14.04 H new ATOM 0 HB3 MET A 70 -13.676 7.008 10.173 1.00 14.04 H new ATOM 0 HG2 MET A 70 -16.016 6.680 11.945 1.00 43.35 H new ATOM 0 HG3 MET A 70 -15.723 8.340 11.465 1.00 43.35 H new ATOM 0 HE1 MET A 70 -18.642 6.867 9.204 1.00 1.44 H new ATOM 0 HE2 MET A 70 -18.256 7.072 10.929 1.00 1.44 H new ATOM 0 HE3 MET A 70 -18.138 8.459 9.821 1.00 1.44 H new ATOM 1152 N THR A 71 -11.571 4.495 11.998 1.00 61.11 N ATOM 1153 CA THR A 71 -10.136 4.313 12.175 1.00 22.11 C ATOM 1154 C THR A 71 -9.347 5.297 11.319 1.00 1.44 C ATOM 1155 O THR A 71 -9.849 5.844 10.337 1.00 2.10 O ATOM 1156 CB THR A 71 -9.703 2.878 11.818 1.00 52.43 C ATOM 1157 OG1 THR A 71 -10.592 2.328 10.839 1.00 32.14 O ATOM 1158 CG2 THR A 71 -9.691 1.993 13.055 1.00 71.14 C ATOM 0 H THR A 71 -12.081 3.638 11.782 1.00 61.11 H new ATOM 0 HA THR A 71 -9.922 4.498 13.228 1.00 22.11 H new ATOM 0 HB THR A 71 -8.693 2.917 11.410 1.00 52.43 H new ATOM 0 HG1 THR A 71 -10.081 2.058 10.048 1.00 32.14 H new ATOM 0 HG21 THR A 71 -9.382 0.985 12.778 1.00 71.14 H new ATOM 0 HG22 THR A 71 -8.992 2.399 13.786 1.00 71.14 H new ATOM 0 HG23 THR A 71 -10.691 1.960 13.489 1.00 71.14 H new ATOM 1166 N PRO A 72 -8.082 5.530 11.698 1.00 5.24 N ATOM 1167 CA PRO A 72 -7.196 6.449 10.978 1.00 43.43 C ATOM 1168 C PRO A 72 -6.791 5.911 9.610 1.00 65.02 C ATOM 1169 O PRO A 72 -6.115 6.593 8.839 1.00 33.24 O ATOM 1170 CB PRO A 72 -5.974 6.556 11.894 1.00 50.02 C ATOM 1171 CG PRO A 72 -5.973 5.286 12.673 1.00 0.41 C ATOM 1172 CD PRO A 72 -7.418 4.914 12.859 1.00 22.42 C ATOM 0 HA PRO A 72 -7.679 7.405 10.776 1.00 43.43 H new ATOM 0 HB2 PRO A 72 -5.056 6.668 11.318 1.00 50.02 H new ATOM 0 HB3 PRO A 72 -6.046 7.423 12.550 1.00 50.02 H new ATOM 0 HG2 PRO A 72 -5.433 4.502 12.141 1.00 0.41 H new ATOM 0 HG3 PRO A 72 -5.477 5.418 13.635 1.00 0.41 H new ATOM 0 HD2 PRO A 72 -7.556 3.833 12.874 1.00 22.42 H new ATOM 0 HD3 PRO A 72 -7.814 5.298 13.799 1.00 22.42 H new ATOM 1180 N MET A 73 -7.208 4.684 9.315 1.00 44.13 N ATOM 1181 CA MET A 73 -6.889 4.055 8.038 1.00 2.50 C ATOM 1182 C MET A 73 -8.132 3.946 7.161 1.00 62.43 C ATOM 1183 O MET A 73 -8.034 3.870 5.936 1.00 41.13 O ATOM 1184 CB MET A 73 -6.286 2.668 8.265 1.00 72.30 C ATOM 1185 CG MET A 73 -4.831 2.701 8.703 1.00 10.20 C ATOM 1186 SD MET A 73 -3.731 1.903 7.519 1.00 64.14 S ATOM 1187 CE MET A 73 -4.033 2.892 6.056 1.00 22.50 C ATOM 0 H MET A 73 -7.767 4.106 9.942 1.00 44.13 H new ATOM 0 HA MET A 73 -6.158 4.680 7.525 1.00 2.50 H new ATOM 0 HB2 MET A 73 -6.872 2.145 9.021 1.00 72.30 H new ATOM 0 HB3 MET A 73 -6.366 2.091 7.344 1.00 72.30 H new ATOM 0 HG2 MET A 73 -4.520 3.737 8.841 1.00 10.20 H new ATOM 0 HG3 MET A 73 -4.736 2.208 9.671 1.00 10.20 H new ATOM 0 HE1 MET A 73 -4.667 2.336 5.365 1.00 22.50 H new ATOM 0 HE2 MET A 73 -4.531 3.819 6.340 1.00 22.50 H new ATOM 0 HE3 MET A 73 -3.085 3.124 5.571 1.00 22.50 H new ATOM 1197 N TYR A 74 -9.299 3.937 7.795 1.00 41.02 N ATOM 1198 CA TYR A 74 -10.561 3.834 7.072 1.00 62.43 C ATOM 1199 C TYR A 74 -10.606 4.822 5.911 1.00 52.42 C ATOM 1200 O TYR A 74 -9.995 5.891 5.947 1.00 21.51 O ATOM 1201 CB TYR A 74 -11.737 4.086 8.017 1.00 24.40 C ATOM 1202 CG TYR A 74 -12.917 4.755 7.350 1.00 1.43 C ATOM 1203 CD1 TYR A 74 -12.814 6.046 6.846 1.00 52.10 C ATOM 1204 CD2 TYR A 74 -14.135 4.098 7.226 1.00 43.45 C ATOM 1205 CE1 TYR A 74 -13.890 6.663 6.237 1.00 61.44 C ATOM 1206 CE2 TYR A 74 -15.215 4.706 6.616 1.00 12.54 C ATOM 1207 CZ TYR A 74 -15.088 5.989 6.124 1.00 60.52 C ATOM 1208 OH TYR A 74 -16.162 6.598 5.518 1.00 54.24 O ATOM 0 H TYR A 74 -9.397 4.000 8.808 1.00 41.02 H new ATOM 0 HA TYR A 74 -10.638 2.824 6.669 1.00 62.43 H new ATOM 0 HB2 TYR A 74 -12.061 3.136 8.442 1.00 24.40 H new ATOM 0 HB3 TYR A 74 -11.399 4.707 8.847 1.00 24.40 H new ATOM 0 HD1 TYR A 74 -11.877 6.576 6.932 1.00 52.10 H new ATOM 0 HD2 TYR A 74 -14.239 3.095 7.613 1.00 43.45 H new ATOM 0 HE1 TYR A 74 -13.793 7.667 5.852 1.00 61.44 H new ATOM 0 HE2 TYR A 74 -16.154 4.180 6.525 1.00 12.54 H new ATOM 0 HH TYR A 74 -16.962 6.477 6.072 1.00 54.24 H new ATOM 1218 N PRO A 75 -11.349 4.459 4.855 1.00 41.55 N ATOM 1219 CA PRO A 75 -12.080 3.190 4.800 1.00 55.32 C ATOM 1220 C PRO A 75 -11.149 1.989 4.682 1.00 61.14 C ATOM 1221 O PRO A 75 -11.574 0.844 4.837 1.00 71.11 O ATOM 1222 CB PRO A 75 -12.937 3.329 3.539 1.00 72.21 C ATOM 1223 CG PRO A 75 -12.200 4.302 2.685 1.00 13.22 C ATOM 1224 CD PRO A 75 -11.531 5.260 3.632 1.00 33.10 C ATOM 0 HA PRO A 75 -12.658 3.013 5.707 1.00 55.32 H new ATOM 0 HB2 PRO A 75 -13.057 2.370 3.034 1.00 72.21 H new ATOM 0 HB3 PRO A 75 -13.937 3.690 3.778 1.00 72.21 H new ATOM 0 HG2 PRO A 75 -11.465 3.794 2.060 1.00 13.22 H new ATOM 0 HG3 PRO A 75 -12.881 4.827 2.015 1.00 13.22 H new ATOM 0 HD2 PRO A 75 -10.578 5.615 3.238 1.00 33.10 H new ATOM 0 HD3 PRO A 75 -12.148 6.140 3.816 1.00 33.10 H new ATOM 1232 N TYR A 76 -9.877 2.257 4.406 1.00 14.14 N ATOM 1233 CA TYR A 76 -8.886 1.197 4.266 1.00 40.35 C ATOM 1234 C TYR A 76 -9.171 0.052 5.233 1.00 51.43 C ATOM 1235 O TYR A 76 -9.261 -1.108 4.831 1.00 33.54 O ATOM 1236 CB TYR A 76 -7.481 1.749 4.511 1.00 64.01 C ATOM 1237 CG TYR A 76 -6.390 0.950 3.835 1.00 63.34 C ATOM 1238 CD1 TYR A 76 -6.056 1.179 2.505 1.00 1.24 C ATOM 1239 CD2 TYR A 76 -5.694 -0.035 4.524 1.00 24.30 C ATOM 1240 CE1 TYR A 76 -5.060 0.451 1.883 1.00 54.11 C ATOM 1241 CE2 TYR A 76 -4.696 -0.767 3.910 1.00 23.22 C ATOM 1242 CZ TYR A 76 -4.383 -0.521 2.590 1.00 40.54 C ATOM 1243 OH TYR A 76 -3.391 -1.248 1.974 1.00 24.51 O ATOM 0 H TYR A 76 -9.508 3.199 4.275 1.00 14.14 H new ATOM 0 HA TYR A 76 -8.946 0.811 3.248 1.00 40.35 H new ATOM 0 HB2 TYR A 76 -7.438 2.779 4.157 1.00 64.01 H new ATOM 0 HB3 TYR A 76 -7.291 1.772 5.584 1.00 64.01 H new ATOM 0 HD1 TYR A 76 -6.584 1.939 1.948 1.00 1.24 H new ATOM 0 HD2 TYR A 76 -5.937 -0.232 5.558 1.00 24.30 H new ATOM 0 HE1 TYR A 76 -4.813 0.642 0.849 1.00 54.11 H new ATOM 0 HE2 TYR A 76 -4.164 -1.528 4.461 1.00 23.22 H new ATOM 0 HH TYR A 76 -3.013 -1.891 2.610 1.00 24.51 H new ATOM 1253 N THR A 77 -9.313 0.388 6.511 1.00 30.13 N ATOM 1254 CA THR A 77 -9.587 -0.610 7.537 1.00 15.05 C ATOM 1255 C THR A 77 -11.062 -0.612 7.922 1.00 15.43 C ATOM 1256 O THR A 77 -11.837 0.220 7.451 1.00 14.45 O ATOM 1257 CB THR A 77 -8.739 -0.365 8.800 1.00 75.51 C ATOM 1258 OG1 THR A 77 -9.122 0.870 9.415 1.00 22.32 O ATOM 1259 CG2 THR A 77 -7.258 -0.330 8.458 1.00 24.20 C ATOM 0 H THR A 77 -9.243 1.344 6.860 1.00 30.13 H new ATOM 0 HA THR A 77 -9.323 -1.579 7.113 1.00 15.05 H new ATOM 0 HB THR A 77 -8.916 -1.186 9.495 1.00 75.51 H new ATOM 0 HG1 THR A 77 -8.580 1.018 10.218 1.00 22.32 H new ATOM 0 HG21 THR A 77 -6.679 -0.156 9.365 1.00 24.20 H new ATOM 0 HG22 THR A 77 -6.964 -1.282 8.017 1.00 24.20 H new ATOM 0 HG23 THR A 77 -7.068 0.473 7.746 1.00 24.20 H new ATOM 1267 N ALA A 78 -11.444 -1.551 8.782 1.00 50.05 N ATOM 1268 CA ALA A 78 -12.826 -1.659 9.232 1.00 52.43 C ATOM 1269 C ALA A 78 -13.011 -1.005 10.597 1.00 33.20 C ATOM 1270 O ALA A 78 -12.250 -1.244 11.534 1.00 4.55 O ATOM 1271 CB ALA A 78 -13.253 -3.118 9.281 1.00 72.14 C ATOM 0 H ALA A 78 -10.815 -2.248 9.181 1.00 50.05 H new ATOM 0 HA ALA A 78 -13.457 -1.132 8.517 1.00 52.43 H new ATOM 0 HB1 ALA A 78 -14.287 -3.183 9.619 1.00 72.14 H new ATOM 0 HB2 ALA A 78 -13.168 -3.556 8.286 1.00 72.14 H new ATOM 0 HB3 ALA A 78 -12.610 -3.662 9.973 1.00 72.14 H new ATOM 1277 N PRO A 79 -14.046 -0.160 10.714 1.00 35.32 N ATOM 1278 CA PRO A 79 -14.355 0.545 11.962 1.00 74.05 C ATOM 1279 C PRO A 79 -14.873 -0.394 13.046 1.00 63.23 C ATOM 1280 O PRO A 79 -15.047 -1.590 12.812 1.00 53.51 O ATOM 1281 CB PRO A 79 -15.446 1.536 11.548 1.00 41.32 C ATOM 1282 CG PRO A 79 -16.087 0.918 10.354 1.00 61.33 C ATOM 1283 CD PRO A 79 -14.995 0.171 9.638 1.00 35.00 C ATOM 0 HA PRO A 79 -13.472 1.017 12.393 1.00 74.05 H new ATOM 0 HB2 PRO A 79 -16.168 1.688 12.351 1.00 41.32 H new ATOM 0 HB3 PRO A 79 -15.024 2.512 11.310 1.00 41.32 H new ATOM 0 HG2 PRO A 79 -16.892 0.245 10.648 1.00 61.33 H new ATOM 0 HG3 PRO A 79 -16.527 1.679 9.709 1.00 61.33 H new ATOM 0 HD2 PRO A 79 -15.376 -0.725 9.148 1.00 35.00 H new ATOM 0 HD3 PRO A 79 -14.529 0.783 8.866 1.00 35.00 H new ATOM 1291 N GLU A 80 -15.116 0.155 14.232 1.00 53.35 N ATOM 1292 CA GLU A 80 -15.614 -0.635 15.351 1.00 24.33 C ATOM 1293 C GLU A 80 -17.047 -0.245 15.699 1.00 53.22 C ATOM 1294 O GLU A 80 -17.373 0.939 15.798 1.00 65.31 O ATOM 1295 CB GLU A 80 -14.713 -0.451 16.574 1.00 24.33 C ATOM 1296 CG GLU A 80 -15.411 -0.738 17.893 1.00 4.42 C ATOM 1297 CD GLU A 80 -14.539 -1.520 18.856 1.00 34.34 C ATOM 1298 OE1 GLU A 80 -13.338 -1.196 18.966 1.00 32.31 O ATOM 1299 OE2 GLU A 80 -15.058 -2.456 19.500 1.00 70.31 O ATOM 0 H GLU A 80 -14.976 1.143 14.442 1.00 53.35 H new ATOM 0 HA GLU A 80 -15.604 -1.684 15.054 1.00 24.33 H new ATOM 0 HB2 GLU A 80 -13.848 -1.108 16.480 1.00 24.33 H new ATOM 0 HB3 GLU A 80 -14.337 0.572 16.587 1.00 24.33 H new ATOM 0 HG2 GLU A 80 -15.704 0.204 18.357 1.00 4.42 H new ATOM 0 HG3 GLU A 80 -16.326 -1.298 17.701 1.00 4.42 H new ATOM 1306 N ILE A 81 -17.899 -1.248 15.882 1.00 54.31 N ATOM 1307 CA ILE A 81 -19.297 -1.010 16.219 1.00 55.44 C ATOM 1308 C ILE A 81 -19.683 -1.728 17.507 1.00 23.41 C ATOM 1309 O ILE A 81 -19.470 -2.932 17.645 1.00 61.54 O ATOM 1310 CB ILE A 81 -20.235 -1.470 15.087 1.00 33.21 C ATOM 1311 CG1 ILE A 81 -19.686 -1.030 13.729 1.00 42.23 C ATOM 1312 CG2 ILE A 81 -21.636 -0.917 15.302 1.00 33.33 C ATOM 1313 CD1 ILE A 81 -19.742 0.466 13.510 1.00 20.03 C ATOM 0 H ILE A 81 -17.646 -2.233 15.803 1.00 54.31 H new ATOM 0 HA ILE A 81 -19.409 0.065 16.359 1.00 55.44 H new ATOM 0 HB ILE A 81 -20.289 -2.559 15.100 1.00 33.21 H new ATOM 0 HG12 ILE A 81 -18.652 -1.364 13.639 1.00 42.23 H new ATOM 0 HG13 ILE A 81 -20.251 -1.526 12.940 1.00 42.23 H new ATOM 0 HG21 ILE A 81 -22.287 -1.251 14.494 1.00 33.33 H new ATOM 0 HG22 ILE A 81 -22.027 -1.276 16.254 1.00 33.33 H new ATOM 0 HG23 ILE A 81 -21.600 0.172 15.312 1.00 33.33 H new ATOM 0 HD11 ILE A 81 -19.337 0.705 12.527 1.00 20.03 H new ATOM 0 HD12 ILE A 81 -20.777 0.804 13.568 1.00 20.03 H new ATOM 0 HD13 ILE A 81 -19.153 0.968 14.277 1.00 20.03 H new ATOM 1325 N GLU A 82 -20.252 -0.981 18.448 1.00 73.23 N ATOM 1326 CA GLU A 82 -20.668 -1.548 19.725 1.00 33.30 C ATOM 1327 C GLU A 82 -22.061 -1.057 20.111 1.00 63.24 C ATOM 1328 O GLU A 82 -22.409 0.101 19.878 1.00 33.53 O ATOM 1329 CB GLU A 82 -19.665 -1.183 20.821 1.00 31.32 C ATOM 1330 CG GLU A 82 -19.974 0.132 21.516 1.00 52.44 C ATOM 1331 CD GLU A 82 -18.900 0.535 22.507 1.00 1.30 C ATOM 1332 OE1 GLU A 82 -18.274 -0.367 23.102 1.00 63.14 O ATOM 1333 OE2 GLU A 82 -18.685 1.752 22.689 1.00 74.14 O ATOM 0 H GLU A 82 -20.435 0.018 18.350 1.00 73.23 H new ATOM 0 HA GLU A 82 -20.701 -2.632 19.618 1.00 33.30 H new ATOM 0 HB2 GLU A 82 -19.645 -1.981 21.564 1.00 31.32 H new ATOM 0 HB3 GLU A 82 -18.667 -1.128 20.385 1.00 31.32 H new ATOM 0 HG2 GLU A 82 -20.085 0.917 20.768 1.00 52.44 H new ATOM 0 HG3 GLU A 82 -20.929 0.049 22.035 1.00 52.44 H new ATOM 1340 N PHE A 83 -22.853 -1.946 20.701 1.00 62.34 N ATOM 1341 CA PHE A 83 -24.208 -1.605 21.117 1.00 21.14 C ATOM 1342 C PHE A 83 -24.230 -1.147 22.573 1.00 52.13 C ATOM 1343 O PHE A 83 -23.527 -1.697 23.420 1.00 25.01 O ATOM 1344 CB PHE A 83 -25.138 -2.806 20.935 1.00 71.22 C ATOM 1345 CG PHE A 83 -25.003 -3.471 19.595 1.00 42.12 C ATOM 1346 CD1 PHE A 83 -25.552 -2.893 18.461 1.00 30.25 C ATOM 1347 CD2 PHE A 83 -24.327 -4.674 19.468 1.00 2.25 C ATOM 1348 CE1 PHE A 83 -25.429 -3.502 17.227 1.00 71.13 C ATOM 1349 CE2 PHE A 83 -24.200 -5.287 18.236 1.00 32.04 C ATOM 1350 CZ PHE A 83 -24.753 -4.701 17.114 1.00 31.13 C ATOM 0 H PHE A 83 -22.580 -2.908 20.902 1.00 62.34 H new ATOM 0 HA PHE A 83 -24.558 -0.785 20.490 1.00 21.14 H new ATOM 0 HB2 PHE A 83 -24.932 -3.537 21.717 1.00 71.22 H new ATOM 0 HB3 PHE A 83 -26.170 -2.480 21.068 1.00 71.22 H new ATOM 0 HD1 PHE A 83 -26.082 -1.956 18.543 1.00 30.25 H new ATOM 0 HD2 PHE A 83 -23.894 -5.138 20.342 1.00 2.25 H new ATOM 0 HE1 PHE A 83 -25.861 -3.041 16.351 1.00 71.13 H new ATOM 0 HE2 PHE A 83 -23.669 -6.223 18.150 1.00 32.04 H new ATOM 0 HZ PHE A 83 -24.657 -5.179 16.151 1.00 31.13 H new ATOM 1360 N LYS A 84 -25.043 -0.135 22.856 1.00 53.24 N ATOM 1361 CA LYS A 84 -25.160 0.399 24.207 1.00 3.04 C ATOM 1362 C LYS A 84 -26.608 0.360 24.685 1.00 23.31 C ATOM 1363 O LYS A 84 -27.521 0.087 23.907 1.00 44.53 O ATOM 1364 CB LYS A 84 -24.634 1.835 24.258 1.00 43.32 C ATOM 1365 CG LYS A 84 -23.495 2.100 23.289 1.00 43.25 C ATOM 1366 CD LYS A 84 -22.283 1.238 23.603 1.00 53.53 C ATOM 1367 CE LYS A 84 -22.001 1.197 25.097 1.00 51.13 C ATOM 1368 NZ LYS A 84 -20.756 0.440 25.405 1.00 13.23 N ATOM 0 H LYS A 84 -25.631 0.332 22.166 1.00 53.24 H new ATOM 0 HA LYS A 84 -24.560 -0.225 24.870 1.00 3.04 H new ATOM 0 HB2 LYS A 84 -25.453 2.521 24.040 1.00 43.32 H new ATOM 0 HB3 LYS A 84 -24.296 2.054 25.271 1.00 43.32 H new ATOM 0 HG2 LYS A 84 -23.829 1.902 22.271 1.00 43.25 H new ATOM 0 HG3 LYS A 84 -23.215 3.153 23.334 1.00 43.25 H new ATOM 0 HD2 LYS A 84 -22.450 0.226 23.235 1.00 53.53 H new ATOM 0 HD3 LYS A 84 -21.411 1.628 23.078 1.00 53.53 H new ATOM 0 HE2 LYS A 84 -21.911 2.214 25.478 1.00 51.13 H new ATOM 0 HE3 LYS A 84 -22.843 0.737 25.613 1.00 51.13 H new ATOM 0 HZ1 LYS A 84 -20.625 0.391 26.436 1.00 13.23 H new ATOM 0 HZ2 LYS A 84 -20.831 -0.523 25.019 1.00 13.23 H new ATOM 0 HZ3 LYS A 84 -19.941 0.923 24.975 1.00 13.23 H new ATOM 1382 N ASN A 85 -26.810 0.635 25.970 1.00 71.34 N ATOM 1383 CA ASN A 85 -28.148 0.632 26.550 1.00 22.54 C ATOM 1384 C ASN A 85 -28.772 -0.759 26.472 1.00 43.52 C ATOM 1385 O ASN A 85 -28.886 -1.457 27.479 1.00 73.31 O ATOM 1386 CB ASN A 85 -29.041 1.645 25.832 1.00 62.02 C ATOM 1387 CG ASN A 85 -28.675 3.078 26.167 1.00 61.01 C ATOM 1388 OD1 ASN A 85 -27.458 3.476 25.814 1.00 0.41 O flip ATOM 1389 ND2 ASN A 85 -29.477 3.818 26.736 1.00 70.31 N flip ATOM 0 H ASN A 85 -26.065 0.862 26.628 1.00 71.34 H new ATOM 0 HA ASN A 85 -28.062 0.914 27.599 1.00 22.54 H new ATOM 0 HB2 ASN A 85 -28.963 1.495 24.755 1.00 62.02 H new ATOM 0 HB3 ASN A 85 -30.081 1.465 26.104 1.00 62.02 H new ATOM 0 HD21 ASN A 85 -30.402 3.470 26.989 1.00 70.31 H new ATOM 0 HD22 ASN A 85 -29.217 4.780 26.955 1.00 70.31 H new ATOM 1396 N VAL A 86 -29.173 -1.154 25.268 1.00 51.12 N ATOM 1397 CA VAL A 86 -29.784 -2.461 25.057 1.00 42.15 C ATOM 1398 C VAL A 86 -30.637 -2.869 26.252 1.00 10.43 C ATOM 1399 O VAL A 86 -30.146 -3.491 27.194 1.00 60.05 O ATOM 1400 CB VAL A 86 -28.718 -3.545 24.807 1.00 50.50 C ATOM 1401 CG1 VAL A 86 -28.130 -3.404 23.411 1.00 32.21 C ATOM 1402 CG2 VAL A 86 -27.626 -3.471 25.864 1.00 75.10 C ATOM 0 H VAL A 86 -29.086 -0.588 24.424 1.00 51.12 H new ATOM 0 HA VAL A 86 -30.418 -2.375 24.175 1.00 42.15 H new ATOM 0 HB VAL A 86 -29.195 -4.523 24.877 1.00 50.50 H new ATOM 0 HG11 VAL A 86 -27.379 -4.178 23.253 1.00 32.21 H new ATOM 0 HG12 VAL A 86 -28.922 -3.510 22.670 1.00 32.21 H new ATOM 0 HG13 VAL A 86 -27.667 -2.423 23.309 1.00 32.21 H new ATOM 0 HG21 VAL A 86 -26.881 -4.244 25.672 1.00 75.10 H new ATOM 0 HG22 VAL A 86 -27.150 -2.491 25.827 1.00 75.10 H new ATOM 0 HG23 VAL A 86 -28.063 -3.625 26.850 1.00 75.10 H new ATOM 1412 N GLN A 87 -31.917 -2.514 26.207 1.00 11.54 N ATOM 1413 CA GLN A 87 -32.839 -2.843 27.288 1.00 0.20 C ATOM 1414 C GLN A 87 -33.713 -4.036 26.914 1.00 45.41 C ATOM 1415 O GLN A 87 -33.402 -5.176 27.256 1.00 14.22 O ATOM 1416 CB GLN A 87 -33.718 -1.636 27.622 1.00 72.40 C ATOM 1417 CG GLN A 87 -33.851 -0.645 26.478 1.00 45.45 C ATOM 1418 CD GLN A 87 -34.941 0.381 26.717 1.00 20.11 C ATOM 1419 OE1 GLN A 87 -34.681 1.584 26.754 1.00 24.23 O ATOM 1420 NE2 GLN A 87 -36.172 -0.090 26.881 1.00 25.41 N ATOM 0 H GLN A 87 -32.339 -1.999 25.434 1.00 11.54 H new ATOM 0 HA GLN A 87 -32.250 -3.109 28.166 1.00 0.20 H new ATOM 0 HB2 GLN A 87 -34.710 -1.987 27.905 1.00 72.40 H new ATOM 0 HB3 GLN A 87 -33.302 -1.123 28.489 1.00 72.40 H new ATOM 0 HG2 GLN A 87 -32.900 -0.132 26.335 1.00 45.45 H new ATOM 0 HG3 GLN A 87 -34.063 -1.187 25.556 1.00 45.45 H new ATOM 0 HE21 GLN A 87 -36.343 -1.095 26.843 1.00 25.41 H new ATOM 0 HE22 GLN A 87 -36.946 0.553 27.045 1.00 25.41 H new ATOM 1429 N ASN A 88 -34.806 -3.764 26.209 1.00 13.04 N ATOM 1430 CA ASN A 88 -35.726 -4.815 25.790 1.00 63.35 C ATOM 1431 C ASN A 88 -34.972 -5.965 25.128 1.00 41.24 C ATOM 1432 O ASN A 88 -35.286 -7.135 25.346 1.00 51.11 O ATOM 1433 CB ASN A 88 -36.770 -4.252 24.824 1.00 72.34 C ATOM 1434 CG ASN A 88 -37.582 -3.130 25.440 1.00 12.31 C ATOM 1435 OD1 ASN A 88 -37.325 -1.952 25.189 1.00 74.35 O ATOM 1436 ND2 ASN A 88 -38.568 -3.490 26.253 1.00 34.40 N ATOM 0 H ASN A 88 -35.076 -2.825 25.916 1.00 13.04 H new ATOM 0 HA ASN A 88 -36.231 -5.197 26.677 1.00 63.35 H new ATOM 0 HB2 ASN A 88 -36.271 -3.885 23.927 1.00 72.34 H new ATOM 0 HB3 ASN A 88 -37.440 -5.052 24.511 1.00 72.34 H new ATOM 0 HD21 ASN A 88 -39.148 -2.778 26.698 1.00 34.40 H new ATOM 0 HD22 ASN A 88 -38.746 -4.478 26.433 1.00 34.40 H new ATOM 1443 N VAL A 89 -33.975 -5.623 24.318 1.00 43.21 N ATOM 1444 CA VAL A 89 -33.174 -6.625 23.625 1.00 33.41 C ATOM 1445 C VAL A 89 -32.320 -7.420 24.606 1.00 31.41 C ATOM 1446 O VAL A 89 -31.752 -6.862 25.544 1.00 41.00 O ATOM 1447 CB VAL A 89 -32.258 -5.980 22.569 1.00 5.00 C ATOM 1448 CG1 VAL A 89 -31.524 -4.785 23.158 1.00 41.55 C ATOM 1449 CG2 VAL A 89 -31.274 -7.003 22.021 1.00 2.14 C ATOM 0 H VAL A 89 -33.703 -4.659 24.126 1.00 43.21 H new ATOM 0 HA VAL A 89 -33.872 -7.298 23.127 1.00 33.41 H new ATOM 0 HB VAL A 89 -32.876 -5.626 21.744 1.00 5.00 H new ATOM 0 HG11 VAL A 89 -30.881 -4.342 22.397 1.00 41.55 H new ATOM 0 HG12 VAL A 89 -32.248 -4.044 23.498 1.00 41.55 H new ATOM 0 HG13 VAL A 89 -30.916 -5.111 24.002 1.00 41.55 H new ATOM 0 HG21 VAL A 89 -30.634 -6.530 21.276 1.00 2.14 H new ATOM 0 HG22 VAL A 89 -30.659 -7.389 22.834 1.00 2.14 H new ATOM 0 HG23 VAL A 89 -31.822 -7.824 21.560 1.00 2.14 H new ATOM 1459 N MET A 90 -32.234 -8.728 24.382 1.00 3.35 N ATOM 1460 CA MET A 90 -31.447 -9.600 25.246 1.00 3.04 C ATOM 1461 C MET A 90 -29.994 -9.655 24.785 1.00 61.22 C ATOM 1462 O MET A 90 -29.095 -9.172 25.474 1.00 71.14 O ATOM 1463 CB MET A 90 -32.043 -11.009 25.263 1.00 4.04 C ATOM 1464 CG MET A 90 -33.561 -11.026 25.329 1.00 11.20 C ATOM 1465 SD MET A 90 -34.279 -12.423 24.444 1.00 32.11 S ATOM 1466 CE MET A 90 -34.012 -11.921 22.746 1.00 73.45 C ATOM 0 H MET A 90 -32.699 -9.206 23.610 1.00 3.35 H new ATOM 0 HA MET A 90 -31.474 -9.190 26.256 1.00 3.04 H new ATOM 0 HB2 MET A 90 -31.720 -11.542 24.368 1.00 4.04 H new ATOM 0 HB3 MET A 90 -31.644 -11.553 26.119 1.00 4.04 H new ATOM 0 HG2 MET A 90 -33.875 -11.062 26.372 1.00 11.20 H new ATOM 0 HG3 MET A 90 -33.949 -10.097 24.911 1.00 11.20 H new ATOM 0 HE1 MET A 90 -34.973 -11.740 22.265 1.00 73.45 H new ATOM 0 HE2 MET A 90 -33.418 -11.007 22.726 1.00 73.45 H new ATOM 0 HE3 MET A 90 -33.482 -12.710 22.212 1.00 73.45 H new ATOM 1476 N ASP A 91 -29.771 -10.247 23.616 1.00 13.24 N ATOM 1477 CA ASP A 91 -28.427 -10.364 23.063 1.00 73.33 C ATOM 1478 C ASP A 91 -28.458 -11.056 21.703 1.00 12.32 C ATOM 1479 O ASP A 91 -27.622 -10.788 20.840 1.00 13.33 O ATOM 1480 CB ASP A 91 -27.523 -11.139 24.022 1.00 32.44 C ATOM 1481 CG ASP A 91 -27.372 -12.595 23.627 1.00 61.11 C ATOM 1482 OD1 ASP A 91 -28.250 -13.404 23.994 1.00 24.41 O ATOM 1483 OD2 ASP A 91 -26.376 -12.925 22.949 1.00 13.04 O ATOM 0 H ASP A 91 -30.504 -10.653 23.034 1.00 13.24 H new ATOM 0 HA ASP A 91 -28.026 -9.359 22.931 1.00 73.33 H new ATOM 0 HB2 ASP A 91 -26.540 -10.669 24.049 1.00 32.44 H new ATOM 0 HB3 ASP A 91 -27.933 -11.080 25.030 1.00 32.44 H new ATOM 1488 N SER A 92 -29.427 -11.947 21.520 1.00 20.12 N ATOM 1489 CA SER A 92 -29.564 -12.681 20.267 1.00 0.15 C ATOM 1490 C SER A 92 -29.627 -11.724 19.081 1.00 11.53 C ATOM 1491 O SER A 92 -29.005 -11.960 18.046 1.00 74.30 O ATOM 1492 CB SER A 92 -30.819 -13.556 20.299 1.00 43.42 C ATOM 1493 OG SER A 92 -30.481 -14.931 20.356 1.00 44.41 O ATOM 0 H SER A 92 -30.129 -12.178 22.223 1.00 20.12 H new ATOM 0 HA SER A 92 -28.688 -13.319 20.150 1.00 0.15 H new ATOM 0 HB2 SER A 92 -31.428 -13.292 21.163 1.00 43.42 H new ATOM 0 HB3 SER A 92 -31.423 -13.363 19.412 1.00 43.42 H new ATOM 0 HG SER A 92 -31.300 -15.469 20.377 1.00 44.41 H new ATOM 1499 N GLN A 93 -30.383 -10.642 19.241 1.00 20.04 N ATOM 1500 CA GLN A 93 -30.528 -9.649 18.184 1.00 54.12 C ATOM 1501 C GLN A 93 -29.231 -8.874 17.983 1.00 44.51 C ATOM 1502 O GLN A 93 -28.839 -8.579 16.853 1.00 73.45 O ATOM 1503 CB GLN A 93 -31.667 -8.683 18.515 1.00 33.03 C ATOM 1504 CG GLN A 93 -33.035 -9.181 18.077 1.00 62.53 C ATOM 1505 CD GLN A 93 -33.606 -10.222 19.019 1.00 35.31 C ATOM 1506 OE1 GLN A 93 -33.208 -11.387 18.992 1.00 61.15 O ATOM 1507 NE2 GLN A 93 -34.546 -9.807 19.860 1.00 31.15 N ATOM 0 H GLN A 93 -30.904 -10.431 20.092 1.00 20.04 H new ATOM 0 HA GLN A 93 -30.763 -10.174 17.258 1.00 54.12 H new ATOM 0 HB2 GLN A 93 -31.681 -8.506 19.591 1.00 33.03 H new ATOM 0 HB3 GLN A 93 -31.469 -7.724 18.037 1.00 33.03 H new ATOM 0 HG2 GLN A 93 -33.722 -8.337 18.015 1.00 62.53 H new ATOM 0 HG3 GLN A 93 -32.960 -9.605 17.076 1.00 62.53 H new ATOM 0 HE21 GLN A 93 -34.846 -8.832 19.849 1.00 31.15 H new ATOM 0 HE22 GLN A 93 -34.968 -10.463 20.517 1.00 31.15 H new ATOM 1516 N LEU A 94 -28.567 -8.545 19.086 1.00 51.32 N ATOM 1517 CA LEU A 94 -27.312 -7.803 19.031 1.00 13.52 C ATOM 1518 C LEU A 94 -26.262 -8.566 18.230 1.00 34.24 C ATOM 1519 O LEU A 94 -25.584 -7.996 17.377 1.00 42.40 O ATOM 1520 CB LEU A 94 -26.795 -7.532 20.445 1.00 21.31 C ATOM 1521 CG LEU A 94 -27.181 -6.184 21.055 1.00 63.22 C ATOM 1522 CD1 LEU A 94 -28.474 -5.671 20.441 1.00 42.05 C ATOM 1523 CD2 LEU A 94 -27.316 -6.301 22.566 1.00 63.40 C ATOM 0 H LEU A 94 -28.877 -8.780 20.029 1.00 51.32 H new ATOM 0 HA LEU A 94 -27.502 -6.853 18.532 1.00 13.52 H new ATOM 0 HB2 LEU A 94 -27.159 -8.323 21.101 1.00 21.31 H new ATOM 0 HB3 LEU A 94 -25.707 -7.604 20.433 1.00 21.31 H new ATOM 0 HG LEU A 94 -26.389 -5.468 20.835 1.00 63.22 H new ATOM 0 HD11 LEU A 94 -28.733 -4.711 20.887 1.00 42.05 H new ATOM 0 HD12 LEU A 94 -28.342 -5.548 19.366 1.00 42.05 H new ATOM 0 HD13 LEU A 94 -29.275 -6.386 20.629 1.00 42.05 H new ATOM 0 HD21 LEU A 94 -27.591 -5.332 22.983 1.00 63.40 H new ATOM 0 HD22 LEU A 94 -28.088 -7.032 22.807 1.00 63.40 H new ATOM 0 HD23 LEU A 94 -26.366 -6.623 22.992 1.00 63.40 H new ATOM 1535 N GLN A 95 -26.137 -9.859 18.511 1.00 62.22 N ATOM 1536 CA GLN A 95 -25.171 -10.701 17.815 1.00 5.11 C ATOM 1537 C GLN A 95 -25.518 -10.820 16.335 1.00 53.31 C ATOM 1538 O GLN A 95 -24.635 -10.819 15.478 1.00 20.21 O ATOM 1539 CB GLN A 95 -25.121 -12.090 18.453 1.00 64.54 C ATOM 1540 CG GLN A 95 -24.895 -12.063 19.956 1.00 50.43 C ATOM 1541 CD GLN A 95 -23.432 -12.197 20.329 1.00 61.12 C ATOM 1542 OE1 GLN A 95 -22.900 -13.305 20.413 1.00 11.54 O ATOM 1543 NE2 GLN A 95 -22.772 -11.067 20.554 1.00 22.13 N ATOM 0 H GLN A 95 -26.692 -10.346 19.215 1.00 62.22 H new ATOM 0 HA GLN A 95 -24.190 -10.233 17.902 1.00 5.11 H new ATOM 0 HB2 GLN A 95 -26.056 -12.610 18.244 1.00 64.54 H new ATOM 0 HB3 GLN A 95 -24.324 -12.667 17.985 1.00 64.54 H new ATOM 0 HG2 GLN A 95 -25.285 -11.130 20.361 1.00 50.43 H new ATOM 0 HG3 GLN A 95 -25.460 -12.872 20.419 1.00 50.43 H new ATOM 0 HE21 GLN A 95 -23.253 -10.171 20.473 1.00 22.13 H new ATOM 0 HE22 GLN A 95 -21.784 -11.095 20.808 1.00 22.13 H new ATOM 1552 N MET A 96 -26.811 -10.922 16.042 1.00 4.21 N ATOM 1553 CA MET A 96 -27.275 -11.041 14.665 1.00 44.53 C ATOM 1554 C MET A 96 -26.875 -9.815 13.849 1.00 61.21 C ATOM 1555 O MET A 96 -26.536 -9.925 12.670 1.00 64.41 O ATOM 1556 CB MET A 96 -28.794 -11.218 14.629 1.00 2.13 C ATOM 1557 CG MET A 96 -29.417 -10.851 13.293 1.00 55.44 C ATOM 1558 SD MET A 96 -31.220 -10.879 13.336 1.00 62.52 S ATOM 1559 CE MET A 96 -31.575 -9.184 13.790 1.00 2.32 C ATOM 0 H MET A 96 -27.555 -10.925 16.740 1.00 4.21 H new ATOM 0 HA MET A 96 -26.804 -11.919 14.224 1.00 44.53 H new ATOM 0 HB2 MET A 96 -29.036 -12.255 14.861 1.00 2.13 H new ATOM 0 HB3 MET A 96 -29.242 -10.604 15.410 1.00 2.13 H new ATOM 0 HG2 MET A 96 -29.080 -9.857 13.000 1.00 55.44 H new ATOM 0 HG3 MET A 96 -29.065 -11.545 12.530 1.00 55.44 H new ATOM 0 HE1 MET A 96 -32.549 -8.897 13.393 1.00 2.32 H new ATOM 0 HE2 MET A 96 -31.584 -9.093 14.876 1.00 2.32 H new ATOM 0 HE3 MET A 96 -30.808 -8.529 13.377 1.00 2.32 H new ATOM 1569 N LEU A 97 -26.917 -8.649 14.483 1.00 53.53 N ATOM 1570 CA LEU A 97 -26.560 -7.402 13.815 1.00 4.31 C ATOM 1571 C LEU A 97 -25.103 -7.424 13.364 1.00 24.02 C ATOM 1572 O LEU A 97 -24.777 -6.996 12.256 1.00 34.15 O ATOM 1573 CB LEU A 97 -26.798 -6.214 14.749 1.00 52.32 C ATOM 1574 CG LEU A 97 -28.256 -5.923 15.106 1.00 54.24 C ATOM 1575 CD1 LEU A 97 -28.337 -4.896 16.224 1.00 15.23 C ATOM 1576 CD2 LEU A 97 -29.019 -5.441 13.880 1.00 13.23 C ATOM 0 H LEU A 97 -27.195 -8.540 15.458 1.00 53.53 H new ATOM 0 HA LEU A 97 -27.193 -7.296 12.934 1.00 4.31 H new ATOM 0 HB2 LEU A 97 -26.246 -6.388 15.673 1.00 52.32 H new ATOM 0 HB3 LEU A 97 -26.373 -5.323 14.287 1.00 52.32 H new ATOM 0 HG LEU A 97 -28.716 -6.847 15.456 1.00 54.24 H new ATOM 0 HD11 LEU A 97 -29.382 -4.702 16.464 1.00 15.23 H new ATOM 0 HD12 LEU A 97 -27.827 -5.279 17.108 1.00 15.23 H new ATOM 0 HD13 LEU A 97 -27.860 -3.970 15.903 1.00 15.23 H new ATOM 0 HD21 LEU A 97 -30.055 -5.239 14.152 1.00 13.23 H new ATOM 0 HD22 LEU A 97 -28.559 -4.529 13.500 1.00 13.23 H new ATOM 0 HD23 LEU A 97 -28.990 -6.210 13.108 1.00 13.23 H new ATOM 1588 N LYS A 98 -24.229 -7.928 14.229 1.00 3.20 N ATOM 1589 CA LYS A 98 -22.806 -8.010 13.920 1.00 72.22 C ATOM 1590 C LYS A 98 -22.576 -8.764 12.614 1.00 50.02 C ATOM 1591 O LYS A 98 -21.783 -8.340 11.773 1.00 55.02 O ATOM 1592 CB LYS A 98 -22.055 -8.702 15.059 1.00 2.15 C ATOM 1593 CG LYS A 98 -22.286 -8.062 16.417 1.00 1.52 C ATOM 1594 CD LYS A 98 -21.795 -6.624 16.446 1.00 15.43 C ATOM 1595 CE LYS A 98 -20.947 -6.349 17.678 1.00 23.03 C ATOM 1596 NZ LYS A 98 -21.588 -6.864 18.920 1.00 62.34 N ATOM 0 H LYS A 98 -24.481 -8.286 15.150 1.00 3.20 H new ATOM 0 HA LYS A 98 -22.425 -6.995 13.806 1.00 72.22 H new ATOM 0 HB2 LYS A 98 -22.361 -9.747 15.103 1.00 2.15 H new ATOM 0 HB3 LYS A 98 -20.988 -8.691 14.838 1.00 2.15 H new ATOM 0 HG2 LYS A 98 -23.349 -8.090 16.657 1.00 1.52 H new ATOM 0 HG3 LYS A 98 -21.771 -8.639 17.185 1.00 1.52 H new ATOM 0 HD2 LYS A 98 -21.211 -6.420 15.548 1.00 15.43 H new ATOM 0 HD3 LYS A 98 -22.649 -5.947 16.432 1.00 15.43 H new ATOM 0 HE2 LYS A 98 -19.968 -6.813 17.556 1.00 23.03 H new ATOM 0 HE3 LYS A 98 -20.782 -5.276 17.773 1.00 23.03 H new ATOM 0 HZ1 LYS A 98 -20.942 -6.733 19.724 1.00 62.34 H new ATOM 0 HZ2 LYS A 98 -22.471 -6.343 19.097 1.00 62.34 H new ATOM 0 HZ3 LYS A 98 -21.800 -7.876 18.807 1.00 62.34 H new ATOM 1610 N SER A 99 -23.275 -9.883 12.450 1.00 0.34 N ATOM 1611 CA SER A 99 -23.145 -10.697 11.247 1.00 3.55 C ATOM 1612 C SER A 99 -23.468 -9.879 10.001 1.00 44.33 C ATOM 1613 O SER A 99 -22.814 -10.019 8.967 1.00 34.44 O ATOM 1614 CB SER A 99 -24.069 -11.913 11.327 1.00 60.13 C ATOM 1615 OG SER A 99 -23.648 -12.808 12.342 1.00 54.21 O ATOM 0 H SER A 99 -23.937 -10.247 13.135 1.00 0.34 H new ATOM 0 HA SER A 99 -22.112 -11.039 11.178 1.00 3.55 H new ATOM 0 HB2 SER A 99 -25.089 -11.586 11.527 1.00 60.13 H new ATOM 0 HB3 SER A 99 -24.082 -12.428 10.366 1.00 60.13 H new ATOM 0 HG SER A 99 -24.256 -13.576 12.374 1.00 54.21 H new ATOM 1621 N GLU A 100 -24.480 -9.024 10.107 1.00 13.00 N ATOM 1622 CA GLU A 100 -24.891 -8.184 8.988 1.00 2.00 C ATOM 1623 C GLU A 100 -23.860 -7.091 8.721 1.00 24.31 C ATOM 1624 O GLU A 100 -23.733 -6.602 7.598 1.00 33.32 O ATOM 1625 CB GLU A 100 -26.257 -7.554 9.269 1.00 63.04 C ATOM 1626 CG GLU A 100 -27.331 -8.566 9.628 1.00 35.11 C ATOM 1627 CD GLU A 100 -28.392 -8.698 8.552 1.00 23.10 C ATOM 1628 OE1 GLU A 100 -28.055 -8.528 7.362 1.00 45.31 O ATOM 1629 OE2 GLU A 100 -29.559 -8.972 8.901 1.00 72.40 O ATOM 0 H GLU A 100 -25.030 -8.895 10.956 1.00 13.00 H new ATOM 0 HA GLU A 100 -24.965 -8.814 8.102 1.00 2.00 H new ATOM 0 HB2 GLU A 100 -26.157 -6.838 10.085 1.00 63.04 H new ATOM 0 HB3 GLU A 100 -26.577 -6.993 8.391 1.00 63.04 H new ATOM 0 HG2 GLU A 100 -26.867 -9.538 9.797 1.00 35.11 H new ATOM 0 HG3 GLU A 100 -27.804 -8.271 10.565 1.00 35.11 H new ATOM 1636 N PHE A 101 -23.125 -6.712 9.762 1.00 62.45 N ATOM 1637 CA PHE A 101 -22.106 -5.677 9.641 1.00 44.50 C ATOM 1638 C PHE A 101 -21.049 -6.070 8.613 1.00 24.53 C ATOM 1639 O PHE A 101 -20.454 -5.215 7.957 1.00 11.23 O ATOM 1640 CB PHE A 101 -21.444 -5.422 10.997 1.00 15.51 C ATOM 1641 CG PHE A 101 -22.404 -4.951 12.053 1.00 42.35 C ATOM 1642 CD1 PHE A 101 -23.734 -4.717 11.744 1.00 52.14 C ATOM 1643 CD2 PHE A 101 -21.976 -4.742 13.354 1.00 65.44 C ATOM 1644 CE1 PHE A 101 -24.619 -4.283 12.713 1.00 43.12 C ATOM 1645 CE2 PHE A 101 -22.856 -4.309 14.327 1.00 4.23 C ATOM 1646 CZ PHE A 101 -24.179 -4.080 14.006 1.00 12.24 C ATOM 0 H PHE A 101 -23.217 -7.106 10.698 1.00 62.45 H new ATOM 0 HA PHE A 101 -22.593 -4.762 9.304 1.00 44.50 H new ATOM 0 HB2 PHE A 101 -20.964 -6.340 11.337 1.00 15.51 H new ATOM 0 HB3 PHE A 101 -20.657 -4.678 10.874 1.00 15.51 H new ATOM 0 HD1 PHE A 101 -24.083 -4.875 10.734 1.00 52.14 H new ATOM 0 HD2 PHE A 101 -20.942 -4.920 13.611 1.00 65.44 H new ATOM 0 HE1 PHE A 101 -25.653 -4.103 12.459 1.00 43.12 H new ATOM 0 HE2 PHE A 101 -22.509 -4.150 15.337 1.00 4.23 H new ATOM 0 HZ PHE A 101 -24.869 -3.743 14.765 1.00 12.24 H new ATOM 1656 N LYS A 102 -20.819 -7.372 8.479 1.00 30.30 N ATOM 1657 CA LYS A 102 -19.835 -7.882 7.532 1.00 61.42 C ATOM 1658 C LYS A 102 -20.327 -7.721 6.097 1.00 64.52 C ATOM 1659 O LYS A 102 -19.560 -7.362 5.203 1.00 24.12 O ATOM 1660 CB LYS A 102 -19.537 -9.356 7.818 1.00 74.11 C ATOM 1661 CG LYS A 102 -18.331 -9.890 7.065 1.00 75.53 C ATOM 1662 CD LYS A 102 -18.725 -10.983 6.085 1.00 32.42 C ATOM 1663 CE LYS A 102 -19.726 -10.477 5.058 1.00 34.12 C ATOM 1664 NZ LYS A 102 -19.841 -11.399 3.894 1.00 44.41 N ATOM 0 H LYS A 102 -21.301 -8.094 9.015 1.00 30.30 H new ATOM 0 HA LYS A 102 -18.919 -7.303 7.651 1.00 61.42 H new ATOM 0 HB2 LYS A 102 -19.373 -9.484 8.888 1.00 74.11 H new ATOM 0 HB3 LYS A 102 -20.411 -9.952 7.556 1.00 74.11 H new ATOM 0 HG2 LYS A 102 -17.847 -9.075 6.527 1.00 75.53 H new ATOM 0 HG3 LYS A 102 -17.602 -10.282 7.774 1.00 75.53 H new ATOM 0 HD2 LYS A 102 -17.836 -11.354 5.576 1.00 32.42 H new ATOM 0 HD3 LYS A 102 -19.155 -11.824 6.630 1.00 32.42 H new ATOM 0 HE2 LYS A 102 -20.703 -10.363 5.528 1.00 34.12 H new ATOM 0 HE3 LYS A 102 -19.422 -9.490 4.710 1.00 34.12 H new ATOM 0 HZ1 LYS A 102 -20.533 -11.019 3.217 1.00 44.41 H new ATOM 0 HZ2 LYS A 102 -18.915 -11.489 3.429 1.00 44.41 H new ATOM 0 HZ3 LYS A 102 -20.156 -12.334 4.222 1.00 44.41 H new ATOM 1678 N LYS A 103 -21.611 -7.988 5.883 1.00 65.22 N ATOM 1679 CA LYS A 103 -22.206 -7.871 4.557 1.00 13.52 C ATOM 1680 C LYS A 103 -22.313 -6.408 4.136 1.00 23.24 C ATOM 1681 O LYS A 103 -22.012 -6.058 2.995 1.00 45.20 O ATOM 1682 CB LYS A 103 -23.592 -8.520 4.539 1.00 40.32 C ATOM 1683 CG LYS A 103 -24.244 -8.523 3.167 1.00 51.20 C ATOM 1684 CD LYS A 103 -25.419 -7.561 3.106 1.00 45.33 C ATOM 1685 CE LYS A 103 -26.604 -8.076 3.907 1.00 21.42 C ATOM 1686 NZ LYS A 103 -27.310 -9.182 3.203 1.00 35.33 N ATOM 0 H LYS A 103 -22.260 -8.287 6.611 1.00 65.22 H new ATOM 0 HA LYS A 103 -21.559 -8.389 3.849 1.00 13.52 H new ATOM 0 HB2 LYS A 103 -23.508 -9.547 4.894 1.00 40.32 H new ATOM 0 HB3 LYS A 103 -24.240 -7.993 5.239 1.00 40.32 H new ATOM 0 HG2 LYS A 103 -23.507 -8.247 2.412 1.00 51.20 H new ATOM 0 HG3 LYS A 103 -24.584 -9.530 2.927 1.00 51.20 H new ATOM 0 HD2 LYS A 103 -25.114 -6.588 3.491 1.00 45.33 H new ATOM 0 HD3 LYS A 103 -25.717 -7.414 2.068 1.00 45.33 H new ATOM 0 HE2 LYS A 103 -26.260 -8.426 4.880 1.00 21.42 H new ATOM 0 HE3 LYS A 103 -27.301 -7.259 4.090 1.00 21.42 H new ATOM 0 HZ1 LYS A 103 -28.169 -9.437 3.731 1.00 35.33 H new ATOM 0 HZ2 LYS A 103 -27.571 -8.873 2.245 1.00 35.33 H new ATOM 0 HZ3 LYS A 103 -26.683 -10.010 3.141 1.00 35.33 H new ATOM 1700 N ILE A 104 -22.741 -5.560 5.065 1.00 52.21 N ATOM 1701 CA ILE A 104 -22.884 -4.136 4.790 1.00 52.41 C ATOM 1702 C ILE A 104 -21.540 -3.505 4.441 1.00 72.42 C ATOM 1703 O ILE A 104 -21.423 -2.770 3.460 1.00 13.42 O ATOM 1704 CB ILE A 104 -23.492 -3.388 5.992 1.00 70.53 C ATOM 1705 CG1 ILE A 104 -24.999 -3.641 6.068 1.00 53.33 C ATOM 1706 CG2 ILE A 104 -23.203 -1.898 5.890 1.00 34.20 C ATOM 1707 CD1 ILE A 104 -25.467 -4.100 7.431 1.00 52.30 C ATOM 0 H ILE A 104 -22.995 -5.834 6.014 1.00 52.21 H new ATOM 0 HA ILE A 104 -23.557 -4.046 3.938 1.00 52.41 H new ATOM 0 HB ILE A 104 -23.033 -3.765 6.906 1.00 70.53 H new ATOM 0 HG12 ILE A 104 -25.527 -2.725 5.801 1.00 53.33 H new ATOM 0 HG13 ILE A 104 -25.271 -4.393 5.327 1.00 53.33 H new ATOM 0 HG21 ILE A 104 -23.639 -1.383 6.746 1.00 34.20 H new ATOM 0 HG22 ILE A 104 -22.125 -1.736 5.880 1.00 34.20 H new ATOM 0 HG23 ILE A 104 -23.638 -1.505 4.971 1.00 34.20 H new ATOM 0 HD11 ILE A 104 -26.545 -4.260 7.411 1.00 52.30 H new ATOM 0 HD12 ILE A 104 -24.967 -5.032 7.692 1.00 52.30 H new ATOM 0 HD13 ILE A 104 -25.227 -3.339 8.173 1.00 52.30 H new ATOM 1719 N HIS A 105 -20.527 -3.800 5.249 1.00 62.22 N ATOM 1720 CA HIS A 105 -19.189 -3.264 5.024 1.00 21.40 C ATOM 1721 C HIS A 105 -18.627 -3.747 3.690 1.00 55.00 C ATOM 1722 O HIS A 105 -18.011 -2.980 2.951 1.00 33.13 O ATOM 1723 CB HIS A 105 -18.254 -3.675 6.162 1.00 13.24 C ATOM 1724 CG HIS A 105 -16.943 -2.951 6.152 1.00 53.35 C ATOM 1725 ND1 HIS A 105 -16.127 -2.889 5.042 1.00 40.30 N ATOM 1726 CD2 HIS A 105 -16.309 -2.254 7.123 1.00 3.11 C ATOM 1727 CE1 HIS A 105 -15.046 -2.186 5.332 1.00 72.41 C ATOM 1728 NE2 HIS A 105 -15.132 -1.789 6.589 1.00 72.33 N ATOM 0 H HIS A 105 -20.607 -4.407 6.065 1.00 62.22 H new ATOM 0 HA HIS A 105 -19.260 -2.177 4.996 1.00 21.40 H new ATOM 0 HB2 HIS A 105 -18.753 -3.493 7.114 1.00 13.24 H new ATOM 0 HB3 HIS A 105 -18.068 -4.747 6.099 1.00 13.24 H new ATOM 0 HD1 HIS A 105 -16.326 -3.318 4.139 1.00 40.30 H new ATOM 0 HD2 HIS A 105 -16.663 -2.093 8.131 1.00 3.11 H new ATOM 0 HE1 HIS A 105 -14.231 -1.972 4.656 1.00 72.41 H new ATOM 1736 N ASN A 106 -18.844 -5.023 3.389 1.00 35.20 N ATOM 1737 CA ASN A 106 -18.359 -5.608 2.145 1.00 62.35 C ATOM 1738 C ASN A 106 -18.913 -4.857 0.938 1.00 61.23 C ATOM 1739 O ASN A 106 -18.194 -4.591 -0.026 1.00 73.34 O ATOM 1740 CB ASN A 106 -18.750 -7.085 2.064 1.00 35.20 C ATOM 1741 CG ASN A 106 -17.553 -7.990 1.846 1.00 51.23 C ATOM 1742 OD1 ASN A 106 -16.616 -7.636 1.130 1.00 3.45 O ATOM 1743 ND2 ASN A 106 -17.580 -9.165 2.463 1.00 64.42 N ATOM 0 H ASN A 106 -19.353 -5.672 3.990 1.00 35.20 H new ATOM 0 HA ASN A 106 -17.272 -5.526 2.134 1.00 62.35 H new ATOM 0 HB2 ASN A 106 -19.258 -7.374 2.984 1.00 35.20 H new ATOM 0 HB3 ASN A 106 -19.461 -7.225 1.250 1.00 35.20 H new ATOM 0 HD21 ASN A 106 -16.803 -9.817 2.353 1.00 64.42 H new ATOM 0 HD22 ASN A 106 -18.378 -9.416 3.047 1.00 64.42 H new ATOM 1750 N THR A 107 -20.197 -4.517 0.998 1.00 44.53 N ATOM 1751 CA THR A 107 -20.848 -3.797 -0.089 1.00 40.33 C ATOM 1752 C THR A 107 -20.491 -2.315 -0.059 1.00 52.01 C ATOM 1753 O THR A 107 -20.349 -1.680 -1.104 1.00 11.53 O ATOM 1754 CB THR A 107 -22.380 -3.946 -0.023 1.00 43.33 C ATOM 1755 OG1 THR A 107 -22.990 -3.215 -1.093 1.00 4.52 O ATOM 1756 CG2 THR A 107 -22.915 -3.445 1.310 1.00 71.32 C ATOM 0 H THR A 107 -20.806 -4.729 1.788 1.00 44.53 H new ATOM 0 HA THR A 107 -20.487 -4.236 -1.019 1.00 40.33 H new ATOM 0 HB THR A 107 -22.625 -5.004 -0.121 1.00 43.33 H new ATOM 0 HG1 THR A 107 -23.964 -3.316 -1.045 1.00 4.52 H new ATOM 0 HG21 THR A 107 -23.999 -3.560 1.334 1.00 71.32 H new ATOM 0 HG22 THR A 107 -22.471 -4.023 2.121 1.00 71.32 H new ATOM 0 HG23 THR A 107 -22.659 -2.393 1.432 1.00 71.32 H new ATOM 1764 N SER A 108 -20.347 -1.770 1.145 1.00 61.23 N ATOM 1765 CA SER A 108 -20.009 -0.361 1.311 1.00 73.33 C ATOM 1766 C SER A 108 -18.543 -0.196 1.699 1.00 71.11 C ATOM 1767 O SER A 108 -18.176 0.752 2.393 1.00 55.53 O ATOM 1768 CB SER A 108 -20.905 0.278 2.373 1.00 32.24 C ATOM 1769 OG SER A 108 -22.275 0.070 2.077 1.00 13.24 O ATOM 0 H SER A 108 -20.459 -2.283 2.020 1.00 61.23 H new ATOM 0 HA SER A 108 -20.173 0.141 0.358 1.00 73.33 H new ATOM 0 HB2 SER A 108 -20.673 -0.144 3.351 1.00 32.24 H new ATOM 0 HB3 SER A 108 -20.700 1.347 2.430 1.00 32.24 H new ATOM 0 HG SER A 108 -22.731 -0.282 2.870 1.00 13.24 H new ATOM 1775 N ARG A 109 -17.709 -1.127 1.246 1.00 12.41 N ATOM 1776 CA ARG A 109 -16.283 -1.086 1.546 1.00 11.14 C ATOM 1777 C ARG A 109 -15.596 0.033 0.769 1.00 24.13 C ATOM 1778 O ARG A 109 -14.977 -0.206 -0.267 1.00 22.33 O ATOM 1779 CB ARG A 109 -15.631 -2.429 1.212 1.00 53.22 C ATOM 1780 CG ARG A 109 -14.164 -2.507 1.599 1.00 4.32 C ATOM 1781 CD ARG A 109 -13.791 -3.895 2.095 1.00 32.30 C ATOM 1782 NE ARG A 109 -12.386 -3.979 2.484 1.00 60.14 N ATOM 1783 CZ ARG A 109 -11.791 -5.109 2.849 1.00 2.15 C ATOM 1784 NH1 ARG A 109 -12.475 -6.244 2.876 1.00 32.10 N ATOM 1785 NH2 ARG A 109 -10.508 -5.105 3.189 1.00 11.42 N ATOM 0 H ARG A 109 -17.996 -1.918 0.670 1.00 12.41 H new ATOM 0 HA ARG A 109 -16.167 -0.889 2.612 1.00 11.14 H new ATOM 0 HB2 ARG A 109 -16.175 -3.224 1.722 1.00 53.22 H new ATOM 0 HB3 ARG A 109 -15.726 -2.613 0.142 1.00 53.22 H new ATOM 0 HG2 ARG A 109 -13.546 -2.248 0.739 1.00 4.32 H new ATOM 0 HG3 ARG A 109 -13.952 -1.773 2.376 1.00 4.32 H new ATOM 0 HD2 ARG A 109 -14.419 -4.156 2.947 1.00 32.30 H new ATOM 0 HD3 ARG A 109 -13.995 -4.626 1.313 1.00 32.30 H new ATOM 0 HE ARG A 109 -11.831 -3.123 2.475 1.00 60.14 H new ATOM 0 HH11 ARG A 109 -13.461 -6.251 2.616 1.00 32.10 H new ATOM 0 HH12 ARG A 109 -12.015 -7.110 3.157 1.00 32.10 H new ATOM 0 HH21 ARG A 109 -9.978 -4.234 3.170 1.00 11.42 H new ATOM 0 HH22 ARG A 109 -10.052 -5.973 3.469 1.00 11.42 H new ATOM 1799 N GLY A 110 -15.710 1.256 1.278 1.00 44.44 N ATOM 1800 CA GLY A 110 -15.095 2.394 0.618 1.00 21.34 C ATOM 1801 C GLY A 110 -15.966 3.633 0.668 1.00 11.23 C ATOM 1802 O GLY A 110 -15.526 4.723 0.305 1.00 5.44 O ATOM 0 H GLY A 110 -16.217 1.479 2.135 1.00 44.44 H new ATOM 0 HA2 GLY A 110 -14.136 2.609 1.089 1.00 21.34 H new ATOM 0 HA3 GLY A 110 -14.890 2.140 -0.422 1.00 21.34 H new ATOM 1806 N GLN A 111 -17.206 3.466 1.117 1.00 22.43 N ATOM 1807 CA GLN A 111 -18.141 4.580 1.210 1.00 12.34 C ATOM 1808 C GLN A 111 -18.725 4.685 2.615 1.00 34.34 C ATOM 1809 O GLN A 111 -18.175 4.134 3.568 1.00 12.14 O ATOM 1810 CB GLN A 111 -19.267 4.416 0.188 1.00 30.41 C ATOM 1811 CG GLN A 111 -20.288 3.357 0.573 1.00 52.22 C ATOM 1812 CD GLN A 111 -21.021 2.790 -0.627 1.00 14.31 C ATOM 1813 OE1 GLN A 111 -20.518 1.900 -1.313 1.00 32.14 O ATOM 1814 NE2 GLN A 111 -22.218 3.304 -0.887 1.00 2.21 N ATOM 0 H GLN A 111 -17.586 2.570 1.422 1.00 22.43 H new ATOM 0 HA GLN A 111 -17.595 5.498 0.994 1.00 12.34 H new ATOM 0 HB2 GLN A 111 -19.776 5.372 0.064 1.00 30.41 H new ATOM 0 HB3 GLN A 111 -18.834 4.158 -0.779 1.00 30.41 H new ATOM 0 HG2 GLN A 111 -19.785 2.548 1.102 1.00 52.22 H new ATOM 0 HG3 GLN A 111 -21.011 3.789 1.265 1.00 52.22 H new ATOM 0 HE21 GLN A 111 -22.597 4.041 -0.292 1.00 2.21 H new ATOM 0 HE22 GLN A 111 -22.758 2.962 -1.682 1.00 2.21 H new ATOM 1823 N GLU A 112 -19.843 5.395 2.735 1.00 3.01 N ATOM 1824 CA GLU A 112 -20.500 5.572 4.025 1.00 60.03 C ATOM 1825 C GLU A 112 -21.142 4.269 4.491 1.00 33.23 C ATOM 1826 O GLU A 112 -21.814 3.584 3.719 1.00 43.22 O ATOM 1827 CB GLU A 112 -21.560 6.672 3.935 1.00 4.23 C ATOM 1828 CG GLU A 112 -21.011 8.009 3.467 1.00 44.34 C ATOM 1829 CD GLU A 112 -22.101 8.963 3.020 1.00 52.34 C ATOM 1830 OE1 GLU A 112 -22.944 8.555 2.194 1.00 72.53 O ATOM 1831 OE2 GLU A 112 -22.112 10.118 3.495 1.00 63.11 O ATOM 0 H GLU A 112 -20.312 5.856 1.956 1.00 3.01 H new ATOM 0 HA GLU A 112 -19.743 5.865 4.753 1.00 60.03 H new ATOM 0 HB2 GLU A 112 -22.346 6.352 3.251 1.00 4.23 H new ATOM 0 HB3 GLU A 112 -22.022 6.801 4.914 1.00 4.23 H new ATOM 0 HG2 GLU A 112 -20.442 8.467 4.276 1.00 44.34 H new ATOM 0 HG3 GLU A 112 -20.317 7.844 2.643 1.00 44.34 H new ATOM 1838 N ILE A 113 -20.931 3.933 5.759 1.00 24.33 N ATOM 1839 CA ILE A 113 -21.489 2.713 6.329 1.00 21.31 C ATOM 1840 C ILE A 113 -22.279 3.010 7.599 1.00 2.50 C ATOM 1841 O ILE A 113 -22.997 2.151 8.111 1.00 4.12 O ATOM 1842 CB ILE A 113 -20.387 1.687 6.652 1.00 23.32 C ATOM 1843 CG1 ILE A 113 -19.524 2.181 7.815 1.00 15.14 C ATOM 1844 CG2 ILE A 113 -19.529 1.426 5.423 1.00 2.21 C ATOM 1845 CD1 ILE A 113 -18.556 1.141 8.334 1.00 1.42 C ATOM 0 H ILE A 113 -20.378 4.489 6.411 1.00 24.33 H new ATOM 0 HA ILE A 113 -22.158 2.292 5.578 1.00 21.31 H new ATOM 0 HB ILE A 113 -20.860 0.750 6.947 1.00 23.32 H new ATOM 0 HG12 ILE A 113 -18.963 3.059 7.494 1.00 15.14 H new ATOM 0 HG13 ILE A 113 -20.174 2.499 8.630 1.00 15.14 H new ATOM 0 HG21 ILE A 113 -18.755 0.699 5.668 1.00 2.21 H new ATOM 0 HG22 ILE A 113 -20.153 1.035 4.620 1.00 2.21 H new ATOM 0 HG23 ILE A 113 -19.063 2.357 5.100 1.00 2.21 H new ATOM 0 HD11 ILE A 113 -17.978 1.561 9.157 1.00 1.42 H new ATOM 0 HD12 ILE A 113 -19.111 0.272 8.687 1.00 1.42 H new ATOM 0 HD13 ILE A 113 -17.881 0.840 7.533 1.00 1.42 H new ATOM 1857 N ILE A 114 -22.143 4.233 8.101 1.00 44.22 N ATOM 1858 CA ILE A 114 -22.846 4.645 9.309 1.00 1.22 C ATOM 1859 C ILE A 114 -24.357 4.586 9.113 1.00 30.31 C ATOM 1860 O ILE A 114 -25.085 4.078 9.966 1.00 30.32 O ATOM 1861 CB ILE A 114 -22.450 6.072 9.732 1.00 53.30 C ATOM 1862 CG1 ILE A 114 -20.927 6.207 9.788 1.00 12.30 C ATOM 1863 CG2 ILE A 114 -23.068 6.416 11.079 1.00 1.02 C ATOM 1864 CD1 ILE A 114 -20.277 5.295 10.805 1.00 42.43 C ATOM 0 H ILE A 114 -21.552 4.956 7.689 1.00 44.22 H new ATOM 0 HA ILE A 114 -22.556 3.948 10.096 1.00 1.22 H new ATOM 0 HB ILE A 114 -22.831 6.774 8.990 1.00 53.30 H new ATOM 0 HG12 ILE A 114 -20.515 5.991 8.802 1.00 12.30 H new ATOM 0 HG13 ILE A 114 -20.670 7.240 10.022 1.00 12.30 H new ATOM 0 HG21 ILE A 114 -22.779 7.428 11.364 1.00 1.02 H new ATOM 0 HG22 ILE A 114 -24.154 6.356 11.007 1.00 1.02 H new ATOM 0 HG23 ILE A 114 -22.714 5.712 11.832 1.00 1.02 H new ATOM 0 HD11 ILE A 114 -19.197 5.444 10.790 1.00 42.43 H new ATOM 0 HD12 ILE A 114 -20.661 5.526 11.799 1.00 42.43 H new ATOM 0 HD13 ILE A 114 -20.503 4.257 10.560 1.00 42.43 H new ATOM 1876 N PHE A 115 -24.822 5.107 7.983 1.00 74.44 N ATOM 1877 CA PHE A 115 -26.247 5.112 7.673 1.00 14.11 C ATOM 1878 C PHE A 115 -26.733 3.709 7.319 1.00 4.42 C ATOM 1879 O PHE A 115 -27.876 3.349 7.598 1.00 64.34 O ATOM 1880 CB PHE A 115 -26.536 6.071 6.516 1.00 61.20 C ATOM 1881 CG PHE A 115 -27.973 6.502 6.439 1.00 64.13 C ATOM 1882 CD1 PHE A 115 -28.556 7.203 7.482 1.00 53.14 C ATOM 1883 CD2 PHE A 115 -28.739 6.207 5.323 1.00 33.41 C ATOM 1884 CE1 PHE A 115 -29.878 7.600 7.413 1.00 13.23 C ATOM 1885 CE2 PHE A 115 -30.062 6.602 5.249 1.00 61.41 C ATOM 1886 CZ PHE A 115 -30.632 7.300 6.295 1.00 3.21 C ATOM 0 H PHE A 115 -24.233 5.531 7.266 1.00 74.44 H new ATOM 0 HA PHE A 115 -26.784 5.450 8.559 1.00 14.11 H new ATOM 0 HB2 PHE A 115 -25.905 6.954 6.620 1.00 61.20 H new ATOM 0 HB3 PHE A 115 -26.259 5.590 5.578 1.00 61.20 H new ATOM 0 HD1 PHE A 115 -27.971 7.442 8.358 1.00 53.14 H new ATOM 0 HD2 PHE A 115 -28.298 5.662 4.501 1.00 33.41 H new ATOM 0 HE1 PHE A 115 -30.322 8.145 8.233 1.00 13.23 H new ATOM 0 HE2 PHE A 115 -30.649 6.365 4.374 1.00 61.41 H new ATOM 0 HZ PHE A 115 -31.665 7.611 6.239 1.00 3.21 H new ATOM 1896 N GLU A 116 -25.855 2.924 6.703 1.00 23.23 N ATOM 1897 CA GLU A 116 -26.194 1.561 6.310 1.00 11.30 C ATOM 1898 C GLU A 116 -26.399 0.676 7.536 1.00 3.01 C ATOM 1899 O GLU A 116 -27.382 -0.059 7.626 1.00 32.35 O ATOM 1900 CB GLU A 116 -25.095 0.975 5.421 1.00 33.54 C ATOM 1901 CG GLU A 116 -24.774 1.829 4.206 1.00 32.35 C ATOM 1902 CD GLU A 116 -25.881 1.809 3.170 1.00 13.04 C ATOM 1903 OE1 GLU A 116 -26.223 0.708 2.689 1.00 41.40 O ATOM 1904 OE2 GLU A 116 -26.406 2.893 2.841 1.00 43.30 O ATOM 0 H GLU A 116 -24.905 3.208 6.465 1.00 23.23 H new ATOM 0 HA GLU A 116 -27.127 1.593 5.748 1.00 11.30 H new ATOM 0 HB2 GLU A 116 -24.189 0.847 6.014 1.00 33.54 H new ATOM 0 HB3 GLU A 116 -25.400 -0.017 5.087 1.00 33.54 H new ATOM 0 HG2 GLU A 116 -24.598 2.856 4.525 1.00 32.35 H new ATOM 0 HG3 GLU A 116 -23.849 1.474 3.751 1.00 32.35 H new ATOM 1911 N ILE A 117 -25.463 0.752 8.476 1.00 1.43 N ATOM 1912 CA ILE A 117 -25.540 -0.041 9.697 1.00 54.13 C ATOM 1913 C ILE A 117 -26.753 0.354 10.533 1.00 71.43 C ATOM 1914 O ILE A 117 -27.450 -0.502 11.079 1.00 21.05 O ATOM 1915 CB ILE A 117 -24.269 0.115 10.551 1.00 2.44 C ATOM 1916 CG1 ILE A 117 -23.979 -1.179 11.315 1.00 44.45 C ATOM 1917 CG2 ILE A 117 -24.419 1.283 11.515 1.00 22.13 C ATOM 1918 CD1 ILE A 117 -22.514 -1.557 11.328 1.00 51.04 C ATOM 0 H ILE A 117 -24.642 1.355 8.416 1.00 1.43 H new ATOM 0 HA ILE A 117 -25.636 -1.083 9.391 1.00 54.13 H new ATOM 0 HB ILE A 117 -23.428 0.320 9.889 1.00 2.44 H new ATOM 0 HG12 ILE A 117 -24.327 -1.071 12.342 1.00 44.45 H new ATOM 0 HG13 ILE A 117 -24.552 -1.992 10.868 1.00 44.45 H new ATOM 0 HG21 ILE A 117 -23.512 1.381 12.112 1.00 22.13 H new ATOM 0 HG22 ILE A 117 -24.583 2.201 10.951 1.00 22.13 H new ATOM 0 HG23 ILE A 117 -25.269 1.105 12.173 1.00 22.13 H new ATOM 0 HD11 ILE A 117 -22.382 -2.484 11.887 1.00 51.04 H new ATOM 0 HD12 ILE A 117 -22.165 -1.697 10.305 1.00 51.04 H new ATOM 0 HD13 ILE A 117 -21.937 -0.763 11.802 1.00 51.04 H new ATOM 1930 N THR A 118 -27.002 1.656 10.627 1.00 43.30 N ATOM 1931 CA THR A 118 -28.131 2.165 11.395 1.00 4.34 C ATOM 1932 C THR A 118 -29.455 1.788 10.742 1.00 12.01 C ATOM 1933 O THR A 118 -30.403 1.394 11.421 1.00 14.43 O ATOM 1934 CB THR A 118 -28.063 3.697 11.546 1.00 71.23 C ATOM 1935 OG1 THR A 118 -28.230 4.322 10.268 1.00 11.14 O ATOM 1936 CG2 THR A 118 -26.736 4.123 12.155 1.00 61.21 C ATOM 0 H THR A 118 -26.436 2.378 10.180 1.00 43.30 H new ATOM 0 HA THR A 118 -28.073 1.707 12.383 1.00 4.34 H new ATOM 0 HB THR A 118 -28.867 4.011 12.212 1.00 71.23 H new ATOM 0 HG1 THR A 118 -28.139 5.293 10.364 1.00 11.14 H new ATOM 0 HG21 THR A 118 -26.712 5.208 12.252 1.00 61.21 H new ATOM 0 HG22 THR A 118 -26.625 3.669 13.139 1.00 61.21 H new ATOM 0 HG23 THR A 118 -25.919 3.798 11.511 1.00 61.21 H new ATOM 1944 N SER A 119 -29.514 1.910 9.420 1.00 45.12 N ATOM 1945 CA SER A 119 -30.724 1.585 8.675 1.00 70.42 C ATOM 1946 C SER A 119 -31.028 0.092 8.758 1.00 35.14 C ATOM 1947 O SER A 119 -32.174 -0.309 8.964 1.00 31.24 O ATOM 1948 CB SER A 119 -30.576 2.005 7.211 1.00 12.23 C ATOM 1949 OG SER A 119 -30.792 3.397 7.057 1.00 42.25 O ATOM 0 H SER A 119 -28.737 2.232 8.843 1.00 45.12 H new ATOM 0 HA SER A 119 -31.554 2.133 9.121 1.00 70.42 H new ATOM 0 HB2 SER A 119 -29.579 1.747 6.854 1.00 12.23 H new ATOM 0 HB3 SER A 119 -31.288 1.453 6.597 1.00 12.23 H new ATOM 0 HG SER A 119 -29.942 3.873 7.160 1.00 42.25 H new ATOM 1955 N PHE A 120 -29.994 -0.726 8.597 1.00 60.42 N ATOM 1956 CA PHE A 120 -30.149 -2.175 8.653 1.00 73.33 C ATOM 1957 C PHE A 120 -30.647 -2.616 10.026 1.00 31.40 C ATOM 1958 O PHE A 120 -31.610 -3.376 10.136 1.00 31.13 O ATOM 1959 CB PHE A 120 -28.821 -2.865 8.334 1.00 50.43 C ATOM 1960 CG PHE A 120 -28.915 -3.857 7.210 1.00 34.14 C ATOM 1961 CD1 PHE A 120 -29.287 -5.169 7.457 1.00 63.03 C ATOM 1962 CD2 PHE A 120 -28.632 -3.478 5.908 1.00 71.30 C ATOM 1963 CE1 PHE A 120 -29.375 -6.085 6.425 1.00 2.12 C ATOM 1964 CE2 PHE A 120 -28.719 -4.389 4.872 1.00 20.55 C ATOM 1965 CZ PHE A 120 -29.090 -5.695 5.132 1.00 45.35 C ATOM 0 H PHE A 120 -29.039 -0.410 8.427 1.00 60.42 H new ATOM 0 HA PHE A 120 -30.889 -2.465 7.907 1.00 73.33 H new ATOM 0 HB2 PHE A 120 -28.080 -2.108 8.079 1.00 50.43 H new ATOM 0 HB3 PHE A 120 -28.461 -3.374 9.228 1.00 50.43 H new ATOM 0 HD1 PHE A 120 -29.511 -5.479 8.467 1.00 63.03 H new ATOM 0 HD2 PHE A 120 -28.340 -2.459 5.700 1.00 71.30 H new ATOM 0 HE1 PHE A 120 -29.666 -7.104 6.630 1.00 2.12 H new ATOM 0 HE2 PHE A 120 -28.497 -4.081 3.861 1.00 20.55 H new ATOM 0 HZ PHE A 120 -29.157 -6.409 4.325 1.00 45.35 H new ATOM 1975 N THR A 121 -29.983 -2.135 11.072 1.00 14.44 N ATOM 1976 CA THR A 121 -30.356 -2.479 12.439 1.00 61.45 C ATOM 1977 C THR A 121 -31.755 -1.975 12.771 1.00 53.41 C ATOM 1978 O THR A 121 -32.526 -2.657 13.445 1.00 13.44 O ATOM 1979 CB THR A 121 -29.357 -1.898 13.457 1.00 53.41 C ATOM 1980 OG1 THR A 121 -29.252 -0.480 13.285 1.00 14.12 O ATOM 1981 CG2 THR A 121 -27.986 -2.536 13.295 1.00 0.04 C ATOM 0 H THR A 121 -29.184 -1.506 10.999 1.00 14.44 H new ATOM 0 HA THR A 121 -30.340 -3.567 12.507 1.00 61.45 H new ATOM 0 HB THR A 121 -29.725 -2.116 14.459 1.00 53.41 H new ATOM 0 HG1 THR A 121 -28.685 -0.286 12.510 1.00 14.12 H new ATOM 0 HG21 THR A 121 -27.298 -2.110 14.025 1.00 0.04 H new ATOM 0 HG22 THR A 121 -28.064 -3.611 13.455 1.00 0.04 H new ATOM 0 HG23 THR A 121 -27.612 -2.345 12.289 1.00 0.04 H new ATOM 1989 N GLN A 122 -32.076 -0.777 12.293 1.00 55.14 N ATOM 1990 CA GLN A 122 -33.384 -0.182 12.540 1.00 54.31 C ATOM 1991 C GLN A 122 -34.489 -1.003 11.884 1.00 72.22 C ATOM 1992 O GLN A 122 -35.513 -1.289 12.503 1.00 54.10 O ATOM 1993 CB GLN A 122 -33.422 1.255 12.016 1.00 5.14 C ATOM 1994 CG GLN A 122 -34.700 1.998 12.369 1.00 40.20 C ATOM 1995 CD GLN A 122 -35.305 2.716 11.179 1.00 72.34 C ATOM 1996 OE1 GLN A 122 -36.403 2.383 10.731 1.00 62.33 O ATOM 1997 NE2 GLN A 122 -34.591 3.707 10.659 1.00 51.32 N ATOM 0 H GLN A 122 -31.449 -0.200 11.733 1.00 55.14 H new ATOM 0 HA GLN A 122 -33.553 -0.174 13.617 1.00 54.31 H new ATOM 0 HB2 GLN A 122 -32.570 1.803 12.419 1.00 5.14 H new ATOM 0 HB3 GLN A 122 -33.308 1.241 10.932 1.00 5.14 H new ATOM 0 HG2 GLN A 122 -35.427 1.292 12.771 1.00 40.20 H new ATOM 0 HG3 GLN A 122 -34.489 2.722 13.157 1.00 40.20 H new ATOM 0 HE21 GLN A 122 -33.686 3.949 11.062 1.00 51.32 H new ATOM 0 HE22 GLN A 122 -34.948 4.226 9.857 1.00 51.32 H new ATOM 2006 N GLU A 123 -34.274 -1.379 10.627 1.00 25.20 N ATOM 2007 CA GLU A 123 -35.253 -2.167 9.887 1.00 4.04 C ATOM 2008 C GLU A 123 -35.316 -3.595 10.421 1.00 73.45 C ATOM 2009 O GLU A 123 -36.390 -4.193 10.502 1.00 43.02 O ATOM 2010 CB GLU A 123 -34.907 -2.182 8.397 1.00 61.21 C ATOM 2011 CG GLU A 123 -33.947 -3.293 8.006 1.00 22.11 C ATOM 2012 CD GLU A 123 -33.783 -3.421 6.504 1.00 4.30 C ATOM 2013 OE1 GLU A 123 -33.208 -2.497 5.890 1.00 24.42 O ATOM 2014 OE2 GLU A 123 -34.229 -4.443 5.942 1.00 10.35 O ATOM 0 H GLU A 123 -33.431 -1.151 10.100 1.00 25.20 H new ATOM 0 HA GLU A 123 -36.231 -1.704 10.020 1.00 4.04 H new ATOM 0 HB2 GLU A 123 -35.826 -2.288 7.820 1.00 61.21 H new ATOM 0 HB3 GLU A 123 -34.469 -1.222 8.125 1.00 61.21 H new ATOM 0 HG2 GLU A 123 -32.974 -3.103 8.459 1.00 22.11 H new ATOM 0 HG3 GLU A 123 -34.308 -4.239 8.410 1.00 22.11 H new ATOM 2021 N LYS A 124 -34.159 -4.138 10.782 1.00 5.33 N ATOM 2022 CA LYS A 124 -34.080 -5.495 11.308 1.00 32.34 C ATOM 2023 C LYS A 124 -34.598 -5.554 12.742 1.00 2.10 C ATOM 2024 O LYS A 124 -35.128 -6.576 13.180 1.00 2.13 O ATOM 2025 CB LYS A 124 -32.637 -6.003 11.255 1.00 53.42 C ATOM 2026 CG LYS A 124 -32.528 -7.506 11.071 1.00 23.43 C ATOM 2027 CD LYS A 124 -32.526 -7.890 9.601 1.00 35.11 C ATOM 2028 CE LYS A 124 -33.861 -7.576 8.942 1.00 44.32 C ATOM 2029 NZ LYS A 124 -34.020 -8.290 7.645 1.00 52.43 N ATOM 0 H LYS A 124 -33.261 -3.658 10.720 1.00 5.33 H new ATOM 0 HA LYS A 124 -34.707 -6.135 10.687 1.00 32.34 H new ATOM 0 HB2 LYS A 124 -32.116 -5.506 10.437 1.00 53.42 H new ATOM 0 HB3 LYS A 124 -32.127 -5.720 12.176 1.00 53.42 H new ATOM 0 HG2 LYS A 124 -31.614 -7.866 11.543 1.00 23.43 H new ATOM 0 HG3 LYS A 124 -33.361 -7.996 11.575 1.00 23.43 H new ATOM 0 HD2 LYS A 124 -31.729 -7.355 9.085 1.00 35.11 H new ATOM 0 HD3 LYS A 124 -32.311 -8.954 9.502 1.00 35.11 H new ATOM 0 HE2 LYS A 124 -34.673 -7.857 9.613 1.00 44.32 H new ATOM 0 HE3 LYS A 124 -33.941 -6.501 8.777 1.00 44.32 H new ATOM 0 HZ1 LYS A 124 -34.942 -8.050 7.227 1.00 52.43 H new ATOM 0 HZ2 LYS A 124 -33.260 -8.003 6.995 1.00 52.43 H new ATOM 0 HZ3 LYS A 124 -33.969 -9.316 7.805 1.00 52.43 H new ATOM 2043 N LEU A 125 -34.443 -4.452 13.468 1.00 65.13 N ATOM 2044 CA LEU A 125 -34.896 -4.378 14.852 1.00 10.42 C ATOM 2045 C LEU A 125 -36.419 -4.410 14.929 1.00 70.41 C ATOM 2046 O LEU A 125 -36.994 -5.144 15.733 1.00 74.22 O ATOM 2047 CB LEU A 125 -34.368 -3.104 15.515 1.00 40.13 C ATOM 2048 CG LEU A 125 -35.125 -2.629 16.756 1.00 61.53 C ATOM 2049 CD1 LEU A 125 -35.499 -3.811 17.637 1.00 74.13 C ATOM 2050 CD2 LEU A 125 -34.292 -1.623 17.536 1.00 40.10 C ATOM 0 H LEU A 125 -34.007 -3.598 13.121 1.00 65.13 H new ATOM 0 HA LEU A 125 -34.505 -5.246 15.383 1.00 10.42 H new ATOM 0 HB2 LEU A 125 -33.326 -3.267 15.790 1.00 40.13 H new ATOM 0 HB3 LEU A 125 -34.381 -2.302 14.777 1.00 40.13 H new ATOM 0 HG LEU A 125 -36.043 -2.138 16.433 1.00 61.53 H new ATOM 0 HD11 LEU A 125 -36.037 -3.454 18.515 1.00 74.13 H new ATOM 0 HD12 LEU A 125 -36.134 -4.496 17.076 1.00 74.13 H new ATOM 0 HD13 LEU A 125 -34.594 -4.331 17.952 1.00 74.13 H new ATOM 0 HD21 LEU A 125 -34.846 -1.296 18.416 1.00 40.10 H new ATOM 0 HD22 LEU A 125 -33.357 -2.089 17.849 1.00 40.10 H new ATOM 0 HD23 LEU A 125 -34.075 -0.762 16.903 1.00 40.10 H new ATOM 2062 N ASP A 126 -37.066 -3.613 14.086 1.00 1.44 N ATOM 2063 CA ASP A 126 -38.523 -3.553 14.056 1.00 4.52 C ATOM 2064 C ASP A 126 -39.116 -4.920 13.731 1.00 13.34 C ATOM 2065 O ASP A 126 -40.154 -5.300 14.273 1.00 65.52 O ATOM 2066 CB ASP A 126 -38.991 -2.522 13.027 1.00 24.14 C ATOM 2067 CG ASP A 126 -38.172 -1.247 13.072 1.00 40.23 C ATOM 2068 OD1 ASP A 126 -37.905 -0.752 14.187 1.00 70.24 O ATOM 2069 OD2 ASP A 126 -37.799 -0.743 11.991 1.00 11.24 O ATOM 0 H ASP A 126 -36.605 -2.999 13.414 1.00 1.44 H new ATOM 0 HA ASP A 126 -38.871 -3.252 15.044 1.00 4.52 H new ATOM 0 HB2 ASP A 126 -38.929 -2.955 12.029 1.00 24.14 H new ATOM 0 HB3 ASP A 126 -40.039 -2.284 13.207 1.00 24.14 H new ATOM 2074 N GLU A 127 -38.451 -5.652 12.843 1.00 33.34 N ATOM 2075 CA GLU A 127 -38.915 -6.976 12.446 1.00 72.24 C ATOM 2076 C GLU A 127 -38.975 -7.916 13.647 1.00 42.52 C ATOM 2077 O GLU A 127 -39.983 -8.583 13.878 1.00 55.50 O ATOM 2078 CB GLU A 127 -37.996 -7.562 11.372 1.00 40.34 C ATOM 2079 CG GLU A 127 -37.767 -6.631 10.193 1.00 54.14 C ATOM 2080 CD GLU A 127 -38.406 -7.140 8.915 1.00 63.31 C ATOM 2081 OE1 GLU A 127 -39.539 -7.661 8.983 1.00 5.15 O ATOM 2082 OE2 GLU A 127 -37.771 -7.018 7.846 1.00 54.31 O ATOM 0 H GLU A 127 -37.590 -5.351 12.385 1.00 33.34 H new ATOM 0 HA GLU A 127 -39.920 -6.872 12.038 1.00 72.24 H new ATOM 0 HB2 GLU A 127 -37.034 -7.807 11.823 1.00 40.34 H new ATOM 0 HB3 GLU A 127 -38.425 -8.496 11.009 1.00 40.34 H new ATOM 0 HG2 GLU A 127 -38.170 -5.646 10.429 1.00 54.14 H new ATOM 0 HG3 GLU A 127 -36.696 -6.508 10.035 1.00 54.14 H new ATOM 2089 N PHE A 128 -37.887 -7.963 14.408 1.00 4.41 N ATOM 2090 CA PHE A 128 -37.813 -8.821 15.585 1.00 54.12 C ATOM 2091 C PHE A 128 -38.800 -8.362 16.655 1.00 62.22 C ATOM 2092 O PHE A 128 -39.671 -9.122 17.076 1.00 73.10 O ATOM 2093 CB PHE A 128 -36.393 -8.824 16.153 1.00 45.44 C ATOM 2094 CG PHE A 128 -35.518 -9.900 15.575 1.00 52.41 C ATOM 2095 CD1 PHE A 128 -34.972 -9.762 14.309 1.00 11.30 C ATOM 2096 CD2 PHE A 128 -35.243 -11.049 16.298 1.00 60.34 C ATOM 2097 CE1 PHE A 128 -34.167 -10.750 13.775 1.00 42.14 C ATOM 2098 CE2 PHE A 128 -34.438 -12.041 15.769 1.00 51.54 C ATOM 2099 CZ PHE A 128 -33.900 -11.891 14.505 1.00 34.21 C ATOM 0 H PHE A 128 -37.044 -7.417 14.231 1.00 4.41 H new ATOM 0 HA PHE A 128 -38.077 -9.834 15.282 1.00 54.12 H new ATOM 0 HB2 PHE A 128 -35.933 -7.854 15.966 1.00 45.44 H new ATOM 0 HB3 PHE A 128 -36.443 -8.950 17.235 1.00 45.44 H new ATOM 0 HD1 PHE A 128 -35.178 -8.872 13.733 1.00 11.30 H new ATOM 0 HD2 PHE A 128 -35.662 -11.171 17.286 1.00 60.34 H new ATOM 0 HE1 PHE A 128 -33.747 -10.630 12.787 1.00 42.14 H new ATOM 0 HE2 PHE A 128 -34.230 -12.932 16.343 1.00 51.54 H new ATOM 0 HZ PHE A 128 -33.272 -12.665 14.089 1.00 34.21 H new ATOM 2109 N GLN A 129 -38.654 -7.115 17.089 1.00 14.43 N ATOM 2110 CA GLN A 129 -39.531 -6.555 18.111 1.00 55.11 C ATOM 2111 C GLN A 129 -40.991 -6.886 17.817 1.00 63.43 C ATOM 2112 O GLN A 129 -41.800 -7.033 18.731 1.00 34.21 O ATOM 2113 CB GLN A 129 -39.348 -5.039 18.196 1.00 43.30 C ATOM 2114 CG GLN A 129 -40.209 -4.380 19.262 1.00 24.40 C ATOM 2115 CD GLN A 129 -41.556 -3.933 18.730 1.00 43.20 C ATOM 2116 OE1 GLN A 129 -42.206 -4.652 17.971 1.00 52.42 O ATOM 2117 NE2 GLN A 129 -41.982 -2.740 19.127 1.00 54.44 N ATOM 0 H GLN A 129 -37.938 -6.473 16.750 1.00 14.43 H new ATOM 0 HA GLN A 129 -39.261 -7.001 19.068 1.00 55.11 H new ATOM 0 HB2 GLN A 129 -38.300 -4.819 18.400 1.00 43.30 H new ATOM 0 HB3 GLN A 129 -39.583 -4.598 17.227 1.00 43.30 H new ATOM 0 HG2 GLN A 129 -40.361 -5.079 20.084 1.00 24.40 H new ATOM 0 HG3 GLN A 129 -39.680 -3.519 19.670 1.00 24.40 H new ATOM 0 HE21 GLN A 129 -41.410 -2.178 19.757 1.00 54.44 H new ATOM 0 HE22 GLN A 129 -42.881 -2.386 18.802 1.00 54.44 H new ATOM 2126 N ASN A 130 -41.319 -7.003 16.534 1.00 50.50 N ATOM 2127 CA ASN A 130 -42.682 -7.316 16.119 1.00 4.21 C ATOM 2128 C ASN A 130 -43.071 -8.726 16.552 1.00 14.10 C ATOM 2129 O ASN A 130 -43.894 -8.906 17.450 1.00 72.31 O ATOM 2130 CB ASN A 130 -42.819 -7.180 14.601 1.00 2.04 C ATOM 2131 CG ASN A 130 -44.012 -6.334 14.202 1.00 13.22 C ATOM 2132 OD1 ASN A 130 -44.929 -6.120 14.996 1.00 41.13 O ATOM 2133 ND2 ASN A 130 -44.006 -5.848 12.966 1.00 31.03 N ATOM 0 H ASN A 130 -40.660 -6.886 15.764 1.00 50.50 H new ATOM 0 HA ASN A 130 -43.355 -6.608 16.602 1.00 4.21 H new ATOM 0 HB2 ASN A 130 -41.910 -6.736 14.195 1.00 2.04 H new ATOM 0 HB3 ASN A 130 -42.915 -8.171 14.157 1.00 2.04 H new ATOM 0 HD21 ASN A 130 -44.782 -5.272 12.641 1.00 31.03 H new ATOM 0 HD22 ASN A 130 -43.225 -6.051 12.342 1.00 31.03 H new ATOM 2140 N VAL A 131 -42.474 -9.723 15.907 1.00 31.45 N ATOM 2141 CA VAL A 131 -42.757 -11.118 16.226 1.00 1.34 C ATOM 2142 C VAL A 131 -41.997 -12.059 15.298 1.00 12.32 C ATOM 2143 O VAL A 131 -41.524 -13.115 15.719 1.00 51.35 O ATOM 2144 CB VAL A 131 -44.264 -11.422 16.127 1.00 44.22 C ATOM 2145 CG1 VAL A 131 -44.804 -11.004 14.768 1.00 52.21 C ATOM 2146 CG2 VAL A 131 -44.527 -12.898 16.383 1.00 2.15 C ATOM 0 H VAL A 131 -41.791 -9.591 15.161 1.00 31.45 H new ATOM 0 HA VAL A 131 -42.428 -11.281 17.252 1.00 1.34 H new ATOM 0 HB VAL A 131 -44.785 -10.846 16.892 1.00 44.22 H new ATOM 0 HG11 VAL A 131 -45.870 -11.226 14.716 1.00 52.21 H new ATOM 0 HG12 VAL A 131 -44.649 -9.934 14.628 1.00 52.21 H new ATOM 0 HG13 VAL A 131 -44.281 -11.552 13.984 1.00 52.21 H new ATOM 0 HG21 VAL A 131 -45.596 -13.095 16.309 1.00 2.15 H new ATOM 0 HG22 VAL A 131 -43.996 -13.496 15.643 1.00 2.15 H new ATOM 0 HG23 VAL A 131 -44.177 -13.162 17.381 1.00 2.15 H new ATOM 2156 N VAL A 132 -41.883 -11.668 14.033 1.00 74.44 N ATOM 2157 CA VAL A 132 -41.179 -12.476 13.044 1.00 74.22 C ATOM 2158 C VAL A 132 -41.873 -13.818 12.836 1.00 3.00 C ATOM 2159 O VAL A 132 -41.618 -14.779 13.561 1.00 43.41 O ATOM 2160 CB VAL A 132 -39.718 -12.725 13.460 1.00 24.24 C ATOM 2161 CG1 VAL A 132 -39.073 -13.763 12.554 1.00 52.31 C ATOM 2162 CG2 VAL A 132 -38.929 -11.424 13.440 1.00 34.32 C ATOM 0 H VAL A 132 -42.269 -10.797 13.669 1.00 74.44 H new ATOM 0 HA VAL A 132 -41.192 -11.915 12.110 1.00 74.22 H new ATOM 0 HB VAL A 132 -39.710 -13.113 14.479 1.00 24.24 H new ATOM 0 HG11 VAL A 132 -38.041 -13.925 12.864 1.00 52.31 H new ATOM 0 HG12 VAL A 132 -39.625 -14.700 12.624 1.00 52.31 H new ATOM 0 HG13 VAL A 132 -39.091 -13.408 11.524 1.00 52.31 H new ATOM 0 HG21 VAL A 132 -37.898 -11.619 13.737 1.00 34.32 H new ATOM 0 HG22 VAL A 132 -38.944 -11.005 12.434 1.00 34.32 H new ATOM 0 HG23 VAL A 132 -39.379 -10.715 14.135 1.00 34.32 H new ATOM 2172 N ASN A 133 -42.751 -13.876 11.840 1.00 21.11 N ATOM 2173 CA ASN A 133 -43.482 -15.101 11.536 1.00 0.12 C ATOM 2174 C ASN A 133 -43.971 -15.098 10.091 1.00 63.40 C ATOM 2175 O ASN A 133 -44.090 -14.044 9.465 1.00 24.33 O ATOM 2176 CB ASN A 133 -44.670 -15.260 12.488 1.00 65.13 C ATOM 2177 CG ASN A 133 -44.598 -16.544 13.292 1.00 51.12 C ATOM 2178 OD1 ASN A 133 -45.268 -17.526 12.974 1.00 34.52 O ATOM 2179 ND2 ASN A 133 -43.783 -16.541 14.340 1.00 43.31 N ATOM 0 H ASN A 133 -42.974 -13.089 11.230 1.00 21.11 H new ATOM 0 HA ASN A 133 -42.803 -15.943 11.669 1.00 0.12 H new ATOM 0 HB2 ASN A 133 -44.703 -14.409 13.169 1.00 65.13 H new ATOM 0 HB3 ASN A 133 -45.597 -15.245 11.914 1.00 65.13 H new ATOM 0 HD21 ASN A 133 -43.693 -17.376 14.919 1.00 43.31 H new ATOM 0 HD22 ASN A 133 -43.246 -15.704 14.566 1.00 43.31 H new ATOM 2186 N THR A 134 -44.254 -16.286 9.565 1.00 24.44 N ATOM 2187 CA THR A 134 -44.729 -16.422 8.194 1.00 21.04 C ATOM 2188 C THR A 134 -46.196 -16.025 8.079 1.00 32.24 C ATOM 2189 O THR A 134 -47.086 -16.869 8.180 1.00 61.43 O ATOM 2190 CB THR A 134 -44.557 -17.864 7.680 1.00 0.23 C ATOM 2191 OG1 THR A 134 -45.276 -18.773 8.521 1.00 3.15 O ATOM 2192 CG2 THR A 134 -43.087 -18.253 7.643 1.00 20.54 C ATOM 0 H THR A 134 -44.162 -17.168 10.069 1.00 24.44 H new ATOM 0 HA THR A 134 -44.125 -15.752 7.582 1.00 21.04 H new ATOM 0 HB THR A 134 -44.956 -17.915 6.667 1.00 0.23 H new ATOM 0 HG1 THR A 134 -46.177 -18.424 8.685 1.00 3.15 H new ATOM 0 HG21 THR A 134 -42.990 -19.275 7.277 1.00 20.54 H new ATOM 0 HG22 THR A 134 -42.548 -17.577 6.979 1.00 20.54 H new ATOM 0 HG23 THR A 134 -42.668 -18.186 8.647 1.00 20.54 H new ATOM 2200 N GLN A 135 -46.441 -14.736 7.868 1.00 61.02 N ATOM 2201 CA GLN A 135 -47.802 -14.228 7.739 1.00 22.41 C ATOM 2202 C GLN A 135 -47.822 -12.915 6.964 1.00 21.11 C ATOM 2203 O GLN A 135 -48.489 -12.800 5.936 1.00 11.31 O ATOM 2204 CB GLN A 135 -48.427 -14.029 9.121 1.00 41.42 C ATOM 2205 CG GLN A 135 -49.925 -13.776 9.080 1.00 53.11 C ATOM 2206 CD GLN A 135 -50.478 -13.323 10.417 1.00 24.32 C ATOM 2207 OE1 GLN A 135 -50.541 -12.127 10.703 1.00 25.21 O ATOM 2208 NE2 GLN A 135 -50.882 -14.279 11.245 1.00 22.42 N ATOM 0 H GLN A 135 -45.715 -14.024 7.783 1.00 61.02 H new ATOM 0 HA GLN A 135 -48.387 -14.963 7.186 1.00 22.41 H new ATOM 0 HB2 GLN A 135 -48.233 -14.912 9.729 1.00 41.42 H new ATOM 0 HB3 GLN A 135 -47.938 -13.189 9.614 1.00 41.42 H new ATOM 0 HG2 GLN A 135 -50.141 -13.019 8.327 1.00 53.11 H new ATOM 0 HG3 GLN A 135 -50.435 -14.688 8.770 1.00 53.11 H new ATOM 0 HE21 GLN A 135 -50.812 -15.258 10.967 1.00 22.42 H new ATOM 0 HE22 GLN A 135 -51.263 -14.035 12.159 1.00 22.42 H new ATOM 2217 N SER A 136 -47.087 -11.927 7.464 1.00 24.22 N ATOM 2218 CA SER A 136 -47.023 -10.620 6.821 1.00 73.11 C ATOM 2219 C SER A 136 -45.576 -10.178 6.630 1.00 64.12 C ATOM 2220 O SER A 136 -44.766 -10.246 7.556 1.00 51.42 O ATOM 2221 CB SER A 136 -47.780 -9.582 7.652 1.00 61.01 C ATOM 2222 OG SER A 136 -47.710 -8.300 7.052 1.00 14.25 O ATOM 0 H SER A 136 -46.527 -12.007 8.313 1.00 24.22 H new ATOM 0 HA SER A 136 -47.491 -10.702 5.840 1.00 73.11 H new ATOM 0 HB2 SER A 136 -48.823 -9.883 7.754 1.00 61.01 H new ATOM 0 HB3 SER A 136 -47.361 -9.540 8.657 1.00 61.01 H new ATOM 0 HG SER A 136 -48.203 -7.655 7.601 1.00 14.25 H new ATOM 2228 N LEU A 137 -45.256 -9.726 5.422 1.00 15.33 N ATOM 2229 CA LEU A 137 -43.906 -9.272 5.108 1.00 52.15 C ATOM 2230 C LEU A 137 -43.889 -8.477 3.806 1.00 65.02 C ATOM 2231 O LEU A 137 -44.803 -8.585 2.990 1.00 52.32 O ATOM 2232 CB LEU A 137 -42.957 -10.467 5.002 1.00 50.23 C ATOM 2233 CG LEU A 137 -41.489 -10.188 5.324 1.00 24.13 C ATOM 2234 CD1 LEU A 137 -40.928 -11.269 6.235 1.00 64.10 C ATOM 2235 CD2 LEU A 137 -40.671 -10.089 4.045 1.00 40.04 C ATOM 0 H LEU A 137 -45.913 -9.664 4.644 1.00 15.33 H new ATOM 0 HA LEU A 137 -43.571 -8.620 5.915 1.00 52.15 H new ATOM 0 HB2 LEU A 137 -43.313 -11.249 5.673 1.00 50.23 H new ATOM 0 HB3 LEU A 137 -43.017 -10.864 3.989 1.00 50.23 H new ATOM 0 HG LEU A 137 -41.427 -9.233 5.846 1.00 24.13 H new ATOM 0 HD11 LEU A 137 -39.882 -11.054 6.454 1.00 64.10 H new ATOM 0 HD12 LEU A 137 -41.496 -11.292 7.165 1.00 64.10 H new ATOM 0 HD13 LEU A 137 -41.004 -12.237 5.740 1.00 64.10 H new ATOM 0 HD21 LEU A 137 -39.629 -9.890 4.294 1.00 40.04 H new ATOM 0 HD22 LEU A 137 -40.740 -11.028 3.495 1.00 40.04 H new ATOM 0 HD23 LEU A 137 -41.058 -9.278 3.428 1.00 40.04 H new ATOM 2247 N GLU A 138 -42.840 -7.681 3.619 1.00 74.15 N ATOM 2248 CA GLU A 138 -42.704 -6.870 2.415 1.00 43.52 C ATOM 2249 C GLU A 138 -42.632 -7.750 1.170 1.00 4.14 C ATOM 2250 O GLU A 138 -43.557 -8.506 0.879 1.00 75.11 O ATOM 2251 CB GLU A 138 -41.454 -5.991 2.504 1.00 13.24 C ATOM 2252 CG GLU A 138 -41.460 -4.823 1.532 1.00 35.03 C ATOM 2253 CD GLU A 138 -40.273 -3.899 1.723 1.00 74.01 C ATOM 2254 OE1 GLU A 138 -39.128 -4.398 1.726 1.00 74.05 O ATOM 2255 OE2 GLU A 138 -40.489 -2.678 1.870 1.00 42.13 O ATOM 0 H GLU A 138 -42.074 -7.581 4.285 1.00 74.15 H new ATOM 0 HA GLU A 138 -43.584 -6.232 2.337 1.00 43.52 H new ATOM 0 HB2 GLU A 138 -41.362 -5.607 3.520 1.00 13.24 H new ATOM 0 HB3 GLU A 138 -40.574 -6.606 2.315 1.00 13.24 H new ATOM 0 HG2 GLU A 138 -41.458 -5.205 0.511 1.00 35.03 H new ATOM 0 HG3 GLU A 138 -42.382 -4.255 1.658 1.00 35.03 H new TER 2262 GLU A 138