USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1050 hydrogens (6 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 NoAdj-H: A 15 TPO H2 : A 15 TPO N : A 14 THR C :(H bumps) USER MOD Set 1.1: A 113 ASN : amide:sc= -0.719 X(o=-0.71,f=-1.2) USER MOD Set 1.2: A 123 GLN : amide:sc= 0.0135 X(o=-0.71,f=-1.2) USER MOD Set 2.1: A 89 HIS : no HD1:sc= 0 X(o=2.5,f=2.3) USER MOD Set 2.2: A 106 SER OG : rot -21:sc= 1.27 USER MOD Set 2.3: A 110 THR OG1 : rot 148:sc= 1.25 USER MOD Set 3.1: A 73 HIS : no HE2:sc= -0.184 K(o=0.45,f=-3.7!) USER MOD Set 3.2: A 76 SER OG : rot 89:sc= 0.631 USER MOD Set 4.1: A 65 GLN : amide:sc= 2.18 K(o=2.2,f=-14!) USER MOD Set 4.2: A 68 THR OG1 : rot 90:sc=-0.00249 USER MOD Set 5.1: A 29 SER OG : rot 50:sc= 0.886 USER MOD Set 5.2: A 32 THR OG1 : rot -16:sc= 1.03 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 164:sc= 1.37 (180deg=0.335) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -170:sc= -0.0034 (180deg=-0.126) USER MOD Single : A 26 MET CE :methyl 164:sc= -0.0314 (180deg=-0.32) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= -0.0397 X(o=-0.04,f=-0.04) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= -2.38 K(o=-2.4,f=-4.6!) USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.0166 USER MOD Single : A 69 THR OG1 : rot 141:sc= 0.744 USER MOD Single : A 84 THR OG1 : rot 180:sc= -0.0211 USER MOD Single : A 86 SER OG : rot 180:sc= 0.455 USER MOD Single : A 95 ASN : amide:sc= 0.0693 X(o=0.069,f=0) USER MOD Single : A 108 ASN : amide:sc= -0.614 K(o=-0.61,f=-6.6!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 ASN : amide:sc= 0.925 K(o=0.93,f=-0.12) USER MOD Single : A 120 GLN : amide:sc= -0.0188 K(o=-0.019,f=-1.4) USER MOD Single : A 122 MET CE :methyl 159:sc= -0.567 (180deg=-1.77) USER MOD Single : A 124 THR OG1 : rot -90:sc= 0.882 USER MOD Single : A 129 GLN : amide:sc= -0.0201 K(o=-0.02,f=-9.7!) USER MOD Single : A 132 LYS NZ :NH3+ -167:sc= -0.211 (180deg=-1.49!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 28.415 -18.723 1.295 1.00 11.00 N ATOM 2 CA MET A 1 28.992 -17.592 2.017 1.00 43.05 C ATOM 3 C MET A 1 28.097 -16.391 1.850 1.00 35.51 C ATOM 4 O MET A 1 27.845 -15.947 0.727 1.00 13.21 O ATOM 5 CB MET A 1 30.408 -17.238 1.506 1.00 4.44 C ATOM 6 CG MET A 1 31.467 -18.329 1.663 1.00 75.13 C ATOM 7 SD MET A 1 31.175 -19.767 0.609 1.00 5.32 S ATOM 8 CE MET A 1 32.551 -20.807 1.089 1.00 35.04 C ATOM 0 H1 MET A 1 29.137 -19.462 1.174 1.00 11.00 H new ATOM 0 H2 MET A 1 27.613 -19.107 1.835 1.00 11.00 H new ATOM 0 H3 MET A 1 28.084 -18.406 0.361 1.00 11.00 H new ATOM 0 HA MET A 1 29.074 -17.874 3.067 1.00 43.05 H new ATOM 0 HB2 MET A 1 30.337 -16.977 0.450 1.00 4.44 H new ATOM 0 HB3 MET A 1 30.751 -16.347 2.033 1.00 4.44 H new ATOM 0 HG2 MET A 1 32.447 -17.911 1.431 1.00 75.13 H new ATOM 0 HG3 MET A 1 31.496 -18.650 2.704 1.00 75.13 H new ATOM 0 HE1 MET A 1 32.516 -21.740 0.526 1.00 35.04 H new ATOM 0 HE2 MET A 1 33.488 -20.291 0.878 1.00 35.04 H new ATOM 0 HE3 MET A 1 32.488 -21.024 2.155 1.00 35.04 H new ATOM 20 N SER A 2 27.604 -15.875 2.933 1.00 21.34 N ATOM 21 CA SER A 2 26.743 -14.732 2.900 1.00 10.20 C ATOM 22 C SER A 2 27.218 -13.687 3.888 1.00 53.43 C ATOM 23 O SER A 2 27.586 -14.016 5.021 1.00 22.20 O ATOM 24 CB SER A 2 25.319 -15.158 3.224 1.00 41.24 C ATOM 25 OG SER A 2 24.871 -16.156 2.310 1.00 42.50 O ATOM 0 H SER A 2 27.788 -16.236 3.869 1.00 21.34 H new ATOM 0 HA SER A 2 26.767 -14.295 1.902 1.00 10.20 H new ATOM 0 HB2 SER A 2 25.272 -15.543 4.243 1.00 41.24 H new ATOM 0 HB3 SER A 2 24.657 -14.294 3.180 1.00 41.24 H new ATOM 0 HG SER A 2 23.954 -16.418 2.536 1.00 42.50 H new ATOM 31 N ASP A 3 27.248 -12.461 3.450 1.00 4.05 N ATOM 32 CA ASP A 3 27.607 -11.345 4.298 1.00 62.31 C ATOM 33 C ASP A 3 26.400 -10.443 4.473 1.00 22.13 C ATOM 34 O ASP A 3 25.470 -10.480 3.663 1.00 32.52 O ATOM 35 CB ASP A 3 28.823 -10.566 3.749 1.00 1.30 C ATOM 36 CG ASP A 3 28.624 -9.976 2.369 1.00 64.05 C ATOM 37 OD1 ASP A 3 28.664 -10.724 1.371 1.00 54.23 O ATOM 38 OD2 ASP A 3 28.462 -8.746 2.244 1.00 14.04 O ATOM 0 H ASP A 3 27.024 -12.199 2.490 1.00 4.05 H new ATOM 0 HA ASP A 3 27.910 -11.731 5.271 1.00 62.31 H new ATOM 0 HB2 ASP A 3 29.065 -9.761 4.442 1.00 1.30 H new ATOM 0 HB3 ASP A 3 29.684 -11.234 3.723 1.00 1.30 H new ATOM 43 N ASN A 4 26.404 -9.672 5.520 1.00 14.14 N ATOM 44 CA ASN A 4 25.269 -8.810 5.882 1.00 33.32 C ATOM 45 C ASN A 4 25.035 -7.698 4.832 1.00 40.35 C ATOM 46 O ASN A 4 25.992 -7.149 4.270 1.00 31.01 O ATOM 47 CB ASN A 4 25.538 -8.192 7.256 1.00 13.52 C ATOM 48 CG ASN A 4 24.407 -7.343 7.788 1.00 42.43 C ATOM 49 OD1 ASN A 4 23.223 -7.616 7.547 1.00 42.11 O ATOM 50 ND2 ASN A 4 24.754 -6.306 8.492 1.00 55.01 N ATOM 0 H ASN A 4 27.191 -9.608 6.165 1.00 14.14 H new ATOM 0 HA ASN A 4 24.365 -9.419 5.913 1.00 33.32 H new ATOM 0 HB2 ASN A 4 25.742 -8.992 7.968 1.00 13.52 H new ATOM 0 HB3 ASN A 4 26.439 -7.581 7.197 1.00 13.52 H new ATOM 0 HD21 ASN A 4 24.040 -5.683 8.868 1.00 55.01 H new ATOM 0 HD22 ASN A 4 25.741 -6.116 8.668 1.00 55.01 H new ATOM 57 N ASN A 5 23.773 -7.403 4.552 1.00 23.21 N ATOM 58 CA ASN A 5 23.400 -6.342 3.607 1.00 61.13 C ATOM 59 C ASN A 5 23.580 -4.986 4.247 1.00 40.21 C ATOM 60 O ASN A 5 23.168 -4.778 5.407 1.00 4.03 O ATOM 61 CB ASN A 5 21.927 -6.462 3.137 1.00 51.30 C ATOM 62 CG ASN A 5 21.638 -7.590 2.154 1.00 24.11 C ATOM 63 OD1 ASN A 5 22.294 -8.638 2.150 1.00 31.03 O ATOM 64 ND2 ASN A 5 20.635 -7.387 1.324 1.00 23.03 N ATOM 0 H ASN A 5 22.977 -7.886 4.968 1.00 23.21 H new ATOM 0 HA ASN A 5 24.053 -6.453 2.742 1.00 61.13 H new ATOM 0 HB2 ASN A 5 21.295 -6.598 4.014 1.00 51.30 H new ATOM 0 HB3 ASN A 5 21.634 -5.519 2.676 1.00 51.30 H new ATOM 0 HD21 ASN A 5 20.377 -8.107 0.649 1.00 23.03 H new ATOM 0 HD22 ASN A 5 20.116 -6.509 1.356 1.00 23.03 H new ATOM 71 N GLY A 6 24.180 -4.070 3.513 1.00 64.52 N ATOM 72 CA GLY A 6 24.364 -2.724 3.996 1.00 61.23 C ATOM 73 C GLY A 6 23.044 -2.019 4.153 1.00 2.22 C ATOM 74 O GLY A 6 22.099 -2.287 3.407 1.00 45.34 O ATOM 0 H GLY A 6 24.548 -4.238 2.577 1.00 64.52 H new ATOM 0 HA2 GLY A 6 24.884 -2.746 4.954 1.00 61.23 H new ATOM 0 HA3 GLY A 6 24.996 -2.169 3.303 1.00 61.23 H new ATOM 78 N THR A 7 22.962 -1.149 5.108 1.00 14.24 N ATOM 79 CA THR A 7 21.742 -0.454 5.388 1.00 23.04 C ATOM 80 C THR A 7 21.689 0.851 4.591 1.00 44.45 C ATOM 81 O THR A 7 22.589 1.693 4.720 1.00 72.11 O ATOM 82 CB THR A 7 21.656 -0.162 6.889 1.00 2.40 C ATOM 83 OG1 THR A 7 21.881 -1.388 7.610 1.00 30.31 O ATOM 84 CG2 THR A 7 20.288 0.387 7.258 1.00 52.13 C ATOM 0 H THR A 7 23.740 -0.898 5.718 1.00 14.24 H new ATOM 0 HA THR A 7 20.895 -1.075 5.095 1.00 23.04 H new ATOM 0 HB THR A 7 22.409 0.583 7.148 1.00 2.40 H new ATOM 0 HG1 THR A 7 21.830 -1.215 8.573 1.00 30.31 H new ATOM 0 HG21 THR A 7 20.253 0.586 8.329 1.00 52.13 H new ATOM 0 HG22 THR A 7 20.108 1.312 6.711 1.00 52.13 H new ATOM 0 HG23 THR A 7 19.521 -0.343 6.999 1.00 52.13 H new ATOM 92 N PRO A 8 20.678 1.009 3.715 1.00 71.01 N ATOM 93 CA PRO A 8 20.498 2.224 2.913 1.00 4.43 C ATOM 94 C PRO A 8 20.417 3.490 3.775 1.00 70.04 C ATOM 95 O PRO A 8 19.825 3.487 4.879 1.00 62.45 O ATOM 96 CB PRO A 8 19.159 1.989 2.206 1.00 20.23 C ATOM 97 CG PRO A 8 19.027 0.511 2.143 1.00 14.44 C ATOM 98 CD PRO A 8 19.631 0.000 3.414 1.00 21.54 C ATOM 0 HA PRO A 8 21.337 2.387 2.237 1.00 4.43 H new ATOM 0 HB2 PRO A 8 18.334 2.438 2.759 1.00 20.23 H new ATOM 0 HB3 PRO A 8 19.153 2.431 1.210 1.00 20.23 H new ATOM 0 HG2 PRO A 8 17.982 0.214 2.058 1.00 14.44 H new ATOM 0 HG3 PRO A 8 19.545 0.108 1.273 1.00 14.44 H new ATOM 0 HD2 PRO A 8 18.893 -0.067 4.213 1.00 21.54 H new ATOM 0 HD3 PRO A 8 20.055 -0.996 3.288 1.00 21.54 H new ATOM 106 N GLU A 9 21.021 4.550 3.299 1.00 42.13 N ATOM 107 CA GLU A 9 20.991 5.805 3.992 1.00 11.12 C ATOM 108 C GLU A 9 19.787 6.641 3.541 1.00 23.44 C ATOM 109 O GLU A 9 19.537 6.793 2.337 1.00 15.10 O ATOM 110 CB GLU A 9 22.296 6.601 3.780 1.00 63.40 C ATOM 111 CG GLU A 9 22.638 6.847 2.321 1.00 32.44 C ATOM 112 CD GLU A 9 23.764 7.816 2.131 1.00 14.14 C ATOM 113 OE1 GLU A 9 24.943 7.422 2.282 1.00 21.33 O ATOM 114 OE2 GLU A 9 23.498 8.986 1.790 1.00 73.12 O ATOM 0 H GLU A 9 21.544 4.563 2.424 1.00 42.13 H new ATOM 0 HA GLU A 9 20.896 5.589 5.056 1.00 11.12 H new ATOM 0 HB2 GLU A 9 22.211 7.561 4.290 1.00 63.40 H new ATOM 0 HB3 GLU A 9 23.119 6.062 4.250 1.00 63.40 H new ATOM 0 HG2 GLU A 9 22.901 5.899 1.852 1.00 32.44 H new ATOM 0 HG3 GLU A 9 21.754 7.223 1.806 1.00 32.44 H new ATOM 121 N PRO A 10 18.992 7.122 4.486 1.00 34.43 N ATOM 122 CA PRO A 10 17.939 8.057 4.203 1.00 11.42 C ATOM 123 C PRO A 10 18.487 9.482 4.343 1.00 41.43 C ATOM 124 O PRO A 10 19.702 9.681 4.419 1.00 43.42 O ATOM 125 CB PRO A 10 16.915 7.755 5.299 1.00 20.43 C ATOM 126 CG PRO A 10 17.727 7.285 6.463 1.00 32.23 C ATOM 127 CD PRO A 10 19.039 6.773 5.911 1.00 60.23 C ATOM 0 HA PRO A 10 17.519 7.976 3.201 1.00 11.42 H new ATOM 0 HB2 PRO A 10 16.335 8.642 5.554 1.00 20.43 H new ATOM 0 HB3 PRO A 10 16.206 6.992 4.978 1.00 20.43 H new ATOM 0 HG2 PRO A 10 17.897 8.099 7.168 1.00 32.23 H new ATOM 0 HG3 PRO A 10 17.204 6.498 7.005 1.00 32.23 H new ATOM 0 HD2 PRO A 10 19.889 7.241 6.407 1.00 60.23 H new ATOM 0 HD3 PRO A 10 19.138 5.697 6.054 1.00 60.23 H new ATOM 135 N GLN A 11 17.624 10.446 4.391 1.00 42.24 N ATOM 136 CA GLN A 11 18.040 11.819 4.532 1.00 52.21 C ATOM 137 C GLN A 11 17.662 12.300 5.921 1.00 41.21 C ATOM 138 O GLN A 11 16.899 11.627 6.604 1.00 50.01 O ATOM 139 CB GLN A 11 17.393 12.673 3.441 1.00 55.10 C ATOM 140 CG GLN A 11 17.802 12.247 2.026 1.00 31.10 C ATOM 141 CD GLN A 11 17.147 13.064 0.926 1.00 14.33 C ATOM 142 OE1 GLN A 11 16.030 13.564 1.075 1.00 5.21 O ATOM 143 NE2 GLN A 11 17.826 13.204 -0.187 1.00 53.20 N ATOM 0 H GLN A 11 16.614 10.313 4.335 1.00 42.24 H new ATOM 0 HA GLN A 11 19.120 11.906 4.415 1.00 52.21 H new ATOM 0 HB2 GLN A 11 16.309 12.611 3.534 1.00 55.10 H new ATOM 0 HB3 GLN A 11 17.667 13.717 3.594 1.00 55.10 H new ATOM 0 HG2 GLN A 11 18.885 12.329 1.931 1.00 31.10 H new ATOM 0 HG3 GLN A 11 17.548 11.196 1.885 1.00 31.10 H new ATOM 0 HE21 GLN A 11 18.748 12.778 -0.279 1.00 53.20 H new ATOM 0 HE22 GLN A 11 17.432 13.739 -0.961 1.00 53.20 H new ATOM 152 N VAL A 12 18.189 13.428 6.345 1.00 52.15 N ATOM 153 CA VAL A 12 17.894 13.963 7.669 1.00 72.41 C ATOM 154 C VAL A 12 17.019 15.181 7.501 1.00 13.44 C ATOM 155 O VAL A 12 17.363 16.100 6.750 1.00 24.32 O ATOM 156 CB VAL A 12 19.188 14.342 8.442 1.00 21.00 C ATOM 157 CG1 VAL A 12 18.861 14.867 9.839 1.00 5.30 C ATOM 158 CG2 VAL A 12 20.115 13.146 8.539 1.00 43.45 C ATOM 0 H VAL A 12 18.828 14.000 5.793 1.00 52.15 H new ATOM 0 HA VAL A 12 17.384 13.197 8.254 1.00 72.41 H new ATOM 0 HB VAL A 12 19.689 15.136 7.888 1.00 21.00 H new ATOM 0 HG11 VAL A 12 19.785 15.124 10.357 1.00 5.30 H new ATOM 0 HG12 VAL A 12 18.232 15.754 9.757 1.00 5.30 H new ATOM 0 HG13 VAL A 12 18.332 14.098 10.402 1.00 5.30 H new ATOM 0 HG21 VAL A 12 21.017 13.428 9.083 1.00 43.45 H new ATOM 0 HG22 VAL A 12 19.611 12.337 9.067 1.00 43.45 H new ATOM 0 HG23 VAL A 12 20.385 12.813 7.537 1.00 43.45 H new ATOM 168 N GLU A 13 15.891 15.180 8.166 1.00 33.32 N ATOM 169 CA GLU A 13 14.903 16.206 7.990 1.00 61.20 C ATOM 170 C GLU A 13 13.979 16.269 9.194 1.00 22.51 C ATOM 171 O GLU A 13 13.491 15.223 9.658 1.00 12.21 O ATOM 172 CB GLU A 13 14.083 15.837 6.749 1.00 23.23 C ATOM 173 CG GLU A 13 12.859 16.682 6.489 1.00 52.42 C ATOM 174 CD GLU A 13 12.071 16.147 5.335 1.00 45.33 C ATOM 175 OE1 GLU A 13 11.803 14.927 5.303 1.00 24.01 O ATOM 176 OE2 GLU A 13 11.700 16.933 4.440 1.00 34.41 O ATOM 0 H GLU A 13 15.635 14.464 8.846 1.00 33.32 H new ATOM 0 HA GLU A 13 15.386 17.177 7.878 1.00 61.20 H new ATOM 0 HB2 GLU A 13 14.734 15.898 5.877 1.00 23.23 H new ATOM 0 HB3 GLU A 13 13.769 14.797 6.841 1.00 23.23 H new ATOM 0 HG2 GLU A 13 12.233 16.705 7.381 1.00 52.42 H new ATOM 0 HG3 GLU A 13 13.159 17.709 6.283 1.00 52.42 H new ATOM 183 N THR A 14 13.745 17.460 9.705 1.00 44.45 N ATOM 184 CA THR A 14 12.721 17.647 10.694 1.00 44.54 C ATOM 185 C THR A 14 11.398 17.600 9.934 1.00 2.01 C ATOM 186 O THR A 14 11.256 18.264 8.901 1.00 71.51 O ATOM 187 CB THR A 14 12.874 19.001 11.431 1.00 62.41 C ATOM 188 OG1 THR A 14 14.179 19.074 12.031 1.00 12.53 O ATOM 189 CG2 THR A 14 11.819 19.153 12.523 1.00 2.01 C ATOM 0 H THR A 14 14.252 18.307 9.448 1.00 44.45 H new ATOM 0 HA THR A 14 12.780 16.876 11.462 1.00 44.54 H new ATOM 0 HB THR A 14 12.744 19.802 10.703 1.00 62.41 H new ATOM 0 HG1 THR A 14 14.278 19.931 12.496 1.00 12.53 H new ATOM 0 HG21 THR A 14 11.950 20.112 13.024 1.00 2.01 H new ATOM 0 HG22 THR A 14 10.825 19.109 12.077 1.00 2.01 H new ATOM 0 HG23 THR A 14 11.928 18.347 13.249 1.00 2.01 H new HETATM 197 N TPO A 15 10.442 16.870 10.413 1.00 25.04 N HETATM 198 CA TPO A 15 9.257 16.657 9.630 1.00 74.13 C HETATM 199 CB TPO A 15 8.864 15.176 9.674 1.00 11.33 C HETATM 200 CG2 TPO A 15 7.813 14.853 8.624 1.00 11.01 C HETATM 201 OG1 TPO A 15 10.023 14.383 9.350 1.00 75.23 O HETATM 202 P TPO A 15 10.169 12.806 9.636 1.00 35.04 P HETATM 203 O1P TPO A 15 9.200 12.369 10.715 1.00 32.01 O HETATM 204 O2P TPO A 15 11.565 12.485 10.129 1.00 42.12 O HETATM 205 O3P TPO A 15 9.902 12.033 8.332 1.00 22.23 O HETATM 206 C TPO A 15 8.108 17.503 10.140 1.00 1.33 C HETATM 207 O TPO A 15 7.790 17.507 11.328 1.00 32.55 O HETATM 0 HG23 TPO A 15 6.922 15.454 8.805 1.00 11.01 H new HETATM 0 HG22 TPO A 15 8.208 15.078 7.633 1.00 11.01 H new HETATM 0 HG21 TPO A 15 7.555 13.795 8.681 1.00 11.01 H new HETATM 0 HB TPO A 15 8.475 14.962 10.669 1.00 11.33 H new HETATM 0 HA TPO A 15 9.471 16.950 8.602 1.00 74.13 H new HETATM 0 H TPO A 15 10.885 16.086 10.892 1.00 25.04 H new ATOM 214 N SER A 16 7.517 18.235 9.234 1.00 12.32 N ATOM 215 CA SER A 16 6.428 19.101 9.535 1.00 41.24 C ATOM 216 C SER A 16 5.130 18.324 9.389 1.00 53.42 C ATOM 217 O SER A 16 4.876 17.721 8.351 1.00 10.32 O ATOM 218 CB SER A 16 6.458 20.306 8.571 1.00 64.42 C ATOM 219 OG SER A 16 5.429 21.244 8.850 1.00 24.13 O ATOM 0 H SER A 16 7.790 18.240 8.251 1.00 12.32 H new ATOM 0 HA SER A 16 6.504 19.473 10.557 1.00 41.24 H new ATOM 0 HB2 SER A 16 7.427 20.801 8.641 1.00 64.42 H new ATOM 0 HB3 SER A 16 6.355 19.951 7.546 1.00 64.42 H new ATOM 0 HG SER A 16 5.487 21.990 8.218 1.00 24.13 H new ATOM 225 N VAL A 17 4.353 18.282 10.435 1.00 72.22 N ATOM 226 CA VAL A 17 3.079 17.626 10.381 1.00 34.25 C ATOM 227 C VAL A 17 2.081 18.627 9.848 1.00 34.35 C ATOM 228 O VAL A 17 1.838 19.663 10.480 1.00 3.42 O ATOM 229 CB VAL A 17 2.604 17.152 11.787 1.00 0.23 C ATOM 230 CG1 VAL A 17 1.308 16.356 11.687 1.00 72.44 C ATOM 231 CG2 VAL A 17 3.678 16.338 12.489 1.00 70.10 C ATOM 0 H VAL A 17 4.582 18.697 11.338 1.00 72.22 H new ATOM 0 HA VAL A 17 3.162 16.744 9.746 1.00 34.25 H new ATOM 0 HB VAL A 17 2.413 18.043 12.385 1.00 0.23 H new ATOM 0 HG11 VAL A 17 0.999 16.037 12.683 1.00 72.44 H new ATOM 0 HG12 VAL A 17 0.530 16.981 11.248 1.00 72.44 H new ATOM 0 HG13 VAL A 17 1.467 15.480 11.059 1.00 72.44 H new ATOM 0 HG21 VAL A 17 3.315 16.023 13.467 1.00 70.10 H new ATOM 0 HG22 VAL A 17 3.918 15.459 11.891 1.00 70.10 H new ATOM 0 HG23 VAL A 17 4.573 16.947 12.614 1.00 70.10 H new ATOM 241 N PHE A 18 1.545 18.364 8.705 1.00 70.33 N ATOM 242 CA PHE A 18 0.557 19.224 8.134 1.00 74.32 C ATOM 243 C PHE A 18 -0.754 18.524 8.040 1.00 2.11 C ATOM 244 O PHE A 18 -0.809 17.303 7.816 1.00 11.51 O ATOM 245 CB PHE A 18 0.977 19.894 6.804 1.00 74.23 C ATOM 246 CG PHE A 18 1.341 18.985 5.665 1.00 10.12 C ATOM 247 CD1 PHE A 18 0.364 18.422 4.854 1.00 54.14 C ATOM 248 CD2 PHE A 18 2.662 18.719 5.389 1.00 25.43 C ATOM 249 CE1 PHE A 18 0.709 17.612 3.797 1.00 11.23 C ATOM 250 CE2 PHE A 18 3.010 17.917 4.334 1.00 32.21 C ATOM 251 CZ PHE A 18 2.036 17.358 3.536 1.00 24.35 C ATOM 0 H PHE A 18 1.777 17.548 8.138 1.00 70.33 H new ATOM 0 HA PHE A 18 0.449 20.063 8.821 1.00 74.32 H new ATOM 0 HB2 PHE A 18 0.160 20.537 6.476 1.00 74.23 H new ATOM 0 HB3 PHE A 18 1.830 20.541 7.006 1.00 74.23 H new ATOM 0 HD1 PHE A 18 -0.678 18.622 5.055 1.00 54.14 H new ATOM 0 HD2 PHE A 18 3.434 19.147 6.011 1.00 25.43 H new ATOM 0 HE1 PHE A 18 -0.059 17.177 3.174 1.00 11.23 H new ATOM 0 HE2 PHE A 18 4.052 17.722 4.127 1.00 32.21 H new ATOM 0 HZ PHE A 18 2.313 16.722 2.708 1.00 24.35 H new ATOM 261 N ARG A 19 -1.803 19.254 8.280 1.00 34.15 N ATOM 262 CA ARG A 19 -3.121 18.699 8.251 1.00 14.34 C ATOM 263 C ARG A 19 -3.559 18.624 6.801 1.00 11.51 C ATOM 264 O ARG A 19 -3.991 19.616 6.213 1.00 73.42 O ATOM 265 CB ARG A 19 -4.091 19.563 9.061 1.00 13.12 C ATOM 266 CG ARG A 19 -3.663 19.813 10.500 1.00 54.12 C ATOM 267 CD ARG A 19 -4.747 20.544 11.271 1.00 33.23 C ATOM 268 NE ARG A 19 -5.959 19.718 11.409 1.00 71.25 N ATOM 269 CZ ARG A 19 -7.198 20.171 11.626 1.00 54.14 C ATOM 270 NH1 ARG A 19 -7.444 21.476 11.647 1.00 25.33 N ATOM 271 NH2 ARG A 19 -8.194 19.305 11.797 1.00 64.21 N ATOM 0 H ARG A 19 -1.768 20.249 8.501 1.00 34.15 H new ATOM 0 HA ARG A 19 -3.120 17.705 8.699 1.00 14.34 H new ATOM 0 HB2 ARG A 19 -4.209 20.523 8.558 1.00 13.12 H new ATOM 0 HB3 ARG A 19 -5.069 19.083 9.065 1.00 13.12 H new ATOM 0 HG2 ARG A 19 -3.442 18.863 10.988 1.00 54.12 H new ATOM 0 HG3 ARG A 19 -2.744 20.399 10.513 1.00 54.12 H new ATOM 0 HD2 ARG A 19 -4.374 20.813 12.259 1.00 33.23 H new ATOM 0 HD3 ARG A 19 -4.995 21.474 10.760 1.00 33.23 H new ATOM 0 HE ARG A 19 -5.842 18.708 11.332 1.00 71.25 H new ATOM 0 HH11 ARG A 19 -6.685 22.141 11.497 1.00 25.33 H new ATOM 0 HH12 ARG A 19 -8.392 21.814 11.813 1.00 25.33 H new ATOM 0 HH21 ARG A 19 -8.010 18.302 11.762 1.00 64.21 H new ATOM 0 HH22 ARG A 19 -9.142 19.644 11.963 1.00 64.21 H new ATOM 285 N ALA A 20 -3.371 17.465 6.215 1.00 44.14 N ATOM 286 CA ALA A 20 -3.639 17.260 4.814 1.00 73.23 C ATOM 287 C ALA A 20 -5.112 17.016 4.540 1.00 14.11 C ATOM 288 O ALA A 20 -5.932 16.958 5.452 1.00 24.52 O ATOM 289 CB ALA A 20 -2.784 16.129 4.269 1.00 64.31 C ATOM 0 H ALA A 20 -3.027 16.636 6.699 1.00 44.14 H new ATOM 0 HA ALA A 20 -3.372 18.179 4.293 1.00 73.23 H new ATOM 0 HB1 ALA A 20 -2.999 15.988 3.210 1.00 64.31 H new ATOM 0 HB2 ALA A 20 -1.730 16.376 4.395 1.00 64.31 H new ATOM 0 HB3 ALA A 20 -3.008 15.210 4.810 1.00 64.31 H new ATOM 295 N ASP A 21 -5.413 16.797 3.289 1.00 3.30 N ATOM 296 CA ASP A 21 -6.774 16.685 2.769 1.00 4.42 C ATOM 297 C ASP A 21 -7.486 15.375 3.137 1.00 1.35 C ATOM 298 O ASP A 21 -8.625 15.156 2.737 1.00 11.20 O ATOM 299 CB ASP A 21 -6.741 16.862 1.248 1.00 41.02 C ATOM 300 CG ASP A 21 -5.806 15.882 0.562 1.00 64.42 C ATOM 301 OD1 ASP A 21 -4.559 16.106 0.604 1.00 44.04 O ATOM 302 OD2 ASP A 21 -6.284 14.903 -0.004 1.00 62.03 O ATOM 0 H ASP A 21 -4.701 16.686 2.567 1.00 3.30 H new ATOM 0 HA ASP A 21 -7.358 17.474 3.243 1.00 4.42 H new ATOM 0 HB2 ASP A 21 -7.748 16.736 0.850 1.00 41.02 H new ATOM 0 HB3 ASP A 21 -6.430 17.880 1.012 1.00 41.02 H new ATOM 307 N LEU A 22 -6.860 14.543 3.936 1.00 43.54 N ATOM 308 CA LEU A 22 -7.466 13.267 4.311 1.00 13.55 C ATOM 309 C LEU A 22 -8.448 13.431 5.473 1.00 74.45 C ATOM 310 O LEU A 22 -9.312 12.572 5.694 1.00 60.30 O ATOM 311 CB LEU A 22 -6.416 12.194 4.685 1.00 53.33 C ATOM 312 CG LEU A 22 -5.653 12.336 6.028 1.00 64.35 C ATOM 313 CD1 LEU A 22 -4.845 11.089 6.290 1.00 34.05 C ATOM 314 CD2 LEU A 22 -4.731 13.539 6.043 1.00 72.31 C ATOM 0 H LEU A 22 -5.940 14.715 4.341 1.00 43.54 H new ATOM 0 HA LEU A 22 -8.003 12.926 3.426 1.00 13.55 H new ATOM 0 HB2 LEU A 22 -6.919 11.227 4.691 1.00 53.33 H new ATOM 0 HB3 LEU A 22 -5.676 12.163 3.886 1.00 53.33 H new ATOM 0 HG LEU A 22 -6.400 12.478 6.809 1.00 64.35 H new ATOM 0 HD11 LEU A 22 -4.311 11.193 7.234 1.00 34.05 H new ATOM 0 HD12 LEU A 22 -5.511 10.228 6.343 1.00 34.05 H new ATOM 0 HD13 LEU A 22 -4.128 10.943 5.482 1.00 34.05 H new ATOM 0 HD21 LEU A 22 -4.220 13.594 7.004 1.00 72.31 H new ATOM 0 HD22 LEU A 22 -3.994 13.443 5.246 1.00 72.31 H new ATOM 0 HD23 LEU A 22 -5.315 14.447 5.890 1.00 72.31 H new ATOM 326 N LEU A 23 -8.352 14.560 6.173 1.00 22.22 N ATOM 327 CA LEU A 23 -9.115 14.803 7.395 1.00 12.02 C ATOM 328 C LEU A 23 -10.626 15.004 7.192 1.00 21.11 C ATOM 329 O LEU A 23 -11.357 15.215 8.159 1.00 75.14 O ATOM 330 CB LEU A 23 -8.481 15.951 8.214 1.00 43.44 C ATOM 331 CG LEU A 23 -8.221 17.308 7.509 1.00 63.03 C ATOM 332 CD1 LEU A 23 -9.501 18.046 7.147 1.00 72.45 C ATOM 333 CD2 LEU A 23 -7.343 18.180 8.369 1.00 33.10 C ATOM 0 H LEU A 23 -7.742 15.333 5.908 1.00 22.22 H new ATOM 0 HA LEU A 23 -9.049 13.879 7.969 1.00 12.02 H new ATOM 0 HB2 LEU A 23 -9.126 16.141 9.072 1.00 43.44 H new ATOM 0 HB3 LEU A 23 -7.529 15.593 8.605 1.00 43.44 H new ATOM 0 HG LEU A 23 -7.713 17.083 6.571 1.00 63.03 H new ATOM 0 HD11 LEU A 23 -9.252 18.987 6.657 1.00 72.45 H new ATOM 0 HD12 LEU A 23 -10.097 17.432 6.472 1.00 72.45 H new ATOM 0 HD13 LEU A 23 -10.073 18.249 8.053 1.00 72.45 H new ATOM 0 HD21 LEU A 23 -7.167 19.130 7.864 1.00 33.10 H new ATOM 0 HD22 LEU A 23 -7.835 18.363 9.324 1.00 33.10 H new ATOM 0 HD23 LEU A 23 -6.390 17.679 8.542 1.00 33.10 H new ATOM 345 N LYS A 24 -11.089 14.964 5.959 1.00 55.21 N ATOM 346 CA LYS A 24 -12.513 15.100 5.699 1.00 52.23 C ATOM 347 C LYS A 24 -13.146 13.759 5.396 1.00 60.23 C ATOM 348 O LYS A 24 -14.348 13.566 5.604 1.00 22.41 O ATOM 349 CB LYS A 24 -12.803 16.053 4.540 1.00 33.20 C ATOM 350 CG LYS A 24 -12.368 17.480 4.764 1.00 11.25 C ATOM 351 CD LYS A 24 -12.861 18.377 3.643 1.00 53.01 C ATOM 352 CE LYS A 24 -12.444 19.815 3.858 1.00 53.01 C ATOM 353 NZ LYS A 24 -13.076 20.415 5.053 1.00 45.30 N ATOM 0 H LYS A 24 -10.510 14.840 5.128 1.00 55.21 H new ATOM 0 HA LYS A 24 -12.946 15.515 6.609 1.00 52.23 H new ATOM 0 HB2 LYS A 24 -12.308 15.674 3.646 1.00 33.20 H new ATOM 0 HB3 LYS A 24 -13.874 16.043 4.340 1.00 33.20 H new ATOM 0 HG2 LYS A 24 -12.755 17.837 5.718 1.00 11.25 H new ATOM 0 HG3 LYS A 24 -11.281 17.528 4.823 1.00 11.25 H new ATOM 0 HD2 LYS A 24 -12.467 18.021 2.691 1.00 53.01 H new ATOM 0 HD3 LYS A 24 -13.948 18.318 3.580 1.00 53.01 H new ATOM 0 HE2 LYS A 24 -11.360 19.864 3.961 1.00 53.01 H new ATOM 0 HE3 LYS A 24 -12.708 20.402 2.978 1.00 53.01 H new ATOM 0 HZ1 LYS A 24 -12.896 21.439 5.063 1.00 45.30 H new ATOM 0 HZ2 LYS A 24 -14.101 20.244 5.026 1.00 45.30 H new ATOM 0 HZ3 LYS A 24 -12.675 19.985 5.911 1.00 45.30 H new ATOM 367 N GLU A 25 -12.335 12.806 4.961 1.00 74.31 N ATOM 368 CA GLU A 25 -12.864 11.543 4.490 1.00 50.12 C ATOM 369 C GLU A 25 -13.381 10.680 5.639 1.00 0.43 C ATOM 370 O GLU A 25 -14.263 9.839 5.448 1.00 2.44 O ATOM 371 CB GLU A 25 -11.831 10.776 3.664 1.00 14.43 C ATOM 372 CG GLU A 25 -12.437 9.589 2.936 1.00 23.50 C ATOM 373 CD GLU A 25 -11.444 8.768 2.182 1.00 72.40 C ATOM 374 OE1 GLU A 25 -10.997 9.203 1.114 1.00 41.31 O ATOM 375 OE2 GLU A 25 -11.132 7.651 2.631 1.00 2.33 O ATOM 0 H GLU A 25 -11.319 12.885 4.926 1.00 74.31 H new ATOM 0 HA GLU A 25 -13.709 11.777 3.843 1.00 50.12 H new ATOM 0 HB2 GLU A 25 -11.377 11.451 2.938 1.00 14.43 H new ATOM 0 HB3 GLU A 25 -11.032 10.428 4.319 1.00 14.43 H new ATOM 0 HG2 GLU A 25 -12.945 8.952 3.660 1.00 23.50 H new ATOM 0 HG3 GLU A 25 -13.196 9.950 2.242 1.00 23.50 H new ATOM 382 N MET A 26 -12.869 10.927 6.836 1.00 11.32 N ATOM 383 CA MET A 26 -13.246 10.137 8.000 1.00 30.31 C ATOM 384 C MET A 26 -14.736 10.292 8.281 1.00 20.54 C ATOM 385 O MET A 26 -15.447 9.308 8.451 1.00 31.11 O ATOM 386 CB MET A 26 -12.444 10.542 9.239 1.00 51.25 C ATOM 387 CG MET A 26 -12.627 9.587 10.414 1.00 22.21 C ATOM 388 SD MET A 26 -11.842 10.143 11.948 1.00 5.05 S ATOM 389 CE MET A 26 -12.876 11.547 12.362 1.00 32.34 C ATOM 0 H MET A 26 -12.193 11.666 7.027 1.00 11.32 H new ATOM 0 HA MET A 26 -13.022 9.094 7.777 1.00 30.31 H new ATOM 0 HB2 MET A 26 -11.386 10.589 8.979 1.00 51.25 H new ATOM 0 HB3 MET A 26 -12.742 11.545 9.545 1.00 51.25 H new ATOM 0 HG2 MET A 26 -13.693 9.449 10.593 1.00 22.21 H new ATOM 0 HG3 MET A 26 -12.221 8.613 10.143 1.00 22.21 H new ATOM 0 HE1 MET A 26 -12.713 11.824 13.403 1.00 32.34 H new ATOM 0 HE2 MET A 26 -12.621 12.389 11.718 1.00 32.34 H new ATOM 0 HE3 MET A 26 -13.923 11.283 12.217 1.00 32.34 H new ATOM 399 N GLU A 27 -15.209 11.520 8.281 1.00 20.53 N ATOM 400 CA GLU A 27 -16.601 11.780 8.543 1.00 55.40 C ATOM 401 C GLU A 27 -17.421 11.731 7.249 1.00 70.31 C ATOM 402 O GLU A 27 -18.613 11.480 7.284 1.00 70.32 O ATOM 403 CB GLU A 27 -16.782 13.098 9.281 1.00 51.14 C ATOM 404 CG GLU A 27 -18.191 13.321 9.782 1.00 50.03 C ATOM 405 CD GLU A 27 -18.322 14.560 10.600 1.00 44.23 C ATOM 406 OE1 GLU A 27 -18.495 15.641 10.017 1.00 42.15 O ATOM 407 OE2 GLU A 27 -18.275 14.474 11.851 1.00 30.41 O ATOM 0 H GLU A 27 -14.647 12.352 8.102 1.00 20.53 H new ATOM 0 HA GLU A 27 -16.978 10.992 9.195 1.00 55.40 H new ATOM 0 HB2 GLU A 27 -16.095 13.129 10.127 1.00 51.14 H new ATOM 0 HB3 GLU A 27 -16.507 13.918 8.617 1.00 51.14 H new ATOM 0 HG2 GLU A 27 -18.870 13.379 8.931 1.00 50.03 H new ATOM 0 HG3 GLU A 27 -18.500 12.463 10.378 1.00 50.03 H new ATOM 414 N SER A 28 -16.764 11.933 6.096 1.00 65.54 N ATOM 415 CA SER A 28 -17.430 11.796 4.789 1.00 13.40 C ATOM 416 C SER A 28 -17.909 10.337 4.633 1.00 44.13 C ATOM 417 O SER A 28 -18.902 10.036 3.950 1.00 4.02 O ATOM 418 CB SER A 28 -16.453 12.180 3.653 1.00 34.21 C ATOM 419 OG SER A 28 -17.080 12.189 2.379 1.00 4.12 O ATOM 0 H SER A 28 -15.778 12.190 6.041 1.00 65.54 H new ATOM 0 HA SER A 28 -18.288 12.466 4.732 1.00 13.40 H new ATOM 0 HB2 SER A 28 -16.034 13.166 3.856 1.00 34.21 H new ATOM 0 HB3 SER A 28 -15.621 11.476 3.640 1.00 34.21 H new ATOM 0 HG SER A 28 -16.425 12.438 1.694 1.00 4.12 H new ATOM 425 N SER A 29 -17.197 9.458 5.306 1.00 22.02 N ATOM 426 CA SER A 29 -17.498 8.063 5.383 1.00 12.44 C ATOM 427 C SER A 29 -18.835 7.835 6.128 1.00 43.30 C ATOM 428 O SER A 29 -19.626 6.973 5.749 1.00 14.41 O ATOM 429 CB SER A 29 -16.333 7.388 6.121 1.00 23.14 C ATOM 430 OG SER A 29 -16.533 6.015 6.337 1.00 62.30 O ATOM 0 H SER A 29 -16.362 9.716 5.832 1.00 22.02 H new ATOM 0 HA SER A 29 -17.614 7.636 4.387 1.00 12.44 H new ATOM 0 HB2 SER A 29 -15.418 7.529 5.546 1.00 23.14 H new ATOM 0 HB3 SER A 29 -16.185 7.882 7.081 1.00 23.14 H new ATOM 0 HG SER A 29 -16.798 5.587 5.496 1.00 62.30 H new ATOM 436 N THR A 30 -19.069 8.626 7.192 1.00 4.42 N ATOM 437 CA THR A 30 -20.259 8.535 8.070 1.00 21.10 C ATOM 438 C THR A 30 -20.236 7.223 8.933 1.00 33.33 C ATOM 439 O THR A 30 -21.041 7.029 9.858 1.00 71.33 O ATOM 440 CB THR A 30 -21.583 8.645 7.244 1.00 52.24 C ATOM 441 OG1 THR A 30 -21.482 9.768 6.329 1.00 2.53 O ATOM 442 CG2 THR A 30 -22.778 8.884 8.157 1.00 11.41 C ATOM 0 H THR A 30 -18.424 9.364 7.474 1.00 4.42 H new ATOM 0 HA THR A 30 -20.225 9.381 8.757 1.00 21.10 H new ATOM 0 HB THR A 30 -21.726 7.710 6.703 1.00 52.24 H new ATOM 0 HG1 THR A 30 -22.309 9.840 5.808 1.00 2.53 H new ATOM 0 HG21 THR A 30 -23.685 8.957 7.557 1.00 11.41 H new ATOM 0 HG22 THR A 30 -22.872 8.055 8.858 1.00 11.41 H new ATOM 0 HG23 THR A 30 -22.633 9.812 8.710 1.00 11.41 H new ATOM 450 N GLY A 31 -19.289 6.379 8.648 1.00 63.32 N ATOM 451 CA GLY A 31 -19.130 5.138 9.319 1.00 72.34 C ATOM 452 C GLY A 31 -18.194 4.284 8.529 1.00 33.44 C ATOM 453 O GLY A 31 -18.590 3.672 7.531 1.00 31.40 O ATOM 0 H GLY A 31 -18.592 6.546 7.923 1.00 63.32 H new ATOM 0 HA2 GLY A 31 -18.738 5.299 10.323 1.00 72.34 H new ATOM 0 HA3 GLY A 31 -20.094 4.641 9.428 1.00 72.34 H new ATOM 457 N THR A 32 -16.945 4.298 8.904 1.00 62.20 N ATOM 458 CA THR A 32 -15.957 3.540 8.205 1.00 12.41 C ATOM 459 C THR A 32 -16.112 2.053 8.495 1.00 43.21 C ATOM 460 O THR A 32 -16.080 1.604 9.652 1.00 13.53 O ATOM 461 CB THR A 32 -14.547 4.054 8.552 1.00 1.34 C ATOM 462 OG1 THR A 32 -14.447 5.428 8.117 1.00 62.12 O ATOM 463 CG2 THR A 32 -13.461 3.237 7.867 1.00 14.44 C ATOM 0 H THR A 32 -16.590 4.832 9.697 1.00 62.20 H new ATOM 0 HA THR A 32 -16.101 3.673 7.133 1.00 12.41 H new ATOM 0 HB THR A 32 -14.401 3.965 9.629 1.00 1.34 H new ATOM 0 HG1 THR A 32 -15.177 5.628 7.494 1.00 62.12 H new ATOM 0 HG21 THR A 32 -12.482 3.633 8.138 1.00 14.44 H new ATOM 0 HG22 THR A 32 -13.533 2.197 8.185 1.00 14.44 H new ATOM 0 HG23 THR A 32 -13.589 3.295 6.786 1.00 14.44 H new ATOM 471 N ALA A 33 -16.320 1.313 7.449 1.00 61.32 N ATOM 472 CA ALA A 33 -16.499 -0.091 7.531 1.00 22.13 C ATOM 473 C ALA A 33 -15.553 -0.764 6.571 1.00 73.33 C ATOM 474 O ALA A 33 -15.720 -0.642 5.346 1.00 40.21 O ATOM 475 CB ALA A 33 -17.940 -0.453 7.202 1.00 40.44 C ATOM 0 H ALA A 33 -16.370 1.682 6.500 1.00 61.32 H new ATOM 0 HA ALA A 33 -16.285 -0.431 8.544 1.00 22.13 H new ATOM 0 HB1 ALA A 33 -18.068 -1.533 7.268 1.00 40.44 H new ATOM 0 HB2 ALA A 33 -18.609 0.035 7.911 1.00 40.44 H new ATOM 0 HB3 ALA A 33 -18.177 -0.120 6.191 1.00 40.44 H new ATOM 481 N PRO A 34 -14.488 -1.390 7.072 1.00 31.33 N ATOM 482 CA PRO A 34 -13.609 -2.179 6.234 1.00 53.13 C ATOM 483 C PRO A 34 -14.401 -3.322 5.614 1.00 43.24 C ATOM 484 O PRO A 34 -15.337 -3.879 6.253 1.00 12.51 O ATOM 485 CB PRO A 34 -12.548 -2.709 7.206 1.00 43.55 C ATOM 486 CG PRO A 34 -12.591 -1.751 8.340 1.00 32.13 C ATOM 487 CD PRO A 34 -14.027 -1.347 8.466 1.00 60.24 C ATOM 0 HA PRO A 34 -13.165 -1.616 5.413 1.00 53.13 H new ATOM 0 HB2 PRO A 34 -12.776 -3.724 7.532 1.00 43.55 H new ATOM 0 HB3 PRO A 34 -11.561 -2.737 6.744 1.00 43.55 H new ATOM 0 HG2 PRO A 34 -12.231 -2.214 9.259 1.00 32.13 H new ATOM 0 HG3 PRO A 34 -11.955 -0.887 8.148 1.00 32.13 H new ATOM 0 HD2 PRO A 34 -14.588 -2.033 9.101 1.00 60.24 H new ATOM 0 HD3 PRO A 34 -14.133 -0.352 8.899 1.00 60.24 H new ATOM 495 N ALA A 35 -14.087 -3.634 4.394 1.00 32.23 N ATOM 496 CA ALA A 35 -14.785 -4.647 3.675 1.00 20.13 C ATOM 497 C ALA A 35 -14.444 -6.007 4.223 1.00 23.55 C ATOM 498 O ALA A 35 -13.268 -6.369 4.318 1.00 62.20 O ATOM 499 CB ALA A 35 -14.426 -4.571 2.214 1.00 63.33 C ATOM 0 H ALA A 35 -13.334 -3.189 3.869 1.00 32.23 H new ATOM 0 HA ALA A 35 -15.857 -4.487 3.789 1.00 20.13 H new ATOM 0 HB1 ALA A 35 -14.961 -5.347 1.667 1.00 63.33 H new ATOM 0 HB2 ALA A 35 -14.704 -3.593 1.821 1.00 63.33 H new ATOM 0 HB3 ALA A 35 -13.353 -4.718 2.095 1.00 63.33 H new ATOM 505 N SER A 36 -15.453 -6.748 4.583 1.00 21.41 N ATOM 506 CA SER A 36 -15.272 -8.076 5.075 1.00 35.04 C ATOM 507 C SER A 36 -15.172 -9.027 3.887 1.00 35.52 C ATOM 508 O SER A 36 -16.176 -9.444 3.318 1.00 13.13 O ATOM 509 CB SER A 36 -16.428 -8.445 6.007 1.00 61.55 C ATOM 510 OG SER A 36 -16.556 -7.468 7.046 1.00 32.33 O ATOM 0 H SER A 36 -16.426 -6.443 4.542 1.00 21.41 H new ATOM 0 HA SER A 36 -14.352 -8.150 5.655 1.00 35.04 H new ATOM 0 HB2 SER A 36 -17.357 -8.507 5.440 1.00 61.55 H new ATOM 0 HB3 SER A 36 -16.254 -9.429 6.442 1.00 61.55 H new ATOM 0 HG SER A 36 -17.300 -7.713 7.636 1.00 32.33 H new ATOM 516 N THR A 37 -13.969 -9.269 3.463 1.00 23.24 N ATOM 517 CA THR A 37 -13.706 -10.119 2.337 1.00 72.24 C ATOM 518 C THR A 37 -13.227 -11.480 2.874 1.00 65.30 C ATOM 519 O THR A 37 -12.660 -11.543 3.962 1.00 51.13 O ATOM 520 CB THR A 37 -12.620 -9.448 1.452 1.00 1.32 C ATOM 521 OG1 THR A 37 -13.021 -8.088 1.199 1.00 53.22 O ATOM 522 CG2 THR A 37 -12.457 -10.163 0.115 1.00 40.21 C ATOM 0 H THR A 37 -13.131 -8.878 3.893 1.00 23.24 H new ATOM 0 HA THR A 37 -14.598 -10.270 1.729 1.00 72.24 H new ATOM 0 HB THR A 37 -11.668 -9.495 1.980 1.00 1.32 H new ATOM 0 HG1 THR A 37 -12.346 -7.646 0.642 1.00 53.22 H new ATOM 0 HG21 THR A 37 -11.688 -9.663 -0.474 1.00 40.21 H new ATOM 0 HG22 THR A 37 -12.164 -11.198 0.289 1.00 40.21 H new ATOM 0 HG23 THR A 37 -13.402 -10.140 -0.428 1.00 40.21 H new ATOM 530 N GLY A 38 -13.392 -12.548 2.103 1.00 74.22 N ATOM 531 CA GLY A 38 -13.052 -13.878 2.574 1.00 32.14 C ATOM 532 C GLY A 38 -11.606 -14.184 2.325 1.00 0.34 C ATOM 533 O GLY A 38 -11.196 -15.331 2.235 1.00 11.12 O ATOM 0 H GLY A 38 -13.758 -12.516 1.152 1.00 74.22 H new ATOM 0 HA2 GLY A 38 -13.265 -13.955 3.640 1.00 32.14 H new ATOM 0 HA3 GLY A 38 -13.675 -14.616 2.070 1.00 32.14 H new ATOM 537 N ALA A 39 -10.830 -13.145 2.252 1.00 73.12 N ATOM 538 CA ALA A 39 -9.436 -13.237 1.981 1.00 55.54 C ATOM 539 C ALA A 39 -8.652 -13.348 3.285 1.00 73.44 C ATOM 540 O ALA A 39 -7.425 -13.403 3.289 1.00 74.14 O ATOM 541 CB ALA A 39 -8.990 -12.025 1.195 1.00 25.00 C ATOM 0 H ALA A 39 -11.161 -12.189 2.383 1.00 73.12 H new ATOM 0 HA ALA A 39 -9.244 -14.132 1.389 1.00 55.54 H new ATOM 0 HB1 ALA A 39 -7.922 -12.098 0.989 1.00 25.00 H new ATOM 0 HB2 ALA A 39 -9.539 -11.979 0.254 1.00 25.00 H new ATOM 0 HB3 ALA A 39 -9.187 -11.123 1.774 1.00 25.00 H new ATOM 547 N GLU A 40 -9.388 -13.447 4.385 1.00 14.40 N ATOM 548 CA GLU A 40 -8.842 -13.468 5.750 1.00 22.44 C ATOM 549 C GLU A 40 -8.063 -14.747 6.074 1.00 62.12 C ATOM 550 O GLU A 40 -7.478 -14.865 7.150 1.00 64.41 O ATOM 551 CB GLU A 40 -9.971 -13.276 6.768 1.00 14.45 C ATOM 552 CG GLU A 40 -11.165 -14.198 6.544 1.00 41.20 C ATOM 553 CD GLU A 40 -12.144 -14.185 7.692 1.00 65.41 C ATOM 554 OE1 GLU A 40 -12.781 -13.142 7.948 1.00 51.10 O ATOM 555 OE2 GLU A 40 -12.278 -15.228 8.377 1.00 21.45 O ATOM 0 H GLU A 40 -10.405 -13.517 4.360 1.00 14.40 H new ATOM 0 HA GLU A 40 -8.131 -12.644 5.812 1.00 22.44 H new ATOM 0 HB2 GLU A 40 -9.577 -13.445 7.770 1.00 14.45 H new ATOM 0 HB3 GLU A 40 -10.311 -12.241 6.729 1.00 14.45 H new ATOM 0 HG2 GLU A 40 -11.680 -13.900 5.631 1.00 41.20 H new ATOM 0 HG3 GLU A 40 -10.807 -15.216 6.391 1.00 41.20 H new ATOM 562 N ASN A 41 -8.038 -15.674 5.141 1.00 11.03 N ATOM 563 CA ASN A 41 -7.336 -16.928 5.320 1.00 42.20 C ATOM 564 C ASN A 41 -6.011 -16.839 4.587 1.00 30.45 C ATOM 565 O ASN A 41 -5.191 -17.733 4.658 1.00 52.43 O ATOM 566 CB ASN A 41 -8.197 -18.102 4.788 1.00 73.43 C ATOM 567 CG ASN A 41 -7.606 -19.493 5.061 1.00 34.33 C ATOM 568 OD1 ASN A 41 -7.813 -20.063 6.131 1.00 41.24 O ATOM 569 ND2 ASN A 41 -6.918 -20.064 4.101 1.00 31.42 N ATOM 0 H ASN A 41 -8.503 -15.581 4.238 1.00 11.03 H new ATOM 0 HA ASN A 41 -7.150 -17.114 6.378 1.00 42.20 H new ATOM 0 HB2 ASN A 41 -9.187 -18.045 5.241 1.00 73.43 H new ATOM 0 HB3 ASN A 41 -8.331 -17.981 3.713 1.00 73.43 H new ATOM 0 HD21 ASN A 41 -6.541 -21.002 4.233 1.00 31.42 H new ATOM 0 HD22 ASN A 41 -6.761 -19.570 3.223 1.00 31.42 H new ATOM 576 N LEU A 42 -5.808 -15.698 3.911 1.00 2.22 N ATOM 577 CA LEU A 42 -4.608 -15.419 3.123 1.00 70.01 C ATOM 578 C LEU A 42 -4.446 -16.445 1.983 1.00 22.12 C ATOM 579 O LEU A 42 -3.735 -17.434 2.133 1.00 71.33 O ATOM 580 CB LEU A 42 -3.327 -15.366 4.001 1.00 42.12 C ATOM 581 CG LEU A 42 -3.140 -14.180 4.992 1.00 62.10 C ATOM 582 CD1 LEU A 42 -3.223 -12.837 4.292 1.00 13.33 C ATOM 583 CD2 LEU A 42 -4.102 -14.245 6.177 1.00 63.44 C ATOM 0 H LEU A 42 -6.485 -14.935 3.899 1.00 2.22 H new ATOM 0 HA LEU A 42 -4.739 -14.430 2.684 1.00 70.01 H new ATOM 0 HB2 LEU A 42 -3.287 -16.288 4.580 1.00 42.12 H new ATOM 0 HB3 LEU A 42 -2.468 -15.373 3.330 1.00 42.12 H new ATOM 0 HG LEU A 42 -2.133 -14.282 5.396 1.00 62.10 H new ATOM 0 HD11 LEU A 42 -3.087 -12.038 5.021 1.00 13.33 H new ATOM 0 HD12 LEU A 42 -2.443 -12.773 3.534 1.00 13.33 H new ATOM 0 HD13 LEU A 42 -4.199 -12.734 3.818 1.00 13.33 H new ATOM 0 HD21 LEU A 42 -3.927 -13.394 6.835 1.00 63.44 H new ATOM 0 HD22 LEU A 42 -5.129 -14.217 5.814 1.00 63.44 H new ATOM 0 HD23 LEU A 42 -3.937 -15.170 6.729 1.00 63.44 H new ATOM 595 N PRO A 43 -5.140 -16.235 0.840 1.00 22.31 N ATOM 596 CA PRO A 43 -5.141 -17.184 -0.293 1.00 22.11 C ATOM 597 C PRO A 43 -3.736 -17.539 -0.824 1.00 44.13 C ATOM 598 O PRO A 43 -3.324 -18.693 -0.791 1.00 53.10 O ATOM 599 CB PRO A 43 -5.964 -16.462 -1.375 1.00 73.41 C ATOM 600 CG PRO A 43 -6.039 -15.045 -0.929 1.00 14.13 C ATOM 601 CD PRO A 43 -6.011 -15.078 0.560 1.00 53.13 C ATOM 0 HA PRO A 43 -5.552 -18.146 0.013 1.00 22.11 H new ATOM 0 HB2 PRO A 43 -5.487 -16.542 -2.352 1.00 73.41 H new ATOM 0 HB3 PRO A 43 -6.959 -16.898 -1.469 1.00 73.41 H new ATOM 0 HG2 PRO A 43 -5.202 -14.468 -1.322 1.00 14.13 H new ATOM 0 HG3 PRO A 43 -6.951 -14.570 -1.291 1.00 14.13 H new ATOM 0 HD2 PRO A 43 -5.607 -14.156 0.978 1.00 53.13 H new ATOM 0 HD3 PRO A 43 -7.008 -15.210 0.981 1.00 53.13 H new ATOM 609 N ALA A 44 -2.998 -16.544 -1.274 1.00 43.14 N ATOM 610 CA ALA A 44 -1.672 -16.780 -1.847 1.00 13.51 C ATOM 611 C ALA A 44 -0.580 -16.818 -0.780 1.00 51.23 C ATOM 612 O ALA A 44 0.587 -17.073 -1.082 1.00 33.32 O ATOM 613 CB ALA A 44 -1.353 -15.713 -2.882 1.00 44.42 C ATOM 0 H ALA A 44 -3.285 -15.565 -1.258 1.00 43.14 H new ATOM 0 HA ALA A 44 -1.694 -17.759 -2.325 1.00 13.51 H new ATOM 0 HB1 ALA A 44 -0.364 -15.898 -3.302 1.00 44.42 H new ATOM 0 HB2 ALA A 44 -2.097 -15.744 -3.678 1.00 44.42 H new ATOM 0 HB3 ALA A 44 -1.368 -14.731 -2.409 1.00 44.42 H new ATOM 619 N GLY A 45 -0.956 -16.556 0.462 1.00 71.00 N ATOM 620 CA GLY A 45 0.024 -16.510 1.544 1.00 42.31 C ATOM 621 C GLY A 45 0.798 -15.206 1.537 1.00 41.15 C ATOM 622 O GLY A 45 1.791 -15.046 2.251 1.00 64.42 O ATOM 0 H GLY A 45 -1.918 -16.374 0.747 1.00 71.00 H new ATOM 0 HA2 GLY A 45 -0.484 -16.628 2.501 1.00 42.31 H new ATOM 0 HA3 GLY A 45 0.716 -17.346 1.445 1.00 42.31 H new ATOM 626 N SER A 46 0.335 -14.298 0.722 1.00 72.34 N ATOM 627 CA SER A 46 0.901 -12.995 0.546 1.00 14.13 C ATOM 628 C SER A 46 -0.248 -12.050 0.275 1.00 21.01 C ATOM 629 O SER A 46 -1.379 -12.514 0.033 1.00 44.54 O ATOM 630 CB SER A 46 1.875 -12.994 -0.640 1.00 65.33 C ATOM 631 OG SER A 46 2.914 -13.938 -0.447 1.00 73.23 O ATOM 0 H SER A 46 -0.485 -14.457 0.137 1.00 72.34 H new ATOM 0 HA SER A 46 1.458 -12.691 1.432 1.00 14.13 H new ATOM 0 HB2 SER A 46 1.335 -13.225 -1.558 1.00 65.33 H new ATOM 0 HB3 SER A 46 2.302 -11.999 -0.763 1.00 65.33 H new ATOM 0 HG SER A 46 3.520 -13.919 -1.217 1.00 73.23 H new ATOM 637 N ALA A 47 0.015 -10.771 0.297 1.00 75.41 N ATOM 638 CA ALA A 47 -1.005 -9.784 0.093 1.00 50.33 C ATOM 639 C ALA A 47 -0.425 -8.584 -0.617 1.00 23.42 C ATOM 640 O ALA A 47 0.802 -8.364 -0.585 1.00 73.34 O ATOM 641 CB ALA A 47 -1.634 -9.393 1.409 1.00 40.34 C ATOM 0 H ALA A 47 0.946 -10.386 0.457 1.00 75.41 H new ATOM 0 HA ALA A 47 -1.789 -10.206 -0.535 1.00 50.33 H new ATOM 0 HB1 ALA A 47 -2.406 -8.643 1.235 1.00 40.34 H new ATOM 0 HB2 ALA A 47 -2.080 -10.272 1.874 1.00 40.34 H new ATOM 0 HB3 ALA A 47 -0.871 -8.981 2.069 1.00 40.34 H new ATOM 647 N LEU A 48 -1.272 -7.833 -1.268 1.00 42.04 N ATOM 648 CA LEU A 48 -0.845 -6.708 -2.047 1.00 72.44 C ATOM 649 C LEU A 48 -1.699 -5.499 -1.755 1.00 64.42 C ATOM 650 O LEU A 48 -2.855 -5.621 -1.348 1.00 11.11 O ATOM 651 CB LEU A 48 -0.859 -7.016 -3.575 1.00 42.24 C ATOM 652 CG LEU A 48 -2.217 -7.283 -4.278 1.00 72.34 C ATOM 653 CD1 LEU A 48 -2.016 -7.303 -5.781 1.00 55.20 C ATOM 654 CD2 LEU A 48 -2.833 -8.608 -3.847 1.00 31.53 C ATOM 0 H LEU A 48 -2.280 -7.987 -1.271 1.00 42.04 H new ATOM 0 HA LEU A 48 0.185 -6.494 -1.760 1.00 72.44 H new ATOM 0 HB2 LEU A 48 -0.385 -6.177 -4.084 1.00 42.24 H new ATOM 0 HB3 LEU A 48 -0.226 -7.888 -3.740 1.00 42.24 H new ATOM 0 HG LEU A 48 -2.897 -6.481 -3.990 1.00 72.34 H new ATOM 0 HD11 LEU A 48 -2.970 -7.491 -6.273 1.00 55.20 H new ATOM 0 HD12 LEU A 48 -1.622 -6.341 -6.108 1.00 55.20 H new ATOM 0 HD13 LEU A 48 -1.311 -8.092 -6.043 1.00 55.20 H new ATOM 0 HD21 LEU A 48 -3.782 -8.753 -4.364 1.00 31.53 H new ATOM 0 HD22 LEU A 48 -2.155 -9.423 -4.098 1.00 31.53 H new ATOM 0 HD23 LEU A 48 -3.004 -8.597 -2.771 1.00 31.53 H new ATOM 666 N LEU A 49 -1.135 -4.350 -1.945 1.00 11.44 N ATOM 667 CA LEU A 49 -1.854 -3.130 -1.770 1.00 2.45 C ATOM 668 C LEU A 49 -2.059 -2.468 -3.109 1.00 31.51 C ATOM 669 O LEU A 49 -1.155 -2.451 -3.951 1.00 24.41 O ATOM 670 CB LEU A 49 -1.195 -2.198 -0.702 1.00 12.14 C ATOM 671 CG LEU A 49 0.317 -1.857 -0.829 1.00 34.05 C ATOM 672 CD1 LEU A 49 0.604 -0.850 -1.934 1.00 75.31 C ATOM 673 CD2 LEU A 49 0.863 -1.359 0.503 1.00 54.23 C ATOM 0 H LEU A 49 -0.162 -4.231 -2.226 1.00 11.44 H new ATOM 0 HA LEU A 49 -2.839 -3.355 -1.361 1.00 2.45 H new ATOM 0 HB2 LEU A 49 -1.746 -1.257 -0.702 1.00 12.14 H new ATOM 0 HB3 LEU A 49 -1.348 -2.657 0.275 1.00 12.14 H new ATOM 0 HG LEU A 49 0.827 -2.780 -1.105 1.00 34.05 H new ATOM 0 HD11 LEU A 49 1.675 -0.651 -1.976 1.00 75.31 H new ATOM 0 HD12 LEU A 49 0.273 -1.255 -2.890 1.00 75.31 H new ATOM 0 HD13 LEU A 49 0.070 0.078 -1.728 1.00 75.31 H new ATOM 0 HD21 LEU A 49 1.922 -1.125 0.397 1.00 54.23 H new ATOM 0 HD22 LEU A 49 0.322 -0.463 0.806 1.00 54.23 H new ATOM 0 HD23 LEU A 49 0.736 -2.133 1.260 1.00 54.23 H new ATOM 685 N VAL A 50 -3.244 -2.007 -3.336 1.00 24.23 N ATOM 686 CA VAL A 50 -3.569 -1.341 -4.562 1.00 2.13 C ATOM 687 C VAL A 50 -3.903 0.108 -4.274 1.00 55.14 C ATOM 688 O VAL A 50 -4.596 0.415 -3.283 1.00 61.40 O ATOM 689 CB VAL A 50 -4.741 -2.061 -5.334 1.00 21.13 C ATOM 690 CG1 VAL A 50 -6.013 -2.148 -4.496 1.00 72.22 C ATOM 691 CG2 VAL A 50 -5.028 -1.387 -6.678 1.00 64.42 C ATOM 0 H VAL A 50 -4.019 -2.080 -2.677 1.00 24.23 H new ATOM 0 HA VAL A 50 -2.700 -1.383 -5.219 1.00 2.13 H new ATOM 0 HB VAL A 50 -4.404 -3.079 -5.529 1.00 21.13 H new ATOM 0 HG11 VAL A 50 -6.792 -2.651 -5.069 1.00 72.22 H new ATOM 0 HG12 VAL A 50 -5.811 -2.711 -3.585 1.00 72.22 H new ATOM 0 HG13 VAL A 50 -6.346 -1.144 -4.235 1.00 72.22 H new ATOM 0 HG21 VAL A 50 -5.841 -1.910 -7.181 1.00 64.42 H new ATOM 0 HG22 VAL A 50 -5.314 -0.348 -6.511 1.00 64.42 H new ATOM 0 HG23 VAL A 50 -4.134 -1.422 -7.301 1.00 64.42 H new ATOM 701 N VAL A 51 -3.373 0.996 -5.073 1.00 0.24 N ATOM 702 CA VAL A 51 -3.680 2.377 -4.921 1.00 65.40 C ATOM 703 C VAL A 51 -5.023 2.590 -5.582 1.00 42.34 C ATOM 704 O VAL A 51 -5.174 2.379 -6.794 1.00 32.11 O ATOM 705 CB VAL A 51 -2.623 3.285 -5.594 1.00 60.24 C ATOM 706 CG1 VAL A 51 -2.860 4.741 -5.229 1.00 44.31 C ATOM 707 CG2 VAL A 51 -1.203 2.859 -5.232 1.00 44.44 C ATOM 0 H VAL A 51 -2.728 0.779 -5.833 1.00 0.24 H new ATOM 0 HA VAL A 51 -3.691 2.640 -3.863 1.00 65.40 H new ATOM 0 HB VAL A 51 -2.731 3.176 -6.673 1.00 60.24 H new ATOM 0 HG11 VAL A 51 -2.107 5.364 -5.711 1.00 44.31 H new ATOM 0 HG12 VAL A 51 -3.852 5.044 -5.566 1.00 44.31 H new ATOM 0 HG13 VAL A 51 -2.792 4.861 -4.148 1.00 44.31 H new ATOM 0 HG21 VAL A 51 -0.489 3.520 -5.723 1.00 44.44 H new ATOM 0 HG22 VAL A 51 -1.069 2.919 -4.152 1.00 44.44 H new ATOM 0 HG23 VAL A 51 -1.035 1.834 -5.562 1.00 44.44 H new ATOM 717 N LYS A 52 -5.979 2.989 -4.794 1.00 25.24 N ATOM 718 CA LYS A 52 -7.340 3.151 -5.244 1.00 43.21 C ATOM 719 C LYS A 52 -7.548 4.567 -5.741 1.00 73.20 C ATOM 720 O LYS A 52 -8.309 4.808 -6.665 1.00 14.12 O ATOM 721 CB LYS A 52 -8.294 2.825 -4.072 1.00 4.14 C ATOM 722 CG LYS A 52 -9.820 2.924 -4.320 1.00 3.21 C ATOM 723 CD LYS A 52 -10.385 1.870 -5.299 1.00 21.21 C ATOM 724 CE LYS A 52 -10.200 2.263 -6.757 1.00 40.03 C ATOM 725 NZ LYS A 52 -10.747 1.259 -7.686 1.00 31.12 N ATOM 0 H LYS A 52 -5.839 3.215 -3.809 1.00 25.24 H new ATOM 0 HA LYS A 52 -7.550 2.471 -6.069 1.00 43.21 H new ATOM 0 HB2 LYS A 52 -8.076 1.811 -3.738 1.00 4.14 H new ATOM 0 HB3 LYS A 52 -8.047 3.492 -3.246 1.00 4.14 H new ATOM 0 HG2 LYS A 52 -10.337 2.827 -3.365 1.00 3.21 H new ATOM 0 HG3 LYS A 52 -10.048 3.918 -4.706 1.00 3.21 H new ATOM 0 HD2 LYS A 52 -9.894 0.914 -5.120 1.00 21.21 H new ATOM 0 HD3 LYS A 52 -11.447 1.726 -5.098 1.00 21.21 H new ATOM 0 HE2 LYS A 52 -10.686 3.222 -6.936 1.00 40.03 H new ATOM 0 HE3 LYS A 52 -9.138 2.401 -6.961 1.00 40.03 H new ATOM 0 HZ1 LYS A 52 -10.596 1.574 -8.666 1.00 31.12 H new ATOM 0 HZ2 LYS A 52 -10.266 0.349 -7.536 1.00 31.12 H new ATOM 0 HZ3 LYS A 52 -11.766 1.144 -7.513 1.00 31.12 H new ATOM 739 N ARG A 53 -6.844 5.484 -5.141 1.00 24.20 N ATOM 740 CA ARG A 53 -6.957 6.871 -5.493 1.00 3.24 C ATOM 741 C ARG A 53 -5.618 7.526 -5.280 1.00 51.25 C ATOM 742 O ARG A 53 -4.913 7.197 -4.312 1.00 11.22 O ATOM 743 CB ARG A 53 -7.990 7.558 -4.609 1.00 63.12 C ATOM 744 CG ARG A 53 -8.259 9.013 -4.977 1.00 55.34 C ATOM 745 CD ARG A 53 -8.915 9.729 -3.828 1.00 4.22 C ATOM 746 NE ARG A 53 -8.021 9.741 -2.661 1.00 22.22 N ATOM 747 CZ ARG A 53 -8.387 9.494 -1.402 1.00 64.43 C ATOM 748 NH1 ARG A 53 -9.658 9.259 -1.118 1.00 22.41 N ATOM 749 NH2 ARG A 53 -7.466 9.469 -0.439 1.00 72.44 N ATOM 0 H ARG A 53 -6.176 5.292 -4.395 1.00 24.20 H new ATOM 0 HA ARG A 53 -7.269 6.957 -6.534 1.00 3.24 H new ATOM 0 HB2 ARG A 53 -8.926 7.002 -4.664 1.00 63.12 H new ATOM 0 HB3 ARG A 53 -7.653 7.513 -3.573 1.00 63.12 H new ATOM 0 HG2 ARG A 53 -7.324 9.509 -5.237 1.00 55.34 H new ATOM 0 HG3 ARG A 53 -8.900 9.060 -5.857 1.00 55.34 H new ATOM 0 HD2 ARG A 53 -9.160 10.751 -4.119 1.00 4.22 H new ATOM 0 HD3 ARG A 53 -9.853 9.237 -3.572 1.00 4.22 H new ATOM 0 HE ARG A 53 -7.038 9.956 -2.828 1.00 22.22 H new ATOM 0 HH11 ARG A 53 -10.357 9.267 -1.861 1.00 22.41 H new ATOM 0 HH12 ARG A 53 -9.939 9.070 -0.156 1.00 22.41 H new ATOM 0 HH21 ARG A 53 -6.486 9.638 -0.666 1.00 72.44 H new ATOM 0 HH22 ARG A 53 -7.741 9.281 0.525 1.00 72.44 H new ATOM 763 N GLY A 54 -5.260 8.409 -6.166 1.00 53.04 N ATOM 764 CA GLY A 54 -4.033 9.128 -6.051 1.00 60.52 C ATOM 765 C GLY A 54 -3.343 9.224 -7.385 1.00 43.44 C ATOM 766 O GLY A 54 -3.808 8.633 -8.357 1.00 62.42 O ATOM 0 H GLY A 54 -5.814 8.648 -6.988 1.00 53.04 H new ATOM 0 HA2 GLY A 54 -4.227 10.128 -5.664 1.00 60.52 H new ATOM 0 HA3 GLY A 54 -3.380 8.630 -5.334 1.00 60.52 H new ATOM 770 N PRO A 55 -2.242 9.966 -7.477 1.00 12.40 N ATOM 771 CA PRO A 55 -1.467 10.090 -8.718 1.00 65.04 C ATOM 772 C PRO A 55 -1.044 8.722 -9.285 1.00 32.43 C ATOM 773 O PRO A 55 -1.154 8.482 -10.489 1.00 52.51 O ATOM 774 CB PRO A 55 -0.245 10.898 -8.280 1.00 53.54 C ATOM 775 CG PRO A 55 -0.731 11.705 -7.134 1.00 53.53 C ATOM 776 CD PRO A 55 -1.712 10.832 -6.413 1.00 31.33 C ATOM 0 HA PRO A 55 -2.040 10.556 -9.519 1.00 65.04 H new ATOM 0 HB2 PRO A 55 0.578 10.247 -7.987 1.00 53.54 H new ATOM 0 HB3 PRO A 55 0.122 11.533 -9.086 1.00 53.54 H new ATOM 0 HG2 PRO A 55 0.092 11.992 -6.480 1.00 53.53 H new ATOM 0 HG3 PRO A 55 -1.203 12.626 -7.476 1.00 53.53 H new ATOM 0 HD2 PRO A 55 -1.231 10.252 -5.625 1.00 31.33 H new ATOM 0 HD3 PRO A 55 -2.501 11.418 -5.941 1.00 31.33 H new ATOM 784 N ASN A 56 -0.585 7.816 -8.432 1.00 2.41 N ATOM 785 CA ASN A 56 -0.238 6.476 -8.901 1.00 15.24 C ATOM 786 C ASN A 56 -1.386 5.458 -8.777 1.00 64.34 C ATOM 787 O ASN A 56 -1.143 4.250 -8.815 1.00 73.44 O ATOM 788 CB ASN A 56 1.050 5.940 -8.254 1.00 44.21 C ATOM 789 CG ASN A 56 1.073 5.998 -6.742 1.00 70.22 C ATOM 790 OD1 ASN A 56 0.046 5.976 -6.081 1.00 35.22 O ATOM 791 ND2 ASN A 56 2.247 6.068 -6.192 1.00 31.41 N ATOM 0 H ASN A 56 -0.446 7.975 -7.434 1.00 2.41 H new ATOM 0 HA ASN A 56 -0.049 6.597 -9.968 1.00 15.24 H new ATOM 0 HB2 ASN A 56 1.193 4.905 -8.566 1.00 44.21 H new ATOM 0 HB3 ASN A 56 1.897 6.509 -8.638 1.00 44.21 H new ATOM 0 HD21 ASN A 56 2.333 6.107 -5.176 1.00 31.41 H new ATOM 0 HD22 ASN A 56 3.083 6.084 -6.776 1.00 31.41 H new ATOM 798 N ALA A 57 -2.637 5.941 -8.708 1.00 41.43 N ATOM 799 CA ALA A 57 -3.819 5.057 -8.628 1.00 21.44 C ATOM 800 C ALA A 57 -3.837 4.063 -9.773 1.00 52.11 C ATOM 801 O ALA A 57 -3.522 4.411 -10.917 1.00 25.25 O ATOM 802 CB ALA A 57 -5.109 5.853 -8.626 1.00 31.35 C ATOM 0 H ALA A 57 -2.859 6.936 -8.706 1.00 41.43 H new ATOM 0 HA ALA A 57 -3.745 4.512 -7.687 1.00 21.44 H new ATOM 0 HB1 ALA A 57 -5.957 5.171 -8.566 1.00 31.35 H new ATOM 0 HB2 ALA A 57 -5.121 6.524 -7.767 1.00 31.35 H new ATOM 0 HB3 ALA A 57 -5.177 6.438 -9.543 1.00 31.35 H new ATOM 808 N GLY A 58 -4.163 2.836 -9.463 1.00 64.54 N ATOM 809 CA GLY A 58 -4.165 1.796 -10.459 1.00 42.03 C ATOM 810 C GLY A 58 -2.978 0.879 -10.291 1.00 65.32 C ATOM 811 O GLY A 58 -2.967 -0.243 -10.799 1.00 21.21 O ATOM 0 H GLY A 58 -4.431 2.531 -8.527 1.00 64.54 H new ATOM 0 HA2 GLY A 58 -5.087 1.219 -10.385 1.00 42.03 H new ATOM 0 HA3 GLY A 58 -4.146 2.241 -11.454 1.00 42.03 H new ATOM 815 N ALA A 59 -1.975 1.355 -9.583 1.00 2.42 N ATOM 816 CA ALA A 59 -0.804 0.560 -9.313 1.00 74.13 C ATOM 817 C ALA A 59 -1.055 -0.316 -8.107 1.00 22.40 C ATOM 818 O ALA A 59 -1.741 0.092 -7.160 1.00 63.34 O ATOM 819 CB ALA A 59 0.413 1.439 -9.085 1.00 1.13 C ATOM 0 H ALA A 59 -1.951 2.293 -9.184 1.00 2.42 H new ATOM 0 HA ALA A 59 -0.602 -0.068 -10.180 1.00 74.13 H new ATOM 0 HB1 ALA A 59 1.282 0.812 -8.884 1.00 1.13 H new ATOM 0 HB2 ALA A 59 0.598 2.041 -9.974 1.00 1.13 H new ATOM 0 HB3 ALA A 59 0.234 2.095 -8.233 1.00 1.13 H new ATOM 825 N ARG A 60 -0.539 -1.505 -8.147 1.00 53.00 N ATOM 826 CA ARG A 60 -0.691 -2.435 -7.064 1.00 75.22 C ATOM 827 C ARG A 60 0.647 -3.080 -6.795 1.00 20.11 C ATOM 828 O ARG A 60 1.363 -3.449 -7.726 1.00 43.32 O ATOM 829 CB ARG A 60 -1.771 -3.485 -7.382 1.00 12.22 C ATOM 830 CG ARG A 60 -1.479 -4.324 -8.610 1.00 41.25 C ATOM 831 CD ARG A 60 -2.600 -5.283 -8.927 1.00 25.30 C ATOM 832 NE ARG A 60 -2.262 -6.107 -10.083 1.00 33.14 N ATOM 833 CZ ARG A 60 -3.041 -7.036 -10.633 1.00 14.03 C ATOM 834 NH1 ARG A 60 -4.262 -7.261 -10.156 1.00 4.51 N ATOM 835 NH2 ARG A 60 -2.592 -7.729 -11.677 1.00 64.34 N ATOM 0 H ARG A 60 0.003 -1.862 -8.934 1.00 53.00 H new ATOM 0 HA ARG A 60 -1.023 -1.908 -6.170 1.00 75.22 H new ATOM 0 HB2 ARG A 60 -1.884 -4.146 -6.523 1.00 12.22 H new ATOM 0 HB3 ARG A 60 -2.726 -2.977 -7.521 1.00 12.22 H new ATOM 0 HG2 ARG A 60 -1.312 -3.668 -9.464 1.00 41.25 H new ATOM 0 HG3 ARG A 60 -0.557 -4.885 -8.454 1.00 41.25 H new ATOM 0 HD2 ARG A 60 -2.795 -5.920 -8.064 1.00 25.30 H new ATOM 0 HD3 ARG A 60 -3.516 -4.727 -9.126 1.00 25.30 H new ATOM 0 HE ARG A 60 -1.347 -5.958 -10.508 1.00 33.14 H new ATOM 0 HH11 ARG A 60 -4.608 -6.720 -9.363 1.00 4.51 H new ATOM 0 HH12 ARG A 60 -4.853 -7.975 -10.583 1.00 4.51 H new ATOM 0 HH21 ARG A 60 -1.660 -7.546 -12.048 1.00 64.34 H new ATOM 0 HH22 ARG A 60 -3.180 -8.443 -12.106 1.00 64.34 H new ATOM 849 N PHE A 61 1.000 -3.187 -5.557 1.00 10.03 N ATOM 850 CA PHE A 61 2.281 -3.725 -5.190 1.00 61.13 C ATOM 851 C PHE A 61 2.095 -4.814 -4.177 1.00 73.41 C ATOM 852 O PHE A 61 1.386 -4.627 -3.181 1.00 15.31 O ATOM 853 CB PHE A 61 3.190 -2.625 -4.625 1.00 71.30 C ATOM 854 CG PHE A 61 3.436 -1.484 -5.578 1.00 64.31 C ATOM 855 CD1 PHE A 61 4.376 -1.597 -6.588 1.00 22.22 C ATOM 856 CD2 PHE A 61 2.720 -0.299 -5.462 1.00 32.11 C ATOM 857 CE1 PHE A 61 4.596 -0.554 -7.467 1.00 45.43 C ATOM 858 CE2 PHE A 61 2.937 0.745 -6.338 1.00 41.54 C ATOM 859 CZ PHE A 61 3.878 0.618 -7.340 1.00 71.42 C ATOM 0 H PHE A 61 0.416 -2.907 -4.769 1.00 10.03 H new ATOM 0 HA PHE A 61 2.758 -4.136 -6.079 1.00 61.13 H new ATOM 0 HB2 PHE A 61 2.743 -2.232 -3.712 1.00 71.30 H new ATOM 0 HB3 PHE A 61 4.147 -3.066 -4.347 1.00 71.30 H new ATOM 0 HD1 PHE A 61 4.943 -2.510 -6.690 1.00 22.22 H new ATOM 0 HD2 PHE A 61 1.985 -0.194 -4.677 1.00 32.11 H new ATOM 0 HE1 PHE A 61 5.329 -0.656 -8.253 1.00 45.43 H new ATOM 0 HE2 PHE A 61 2.372 1.660 -6.240 1.00 41.54 H new ATOM 0 HZ PHE A 61 4.052 1.435 -8.024 1.00 71.42 H new ATOM 869 N LEU A 62 2.699 -5.945 -4.427 1.00 32.44 N ATOM 870 CA LEU A 62 2.597 -7.055 -3.522 1.00 74.01 C ATOM 871 C LEU A 62 3.734 -7.008 -2.553 1.00 2.55 C ATOM 872 O LEU A 62 4.866 -6.685 -2.929 1.00 74.32 O ATOM 873 CB LEU A 62 2.524 -8.443 -4.223 1.00 13.11 C ATOM 874 CG LEU A 62 3.711 -8.895 -5.104 1.00 62.32 C ATOM 875 CD1 LEU A 62 3.690 -10.405 -5.241 1.00 34.50 C ATOM 876 CD2 LEU A 62 3.630 -8.286 -6.503 1.00 14.32 C ATOM 0 H LEU A 62 3.269 -6.121 -5.254 1.00 32.44 H new ATOM 0 HA LEU A 62 1.647 -6.950 -2.999 1.00 74.01 H new ATOM 0 HB2 LEU A 62 2.382 -9.197 -3.449 1.00 13.11 H new ATOM 0 HB3 LEU A 62 1.629 -8.452 -4.845 1.00 13.11 H new ATOM 0 HG LEU A 62 4.630 -8.559 -4.624 1.00 62.32 H new ATOM 0 HD11 LEU A 62 4.526 -10.726 -5.862 1.00 34.50 H new ATOM 0 HD12 LEU A 62 3.775 -10.861 -4.255 1.00 34.50 H new ATOM 0 HD13 LEU A 62 2.754 -10.715 -5.705 1.00 34.50 H new ATOM 0 HD21 LEU A 62 4.479 -8.624 -7.097 1.00 14.32 H new ATOM 0 HD22 LEU A 62 2.703 -8.600 -6.984 1.00 14.32 H new ATOM 0 HD23 LEU A 62 3.649 -7.199 -6.428 1.00 14.32 H new ATOM 888 N LEU A 63 3.449 -7.294 -1.327 1.00 14.13 N ATOM 889 CA LEU A 63 4.458 -7.258 -0.320 1.00 4.44 C ATOM 890 C LEU A 63 5.182 -8.583 -0.304 1.00 61.31 C ATOM 891 O LEU A 63 4.651 -9.596 0.153 1.00 11.00 O ATOM 892 CB LEU A 63 3.875 -6.910 1.067 1.00 11.52 C ATOM 893 CG LEU A 63 3.305 -5.476 1.281 1.00 31.32 C ATOM 894 CD1 LEU A 63 4.357 -4.418 0.992 1.00 3.32 C ATOM 895 CD2 LEU A 63 2.048 -5.219 0.455 1.00 2.43 C ATOM 0 H LEU A 63 2.521 -7.557 -0.996 1.00 14.13 H new ATOM 0 HA LEU A 63 5.167 -6.465 -0.557 1.00 4.44 H new ATOM 0 HB2 LEU A 63 3.078 -7.622 1.283 1.00 11.52 H new ATOM 0 HB3 LEU A 63 4.657 -7.073 1.809 1.00 11.52 H new ATOM 0 HG LEU A 63 3.022 -5.408 2.331 1.00 31.32 H new ATOM 0 HD11 LEU A 63 3.930 -3.428 1.150 1.00 3.32 H new ATOM 0 HD12 LEU A 63 5.207 -4.558 1.660 1.00 3.32 H new ATOM 0 HD13 LEU A 63 4.690 -4.509 -0.042 1.00 3.32 H new ATOM 0 HD21 LEU A 63 1.691 -4.206 0.641 1.00 2.43 H new ATOM 0 HD22 LEU A 63 2.279 -5.334 -0.604 1.00 2.43 H new ATOM 0 HD23 LEU A 63 1.275 -5.933 0.737 1.00 2.43 H new ATOM 907 N ASP A 64 6.366 -8.560 -0.848 1.00 12.41 N ATOM 908 CA ASP A 64 7.229 -9.726 -0.962 1.00 34.30 C ATOM 909 C ASP A 64 8.570 -9.415 -0.309 1.00 53.12 C ATOM 910 O ASP A 64 9.453 -10.254 -0.209 1.00 35.41 O ATOM 911 CB ASP A 64 7.414 -10.078 -2.453 1.00 15.32 C ATOM 912 CG ASP A 64 8.259 -11.312 -2.692 1.00 5.14 C ATOM 913 OD1 ASP A 64 7.833 -12.421 -2.336 1.00 2.20 O ATOM 914 OD2 ASP A 64 9.362 -11.203 -3.263 1.00 32.35 O ATOM 0 H ASP A 64 6.778 -7.712 -1.238 1.00 12.41 H new ATOM 0 HA ASP A 64 6.781 -10.582 -0.456 1.00 34.30 H new ATOM 0 HB2 ASP A 64 6.434 -10.228 -2.905 1.00 15.32 H new ATOM 0 HB3 ASP A 64 7.874 -9.231 -2.962 1.00 15.32 H new ATOM 919 N GLN A 65 8.695 -8.204 0.149 1.00 24.21 N ATOM 920 CA GLN A 65 9.879 -7.735 0.781 1.00 20.33 C ATOM 921 C GLN A 65 9.629 -7.585 2.275 1.00 33.21 C ATOM 922 O GLN A 65 8.515 -7.250 2.679 1.00 55.44 O ATOM 923 CB GLN A 65 10.415 -6.408 0.141 1.00 11.55 C ATOM 924 CG GLN A 65 9.526 -5.124 0.175 1.00 74.32 C ATOM 925 CD GLN A 65 8.251 -5.116 -0.707 1.00 23.13 C ATOM 926 OE1 GLN A 65 7.599 -6.111 -0.926 1.00 52.54 O ATOM 927 NE2 GLN A 65 7.935 -3.981 -1.268 1.00 23.10 N ATOM 0 H GLN A 65 7.956 -7.504 0.089 1.00 24.21 H new ATOM 0 HA GLN A 65 10.666 -8.474 0.626 1.00 20.33 H new ATOM 0 HB2 GLN A 65 11.357 -6.166 0.632 1.00 11.55 H new ATOM 0 HB3 GLN A 65 10.645 -6.619 -0.903 1.00 11.55 H new ATOM 0 HG2 GLN A 65 9.222 -4.952 1.208 1.00 74.32 H new ATOM 0 HG3 GLN A 65 10.146 -4.277 -0.121 1.00 74.32 H new ATOM 0 HE21 GLN A 65 8.490 -3.146 -1.078 1.00 23.10 H new ATOM 0 HE22 GLN A 65 7.133 -3.928 -1.896 1.00 23.10 H new ATOM 936 N PRO A 66 10.634 -7.883 3.129 1.00 32.32 N ATOM 937 CA PRO A 66 10.485 -7.808 4.596 1.00 51.35 C ATOM 938 C PRO A 66 10.322 -6.377 5.120 1.00 53.51 C ATOM 939 O PRO A 66 9.922 -6.160 6.265 1.00 53.34 O ATOM 940 CB PRO A 66 11.795 -8.413 5.135 1.00 64.20 C ATOM 941 CG PRO A 66 12.404 -9.126 3.975 1.00 70.10 C ATOM 942 CD PRO A 66 11.977 -8.368 2.755 1.00 70.32 C ATOM 0 HA PRO A 66 9.584 -8.331 4.918 1.00 51.35 H new ATOM 0 HB2 PRO A 66 12.460 -7.637 5.514 1.00 64.20 H new ATOM 0 HB3 PRO A 66 11.602 -9.098 5.961 1.00 64.20 H new ATOM 0 HG2 PRO A 66 13.490 -9.151 4.059 1.00 70.10 H new ATOM 0 HG3 PRO A 66 12.064 -10.161 3.931 1.00 70.10 H new ATOM 0 HD2 PRO A 66 12.657 -7.546 2.530 1.00 70.32 H new ATOM 0 HD3 PRO A 66 11.946 -9.006 1.872 1.00 70.32 H new ATOM 950 N THR A 67 10.653 -5.406 4.313 1.00 74.24 N ATOM 951 CA THR A 67 10.544 -4.025 4.714 1.00 42.20 C ATOM 952 C THR A 67 10.262 -3.159 3.488 1.00 51.03 C ATOM 953 O THR A 67 10.955 -3.264 2.472 1.00 5.10 O ATOM 954 CB THR A 67 11.851 -3.536 5.412 1.00 4.02 C ATOM 955 OG1 THR A 67 12.137 -4.374 6.557 1.00 41.43 O ATOM 956 CG2 THR A 67 11.715 -2.091 5.881 1.00 33.45 C ATOM 0 H THR A 67 11.004 -5.545 3.365 1.00 74.24 H new ATOM 0 HA THR A 67 9.724 -3.938 5.427 1.00 42.20 H new ATOM 0 HB THR A 67 12.663 -3.597 4.687 1.00 4.02 H new ATOM 0 HG1 THR A 67 12.959 -4.065 6.992 1.00 41.43 H new ATOM 0 HG21 THR A 67 12.640 -1.777 6.364 1.00 33.45 H new ATOM 0 HG22 THR A 67 11.516 -1.448 5.024 1.00 33.45 H new ATOM 0 HG23 THR A 67 10.891 -2.015 6.591 1.00 33.45 H new ATOM 964 N THR A 68 9.245 -2.358 3.573 1.00 45.44 N ATOM 965 CA THR A 68 8.882 -1.466 2.517 1.00 11.12 C ATOM 966 C THR A 68 8.850 -0.038 3.068 1.00 43.43 C ATOM 967 O THR A 68 8.104 0.246 3.999 1.00 64.12 O ATOM 968 CB THR A 68 7.484 -1.830 2.011 1.00 33.44 C ATOM 969 OG1 THR A 68 7.394 -3.242 1.808 1.00 21.33 O ATOM 970 CG2 THR A 68 7.191 -1.131 0.708 1.00 33.01 C ATOM 0 H THR A 68 8.636 -2.305 4.389 1.00 45.44 H new ATOM 0 HA THR A 68 9.603 -1.541 1.703 1.00 11.12 H new ATOM 0 HB THR A 68 6.758 -1.513 2.759 1.00 33.44 H new ATOM 0 HG1 THR A 68 7.087 -3.672 2.633 1.00 21.33 H new ATOM 0 HG21 THR A 68 6.193 -1.403 0.366 1.00 33.01 H new ATOM 0 HG22 THR A 68 7.243 -0.052 0.854 1.00 33.01 H new ATOM 0 HG23 THR A 68 7.925 -1.432 -0.039 1.00 33.01 H new ATOM 978 N THR A 69 9.662 0.834 2.535 1.00 14.15 N ATOM 979 CA THR A 69 9.671 2.205 2.970 1.00 33.33 C ATOM 980 C THR A 69 8.635 3.018 2.182 1.00 70.54 C ATOM 981 O THR A 69 8.485 2.834 0.960 1.00 2.34 O ATOM 982 CB THR A 69 11.085 2.809 2.807 1.00 12.04 C ATOM 983 OG1 THR A 69 11.603 2.466 1.505 1.00 22.30 O ATOM 984 CG2 THR A 69 12.024 2.285 3.886 1.00 21.45 C ATOM 0 H THR A 69 10.330 0.618 1.795 1.00 14.15 H new ATOM 0 HA THR A 69 9.404 2.243 4.026 1.00 33.33 H new ATOM 0 HB THR A 69 11.017 3.892 2.906 1.00 12.04 H new ATOM 0 HG1 THR A 69 12.097 3.229 1.138 1.00 22.30 H new ATOM 0 HG21 THR A 69 13.013 2.723 3.752 1.00 21.45 H new ATOM 0 HG22 THR A 69 11.637 2.556 4.868 1.00 21.45 H new ATOM 0 HG23 THR A 69 12.095 1.200 3.811 1.00 21.45 H new ATOM 992 N ALA A 70 7.900 3.869 2.871 1.00 23.03 N ATOM 993 CA ALA A 70 6.896 4.679 2.239 1.00 50.22 C ATOM 994 C ALA A 70 7.052 6.133 2.633 1.00 21.12 C ATOM 995 O ALA A 70 7.523 6.459 3.747 1.00 43.42 O ATOM 996 CB ALA A 70 5.506 4.177 2.590 1.00 62.42 C ATOM 0 H ALA A 70 7.986 4.013 3.877 1.00 23.03 H new ATOM 0 HA ALA A 70 7.027 4.603 1.160 1.00 50.22 H new ATOM 0 HB1 ALA A 70 4.759 4.803 2.102 1.00 62.42 H new ATOM 0 HB2 ALA A 70 5.394 3.147 2.250 1.00 62.42 H new ATOM 0 HB3 ALA A 70 5.366 4.220 3.670 1.00 62.42 H new ATOM 1002 N GLY A 71 6.699 6.986 1.728 1.00 12.13 N ATOM 1003 CA GLY A 71 6.765 8.391 1.940 1.00 65.35 C ATOM 1004 C GLY A 71 7.104 9.048 0.655 1.00 21.31 C ATOM 1005 O GLY A 71 6.915 8.441 -0.415 1.00 35.44 O ATOM 0 H GLY A 71 6.351 6.720 0.807 1.00 12.13 H new ATOM 0 HA2 GLY A 71 5.811 8.762 2.315 1.00 65.35 H new ATOM 0 HA3 GLY A 71 7.516 8.625 2.694 1.00 65.35 H new ATOM 1009 N ARG A 72 7.570 10.256 0.707 1.00 12.15 N ATOM 1010 CA ARG A 72 7.990 10.892 -0.500 1.00 1.21 C ATOM 1011 C ARG A 72 9.459 11.205 -0.336 1.00 11.14 C ATOM 1012 O ARG A 72 9.823 12.000 0.522 1.00 44.41 O ATOM 1013 CB ARG A 72 7.167 12.180 -0.700 1.00 11.34 C ATOM 1014 CG ARG A 72 7.094 12.726 -2.131 1.00 14.51 C ATOM 1015 CD ARG A 72 8.423 13.164 -2.708 1.00 25.12 C ATOM 1016 NE ARG A 72 8.266 13.603 -4.096 1.00 3.43 N ATOM 1017 CZ ARG A 72 9.254 13.821 -4.955 1.00 23.32 C ATOM 1018 NH1 ARG A 72 10.524 13.738 -4.566 1.00 0.12 N ATOM 1019 NH2 ARG A 72 8.960 14.138 -6.204 1.00 13.41 N ATOM 0 H ARG A 72 7.668 10.813 1.556 1.00 12.15 H new ATOM 0 HA ARG A 72 7.837 10.259 -1.374 1.00 1.21 H new ATOM 0 HB2 ARG A 72 6.151 11.994 -0.353 1.00 11.34 H new ATOM 0 HB3 ARG A 72 7.585 12.956 -0.059 1.00 11.34 H new ATOM 0 HG2 ARG A 72 6.668 11.959 -2.777 1.00 14.51 H new ATOM 0 HG3 ARG A 72 6.409 13.573 -2.148 1.00 14.51 H new ATOM 0 HD2 ARG A 72 8.835 13.976 -2.109 1.00 25.12 H new ATOM 0 HD3 ARG A 72 9.135 12.340 -2.660 1.00 25.12 H new ATOM 0 HE ARG A 72 7.315 13.754 -4.432 1.00 3.43 H new ATOM 0 HH11 ARG A 72 10.747 13.505 -3.598 1.00 0.12 H new ATOM 0 HH12 ARG A 72 11.275 13.908 -5.236 1.00 0.12 H new ATOM 0 HH21 ARG A 72 7.985 14.212 -6.495 1.00 13.41 H new ATOM 0 HH22 ARG A 72 9.708 14.309 -6.876 1.00 13.41 H new ATOM 1033 N HIS A 73 10.261 10.607 -1.187 1.00 35.10 N ATOM 1034 CA HIS A 73 11.719 10.739 -1.237 1.00 51.43 C ATOM 1035 C HIS A 73 12.222 9.691 -2.248 1.00 11.24 C ATOM 1036 O HIS A 73 11.478 8.781 -2.580 1.00 40.31 O ATOM 1037 CB HIS A 73 12.410 10.574 0.184 1.00 21.51 C ATOM 1038 CG HIS A 73 12.173 9.270 0.908 1.00 1.14 C ATOM 1039 ND1 HIS A 73 11.210 9.087 1.863 1.00 0.41 N ATOM 1040 CD2 HIS A 73 12.808 8.095 0.806 1.00 74.11 C ATOM 1041 CE1 HIS A 73 11.280 7.836 2.304 1.00 32.33 C ATOM 1042 NE2 HIS A 73 12.240 7.181 1.687 1.00 74.22 N ATOM 0 H HIS A 73 9.905 9.978 -1.907 1.00 35.10 H new ATOM 0 HA HIS A 73 11.989 11.747 -1.551 1.00 51.43 H new ATOM 0 HB2 HIS A 73 13.485 10.701 0.056 1.00 21.51 H new ATOM 0 HB3 HIS A 73 12.067 11.386 0.825 1.00 21.51 H new ATOM 0 HD1 HIS A 73 10.548 9.794 2.183 1.00 0.41 H new ATOM 0 HD2 HIS A 73 13.634 7.889 0.142 1.00 74.11 H new ATOM 0 HE1 HIS A 73 10.638 7.415 3.064 1.00 32.33 H new ATOM 1050 N PRO A 74 13.455 9.804 -2.774 1.00 53.52 N ATOM 1051 CA PRO A 74 13.969 8.866 -3.805 1.00 61.30 C ATOM 1052 C PRO A 74 14.085 7.402 -3.328 1.00 74.34 C ATOM 1053 O PRO A 74 13.937 6.457 -4.122 1.00 61.32 O ATOM 1054 CB PRO A 74 15.363 9.424 -4.137 1.00 3.42 C ATOM 1055 CG PRO A 74 15.344 10.836 -3.663 1.00 33.23 C ATOM 1056 CD PRO A 74 14.438 10.861 -2.469 1.00 62.13 C ATOM 0 HA PRO A 74 13.285 8.816 -4.652 1.00 61.30 H new ATOM 0 HB2 PRO A 74 16.145 8.852 -3.638 1.00 3.42 H new ATOM 0 HB3 PRO A 74 15.563 9.371 -5.207 1.00 3.42 H new ATOM 0 HG2 PRO A 74 16.347 11.172 -3.399 1.00 33.23 H new ATOM 0 HG3 PRO A 74 14.979 11.504 -4.443 1.00 33.23 H new ATOM 0 HD2 PRO A 74 14.980 10.653 -1.547 1.00 62.13 H new ATOM 0 HD3 PRO A 74 13.960 11.833 -2.346 1.00 62.13 H new ATOM 1064 N GLU A 75 14.300 7.220 -2.044 1.00 33.12 N ATOM 1065 CA GLU A 75 14.549 5.895 -1.486 1.00 50.55 C ATOM 1066 C GLU A 75 13.263 5.177 -1.072 1.00 24.15 C ATOM 1067 O GLU A 75 13.326 4.082 -0.505 1.00 34.22 O ATOM 1068 CB GLU A 75 15.497 5.989 -0.282 1.00 2.43 C ATOM 1069 CG GLU A 75 16.779 6.749 -0.563 1.00 51.15 C ATOM 1070 CD GLU A 75 17.569 6.159 -1.700 1.00 21.22 C ATOM 1071 OE1 GLU A 75 18.375 5.257 -1.469 1.00 44.14 O ATOM 1072 OE2 GLU A 75 17.423 6.620 -2.841 1.00 62.24 O ATOM 0 H GLU A 75 14.309 7.974 -1.357 1.00 33.12 H new ATOM 0 HA GLU A 75 15.013 5.306 -2.278 1.00 50.55 H new ATOM 0 HB2 GLU A 75 14.973 6.473 0.543 1.00 2.43 H new ATOM 0 HB3 GLU A 75 15.749 4.981 0.048 1.00 2.43 H new ATOM 0 HG2 GLU A 75 16.538 7.787 -0.794 1.00 51.15 H new ATOM 0 HG3 GLU A 75 17.395 6.758 0.336 1.00 51.15 H new ATOM 1079 N SER A 76 12.115 5.776 -1.344 1.00 50.34 N ATOM 1080 CA SER A 76 10.851 5.165 -0.986 1.00 73.44 C ATOM 1081 C SER A 76 10.634 3.917 -1.833 1.00 11.32 C ATOM 1082 O SER A 76 10.594 4.009 -3.066 1.00 41.31 O ATOM 1083 CB SER A 76 9.717 6.162 -1.219 1.00 33.41 C ATOM 1084 OG SER A 76 9.964 7.367 -0.527 1.00 5.12 O ATOM 0 H SER A 76 12.035 6.680 -1.809 1.00 50.34 H new ATOM 0 HA SER A 76 10.864 4.884 0.067 1.00 73.44 H new ATOM 0 HB2 SER A 76 9.616 6.363 -2.286 1.00 33.41 H new ATOM 0 HB3 SER A 76 8.773 5.732 -0.885 1.00 33.41 H new ATOM 0 HG SER A 76 10.482 7.972 -1.098 1.00 5.12 H new ATOM 1090 N ASP A 77 10.555 2.751 -1.184 1.00 3.20 N ATOM 1091 CA ASP A 77 10.322 1.490 -1.895 1.00 63.41 C ATOM 1092 C ASP A 77 8.992 1.595 -2.625 1.00 33.41 C ATOM 1093 O ASP A 77 8.849 1.157 -3.771 1.00 33.32 O ATOM 1094 CB ASP A 77 10.323 0.293 -0.933 1.00 64.13 C ATOM 1095 CG ASP A 77 10.423 -1.040 -1.660 1.00 72.24 C ATOM 1096 OD1 ASP A 77 11.547 -1.415 -2.069 1.00 52.42 O ATOM 1097 OD2 ASP A 77 9.401 -1.740 -1.823 1.00 21.24 O ATOM 0 H ASP A 77 10.648 2.654 -0.173 1.00 3.20 H new ATOM 0 HA ASP A 77 11.129 1.321 -2.608 1.00 63.41 H new ATOM 0 HB2 ASP A 77 11.159 0.389 -0.240 1.00 64.13 H new ATOM 0 HB3 ASP A 77 9.411 0.310 -0.336 1.00 64.13 H new ATOM 1102 N ILE A 78 8.035 2.216 -1.959 1.00 24.22 N ATOM 1103 CA ILE A 78 6.787 2.594 -2.572 1.00 24.23 C ATOM 1104 C ILE A 78 6.777 4.107 -2.611 1.00 2.42 C ATOM 1105 O ILE A 78 6.735 4.763 -1.568 1.00 45.51 O ATOM 1106 CB ILE A 78 5.531 2.074 -1.804 1.00 23.35 C ATOM 1107 CG1 ILE A 78 5.533 0.542 -1.720 1.00 62.22 C ATOM 1108 CG2 ILE A 78 4.237 2.569 -2.460 1.00 55.52 C ATOM 1109 CD1 ILE A 78 5.594 -0.174 -3.055 1.00 51.24 C ATOM 0 H ILE A 78 8.108 2.471 -0.974 1.00 24.22 H new ATOM 0 HA ILE A 78 6.726 2.145 -3.563 1.00 24.23 H new ATOM 0 HB ILE A 78 5.576 2.475 -0.791 1.00 23.35 H new ATOM 0 HG12 ILE A 78 6.385 0.228 -1.117 1.00 62.22 H new ATOM 0 HG13 ILE A 78 4.634 0.221 -1.194 1.00 62.22 H new ATOM 0 HG21 ILE A 78 3.379 2.191 -1.904 1.00 55.52 H new ATOM 0 HG22 ILE A 78 4.221 3.659 -2.456 1.00 55.52 H new ATOM 0 HG23 ILE A 78 4.190 2.209 -3.488 1.00 55.52 H new ATOM 0 HD11 ILE A 78 5.591 -1.252 -2.890 1.00 51.24 H new ATOM 0 HD12 ILE A 78 4.729 0.104 -3.657 1.00 51.24 H new ATOM 0 HD13 ILE A 78 6.507 0.110 -3.579 1.00 51.24 H new ATOM 1121 N PHE A 79 6.884 4.647 -3.788 1.00 31.15 N ATOM 1122 CA PHE A 79 6.969 6.070 -3.961 1.00 25.32 C ATOM 1123 C PHE A 79 5.594 6.665 -4.204 1.00 1.00 C ATOM 1124 O PHE A 79 4.834 6.173 -5.028 1.00 53.34 O ATOM 1125 CB PHE A 79 7.926 6.398 -5.122 1.00 24.51 C ATOM 1126 CG PHE A 79 8.103 7.867 -5.396 1.00 11.42 C ATOM 1127 CD1 PHE A 79 8.927 8.640 -4.598 1.00 43.11 C ATOM 1128 CD2 PHE A 79 7.441 8.473 -6.454 1.00 33.24 C ATOM 1129 CE1 PHE A 79 9.091 9.984 -4.847 1.00 75.32 C ATOM 1130 CE2 PHE A 79 7.602 9.818 -6.706 1.00 11.32 C ATOM 1131 CZ PHE A 79 8.427 10.574 -5.903 1.00 44.01 C ATOM 0 H PHE A 79 6.915 4.115 -4.658 1.00 31.15 H new ATOM 0 HA PHE A 79 7.365 6.514 -3.048 1.00 25.32 H new ATOM 0 HB2 PHE A 79 8.901 5.963 -4.905 1.00 24.51 H new ATOM 0 HB3 PHE A 79 7.556 5.916 -6.027 1.00 24.51 H new ATOM 0 HD1 PHE A 79 9.448 8.184 -3.769 1.00 43.11 H new ATOM 0 HD2 PHE A 79 6.793 7.885 -7.086 1.00 33.24 H new ATOM 0 HE1 PHE A 79 9.738 10.576 -4.217 1.00 75.32 H new ATOM 0 HE2 PHE A 79 7.082 10.279 -7.533 1.00 11.32 H new ATOM 0 HZ PHE A 79 8.554 11.628 -6.100 1.00 44.01 H new ATOM 1141 N LEU A 80 5.281 7.684 -3.448 1.00 12.15 N ATOM 1142 CA LEU A 80 4.054 8.440 -3.593 1.00 4.30 C ATOM 1143 C LEU A 80 4.491 9.877 -3.775 1.00 60.44 C ATOM 1144 O LEU A 80 5.331 10.349 -3.011 1.00 24.34 O ATOM 1145 CB LEU A 80 3.190 8.385 -2.292 1.00 70.23 C ATOM 1146 CG LEU A 80 2.771 7.015 -1.695 1.00 55.20 C ATOM 1147 CD1 LEU A 80 2.174 6.079 -2.727 1.00 71.02 C ATOM 1148 CD2 LEU A 80 3.896 6.352 -0.905 1.00 51.23 C ATOM 0 H LEU A 80 5.882 8.023 -2.696 1.00 12.15 H new ATOM 0 HA LEU A 80 3.462 8.042 -4.417 1.00 4.30 H new ATOM 0 HB2 LEU A 80 3.737 8.923 -1.517 1.00 70.23 H new ATOM 0 HB3 LEU A 80 2.276 8.947 -2.486 1.00 70.23 H new ATOM 0 HG LEU A 80 1.975 7.235 -0.984 1.00 55.20 H new ATOM 0 HD11 LEU A 80 1.901 5.138 -2.250 1.00 71.02 H new ATOM 0 HD12 LEU A 80 1.286 6.536 -3.162 1.00 71.02 H new ATOM 0 HD13 LEU A 80 2.906 5.889 -3.512 1.00 71.02 H new ATOM 0 HD21 LEU A 80 3.549 5.397 -0.510 1.00 51.23 H new ATOM 0 HD22 LEU A 80 4.751 6.184 -1.560 1.00 51.23 H new ATOM 0 HD23 LEU A 80 4.192 7.000 -0.080 1.00 51.23 H new ATOM 1160 N ASP A 81 4.000 10.559 -4.774 1.00 54.52 N ATOM 1161 CA ASP A 81 4.364 11.965 -4.936 1.00 41.43 C ATOM 1162 C ASP A 81 3.242 12.846 -4.431 1.00 12.53 C ATOM 1163 O ASP A 81 2.135 12.836 -4.980 1.00 51.31 O ATOM 1164 CB ASP A 81 4.696 12.299 -6.404 1.00 14.04 C ATOM 1165 CG ASP A 81 5.082 13.763 -6.617 1.00 35.44 C ATOM 1166 OD1 ASP A 81 6.216 14.163 -6.241 1.00 13.30 O ATOM 1167 OD2 ASP A 81 4.285 14.533 -7.197 1.00 12.45 O ATOM 0 H ASP A 81 3.362 10.188 -5.478 1.00 54.52 H new ATOM 0 HA ASP A 81 5.262 12.154 -4.348 1.00 41.43 H new ATOM 0 HB2 ASP A 81 5.515 11.662 -6.738 1.00 14.04 H new ATOM 0 HB3 ASP A 81 3.834 12.063 -7.027 1.00 14.04 H new ATOM 1172 N ASP A 82 3.523 13.611 -3.405 1.00 51.23 N ATOM 1173 CA ASP A 82 2.529 14.482 -2.804 1.00 1.33 C ATOM 1174 C ASP A 82 3.119 15.900 -2.779 1.00 73.30 C ATOM 1175 O ASP A 82 4.064 16.174 -3.510 1.00 74.24 O ATOM 1176 CB ASP A 82 2.153 13.978 -1.375 1.00 2.22 C ATOM 1177 CG ASP A 82 0.825 14.553 -0.853 1.00 61.35 C ATOM 1178 OD1 ASP A 82 0.808 15.692 -0.347 1.00 32.31 O ATOM 1179 OD2 ASP A 82 -0.229 13.895 -0.984 1.00 53.42 O ATOM 0 H ASP A 82 4.440 13.652 -2.961 1.00 51.23 H new ATOM 0 HA ASP A 82 1.605 14.482 -3.382 1.00 1.33 H new ATOM 0 HB2 ASP A 82 2.089 12.890 -1.387 1.00 2.22 H new ATOM 0 HB3 ASP A 82 2.952 14.243 -0.683 1.00 2.22 H new ATOM 1184 N VAL A 83 2.599 16.763 -1.950 1.00 53.55 N ATOM 1185 CA VAL A 83 2.989 18.167 -1.912 1.00 15.33 C ATOM 1186 C VAL A 83 4.349 18.389 -1.207 1.00 33.41 C ATOM 1187 O VAL A 83 5.071 19.347 -1.510 1.00 51.45 O ATOM 1188 CB VAL A 83 1.876 19.015 -1.207 1.00 1.52 C ATOM 1189 CG1 VAL A 83 2.220 20.499 -1.172 1.00 2.12 C ATOM 1190 CG2 VAL A 83 0.531 18.803 -1.888 1.00 55.14 C ATOM 0 H VAL A 83 1.881 16.519 -1.268 1.00 53.55 H new ATOM 0 HA VAL A 83 3.106 18.494 -2.945 1.00 15.33 H new ATOM 0 HB VAL A 83 1.814 18.669 -0.175 1.00 1.52 H new ATOM 0 HG11 VAL A 83 1.420 21.046 -0.674 1.00 2.12 H new ATOM 0 HG12 VAL A 83 3.152 20.644 -0.626 1.00 2.12 H new ATOM 0 HG13 VAL A 83 2.334 20.870 -2.190 1.00 2.12 H new ATOM 0 HG21 VAL A 83 -0.230 19.400 -1.385 1.00 55.14 H new ATOM 0 HG22 VAL A 83 0.600 19.108 -2.932 1.00 55.14 H new ATOM 0 HG23 VAL A 83 0.259 17.749 -1.835 1.00 55.14 H new ATOM 1200 N THR A 84 4.712 17.529 -0.285 1.00 64.44 N ATOM 1201 CA THR A 84 5.931 17.745 0.475 1.00 31.40 C ATOM 1202 C THR A 84 6.717 16.425 0.693 1.00 42.13 C ATOM 1203 O THR A 84 6.123 15.331 0.755 1.00 51.33 O ATOM 1204 CB THR A 84 5.579 18.432 1.828 1.00 63.14 C ATOM 1205 OG1 THR A 84 4.787 19.606 1.556 1.00 21.32 O ATOM 1206 CG2 THR A 84 6.827 18.858 2.596 1.00 50.15 C ATOM 0 H THR A 84 4.194 16.685 -0.042 1.00 64.44 H new ATOM 0 HA THR A 84 6.588 18.401 -0.096 1.00 31.40 H new ATOM 0 HB THR A 84 5.034 17.713 2.439 1.00 63.14 H new ATOM 0 HG1 THR A 84 4.557 20.048 2.400 1.00 21.32 H new ATOM 0 HG21 THR A 84 6.534 19.332 3.533 1.00 50.15 H new ATOM 0 HG22 THR A 84 7.440 17.982 2.809 1.00 50.15 H new ATOM 0 HG23 THR A 84 7.400 19.564 1.996 1.00 50.15 H new ATOM 1214 N VAL A 85 8.043 16.548 0.767 1.00 43.31 N ATOM 1215 CA VAL A 85 8.958 15.438 0.989 1.00 23.42 C ATOM 1216 C VAL A 85 8.899 14.987 2.459 1.00 41.23 C ATOM 1217 O VAL A 85 8.608 15.784 3.356 1.00 64.50 O ATOM 1218 CB VAL A 85 10.432 15.849 0.606 1.00 52.41 C ATOM 1219 CG1 VAL A 85 11.442 14.737 0.869 1.00 5.32 C ATOM 1220 CG2 VAL A 85 10.509 16.256 -0.849 1.00 73.30 C ATOM 0 H VAL A 85 8.518 17.446 0.671 1.00 43.31 H new ATOM 0 HA VAL A 85 8.654 14.608 0.352 1.00 23.42 H new ATOM 0 HB VAL A 85 10.691 16.693 1.246 1.00 52.41 H new ATOM 0 HG11 VAL A 85 12.439 15.076 0.587 1.00 5.32 H new ATOM 0 HG12 VAL A 85 11.433 14.480 1.928 1.00 5.32 H new ATOM 0 HG13 VAL A 85 11.178 13.859 0.280 1.00 5.32 H new ATOM 0 HG21 VAL A 85 11.533 16.536 -1.095 1.00 73.30 H new ATOM 0 HG22 VAL A 85 10.201 15.420 -1.477 1.00 73.30 H new ATOM 0 HG23 VAL A 85 9.849 17.105 -1.025 1.00 73.30 H new ATOM 1230 N SER A 86 9.123 13.718 2.672 1.00 72.35 N ATOM 1231 CA SER A 86 9.160 13.117 3.976 1.00 42.34 C ATOM 1232 C SER A 86 10.247 12.072 3.982 1.00 53.14 C ATOM 1233 O SER A 86 10.137 11.087 3.259 1.00 15.21 O ATOM 1234 CB SER A 86 7.804 12.487 4.284 1.00 21.45 C ATOM 1235 OG SER A 86 7.177 12.039 3.076 1.00 74.25 O ATOM 0 H SER A 86 9.290 13.053 1.917 1.00 72.35 H new ATOM 0 HA SER A 86 9.370 13.865 4.740 1.00 42.34 H new ATOM 0 HB2 SER A 86 7.932 11.648 4.968 1.00 21.45 H new ATOM 0 HB3 SER A 86 7.164 13.213 4.786 1.00 21.45 H new ATOM 0 HG SER A 86 6.309 11.636 3.288 1.00 74.25 H new ATOM 1241 N ARG A 87 11.303 12.296 4.763 1.00 24.14 N ATOM 1242 CA ARG A 87 12.449 11.371 4.812 1.00 63.34 C ATOM 1243 C ARG A 87 12.053 9.944 5.183 1.00 30.20 C ATOM 1244 O ARG A 87 12.760 9.001 4.835 1.00 23.33 O ATOM 1245 CB ARG A 87 13.557 11.857 5.764 1.00 1.31 C ATOM 1246 CG ARG A 87 13.188 11.892 7.241 1.00 12.31 C ATOM 1247 CD ARG A 87 14.417 12.201 8.069 1.00 30.01 C ATOM 1248 NE ARG A 87 14.187 12.190 9.510 1.00 62.31 N ATOM 1249 CZ ARG A 87 15.109 11.841 10.427 1.00 73.33 C ATOM 1250 NH1 ARG A 87 16.318 11.421 10.041 1.00 71.20 N ATOM 1251 NH2 ARG A 87 14.815 11.893 11.719 1.00 30.41 N ATOM 0 H ARG A 87 11.395 13.108 5.373 1.00 24.14 H new ATOM 0 HA ARG A 87 12.839 11.360 3.794 1.00 63.34 H new ATOM 0 HB2 ARG A 87 14.426 11.211 5.640 1.00 1.31 H new ATOM 0 HB3 ARG A 87 13.859 12.859 5.460 1.00 1.31 H new ATOM 0 HG2 ARG A 87 12.421 12.647 7.416 1.00 12.31 H new ATOM 0 HG3 ARG A 87 12.766 10.933 7.543 1.00 12.31 H new ATOM 0 HD2 ARG A 87 15.194 11.474 7.831 1.00 30.01 H new ATOM 0 HD3 ARG A 87 14.798 13.181 7.781 1.00 30.01 H new ATOM 0 HE ARG A 87 13.264 12.466 9.846 1.00 62.31 H new ATOM 0 HH11 ARG A 87 16.545 11.364 9.048 1.00 71.20 H new ATOM 0 HH12 ARG A 87 17.013 11.158 10.739 1.00 71.20 H new ATOM 0 HH21 ARG A 87 13.889 12.198 12.019 1.00 30.41 H new ATOM 0 HH22 ARG A 87 15.515 11.628 12.412 1.00 30.41 H new ATOM 1265 N ARG A 88 10.940 9.795 5.891 1.00 20.21 N ATOM 1266 CA ARG A 88 10.449 8.503 6.295 1.00 4.02 C ATOM 1267 C ARG A 88 9.070 8.718 6.931 1.00 63.23 C ATOM 1268 O ARG A 88 8.976 9.169 8.062 1.00 44.54 O ATOM 1269 CB ARG A 88 11.455 7.891 7.296 1.00 1.03 C ATOM 1270 CG ARG A 88 11.400 6.385 7.491 1.00 12.51 C ATOM 1271 CD ARG A 88 12.572 5.964 8.375 1.00 35.31 C ATOM 1272 NE ARG A 88 12.612 4.529 8.692 1.00 40.00 N ATOM 1273 CZ ARG A 88 13.734 3.818 8.920 1.00 51.41 C ATOM 1274 NH1 ARG A 88 14.940 4.394 8.840 1.00 63.23 N ATOM 1275 NH2 ARG A 88 13.630 2.551 9.261 1.00 44.51 N ATOM 0 H ARG A 88 10.358 10.575 6.197 1.00 20.21 H new ATOM 0 HA ARG A 88 10.349 7.815 5.456 1.00 4.02 H new ATOM 0 HB2 ARG A 88 12.461 8.154 6.970 1.00 1.03 H new ATOM 0 HB3 ARG A 88 11.300 8.365 8.265 1.00 1.03 H new ATOM 0 HG2 ARG A 88 10.456 6.098 7.953 1.00 12.51 H new ATOM 0 HG3 ARG A 88 11.451 5.877 6.528 1.00 12.51 H new ATOM 0 HD2 ARG A 88 13.502 6.240 7.879 1.00 35.31 H new ATOM 0 HD3 ARG A 88 12.529 6.528 9.307 1.00 35.31 H new ATOM 0 HE ARG A 88 11.722 4.033 8.743 1.00 40.00 H new ATOM 0 HH11 ARG A 88 15.018 5.383 8.604 1.00 63.23 H new ATOM 0 HH12 ARG A 88 15.781 3.844 9.015 1.00 63.23 H new ATOM 0 HH21 ARG A 88 12.710 2.121 9.349 1.00 44.51 H new ATOM 0 HH22 ARG A 88 14.470 2.000 9.437 1.00 44.51 H new ATOM 1289 N HIS A 89 8.016 8.482 6.158 1.00 5.34 N ATOM 1290 CA HIS A 89 6.634 8.696 6.625 1.00 71.33 C ATOM 1291 C HIS A 89 6.153 7.468 7.383 1.00 4.14 C ATOM 1292 O HIS A 89 5.757 7.546 8.558 1.00 72.34 O ATOM 1293 CB HIS A 89 5.726 9.013 5.389 1.00 12.33 C ATOM 1294 CG HIS A 89 4.206 9.011 5.588 1.00 20.14 C ATOM 1295 ND1 HIS A 89 3.470 7.913 5.227 1.00 51.24 N ATOM 1296 CD2 HIS A 89 3.345 10.000 6.000 1.00 32.34 C ATOM 1297 CE1 HIS A 89 2.203 8.233 5.409 1.00 72.44 C ATOM 1298 NE2 HIS A 89 2.063 9.481 5.868 1.00 32.54 N ATOM 0 H HIS A 89 8.084 8.141 5.199 1.00 5.34 H new ATOM 0 HA HIS A 89 6.587 9.542 7.311 1.00 71.33 H new ATOM 0 HB2 HIS A 89 6.011 9.994 5.009 1.00 12.33 H new ATOM 0 HB3 HIS A 89 5.961 8.289 4.609 1.00 12.33 H new ATOM 0 HD2 HIS A 89 3.612 10.984 6.355 1.00 32.34 H new ATOM 0 HE1 HIS A 89 1.377 7.566 5.211 1.00 72.44 H new ATOM 0 HE2 HIS A 89 1.187 9.958 6.080 1.00 32.54 H new ATOM 1306 N ALA A 90 6.282 6.340 6.755 1.00 23.01 N ATOM 1307 CA ALA A 90 5.866 5.105 7.333 1.00 53.42 C ATOM 1308 C ALA A 90 6.654 3.994 6.713 1.00 33.11 C ATOM 1309 O ALA A 90 7.263 4.169 5.645 1.00 62.50 O ATOM 1310 CB ALA A 90 4.370 4.883 7.108 1.00 45.53 C ATOM 0 H ALA A 90 6.682 6.253 5.821 1.00 23.01 H new ATOM 0 HA ALA A 90 6.044 5.129 8.408 1.00 53.42 H new ATOM 0 HB1 ALA A 90 4.071 3.935 7.556 1.00 45.53 H new ATOM 0 HB2 ALA A 90 3.808 5.695 7.569 1.00 45.53 H new ATOM 0 HB3 ALA A 90 4.162 4.860 6.038 1.00 45.53 H new ATOM 1316 N GLU A 91 6.693 2.893 7.369 1.00 21.53 N ATOM 1317 CA GLU A 91 7.341 1.740 6.846 1.00 54.43 C ATOM 1318 C GLU A 91 6.486 0.526 7.093 1.00 10.01 C ATOM 1319 O GLU A 91 5.788 0.431 8.112 1.00 4.33 O ATOM 1320 CB GLU A 91 8.773 1.574 7.407 1.00 43.53 C ATOM 1321 CG GLU A 91 8.876 1.459 8.923 1.00 50.30 C ATOM 1322 CD GLU A 91 10.311 1.370 9.393 1.00 51.53 C ATOM 1323 OE1 GLU A 91 10.941 2.422 9.612 1.00 23.50 O ATOM 1324 OE2 GLU A 91 10.844 0.244 9.555 1.00 24.21 O ATOM 0 H GLU A 91 6.275 2.762 8.290 1.00 21.53 H new ATOM 0 HA GLU A 91 7.459 1.864 5.770 1.00 54.43 H new ATOM 0 HB2 GLU A 91 9.218 0.684 6.962 1.00 43.53 H new ATOM 0 HB3 GLU A 91 9.372 2.425 7.083 1.00 43.53 H new ATOM 0 HG2 GLU A 91 8.397 2.323 9.385 1.00 50.30 H new ATOM 0 HG3 GLU A 91 8.331 0.576 9.257 1.00 50.30 H new ATOM 1331 N PHE A 92 6.502 -0.366 6.162 1.00 22.21 N ATOM 1332 CA PHE A 92 5.766 -1.587 6.268 1.00 31.01 C ATOM 1333 C PHE A 92 6.760 -2.651 6.569 1.00 42.21 C ATOM 1334 O PHE A 92 7.759 -2.790 5.863 1.00 62.22 O ATOM 1335 CB PHE A 92 5.050 -1.946 4.959 1.00 20.14 C ATOM 1336 CG PHE A 92 4.062 -0.927 4.456 1.00 10.41 C ATOM 1337 CD1 PHE A 92 4.468 0.126 3.649 1.00 54.34 C ATOM 1338 CD2 PHE A 92 2.727 -1.039 4.777 1.00 73.32 C ATOM 1339 CE1 PHE A 92 3.550 1.047 3.182 1.00 54.33 C ATOM 1340 CE2 PHE A 92 1.808 -0.123 4.312 1.00 73.30 C ATOM 1341 CZ PHE A 92 2.220 0.919 3.514 1.00 23.44 C ATOM 0 H PHE A 92 7.031 -0.270 5.295 1.00 22.21 H new ATOM 0 HA PHE A 92 5.003 -1.485 7.040 1.00 31.01 H new ATOM 0 HB2 PHE A 92 5.802 -2.108 4.187 1.00 20.14 H new ATOM 0 HB3 PHE A 92 4.528 -2.893 5.099 1.00 20.14 H new ATOM 0 HD1 PHE A 92 5.510 0.227 3.384 1.00 54.34 H new ATOM 0 HD2 PHE A 92 2.396 -1.856 5.401 1.00 73.32 H new ATOM 0 HE1 PHE A 92 3.875 1.866 2.558 1.00 54.33 H new ATOM 0 HE2 PHE A 92 0.765 -0.223 4.574 1.00 73.30 H new ATOM 0 HZ PHE A 92 1.500 1.636 3.148 1.00 23.44 H new ATOM 1351 N ARG A 93 6.536 -3.356 7.610 1.00 52.05 N ATOM 1352 CA ARG A 93 7.440 -4.378 8.018 1.00 30.12 C ATOM 1353 C ARG A 93 6.719 -5.687 7.853 1.00 73.44 C ATOM 1354 O ARG A 93 5.647 -5.892 8.442 1.00 71.51 O ATOM 1355 CB ARG A 93 7.820 -4.172 9.484 1.00 64.42 C ATOM 1356 CG ARG A 93 8.215 -2.740 9.822 1.00 23.14 C ATOM 1357 CD ARG A 93 8.416 -2.548 11.312 1.00 24.22 C ATOM 1358 NE ARG A 93 9.584 -3.261 11.831 1.00 44.23 N ATOM 1359 CZ ARG A 93 9.619 -3.936 12.987 1.00 15.53 C ATOM 1360 NH1 ARG A 93 8.489 -4.245 13.633 1.00 14.22 N ATOM 1361 NH2 ARG A 93 10.774 -4.347 13.475 1.00 14.10 N ATOM 0 H ARG A 93 5.719 -3.246 8.211 1.00 52.05 H new ATOM 0 HA ARG A 93 8.354 -4.359 7.424 1.00 30.12 H new ATOM 0 HB2 ARG A 93 6.979 -4.465 10.112 1.00 64.42 H new ATOM 0 HB3 ARG A 93 8.649 -4.836 9.731 1.00 64.42 H new ATOM 0 HG2 ARG A 93 9.134 -2.482 9.295 1.00 23.14 H new ATOM 0 HG3 ARG A 93 7.443 -2.057 9.468 1.00 23.14 H new ATOM 0 HD2 ARG A 93 8.524 -1.484 11.524 1.00 24.22 H new ATOM 0 HD3 ARG A 93 7.525 -2.890 11.840 1.00 24.22 H new ATOM 0 HE ARG A 93 10.436 -3.242 11.270 1.00 44.23 H new ATOM 0 HH11 ARG A 93 7.588 -3.966 13.246 1.00 14.22 H new ATOM 0 HH12 ARG A 93 8.529 -4.760 14.513 1.00 14.22 H new ATOM 0 HH21 ARG A 93 11.639 -4.150 12.972 1.00 14.10 H new ATOM 0 HH22 ARG A 93 10.802 -4.861 14.355 1.00 14.10 H new ATOM 1375 N ILE A 94 7.235 -6.535 7.036 1.00 22.34 N ATOM 1376 CA ILE A 94 6.625 -7.800 6.842 1.00 51.22 C ATOM 1377 C ILE A 94 7.587 -8.820 7.359 1.00 34.02 C ATOM 1378 O ILE A 94 8.668 -9.015 6.800 1.00 70.34 O ATOM 1379 CB ILE A 94 6.278 -8.122 5.344 1.00 21.43 C ATOM 1380 CG1 ILE A 94 5.378 -7.044 4.686 1.00 51.31 C ATOM 1381 CG2 ILE A 94 5.586 -9.481 5.251 1.00 3.25 C ATOM 1382 CD1 ILE A 94 6.067 -5.740 4.315 1.00 41.02 C ATOM 0 H ILE A 94 8.081 -6.374 6.490 1.00 22.34 H new ATOM 0 HA ILE A 94 5.671 -7.805 7.369 1.00 51.22 H new ATOM 0 HB ILE A 94 7.222 -8.134 4.800 1.00 21.43 H new ATOM 0 HG12 ILE A 94 4.936 -7.468 3.784 1.00 51.31 H new ATOM 0 HG13 ILE A 94 4.558 -6.818 5.367 1.00 51.31 H new ATOM 0 HG21 ILE A 94 5.348 -9.698 4.210 1.00 3.25 H new ATOM 0 HG22 ILE A 94 6.248 -10.254 5.640 1.00 3.25 H new ATOM 0 HG23 ILE A 94 4.667 -9.462 5.837 1.00 3.25 H new ATOM 0 HD11 ILE A 94 5.343 -5.062 3.863 1.00 41.02 H new ATOM 0 HD12 ILE A 94 6.484 -5.281 5.211 1.00 41.02 H new ATOM 0 HD13 ILE A 94 6.868 -5.941 3.604 1.00 41.02 H new ATOM 1394 N ASN A 95 7.229 -9.453 8.419 1.00 14.11 N ATOM 1395 CA ASN A 95 8.093 -10.409 9.040 1.00 65.34 C ATOM 1396 C ASN A 95 7.273 -11.612 9.381 1.00 21.01 C ATOM 1397 O ASN A 95 6.195 -11.473 9.966 1.00 63.42 O ATOM 1398 CB ASN A 95 8.733 -9.859 10.347 1.00 53.14 C ATOM 1399 CG ASN A 95 9.549 -8.554 10.234 1.00 51.32 C ATOM 1400 OD1 ASN A 95 9.601 -7.776 11.195 1.00 21.23 O ATOM 1401 ND2 ASN A 95 10.178 -8.294 9.109 1.00 62.33 N ATOM 0 H ASN A 95 6.330 -9.327 8.885 1.00 14.11 H new ATOM 0 HA ASN A 95 8.901 -10.646 8.348 1.00 65.34 H new ATOM 0 HB2 ASN A 95 7.936 -9.698 11.072 1.00 53.14 H new ATOM 0 HB3 ASN A 95 9.385 -10.631 10.756 1.00 53.14 H new ATOM 0 HD21 ASN A 95 10.723 -7.437 9.016 1.00 62.33 H new ATOM 0 HD22 ASN A 95 10.121 -8.950 8.330 1.00 62.33 H new ATOM 1408 N GLU A 96 7.744 -12.774 8.975 1.00 61.13 N ATOM 1409 CA GLU A 96 7.111 -14.063 9.275 1.00 32.42 C ATOM 1410 C GLU A 96 5.633 -14.104 8.819 1.00 4.44 C ATOM 1411 O GLU A 96 4.767 -14.690 9.494 1.00 60.11 O ATOM 1412 CB GLU A 96 7.248 -14.370 10.778 1.00 54.31 C ATOM 1413 CG GLU A 96 8.697 -14.378 11.259 1.00 42.31 C ATOM 1414 CD GLU A 96 8.841 -14.790 12.696 1.00 4.23 C ATOM 1415 OE1 GLU A 96 8.686 -13.943 13.605 1.00 10.22 O ATOM 1416 OE2 GLU A 96 9.141 -15.961 12.954 1.00 11.24 O ATOM 0 H GLU A 96 8.593 -12.861 8.416 1.00 61.13 H new ATOM 0 HA GLU A 96 7.627 -14.838 8.709 1.00 32.42 H new ATOM 0 HB2 GLU A 96 6.687 -13.628 11.347 1.00 54.31 H new ATOM 0 HB3 GLU A 96 6.797 -15.340 10.987 1.00 54.31 H new ATOM 0 HG2 GLU A 96 9.277 -15.056 10.633 1.00 42.31 H new ATOM 0 HG3 GLU A 96 9.122 -13.383 11.129 1.00 42.31 H new ATOM 1423 N GLY A 97 5.362 -13.495 7.675 1.00 12.11 N ATOM 1424 CA GLY A 97 4.021 -13.503 7.110 1.00 40.41 C ATOM 1425 C GLY A 97 3.099 -12.451 7.699 1.00 33.13 C ATOM 1426 O GLY A 97 1.916 -12.383 7.339 1.00 52.52 O ATOM 0 H GLY A 97 6.052 -12.989 7.120 1.00 12.11 H new ATOM 0 HA2 GLY A 97 4.090 -13.349 6.033 1.00 40.41 H new ATOM 0 HA3 GLY A 97 3.578 -14.487 7.264 1.00 40.41 H new ATOM 1430 N GLU A 98 3.616 -11.652 8.610 1.00 13.00 N ATOM 1431 CA GLU A 98 2.845 -10.611 9.224 1.00 15.40 C ATOM 1432 C GLU A 98 3.201 -9.285 8.611 1.00 30.42 C ATOM 1433 O GLU A 98 4.375 -8.942 8.485 1.00 55.14 O ATOM 1434 CB GLU A 98 3.160 -10.577 10.690 1.00 50.53 C ATOM 1435 CG GLU A 98 2.875 -11.879 11.373 1.00 22.21 C ATOM 1436 CD GLU A 98 1.416 -12.191 11.408 1.00 65.24 C ATOM 1437 OE1 GLU A 98 0.706 -11.653 12.278 1.00 41.13 O ATOM 1438 OE2 GLU A 98 0.941 -12.977 10.571 1.00 30.42 O ATOM 0 H GLU A 98 4.580 -11.712 8.939 1.00 13.00 H new ATOM 0 HA GLU A 98 1.783 -10.803 9.071 1.00 15.40 H new ATOM 0 HB2 GLU A 98 4.211 -10.323 10.826 1.00 50.53 H new ATOM 0 HB3 GLU A 98 2.577 -9.787 11.164 1.00 50.53 H new ATOM 0 HG2 GLU A 98 3.404 -12.681 10.858 1.00 22.21 H new ATOM 0 HG3 GLU A 98 3.262 -11.845 12.391 1.00 22.21 H new ATOM 1445 N PHE A 99 2.203 -8.551 8.254 1.00 54.43 N ATOM 1446 CA PHE A 99 2.364 -7.278 7.619 1.00 44.23 C ATOM 1447 C PHE A 99 1.992 -6.217 8.639 1.00 54.33 C ATOM 1448 O PHE A 99 0.872 -6.205 9.120 1.00 72.44 O ATOM 1449 CB PHE A 99 1.389 -7.165 6.429 1.00 30.14 C ATOM 1450 CG PHE A 99 1.400 -8.328 5.460 1.00 50.42 C ATOM 1451 CD1 PHE A 99 0.593 -9.440 5.679 1.00 24.22 C ATOM 1452 CD2 PHE A 99 2.195 -8.303 4.330 1.00 55.32 C ATOM 1453 CE1 PHE A 99 0.588 -10.498 4.794 1.00 64.44 C ATOM 1454 CE2 PHE A 99 2.196 -9.361 3.441 1.00 5.12 C ATOM 1455 CZ PHE A 99 1.391 -10.458 3.673 1.00 51.54 C ATOM 0 H PHE A 99 1.230 -8.821 8.396 1.00 54.43 H new ATOM 0 HA PHE A 99 3.387 -7.157 7.263 1.00 44.23 H new ATOM 0 HB2 PHE A 99 0.378 -7.051 6.821 1.00 30.14 H new ATOM 0 HB3 PHE A 99 1.621 -6.254 5.878 1.00 30.14 H new ATOM 0 HD1 PHE A 99 -0.039 -9.475 6.554 1.00 24.22 H new ATOM 0 HD2 PHE A 99 2.824 -7.446 4.139 1.00 55.32 H new ATOM 0 HE1 PHE A 99 -0.043 -11.355 4.978 1.00 64.44 H new ATOM 0 HE2 PHE A 99 2.827 -9.330 2.565 1.00 5.12 H new ATOM 0 HZ PHE A 99 1.390 -11.284 2.978 1.00 51.54 H new ATOM 1465 N GLU A 100 2.900 -5.363 8.995 1.00 24.24 N ATOM 1466 CA GLU A 100 2.583 -4.312 9.942 1.00 3.42 C ATOM 1467 C GLU A 100 2.993 -2.963 9.387 1.00 3.14 C ATOM 1468 O GLU A 100 4.012 -2.851 8.694 1.00 52.33 O ATOM 1469 CB GLU A 100 3.237 -4.580 11.307 1.00 15.24 C ATOM 1470 CG GLU A 100 4.748 -4.669 11.261 1.00 22.32 C ATOM 1471 CD GLU A 100 5.357 -5.039 12.576 1.00 34.40 C ATOM 1472 OE1 GLU A 100 5.470 -6.249 12.871 1.00 44.20 O ATOM 1473 OE2 GLU A 100 5.752 -4.134 13.344 1.00 42.32 O ATOM 0 H GLU A 100 3.861 -5.362 8.654 1.00 24.24 H new ATOM 0 HA GLU A 100 1.504 -4.301 10.097 1.00 3.42 H new ATOM 0 HB2 GLU A 100 2.951 -3.786 11.997 1.00 15.24 H new ATOM 0 HB3 GLU A 100 2.841 -5.512 11.711 1.00 15.24 H new ATOM 0 HG2 GLU A 100 5.039 -5.406 10.513 1.00 22.32 H new ATOM 0 HG3 GLU A 100 5.152 -3.710 10.938 1.00 22.32 H new ATOM 1480 N VAL A 101 2.200 -1.964 9.656 1.00 31.55 N ATOM 1481 CA VAL A 101 2.480 -0.624 9.196 1.00 24.12 C ATOM 1482 C VAL A 101 2.928 0.178 10.382 1.00 54.42 C ATOM 1483 O VAL A 101 2.217 0.236 11.391 1.00 50.52 O ATOM 1484 CB VAL A 101 1.204 0.067 8.631 1.00 12.15 C ATOM 1485 CG1 VAL A 101 1.533 1.420 8.008 1.00 51.40 C ATOM 1486 CG2 VAL A 101 0.482 -0.821 7.644 1.00 45.52 C ATOM 0 H VAL A 101 1.341 -2.051 10.199 1.00 31.55 H new ATOM 0 HA VAL A 101 3.233 -0.677 8.410 1.00 24.12 H new ATOM 0 HB VAL A 101 0.533 0.241 9.472 1.00 12.15 H new ATOM 0 HG11 VAL A 101 0.620 1.875 7.623 1.00 51.40 H new ATOM 0 HG12 VAL A 101 1.973 2.071 8.763 1.00 51.40 H new ATOM 0 HG13 VAL A 101 2.241 1.282 7.191 1.00 51.40 H new ATOM 0 HG21 VAL A 101 -0.403 -0.306 7.271 1.00 45.52 H new ATOM 0 HG22 VAL A 101 1.145 -1.053 6.811 1.00 45.52 H new ATOM 0 HG23 VAL A 101 0.183 -1.745 8.138 1.00 45.52 H new ATOM 1496 N VAL A 102 4.087 0.759 10.303 1.00 33.32 N ATOM 1497 CA VAL A 102 4.543 1.609 11.358 1.00 53.44 C ATOM 1498 C VAL A 102 4.765 3.004 10.811 1.00 1.53 C ATOM 1499 O VAL A 102 5.550 3.196 9.882 1.00 61.34 O ATOM 1500 CB VAL A 102 5.865 1.081 12.002 1.00 42.12 C ATOM 1501 CG1 VAL A 102 6.322 1.988 13.138 1.00 4.50 C ATOM 1502 CG2 VAL A 102 5.691 -0.348 12.508 1.00 3.14 C ATOM 0 H VAL A 102 4.733 0.660 9.520 1.00 33.32 H new ATOM 0 HA VAL A 102 3.780 1.622 12.136 1.00 53.44 H new ATOM 0 HB VAL A 102 6.633 1.085 11.229 1.00 42.12 H new ATOM 0 HG11 VAL A 102 7.244 1.596 13.568 1.00 4.50 H new ATOM 0 HG12 VAL A 102 6.499 2.992 12.753 1.00 4.50 H new ATOM 0 HG13 VAL A 102 5.550 2.025 13.907 1.00 4.50 H new ATOM 0 HG21 VAL A 102 6.625 -0.693 12.952 1.00 3.14 H new ATOM 0 HG22 VAL A 102 4.901 -0.375 13.258 1.00 3.14 H new ATOM 0 HG23 VAL A 102 5.423 -0.999 11.676 1.00 3.14 H new ATOM 1512 N ASP A 103 4.077 3.946 11.373 1.00 25.52 N ATOM 1513 CA ASP A 103 4.259 5.349 11.066 1.00 23.51 C ATOM 1514 C ASP A 103 5.401 5.863 11.870 1.00 60.30 C ATOM 1515 O ASP A 103 5.478 5.601 13.077 1.00 43.34 O ATOM 1516 CB ASP A 103 2.995 6.150 11.407 1.00 52.53 C ATOM 1517 CG ASP A 103 3.233 7.647 11.532 1.00 41.32 C ATOM 1518 OD1 ASP A 103 3.542 8.116 12.658 1.00 74.52 O ATOM 1519 OD2 ASP A 103 3.079 8.376 10.550 1.00 72.45 O ATOM 0 H ASP A 103 3.356 3.770 12.073 1.00 25.52 H new ATOM 0 HA ASP A 103 4.458 5.460 10.000 1.00 23.51 H new ATOM 0 HB2 ASP A 103 2.245 5.974 10.636 1.00 52.53 H new ATOM 0 HB3 ASP A 103 2.582 5.778 12.344 1.00 52.53 H new ATOM 1524 N VAL A 104 6.292 6.549 11.231 1.00 72.21 N ATOM 1525 CA VAL A 104 7.422 7.109 11.918 1.00 54.22 C ATOM 1526 C VAL A 104 7.506 8.614 11.678 1.00 45.13 C ATOM 1527 O VAL A 104 8.216 9.340 12.402 1.00 42.42 O ATOM 1528 CB VAL A 104 8.760 6.411 11.531 1.00 33.50 C ATOM 1529 CG1 VAL A 104 8.748 4.941 11.928 1.00 35.10 C ATOM 1530 CG2 VAL A 104 9.024 6.530 10.053 1.00 21.42 C ATOM 0 H VAL A 104 6.263 6.739 10.229 1.00 72.21 H new ATOM 0 HA VAL A 104 7.269 6.931 12.982 1.00 54.22 H new ATOM 0 HB VAL A 104 9.557 6.917 12.076 1.00 33.50 H new ATOM 0 HG11 VAL A 104 9.694 4.480 11.645 1.00 35.10 H new ATOM 0 HG12 VAL A 104 8.611 4.856 13.006 1.00 35.10 H new ATOM 0 HG13 VAL A 104 7.930 4.433 11.417 1.00 35.10 H new ATOM 0 HG21 VAL A 104 9.964 6.034 9.810 1.00 21.42 H new ATOM 0 HG22 VAL A 104 8.212 6.059 9.499 1.00 21.42 H new ATOM 0 HG23 VAL A 104 9.088 7.583 9.778 1.00 21.42 H new ATOM 1540 N GLY A 105 6.769 9.087 10.698 1.00 2.34 N ATOM 1541 CA GLY A 105 6.797 10.467 10.368 1.00 4.33 C ATOM 1542 C GLY A 105 5.553 10.921 9.668 1.00 32.42 C ATOM 1543 O GLY A 105 5.510 10.977 8.430 1.00 54.22 O ATOM 0 H GLY A 105 6.145 8.522 10.122 1.00 2.34 H new ATOM 0 HA2 GLY A 105 6.930 11.051 11.279 1.00 4.33 H new ATOM 0 HA3 GLY A 105 7.660 10.667 9.732 1.00 4.33 H new ATOM 1547 N SER A 106 4.538 11.250 10.440 1.00 73.12 N ATOM 1548 CA SER A 106 3.314 11.764 9.905 1.00 22.43 C ATOM 1549 C SER A 106 3.537 13.171 9.349 1.00 73.21 C ATOM 1550 O SER A 106 3.385 14.158 10.051 1.00 62.14 O ATOM 1551 CB SER A 106 2.207 11.808 10.974 1.00 61.34 C ATOM 1552 OG SER A 106 1.919 10.528 11.519 1.00 50.32 O ATOM 0 H SER A 106 4.548 11.165 11.456 1.00 73.12 H new ATOM 0 HA SER A 106 2.994 11.095 9.106 1.00 22.43 H new ATOM 0 HB2 SER A 106 2.510 12.480 11.777 1.00 61.34 H new ATOM 0 HB3 SER A 106 1.300 12.224 10.535 1.00 61.34 H new ATOM 0 HG SER A 106 2.221 9.833 10.898 1.00 50.32 H new ATOM 1558 N LEU A 107 4.021 13.236 8.138 1.00 63.23 N ATOM 1559 CA LEU A 107 4.158 14.495 7.452 1.00 2.51 C ATOM 1560 C LEU A 107 2.796 14.900 6.966 1.00 50.44 C ATOM 1561 O LEU A 107 2.305 15.990 7.223 1.00 74.25 O ATOM 1562 CB LEU A 107 5.042 14.297 6.219 1.00 72.30 C ATOM 1563 CG LEU A 107 5.154 15.500 5.289 1.00 34.12 C ATOM 1564 CD1 LEU A 107 6.166 16.508 5.780 1.00 55.20 C ATOM 1565 CD2 LEU A 107 5.415 15.080 3.863 1.00 24.32 C ATOM 0 H LEU A 107 4.330 12.425 7.601 1.00 63.23 H new ATOM 0 HA LEU A 107 4.590 15.242 8.117 1.00 2.51 H new ATOM 0 HB2 LEU A 107 6.043 14.023 6.552 1.00 72.30 H new ATOM 0 HB3 LEU A 107 4.654 13.454 5.648 1.00 72.30 H new ATOM 0 HG LEU A 107 4.187 16.003 5.301 1.00 34.12 H new ATOM 0 HD11 LEU A 107 6.211 17.347 5.085 1.00 55.20 H new ATOM 0 HD12 LEU A 107 5.872 16.868 6.766 1.00 55.20 H new ATOM 0 HD13 LEU A 107 7.147 16.037 5.844 1.00 55.20 H new ATOM 0 HD21 LEU A 107 5.488 15.965 3.231 1.00 24.32 H new ATOM 0 HD22 LEU A 107 6.349 14.520 3.814 1.00 24.32 H new ATOM 0 HD23 LEU A 107 4.596 14.451 3.513 1.00 24.32 H new ATOM 1577 N ASN A 108 2.174 13.952 6.331 1.00 52.15 N ATOM 1578 CA ASN A 108 0.917 14.153 5.678 1.00 43.44 C ATOM 1579 C ASN A 108 -0.219 13.578 6.535 1.00 20.15 C ATOM 1580 O ASN A 108 -1.373 13.972 6.411 1.00 21.14 O ATOM 1581 CB ASN A 108 0.999 13.448 4.318 1.00 40.21 C ATOM 1582 CG ASN A 108 -0.194 13.668 3.437 1.00 10.30 C ATOM 1583 OD1 ASN A 108 -1.155 12.971 3.549 1.00 23.22 O ATOM 1584 ND2 ASN A 108 -0.103 14.597 2.513 1.00 34.34 N ATOM 0 H ASN A 108 2.533 13.001 6.251 1.00 52.15 H new ATOM 0 HA ASN A 108 0.708 15.214 5.538 1.00 43.44 H new ATOM 0 HB2 ASN A 108 1.891 13.794 3.796 1.00 40.21 H new ATOM 0 HB3 ASN A 108 1.122 12.378 4.483 1.00 40.21 H new ATOM 0 HD21 ASN A 108 -0.872 14.742 1.859 1.00 34.34 H new ATOM 0 HD22 ASN A 108 0.736 15.173 2.450 1.00 34.34 H new ATOM 1591 N GLY A 109 0.138 12.695 7.453 1.00 74.31 N ATOM 1592 CA GLY A 109 -0.853 12.082 8.314 1.00 34.25 C ATOM 1593 C GLY A 109 -1.163 10.666 7.895 1.00 44.02 C ATOM 1594 O GLY A 109 -1.718 10.444 6.827 1.00 14.21 O ATOM 0 H GLY A 109 1.097 12.391 7.619 1.00 74.31 H new ATOM 0 HA2 GLY A 109 -0.492 12.086 9.343 1.00 34.25 H new ATOM 0 HA3 GLY A 109 -1.767 12.675 8.295 1.00 34.25 H new ATOM 1598 N THR A 110 -0.724 9.722 8.679 1.00 13.04 N ATOM 1599 CA THR A 110 -0.993 8.325 8.425 1.00 32.33 C ATOM 1600 C THR A 110 -2.344 7.887 9.059 1.00 55.33 C ATOM 1601 O THR A 110 -2.620 8.195 10.240 1.00 35.44 O ATOM 1602 CB THR A 110 0.164 7.491 8.996 1.00 4.11 C ATOM 1603 OG1 THR A 110 1.392 8.093 8.555 1.00 51.32 O ATOM 1604 CG2 THR A 110 0.103 6.049 8.489 1.00 35.21 C ATOM 0 H THR A 110 -0.167 9.895 9.516 1.00 13.04 H new ATOM 0 HA THR A 110 -1.072 8.165 7.350 1.00 32.33 H new ATOM 0 HB THR A 110 0.098 7.470 10.084 1.00 4.11 H new ATOM 0 HG1 THR A 110 2.085 7.959 9.235 1.00 51.32 H new ATOM 0 HG21 THR A 110 0.933 5.480 8.908 1.00 35.21 H new ATOM 0 HG22 THR A 110 -0.839 5.595 8.796 1.00 35.21 H new ATOM 0 HG23 THR A 110 0.172 6.043 7.401 1.00 35.21 H new ATOM 1612 N TYR A 111 -3.183 7.224 8.260 1.00 40.22 N ATOM 1613 CA TYR A 111 -4.457 6.645 8.702 1.00 74.34 C ATOM 1614 C TYR A 111 -4.511 5.187 8.283 1.00 0.43 C ATOM 1615 O TYR A 111 -4.254 4.871 7.124 1.00 22.15 O ATOM 1616 CB TYR A 111 -5.655 7.352 8.056 1.00 72.12 C ATOM 1617 CG TYR A 111 -6.180 8.618 8.706 1.00 4.41 C ATOM 1618 CD1 TYR A 111 -5.519 9.258 9.743 1.00 24.33 C ATOM 1619 CD2 TYR A 111 -7.380 9.159 8.268 1.00 32.44 C ATOM 1620 CE1 TYR A 111 -6.040 10.400 10.316 1.00 60.21 C ATOM 1621 CE2 TYR A 111 -7.904 10.292 8.833 1.00 24.31 C ATOM 1622 CZ TYR A 111 -7.233 10.911 9.853 1.00 24.51 C ATOM 1623 OH TYR A 111 -7.766 12.038 10.417 1.00 40.14 O ATOM 0 H TYR A 111 -2.994 7.071 7.269 1.00 40.22 H new ATOM 0 HA TYR A 111 -4.513 6.759 9.785 1.00 74.34 H new ATOM 0 HB2 TYR A 111 -5.384 7.594 7.028 1.00 72.12 H new ATOM 0 HB3 TYR A 111 -6.477 6.637 8.009 1.00 72.12 H new ATOM 0 HD1 TYR A 111 -4.584 8.858 10.107 1.00 24.33 H new ATOM 0 HD2 TYR A 111 -7.914 8.676 7.463 1.00 32.44 H new ATOM 0 HE1 TYR A 111 -5.516 10.891 11.123 1.00 60.21 H new ATOM 0 HE2 TYR A 111 -8.841 10.694 8.476 1.00 24.31 H new ATOM 0 HH TYR A 111 -8.609 12.261 9.969 1.00 40.14 H new ATOM 1633 N VAL A 112 -4.879 4.323 9.194 1.00 73.44 N ATOM 1634 CA VAL A 112 -4.978 2.890 8.927 1.00 75.14 C ATOM 1635 C VAL A 112 -6.430 2.485 9.208 1.00 62.22 C ATOM 1636 O VAL A 112 -6.960 2.786 10.290 1.00 62.00 O ATOM 1637 CB VAL A 112 -3.995 2.075 9.828 1.00 54.43 C ATOM 1638 CG1 VAL A 112 -4.050 0.597 9.516 1.00 12.32 C ATOM 1639 CG2 VAL A 112 -2.564 2.589 9.686 1.00 61.53 C ATOM 0 H VAL A 112 -5.122 4.583 10.150 1.00 73.44 H new ATOM 0 HA VAL A 112 -4.704 2.676 7.894 1.00 75.14 H new ATOM 0 HB VAL A 112 -4.315 2.216 10.860 1.00 54.43 H new ATOM 0 HG11 VAL A 112 -3.353 0.063 10.162 1.00 12.32 H new ATOM 0 HG12 VAL A 112 -5.061 0.226 9.687 1.00 12.32 H new ATOM 0 HG13 VAL A 112 -3.776 0.435 8.474 1.00 12.32 H new ATOM 0 HG21 VAL A 112 -1.902 2.004 10.324 1.00 61.53 H new ATOM 0 HG22 VAL A 112 -2.245 2.494 8.648 1.00 61.53 H new ATOM 0 HG23 VAL A 112 -2.522 3.637 9.984 1.00 61.53 H new ATOM 1649 N ASN A 113 -7.058 1.822 8.240 1.00 63.54 N ATOM 1650 CA ASN A 113 -8.518 1.530 8.212 1.00 13.33 C ATOM 1651 C ASN A 113 -9.286 2.828 8.308 1.00 73.04 C ATOM 1652 O ASN A 113 -10.374 2.884 8.859 1.00 65.11 O ATOM 1653 CB ASN A 113 -8.946 0.578 9.354 1.00 45.34 C ATOM 1654 CG ASN A 113 -8.300 -0.766 9.239 1.00 72.13 C ATOM 1655 OD1 ASN A 113 -8.823 -1.669 8.581 1.00 64.02 O ATOM 1656 ND2 ASN A 113 -7.190 -0.932 9.899 1.00 41.41 N ATOM 0 H ASN A 113 -6.566 1.457 7.424 1.00 63.54 H new ATOM 0 HA ASN A 113 -8.742 1.026 7.272 1.00 13.33 H new ATOM 0 HB2 ASN A 113 -8.685 1.024 10.314 1.00 45.34 H new ATOM 0 HB3 ASN A 113 -10.030 0.461 9.341 1.00 45.34 H new ATOM 0 HD21 ASN A 113 -6.718 -1.836 9.884 1.00 41.41 H new ATOM 0 HD22 ASN A 113 -6.792 -0.158 10.431 1.00 41.41 H new ATOM 1663 N ARG A 114 -8.721 3.861 7.660 1.00 55.42 N ATOM 1664 CA ARG A 114 -9.220 5.198 7.628 1.00 13.50 C ATOM 1665 C ARG A 114 -9.384 5.830 9.062 1.00 75.31 C ATOM 1666 O ARG A 114 -9.970 6.898 9.259 1.00 65.52 O ATOM 1667 CB ARG A 114 -10.418 5.313 6.672 1.00 23.02 C ATOM 1668 CG ARG A 114 -10.973 6.682 6.607 1.00 22.34 C ATOM 1669 CD ARG A 114 -11.962 6.882 5.478 1.00 40.44 C ATOM 1670 NE ARG A 114 -13.027 5.883 5.405 1.00 63.55 N ATOM 1671 CZ ARG A 114 -13.754 5.664 4.297 1.00 43.10 C ATOM 1672 NH1 ARG A 114 -13.495 6.355 3.190 1.00 43.24 N ATOM 1673 NH2 ARG A 114 -14.678 4.732 4.271 1.00 41.53 N ATOM 0 H ARG A 114 -7.860 3.754 7.124 1.00 55.42 H new ATOM 0 HA ARG A 114 -8.465 5.850 7.189 1.00 13.50 H new ATOM 0 HB2 ARG A 114 -10.110 5.003 5.673 1.00 23.02 H new ATOM 0 HB3 ARG A 114 -11.200 4.624 6.993 1.00 23.02 H new ATOM 0 HG2 ARG A 114 -11.463 6.912 7.553 1.00 22.34 H new ATOM 0 HG3 ARG A 114 -10.154 7.392 6.492 1.00 22.34 H new ATOM 0 HD2 ARG A 114 -12.416 7.868 5.583 1.00 40.44 H new ATOM 0 HD3 ARG A 114 -11.418 6.880 4.534 1.00 40.44 H new ATOM 0 HE ARG A 114 -13.228 5.326 6.235 1.00 63.55 H new ATOM 0 HH11 ARG A 114 -12.747 7.048 3.185 1.00 43.24 H new ATOM 0 HH12 ARG A 114 -14.045 6.192 2.346 1.00 43.24 H new ATOM 0 HH21 ARG A 114 -14.852 4.163 5.099 1.00 41.53 H new ATOM 0 HH22 ARG A 114 -15.222 4.577 3.422 1.00 41.53 H new ATOM 1687 N GLU A 115 -8.800 5.186 10.033 1.00 10.52 N ATOM 1688 CA GLU A 115 -8.810 5.657 11.390 1.00 31.41 C ATOM 1689 C GLU A 115 -7.398 6.126 11.729 1.00 72.45 C ATOM 1690 O GLU A 115 -6.426 5.596 11.163 1.00 72.45 O ATOM 1691 CB GLU A 115 -9.237 4.524 12.339 1.00 40.43 C ATOM 1692 CG GLU A 115 -10.644 3.978 12.097 1.00 13.32 C ATOM 1693 CD GLU A 115 -11.022 2.888 13.079 1.00 2.42 C ATOM 1694 OE1 GLU A 115 -11.122 3.181 14.290 1.00 60.35 O ATOM 1695 OE2 GLU A 115 -11.205 1.717 12.672 1.00 13.53 O ATOM 0 H GLU A 115 -8.297 4.308 9.903 1.00 10.52 H new ATOM 0 HA GLU A 115 -9.519 6.477 11.504 1.00 31.41 H new ATOM 0 HB2 GLU A 115 -8.524 3.705 12.247 1.00 40.43 H new ATOM 0 HB3 GLU A 115 -9.175 4.886 13.365 1.00 40.43 H new ATOM 0 HG2 GLU A 115 -11.364 4.793 12.170 1.00 13.32 H new ATOM 0 HG3 GLU A 115 -10.708 3.586 11.082 1.00 13.32 H new ATOM 1702 N PRO A 116 -7.240 7.145 12.589 1.00 33.01 N ATOM 1703 CA PRO A 116 -5.917 7.601 13.003 1.00 12.13 C ATOM 1704 C PRO A 116 -5.177 6.484 13.724 1.00 61.12 C ATOM 1705 O PRO A 116 -5.653 5.937 14.738 1.00 11.35 O ATOM 1706 CB PRO A 116 -6.198 8.775 13.951 1.00 15.42 C ATOM 1707 CG PRO A 116 -7.622 8.618 14.355 1.00 12.13 C ATOM 1708 CD PRO A 116 -8.317 7.930 13.211 1.00 10.32 C ATOM 0 HA PRO A 116 -5.289 7.894 12.162 1.00 12.13 H new ATOM 0 HB2 PRO A 116 -5.538 8.748 14.818 1.00 15.42 H new ATOM 0 HB3 PRO A 116 -6.033 9.731 13.454 1.00 15.42 H new ATOM 0 HG2 PRO A 116 -7.703 8.029 15.269 1.00 12.13 H new ATOM 0 HG3 PRO A 116 -8.077 9.587 14.559 1.00 12.13 H new ATOM 0 HD2 PRO A 116 -9.131 7.293 13.558 1.00 10.32 H new ATOM 0 HD3 PRO A 116 -8.749 8.647 12.512 1.00 10.32 H new ATOM 1716 N ARG A 117 -4.028 6.152 13.220 1.00 75.23 N ATOM 1717 CA ARG A 117 -3.275 5.049 13.718 1.00 62.14 C ATOM 1718 C ARG A 117 -1.853 5.223 13.262 1.00 51.44 C ATOM 1719 O ARG A 117 -1.621 5.614 12.120 1.00 32.45 O ATOM 1720 CB ARG A 117 -3.875 3.764 13.133 1.00 12.22 C ATOM 1721 CG ARG A 117 -3.267 2.458 13.611 1.00 22.41 C ATOM 1722 CD ARG A 117 -3.432 2.257 15.106 1.00 14.31 C ATOM 1723 NE ARG A 117 -4.837 2.282 15.538 1.00 34.41 N ATOM 1724 CZ ARG A 117 -5.238 1.972 16.780 1.00 70.13 C ATOM 1725 NH1 ARG A 117 -4.397 1.380 17.620 1.00 42.12 N ATOM 1726 NH2 ARG A 117 -6.489 2.203 17.159 1.00 1.02 N ATOM 0 H ARG A 117 -3.585 6.645 12.445 1.00 75.23 H new ATOM 0 HA ARG A 117 -3.303 4.994 14.806 1.00 62.14 H new ATOM 0 HB2 ARG A 117 -4.941 3.749 13.362 1.00 12.22 H new ATOM 0 HB3 ARG A 117 -3.783 3.807 12.048 1.00 12.22 H new ATOM 0 HG2 ARG A 117 -3.734 1.628 13.082 1.00 22.41 H new ATOM 0 HG3 ARG A 117 -2.207 2.440 13.359 1.00 22.41 H new ATOM 0 HD2 ARG A 117 -2.987 1.303 15.390 1.00 14.31 H new ATOM 0 HD3 ARG A 117 -2.881 3.035 15.634 1.00 14.31 H new ATOM 0 HE ARG A 117 -5.546 2.550 14.856 1.00 34.41 H new ATOM 0 HH11 ARG A 117 -3.447 1.161 17.321 1.00 42.12 H new ATOM 0 HH12 ARG A 117 -4.701 1.144 18.565 1.00 42.12 H new ATOM 0 HH21 ARG A 117 -7.152 2.619 16.504 1.00 1.02 H new ATOM 0 HH22 ARG A 117 -6.788 1.965 18.105 1.00 1.02 H new ATOM 1740 N ASN A 118 -0.920 4.979 14.140 1.00 31.15 N ATOM 1741 CA ASN A 118 0.479 5.111 13.791 1.00 75.24 C ATOM 1742 C ASN A 118 1.071 3.749 13.508 1.00 63.12 C ATOM 1743 O ASN A 118 1.622 3.519 12.454 1.00 5.25 O ATOM 1744 CB ASN A 118 1.286 5.862 14.870 1.00 3.02 C ATOM 1745 CG ASN A 118 0.840 7.312 15.049 1.00 73.25 C ATOM 1746 OD1 ASN A 118 -0.056 7.609 15.847 1.00 73.51 O ATOM 1747 ND2 ASN A 118 1.458 8.228 14.355 1.00 72.12 N ATOM 0 H ASN A 118 -1.096 4.688 15.102 1.00 31.15 H new ATOM 0 HA ASN A 118 0.541 5.717 12.887 1.00 75.24 H new ATOM 0 HB2 ASN A 118 1.187 5.337 15.820 1.00 3.02 H new ATOM 0 HB3 ASN A 118 2.343 5.843 14.604 1.00 3.02 H new ATOM 0 HD21 ASN A 118 1.204 9.210 14.466 1.00 72.12 H new ATOM 0 HD22 ASN A 118 2.195 7.962 13.702 1.00 72.12 H new ATOM 1754 N ALA A 119 0.931 2.833 14.427 1.00 65.42 N ATOM 1755 CA ALA A 119 1.425 1.500 14.195 1.00 14.54 C ATOM 1756 C ALA A 119 0.275 0.537 14.301 1.00 55.34 C ATOM 1757 O ALA A 119 -0.556 0.653 15.212 1.00 64.34 O ATOM 1758 CB ALA A 119 2.508 1.158 15.200 1.00 3.52 C ATOM 0 H ALA A 119 0.485 2.980 15.333 1.00 65.42 H new ATOM 0 HA ALA A 119 1.863 1.434 13.199 1.00 14.54 H new ATOM 0 HB1 ALA A 119 2.872 0.148 15.013 1.00 3.52 H new ATOM 0 HB2 ALA A 119 3.332 1.865 15.102 1.00 3.52 H new ATOM 0 HB3 ALA A 119 2.099 1.215 16.209 1.00 3.52 H new ATOM 1764 N GLN A 120 0.192 -0.373 13.364 1.00 44.31 N ATOM 1765 CA GLN A 120 -0.877 -1.340 13.334 1.00 72.40 C ATOM 1766 C GLN A 120 -0.446 -2.594 12.593 1.00 35.10 C ATOM 1767 O GLN A 120 0.264 -2.505 11.580 1.00 3.35 O ATOM 1768 CB GLN A 120 -2.096 -0.716 12.637 1.00 60.55 C ATOM 1769 CG GLN A 120 -3.341 -1.592 12.563 1.00 34.20 C ATOM 1770 CD GLN A 120 -3.882 -1.995 13.921 1.00 55.24 C ATOM 1771 OE1 GLN A 120 -3.736 -1.277 14.908 1.00 52.44 O ATOM 1772 NE2 GLN A 120 -4.530 -3.122 13.972 1.00 60.10 N ATOM 0 H GLN A 120 0.863 -0.465 12.601 1.00 44.31 H new ATOM 0 HA GLN A 120 -1.134 -1.619 14.356 1.00 72.40 H new ATOM 0 HB2 GLN A 120 -2.355 0.206 13.157 1.00 60.55 H new ATOM 0 HB3 GLN A 120 -1.808 -0.440 11.622 1.00 60.55 H new ATOM 0 HG2 GLN A 120 -4.118 -1.059 12.015 1.00 34.20 H new ATOM 0 HG3 GLN A 120 -3.109 -2.491 11.992 1.00 34.20 H new ATOM 0 HE21 GLN A 120 -4.630 -3.691 13.131 1.00 60.10 H new ATOM 0 HE22 GLN A 120 -4.938 -3.437 14.853 1.00 60.10 H new ATOM 1781 N VAL A 121 -0.840 -3.746 13.093 1.00 61.31 N ATOM 1782 CA VAL A 121 -0.689 -4.965 12.344 1.00 23.45 C ATOM 1783 C VAL A 121 -1.787 -4.942 11.292 1.00 41.34 C ATOM 1784 O VAL A 121 -2.962 -4.808 11.621 1.00 43.34 O ATOM 1785 CB VAL A 121 -0.811 -6.232 13.235 1.00 32.00 C ATOM 1786 CG1 VAL A 121 -0.702 -7.498 12.392 1.00 54.54 C ATOM 1787 CG2 VAL A 121 0.274 -6.234 14.293 1.00 71.30 C ATOM 0 H VAL A 121 -1.266 -3.859 14.013 1.00 61.31 H new ATOM 0 HA VAL A 121 0.306 -5.017 11.902 1.00 23.45 H new ATOM 0 HB VAL A 121 -1.788 -6.214 13.718 1.00 32.00 H new ATOM 0 HG11 VAL A 121 -0.790 -8.373 13.036 1.00 54.54 H new ATOM 0 HG12 VAL A 121 -1.501 -7.511 11.651 1.00 54.54 H new ATOM 0 HG13 VAL A 121 0.263 -7.516 11.886 1.00 54.54 H new ATOM 0 HG21 VAL A 121 0.178 -7.127 14.911 1.00 71.30 H new ATOM 0 HG22 VAL A 121 1.252 -6.230 13.811 1.00 71.30 H new ATOM 0 HG23 VAL A 121 0.174 -5.347 14.919 1.00 71.30 H new ATOM 1797 N MET A 122 -1.409 -5.069 10.069 1.00 41.03 N ATOM 1798 CA MET A 122 -2.299 -4.855 8.958 1.00 44.21 C ATOM 1799 C MET A 122 -3.014 -6.142 8.559 1.00 73.42 C ATOM 1800 O MET A 122 -2.441 -7.237 8.596 1.00 53.11 O ATOM 1801 CB MET A 122 -1.486 -4.240 7.814 1.00 62.41 C ATOM 1802 CG MET A 122 -2.240 -3.929 6.538 1.00 71.12 C ATOM 1803 SD MET A 122 -1.240 -2.954 5.382 1.00 43.21 S ATOM 1804 CE MET A 122 0.263 -3.922 5.275 1.00 52.35 C ATOM 0 H MET A 122 -0.461 -5.328 9.797 1.00 41.03 H new ATOM 0 HA MET A 122 -3.095 -4.163 9.235 1.00 44.21 H new ATOM 0 HB2 MET A 122 -1.033 -3.317 8.176 1.00 62.41 H new ATOM 0 HB3 MET A 122 -0.671 -4.921 7.571 1.00 62.41 H new ATOM 0 HG2 MET A 122 -2.543 -4.860 6.059 1.00 71.12 H new ATOM 0 HG3 MET A 122 -3.152 -3.383 6.779 1.00 71.12 H new ATOM 0 HE1 MET A 122 0.794 -3.669 4.358 1.00 52.35 H new ATOM 0 HE2 MET A 122 0.898 -3.705 6.134 1.00 52.35 H new ATOM 0 HE3 MET A 122 0.013 -4.983 5.268 1.00 52.35 H new ATOM 1814 N GLN A 123 -4.261 -5.990 8.218 1.00 15.14 N ATOM 1815 CA GLN A 123 -5.163 -7.080 7.882 1.00 25.34 C ATOM 1816 C GLN A 123 -5.576 -6.975 6.430 1.00 43.12 C ATOM 1817 O GLN A 123 -5.479 -5.914 5.846 1.00 3.52 O ATOM 1818 CB GLN A 123 -6.415 -6.979 8.761 1.00 52.32 C ATOM 1819 CG GLN A 123 -7.059 -5.593 8.716 1.00 73.10 C ATOM 1820 CD GLN A 123 -8.318 -5.471 9.532 1.00 51.22 C ATOM 1821 OE1 GLN A 123 -8.510 -6.175 10.522 1.00 34.22 O ATOM 1822 NE2 GLN A 123 -9.159 -4.552 9.166 1.00 41.21 N ATOM 0 H GLN A 123 -4.705 -5.073 8.161 1.00 15.14 H new ATOM 0 HA GLN A 123 -4.658 -8.032 8.049 1.00 25.34 H new ATOM 0 HB2 GLN A 123 -7.142 -7.723 8.437 1.00 52.32 H new ATOM 0 HB3 GLN A 123 -6.151 -7.219 9.791 1.00 52.32 H new ATOM 0 HG2 GLN A 123 -6.337 -4.857 9.070 1.00 73.10 H new ATOM 0 HG3 GLN A 123 -7.286 -5.343 7.679 1.00 73.10 H new ATOM 0 HE21 GLN A 123 -8.968 -3.986 8.339 1.00 41.21 H new ATOM 0 HE22 GLN A 123 -10.011 -4.396 9.705 1.00 41.21 H new ATOM 1831 N THR A 124 -5.986 -8.061 5.832 1.00 15.25 N ATOM 1832 CA THR A 124 -6.521 -7.978 4.500 1.00 11.11 C ATOM 1833 C THR A 124 -7.882 -7.262 4.586 1.00 1.12 C ATOM 1834 O THR A 124 -8.732 -7.600 5.427 1.00 74.34 O ATOM 1835 CB THR A 124 -6.641 -9.376 3.808 1.00 21.03 C ATOM 1836 OG1 THR A 124 -7.172 -9.241 2.476 1.00 1.31 O ATOM 1837 CG2 THR A 124 -7.519 -10.323 4.605 1.00 31.21 C ATOM 0 H THR A 124 -5.961 -8.997 6.236 1.00 15.25 H new ATOM 0 HA THR A 124 -5.835 -7.411 3.871 1.00 11.11 H new ATOM 0 HB THR A 124 -5.636 -9.795 3.759 1.00 21.03 H new ATOM 0 HG1 THR A 124 -8.150 -9.303 2.506 1.00 1.31 H new ATOM 0 HG21 THR A 124 -7.578 -11.283 4.092 1.00 31.21 H new ATOM 0 HG22 THR A 124 -7.092 -10.467 5.597 1.00 31.21 H new ATOM 0 HG23 THR A 124 -8.519 -9.900 4.699 1.00 31.21 H new ATOM 1845 N GLY A 125 -8.077 -6.276 3.763 1.00 34.40 N ATOM 1846 CA GLY A 125 -9.265 -5.488 3.862 1.00 1.45 C ATOM 1847 C GLY A 125 -8.982 -4.203 4.598 1.00 22.52 C ATOM 1848 O GLY A 125 -9.886 -3.411 4.861 1.00 54.34 O ATOM 0 H GLY A 125 -7.433 -6.001 3.021 1.00 34.40 H new ATOM 0 HA2 GLY A 125 -9.647 -5.267 2.865 1.00 1.45 H new ATOM 0 HA3 GLY A 125 -10.040 -6.050 4.383 1.00 1.45 H new ATOM 1852 N ASP A 126 -7.731 -4.025 4.989 1.00 74.21 N ATOM 1853 CA ASP A 126 -7.309 -2.818 5.674 1.00 24.42 C ATOM 1854 C ASP A 126 -7.198 -1.722 4.629 1.00 73.30 C ATOM 1855 O ASP A 126 -6.712 -1.969 3.506 1.00 34.23 O ATOM 1856 CB ASP A 126 -5.934 -3.033 6.315 1.00 53.35 C ATOM 1857 CG ASP A 126 -5.639 -2.087 7.445 1.00 72.34 C ATOM 1858 OD1 ASP A 126 -5.583 -0.864 7.213 1.00 45.54 O ATOM 1859 OD2 ASP A 126 -5.464 -2.589 8.618 1.00 23.32 O ATOM 0 H ASP A 126 -6.987 -4.707 4.842 1.00 74.21 H new ATOM 0 HA ASP A 126 -8.023 -2.555 6.454 1.00 24.42 H new ATOM 0 HB2 ASP A 126 -5.871 -4.057 6.684 1.00 53.35 H new ATOM 0 HB3 ASP A 126 -5.165 -2.922 5.550 1.00 53.35 H new ATOM 1864 N GLU A 127 -7.660 -0.554 4.947 1.00 73.30 N ATOM 1865 CA GLU A 127 -7.595 0.527 4.009 1.00 50.35 C ATOM 1866 C GLU A 127 -6.767 1.660 4.588 1.00 33.33 C ATOM 1867 O GLU A 127 -7.092 2.219 5.618 1.00 24.13 O ATOM 1868 CB GLU A 127 -9.034 0.949 3.612 1.00 62.34 C ATOM 1869 CG GLU A 127 -10.016 1.140 4.785 1.00 45.31 C ATOM 1870 CD GLU A 127 -11.462 1.315 4.330 1.00 14.34 C ATOM 1871 OE1 GLU A 127 -12.098 0.319 3.915 1.00 51.45 O ATOM 1872 OE2 GLU A 127 -11.980 2.436 4.353 1.00 70.35 O ATOM 0 H GLU A 127 -8.085 -0.323 5.845 1.00 73.30 H new ATOM 0 HA GLU A 127 -7.093 0.217 3.093 1.00 50.35 H new ATOM 0 HB2 GLU A 127 -8.979 1.882 3.051 1.00 62.34 H new ATOM 0 HB3 GLU A 127 -9.442 0.196 2.938 1.00 62.34 H new ATOM 0 HG2 GLU A 127 -9.952 0.278 5.449 1.00 45.31 H new ATOM 0 HG3 GLU A 127 -9.715 2.013 5.365 1.00 45.31 H new ATOM 1879 N ILE A 128 -5.766 2.052 3.881 1.00 33.31 N ATOM 1880 CA ILE A 128 -4.817 3.010 4.386 1.00 3.03 C ATOM 1881 C ILE A 128 -5.028 4.322 3.664 1.00 62.21 C ATOM 1882 O ILE A 128 -5.137 4.359 2.434 1.00 32.15 O ATOM 1883 CB ILE A 128 -3.355 2.514 4.176 1.00 25.43 C ATOM 1884 CG1 ILE A 128 -3.203 1.073 4.694 1.00 4.41 C ATOM 1885 CG2 ILE A 128 -2.373 3.429 4.909 1.00 23.35 C ATOM 1886 CD1 ILE A 128 -1.833 0.475 4.467 1.00 41.40 C ATOM 0 H ILE A 128 -5.572 1.724 2.935 1.00 33.31 H new ATOM 0 HA ILE A 128 -4.972 3.139 5.457 1.00 3.03 H new ATOM 0 HB ILE A 128 -3.133 2.536 3.109 1.00 25.43 H new ATOM 0 HG12 ILE A 128 -3.422 1.058 5.762 1.00 4.41 H new ATOM 0 HG13 ILE A 128 -3.947 0.443 4.207 1.00 4.41 H new ATOM 0 HG21 ILE A 128 -1.356 3.070 4.753 1.00 23.35 H new ATOM 0 HG22 ILE A 128 -2.463 4.444 4.522 1.00 23.35 H new ATOM 0 HG23 ILE A 128 -2.599 3.426 5.975 1.00 23.35 H new ATOM 0 HD11 ILE A 128 -1.810 -0.541 4.861 1.00 41.40 H new ATOM 0 HD12 ILE A 128 -1.617 0.455 3.399 1.00 41.40 H new ATOM 0 HD13 ILE A 128 -1.083 1.079 4.978 1.00 41.40 H new ATOM 1898 N GLN A 129 -5.102 5.366 4.409 1.00 51.15 N ATOM 1899 CA GLN A 129 -5.374 6.669 3.884 1.00 21.12 C ATOM 1900 C GLN A 129 -4.165 7.568 4.113 1.00 20.41 C ATOM 1901 O GLN A 129 -3.739 7.760 5.257 1.00 20.50 O ATOM 1902 CB GLN A 129 -6.624 7.225 4.593 1.00 30.04 C ATOM 1903 CG GLN A 129 -6.985 8.662 4.267 1.00 53.14 C ATOM 1904 CD GLN A 129 -7.600 8.862 2.903 1.00 40.22 C ATOM 1905 OE1 GLN A 129 -7.338 8.132 1.957 1.00 35.13 O ATOM 1906 NE2 GLN A 129 -8.407 9.874 2.796 1.00 35.45 N ATOM 0 H GLN A 129 -4.974 5.345 5.421 1.00 51.15 H new ATOM 0 HA GLN A 129 -5.563 6.625 2.811 1.00 21.12 H new ATOM 0 HB2 GLN A 129 -7.474 6.591 4.340 1.00 30.04 H new ATOM 0 HB3 GLN A 129 -6.474 7.143 5.670 1.00 30.04 H new ATOM 0 HG2 GLN A 129 -7.681 9.028 5.022 1.00 53.14 H new ATOM 0 HG3 GLN A 129 -6.086 9.274 4.339 1.00 53.14 H new ATOM 0 HE21 GLN A 129 -8.601 10.460 3.608 1.00 35.45 H new ATOM 0 HE22 GLN A 129 -8.847 10.083 1.900 1.00 35.45 H new ATOM 1915 N ILE A 130 -3.583 8.065 3.041 1.00 3.32 N ATOM 1916 CA ILE A 130 -2.471 8.996 3.136 1.00 44.32 C ATOM 1917 C ILE A 130 -2.832 10.181 2.281 1.00 2.45 C ATOM 1918 O ILE A 130 -2.692 10.120 1.071 1.00 34.43 O ATOM 1919 CB ILE A 130 -1.092 8.439 2.595 1.00 53.14 C ATOM 1920 CG1 ILE A 130 -0.689 7.080 3.200 1.00 62.13 C ATOM 1921 CG2 ILE A 130 0.026 9.451 2.815 1.00 64.34 C ATOM 1922 CD1 ILE A 130 -1.373 5.888 2.563 1.00 25.53 C ATOM 0 H ILE A 130 -3.862 7.839 2.086 1.00 3.32 H new ATOM 0 HA ILE A 130 -2.326 9.218 4.193 1.00 44.32 H new ATOM 0 HB ILE A 130 -1.242 8.276 1.528 1.00 53.14 H new ATOM 0 HG12 ILE A 130 0.390 6.959 3.105 1.00 62.13 H new ATOM 0 HG13 ILE A 130 -0.916 7.088 4.266 1.00 62.13 H new ATOM 0 HG21 ILE A 130 0.964 9.046 2.435 1.00 64.34 H new ATOM 0 HG22 ILE A 130 -0.210 10.375 2.287 1.00 64.34 H new ATOM 0 HG23 ILE A 130 0.125 9.658 3.881 1.00 64.34 H new ATOM 0 HD11 ILE A 130 -1.034 4.972 3.047 1.00 25.53 H new ATOM 0 HD12 ILE A 130 -2.453 5.982 2.681 1.00 25.53 H new ATOM 0 HD13 ILE A 130 -1.126 5.851 1.502 1.00 25.53 H new ATOM 1934 N GLY A 131 -3.239 11.248 2.910 1.00 12.44 N ATOM 1935 CA GLY A 131 -3.722 12.442 2.192 1.00 75.35 C ATOM 1936 C GLY A 131 -4.719 12.138 1.073 1.00 2.14 C ATOM 1937 O GLY A 131 -5.887 11.820 1.318 1.00 3.13 O ATOM 0 H GLY A 131 -3.254 11.336 3.926 1.00 12.44 H new ATOM 0 HA2 GLY A 131 -4.190 13.118 2.907 1.00 75.35 H new ATOM 0 HA3 GLY A 131 -2.867 12.969 1.769 1.00 75.35 H new ATOM 1941 N LYS A 132 -4.228 12.203 -0.144 1.00 5.32 N ATOM 1942 CA LYS A 132 -5.028 11.981 -1.330 1.00 3.21 C ATOM 1943 C LYS A 132 -4.724 10.643 -1.975 1.00 41.21 C ATOM 1944 O LYS A 132 -5.322 10.272 -2.982 1.00 54.32 O ATOM 1945 CB LYS A 132 -4.902 13.158 -2.296 1.00 11.25 C ATOM 1946 CG LYS A 132 -3.498 13.704 -2.421 1.00 63.03 C ATOM 1947 CD LYS A 132 -3.504 15.052 -3.110 1.00 73.11 C ATOM 1948 CE LYS A 132 -2.192 15.777 -2.890 1.00 23.11 C ATOM 1949 NZ LYS A 132 -1.887 15.898 -1.441 1.00 3.23 N ATOM 0 H LYS A 132 -3.250 12.414 -0.342 1.00 5.32 H new ATOM 0 HA LYS A 132 -6.075 11.929 -1.031 1.00 3.21 H new ATOM 0 HB2 LYS A 132 -5.248 12.845 -3.281 1.00 11.25 H new ATOM 0 HB3 LYS A 132 -5.564 13.958 -1.965 1.00 11.25 H new ATOM 0 HG2 LYS A 132 -3.050 13.798 -1.432 1.00 63.03 H new ATOM 0 HG3 LYS A 132 -2.880 13.005 -2.985 1.00 63.03 H new ATOM 0 HD2 LYS A 132 -3.676 14.918 -4.178 1.00 73.11 H new ATOM 0 HD3 LYS A 132 -4.327 15.657 -2.728 1.00 73.11 H new ATOM 0 HE2 LYS A 132 -1.387 15.240 -3.391 1.00 23.11 H new ATOM 0 HE3 LYS A 132 -2.241 16.769 -3.339 1.00 23.11 H new ATOM 0 HZ1 LYS A 132 -1.112 16.579 -1.305 1.00 3.23 H new ATOM 0 HZ2 LYS A 132 -2.733 16.230 -0.935 1.00 3.23 H new ATOM 0 HZ3 LYS A 132 -1.602 14.970 -1.068 1.00 3.23 H new ATOM 1963 N PHE A 133 -3.848 9.906 -1.357 1.00 40.13 N ATOM 1964 CA PHE A 133 -3.541 8.559 -1.764 1.00 3.21 C ATOM 1965 C PHE A 133 -4.361 7.642 -0.914 1.00 2.34 C ATOM 1966 O PHE A 133 -4.477 7.849 0.294 1.00 31.40 O ATOM 1967 CB PHE A 133 -2.065 8.215 -1.549 1.00 22.14 C ATOM 1968 CG PHE A 133 -1.103 8.949 -2.417 1.00 1.21 C ATOM 1969 CD1 PHE A 133 -0.654 10.208 -2.069 1.00 32.42 C ATOM 1970 CD2 PHE A 133 -0.628 8.364 -3.574 1.00 1.43 C ATOM 1971 CE1 PHE A 133 0.249 10.870 -2.862 1.00 73.10 C ATOM 1972 CE2 PHE A 133 0.275 9.021 -4.372 1.00 31.20 C ATOM 1973 CZ PHE A 133 0.715 10.275 -4.016 1.00 13.22 C ATOM 0 H PHE A 133 -3.318 10.224 -0.546 1.00 40.13 H new ATOM 0 HA PHE A 133 -3.758 8.455 -2.827 1.00 3.21 H new ATOM 0 HB2 PHE A 133 -1.812 8.413 -0.507 1.00 22.14 H new ATOM 0 HB3 PHE A 133 -1.932 7.146 -1.712 1.00 22.14 H new ATOM 0 HD1 PHE A 133 -1.017 10.675 -1.165 1.00 32.42 H new ATOM 0 HD2 PHE A 133 -0.971 7.379 -3.854 1.00 1.43 H new ATOM 0 HE1 PHE A 133 0.594 11.855 -2.583 1.00 73.10 H new ATOM 0 HE2 PHE A 133 0.639 8.555 -5.276 1.00 31.20 H new ATOM 0 HZ PHE A 133 1.426 10.794 -4.641 1.00 13.22 H new ATOM 1983 N ARG A 134 -4.953 6.672 -1.504 1.00 74.41 N ATOM 1984 CA ARG A 134 -5.731 5.751 -0.746 1.00 52.45 C ATOM 1985 C ARG A 134 -5.333 4.361 -1.153 1.00 71.24 C ATOM 1986 O ARG A 134 -5.442 4.004 -2.329 1.00 24.21 O ATOM 1987 CB ARG A 134 -7.213 5.983 -0.990 1.00 64.41 C ATOM 1988 CG ARG A 134 -8.075 5.481 0.135 1.00 53.34 C ATOM 1989 CD ARG A 134 -9.539 5.752 -0.115 1.00 51.41 C ATOM 1990 NE ARG A 134 -10.304 5.574 1.109 1.00 42.43 N ATOM 1991 CZ ARG A 134 -10.760 4.415 1.587 1.00 72.12 C ATOM 1992 NH1 ARG A 134 -10.694 3.294 0.866 1.00 31.03 N ATOM 1993 NH2 ARG A 134 -11.316 4.399 2.771 1.00 1.24 N ATOM 0 H ARG A 134 -4.918 6.490 -2.507 1.00 74.41 H new ATOM 0 HA ARG A 134 -5.550 5.890 0.320 1.00 52.45 H new ATOM 0 HB2 ARG A 134 -7.391 7.049 -1.130 1.00 64.41 H new ATOM 0 HB3 ARG A 134 -7.506 5.487 -1.915 1.00 64.41 H new ATOM 0 HG2 ARG A 134 -7.920 4.409 0.261 1.00 53.34 H new ATOM 0 HG3 ARG A 134 -7.771 5.959 1.066 1.00 53.34 H new ATOM 0 HD2 ARG A 134 -9.669 6.768 -0.488 1.00 51.41 H new ATOM 0 HD3 ARG A 134 -9.913 5.079 -0.886 1.00 51.41 H new ATOM 0 HE ARG A 134 -10.511 6.412 1.652 1.00 42.43 H new ATOM 0 HH11 ARG A 134 -10.289 3.313 -0.070 1.00 31.03 H new ATOM 0 HH12 ARG A 134 -11.049 2.418 1.251 1.00 31.03 H new ATOM 0 HH21 ARG A 134 -11.394 5.262 3.309 1.00 1.24 H new ATOM 0 HH22 ARG A 134 -11.671 3.524 3.156 1.00 1.24 H new ATOM 2007 N LEU A 135 -4.859 3.594 -0.216 1.00 20.34 N ATOM 2008 CA LEU A 135 -4.378 2.262 -0.489 1.00 34.32 C ATOM 2009 C LEU A 135 -5.331 1.259 0.091 1.00 22.21 C ATOM 2010 O LEU A 135 -5.818 1.430 1.202 1.00 73.40 O ATOM 2011 CB LEU A 135 -3.000 2.039 0.147 1.00 53.00 C ATOM 2012 CG LEU A 135 -1.901 3.033 -0.216 1.00 1.41 C ATOM 2013 CD1 LEU A 135 -0.631 2.727 0.558 1.00 30.14 C ATOM 2014 CD2 LEU A 135 -1.622 3.013 -1.703 1.00 11.50 C ATOM 0 H LEU A 135 -4.793 3.871 0.764 1.00 20.34 H new ATOM 0 HA LEU A 135 -4.301 2.142 -1.570 1.00 34.32 H new ATOM 0 HB2 LEU A 135 -3.121 2.049 1.230 1.00 53.00 H new ATOM 0 HB3 LEU A 135 -2.658 1.041 -0.127 1.00 53.00 H new ATOM 0 HG LEU A 135 -2.247 4.031 0.055 1.00 1.41 H new ATOM 0 HD11 LEU A 135 0.142 3.446 0.287 1.00 30.14 H new ATOM 0 HD12 LEU A 135 -0.831 2.795 1.627 1.00 30.14 H new ATOM 0 HD13 LEU A 135 -0.291 1.720 0.316 1.00 30.14 H new ATOM 0 HD21 LEU A 135 -0.835 3.730 -1.935 1.00 11.50 H new ATOM 0 HD22 LEU A 135 -1.302 2.014 -2.000 1.00 11.50 H new ATOM 0 HD23 LEU A 135 -2.528 3.280 -2.247 1.00 11.50 H new ATOM 2026 N VAL A 136 -5.613 0.252 -0.651 1.00 53.13 N ATOM 2027 CA VAL A 136 -6.439 -0.829 -0.175 1.00 3.22 C ATOM 2028 C VAL A 136 -5.574 -2.079 -0.150 1.00 23.24 C ATOM 2029 O VAL A 136 -5.012 -2.466 -1.182 1.00 31.22 O ATOM 2030 CB VAL A 136 -7.683 -1.054 -1.088 1.00 71.34 C ATOM 2031 CG1 VAL A 136 -8.549 -2.181 -0.550 1.00 72.24 C ATOM 2032 CG2 VAL A 136 -8.506 0.222 -1.215 1.00 72.14 C ATOM 0 H VAL A 136 -5.284 0.141 -1.610 1.00 53.13 H new ATOM 0 HA VAL A 136 -6.819 -0.590 0.818 1.00 3.22 H new ATOM 0 HB VAL A 136 -7.322 -1.332 -2.078 1.00 71.34 H new ATOM 0 HG11 VAL A 136 -9.411 -2.321 -1.202 1.00 72.24 H new ATOM 0 HG12 VAL A 136 -7.967 -3.102 -0.515 1.00 72.24 H new ATOM 0 HG13 VAL A 136 -8.891 -1.930 0.454 1.00 72.24 H new ATOM 0 HG21 VAL A 136 -9.367 0.037 -1.857 1.00 72.14 H new ATOM 0 HG22 VAL A 136 -8.849 0.533 -0.228 1.00 72.14 H new ATOM 0 HG23 VAL A 136 -7.891 1.010 -1.651 1.00 72.14 H new ATOM 2042 N PHE A 137 -5.422 -2.663 1.006 1.00 40.11 N ATOM 2043 CA PHE A 137 -4.579 -3.825 1.176 1.00 44.21 C ATOM 2044 C PHE A 137 -5.422 -5.091 1.158 1.00 54.41 C ATOM 2045 O PHE A 137 -6.269 -5.293 2.024 1.00 53.21 O ATOM 2046 CB PHE A 137 -3.808 -3.690 2.494 1.00 34.34 C ATOM 2047 CG PHE A 137 -2.897 -4.835 2.837 1.00 35.22 C ATOM 2048 CD1 PHE A 137 -1.633 -4.924 2.293 1.00 31.25 C ATOM 2049 CD2 PHE A 137 -3.303 -5.805 3.731 1.00 65.42 C ATOM 2050 CE1 PHE A 137 -0.796 -5.962 2.638 1.00 73.51 C ATOM 2051 CE2 PHE A 137 -2.472 -6.838 4.082 1.00 3.32 C ATOM 2052 CZ PHE A 137 -1.217 -6.915 3.537 1.00 14.34 C ATOM 0 H PHE A 137 -5.879 -2.349 1.863 1.00 40.11 H new ATOM 0 HA PHE A 137 -3.866 -3.892 0.355 1.00 44.21 H new ATOM 0 HB2 PHE A 137 -3.214 -2.777 2.454 1.00 34.34 H new ATOM 0 HB3 PHE A 137 -4.528 -3.567 3.303 1.00 34.34 H new ATOM 0 HD1 PHE A 137 -1.297 -4.175 1.592 1.00 31.25 H new ATOM 0 HD2 PHE A 137 -4.292 -5.750 4.161 1.00 65.42 H new ATOM 0 HE1 PHE A 137 0.190 -6.028 2.203 1.00 73.51 H new ATOM 0 HE2 PHE A 137 -2.805 -7.587 4.785 1.00 3.32 H new ATOM 0 HZ PHE A 137 -0.558 -7.724 3.813 1.00 14.34 H new ATOM 2062 N LEU A 138 -5.189 -5.936 0.191 1.00 43.03 N ATOM 2063 CA LEU A 138 -5.953 -7.155 0.037 1.00 61.20 C ATOM 2064 C LEU A 138 -5.052 -8.332 -0.231 1.00 23.34 C ATOM 2065 O LEU A 138 -4.015 -8.205 -0.877 1.00 44.50 O ATOM 2066 CB LEU A 138 -6.973 -7.031 -1.109 1.00 44.24 C ATOM 2067 CG LEU A 138 -8.157 -6.083 -0.888 1.00 61.13 C ATOM 2068 CD1 LEU A 138 -8.976 -5.953 -2.164 1.00 44.42 C ATOM 2069 CD2 LEU A 138 -9.041 -6.593 0.242 1.00 25.42 C ATOM 0 H LEU A 138 -4.465 -5.804 -0.515 1.00 43.03 H new ATOM 0 HA LEU A 138 -6.485 -7.318 0.974 1.00 61.20 H new ATOM 0 HB2 LEU A 138 -6.440 -6.705 -2.002 1.00 44.24 H new ATOM 0 HB3 LEU A 138 -7.369 -8.025 -1.319 1.00 44.24 H new ATOM 0 HG LEU A 138 -7.766 -5.103 -0.616 1.00 61.13 H new ATOM 0 HD11 LEU A 138 -9.813 -5.277 -1.992 1.00 44.42 H new ATOM 0 HD12 LEU A 138 -8.347 -5.556 -2.961 1.00 44.42 H new ATOM 0 HD13 LEU A 138 -9.355 -6.933 -2.455 1.00 44.42 H new ATOM 0 HD21 LEU A 138 -9.877 -5.909 0.387 1.00 25.42 H new ATOM 0 HD22 LEU A 138 -9.421 -7.583 -0.012 1.00 25.42 H new ATOM 0 HD23 LEU A 138 -8.458 -6.653 1.161 1.00 25.42 H new ATOM 2081 N ALA A 139 -5.414 -9.452 0.299 1.00 24.00 N ATOM 2082 CA ALA A 139 -4.750 -10.677 -0.009 1.00 63.21 C ATOM 2083 C ALA A 139 -5.549 -11.342 -1.095 1.00 32.15 C ATOM 2084 O ALA A 139 -6.716 -11.635 -0.899 1.00 10.04 O ATOM 2085 CB ALA A 139 -4.676 -11.566 1.220 1.00 30.13 C ATOM 0 H ALA A 139 -6.183 -9.545 0.962 1.00 24.00 H new ATOM 0 HA ALA A 139 -3.726 -10.494 -0.336 1.00 63.21 H new ATOM 0 HB1 ALA A 139 -4.167 -12.496 0.966 1.00 30.13 H new ATOM 0 HB2 ALA A 139 -4.124 -11.053 2.008 1.00 30.13 H new ATOM 0 HB3 ALA A 139 -5.684 -11.788 1.569 1.00 30.13 H new ATOM 2091 N GLY A 140 -4.951 -11.570 -2.223 1.00 23.02 N ATOM 2092 CA GLY A 140 -5.704 -12.119 -3.303 1.00 72.00 C ATOM 2093 C GLY A 140 -5.043 -13.323 -3.919 1.00 53.12 C ATOM 2094 O GLY A 140 -3.814 -13.467 -3.828 1.00 60.50 O ATOM 0 H GLY A 140 -3.966 -11.389 -2.417 1.00 23.02 H new ATOM 0 HA2 GLY A 140 -6.695 -12.397 -2.945 1.00 72.00 H new ATOM 0 HA3 GLY A 140 -5.844 -11.355 -4.068 1.00 72.00 H new ATOM 2098 N PRO A 141 -5.828 -14.229 -4.521 1.00 22.30 N ATOM 2099 CA PRO A 141 -5.319 -15.392 -5.234 1.00 72.41 C ATOM 2100 C PRO A 141 -4.663 -14.998 -6.547 1.00 5.55 C ATOM 2101 O PRO A 141 -4.818 -13.852 -7.008 1.00 52.21 O ATOM 2102 CB PRO A 141 -6.554 -16.251 -5.512 1.00 34.21 C ATOM 2103 CG PRO A 141 -7.651 -15.637 -4.707 1.00 41.13 C ATOM 2104 CD PRO A 141 -7.299 -14.191 -4.571 1.00 32.14 C ATOM 0 HA PRO A 141 -4.559 -15.912 -4.651 1.00 72.41 H new ATOM 0 HB2 PRO A 141 -6.800 -16.254 -6.574 1.00 34.21 H new ATOM 0 HB3 PRO A 141 -6.386 -17.288 -5.221 1.00 34.21 H new ATOM 0 HG2 PRO A 141 -8.614 -15.760 -5.202 1.00 41.13 H new ATOM 0 HG3 PRO A 141 -7.732 -16.113 -3.730 1.00 41.13 H new ATOM 0 HD2 PRO A 141 -7.662 -13.603 -5.414 1.00 32.14 H new ATOM 0 HD3 PRO A 141 -7.725 -13.752 -3.669 1.00 32.14 H new ATOM 2112 N ALA A 142 -3.895 -15.928 -7.094 1.00 0.44 N ATOM 2113 CA ALA A 142 -3.193 -15.798 -8.367 1.00 50.21 C ATOM 2114 C ALA A 142 -1.871 -15.099 -8.212 1.00 5.45 C ATOM 2115 O ALA A 142 -1.687 -13.939 -8.607 1.00 55.43 O ATOM 2116 CB ALA A 142 -4.048 -15.217 -9.501 1.00 73.43 C ATOM 0 H ALA A 142 -3.736 -16.831 -6.647 1.00 0.44 H new ATOM 0 HA ALA A 142 -2.978 -16.818 -8.686 1.00 50.21 H new ATOM 0 HB1 ALA A 142 -3.451 -15.154 -10.411 1.00 73.43 H new ATOM 0 HB2 ALA A 142 -4.909 -15.863 -9.675 1.00 73.43 H new ATOM 0 HB3 ALA A 142 -4.392 -14.221 -9.223 1.00 73.43 H new ATOM 2122 N GLU A 143 -0.976 -15.783 -7.573 1.00 44.25 N ATOM 2123 CA GLU A 143 0.362 -15.311 -7.362 1.00 25.44 C ATOM 2124 C GLU A 143 1.240 -16.537 -7.480 1.00 25.12 C ATOM 2125 O GLU A 143 1.269 -17.351 -6.533 1.00 37.90 O ATOM 2126 CB GLU A 143 0.500 -14.667 -5.959 1.00 32.32 C ATOM 2127 CG GLU A 143 1.612 -13.596 -5.801 1.00 13.51 C ATOM 2128 CD GLU A 143 3.032 -14.064 -6.103 1.00 1.43 C ATOM 2129 OE1 GLU A 143 3.644 -14.749 -5.257 1.00 54.12 O ATOM 2130 OE2 GLU A 143 3.578 -13.710 -7.176 1.00 34.03 O ATOM 2131 OXT GLU A 143 1.862 -16.727 -8.532 1.00 37.90 O ATOM 0 H GLU A 143 -1.155 -16.704 -7.174 1.00 44.25 H new ATOM 0 HA GLU A 143 0.641 -14.543 -8.083 1.00 25.44 H new ATOM 0 HB2 GLU A 143 -0.454 -14.211 -5.697 1.00 32.32 H new ATOM 0 HB3 GLU A 143 0.684 -15.461 -5.235 1.00 32.32 H new ATOM 0 HG2 GLU A 143 1.379 -12.758 -6.457 1.00 13.51 H new ATOM 0 HG3 GLU A 143 1.584 -13.218 -4.779 1.00 13.51 H new TER 2138 GLU A 143