USER MOD reduce.3.24.130724 H: found=0, std=0, add=1007, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1001 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 50 MET CE :methyl 168:sc= 0 (180deg=-0.131) USER MOD Set 1.2: A 101 HIS : no HD1:sc=-0.00954 X(o=-0.0095,f=-0.4) USER MOD Single : A 1 GLY N :NH3+ -130:sc= 0.0418 (180deg=0) USER MOD Single : A 2 SER OG : rot -55:sc= 0.0237 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 44:sc= 0.664 USER MOD Single : A 11 ASN : amide:sc= -0.495 K(o=-0.49,f=-2) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.0547 K(o=-0.055,f=-1.6!) USER MOD Single : A 19 GLN : amide:sc= -0.0181 K(o=-0.018,f=-0.59) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 23 THR OG1 : rot 79:sc= 0.734 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 1.03 K(o=1,f=-0.0023) USER MOD Single : A 33 SER OG : rot -170:sc= 0.0269 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc=-0.00571 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 CYS SG : rot -90:sc= 0.745 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 MET CE :methyl 155:sc= -0.278 (180deg=-1.07) USER MOD Single : A 44 LYS NZ :NH3+ 151:sc= -1.4! (180deg=-2.4!) USER MOD Single : A 45 LYS NZ :NH3+ -168:sc= 0.0583 (180deg=-0.00968) USER MOD Single : A 48 HIS : no HD1:sc= -0.284 X(o=-0.28,f=0.018) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 ASN : amide:sc= -0.0497 X(o=-0.05,f=-0.05) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 145:sc= -0.793 (180deg=-2.81!) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.103 X(o=-0.1,f=-0.41) USER MOD Single : A 67 GLN : amide:sc= -0.0112 K(o=-0.011,f=-1.1) USER MOD Single : A 69 GLN : amide:sc= -0.0412 K(o=-0.041,f=-1) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl -176:sc= -0.165 (180deg=-0.26) USER MOD Single : A 76 THR OG1 : rot 160:sc= -0.0734 USER MOD Single : A 80 THR OG1 : rot 180:sc= -0.606 USER MOD Single : A 87 ASN : amide:sc= -1.96 K(o=-2,f=-9.7!) USER MOD Single : A 89 THR OG1 : rot 11:sc= 0.305 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0159 USER MOD Single : A 97 THR OG1 : rot 73:sc= 1.04 USER MOD Single : A 98 HIS : no HE2:sc= -0.0523 K(o=-0.052,f=-3.4!) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ -151:sc=-0.000406 (180deg=-0.867) USER MOD Single : A 111 HIS : no HD1:sc= -6.52! C(o=-6.5!,f=-4.6!) USER MOD Single : A 112 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 GLN : amide:sc= -6.94! C(o=-6.9!,f=-12!) USER MOD Single : A 125 SER OG : rot 37:sc= 0.655 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.338 -7.309 -23.195 1.00 0.00 N ATOM 2 CA GLY A 1 7.350 -6.275 -23.303 1.00 0.00 C ATOM 3 C GLY A 1 6.835 -4.913 -22.881 1.00 0.00 C ATOM 4 O GLY A 1 5.883 -4.815 -22.108 1.00 0.00 O ATOM 0 H1 GLY A 1 6.725 -8.120 -22.672 1.00 0.00 H new ATOM 0 H2 GLY A 1 5.511 -6.934 -22.689 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.052 -7.615 -24.147 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.207 -6.544 -22.685 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.704 -6.223 -24.333 1.00 0.00 H new ATOM 8 N SER A 2 7.467 -3.860 -23.390 1.00 0.00 N ATOM 9 CA SER A 2 7.070 -2.497 -23.057 1.00 0.00 C ATOM 10 C SER A 2 7.363 -2.188 -21.592 1.00 0.00 C ATOM 11 O SER A 2 6.553 -1.569 -20.902 1.00 0.00 O ATOM 12 CB SER A 2 5.581 -2.291 -23.345 1.00 0.00 C ATOM 13 OG SER A 2 5.272 -0.914 -23.473 1.00 0.00 O ATOM 0 H SER A 2 8.255 -3.925 -24.034 1.00 0.00 H new ATOM 0 HA SER A 2 7.651 -1.815 -23.678 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.309 -2.815 -24.261 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.988 -2.727 -22.541 1.00 0.00 H new ATOM 0 HG SER A 2 5.565 -0.437 -22.669 1.00 0.00 H new ATOM 19 N SER A 3 8.527 -2.625 -21.123 1.00 0.00 N ATOM 20 CA SER A 3 8.927 -2.399 -19.739 1.00 0.00 C ATOM 21 C SER A 3 10.199 -1.560 -19.671 1.00 0.00 C ATOM 22 O SER A 3 11.006 -1.557 -20.600 1.00 0.00 O ATOM 23 CB SER A 3 9.146 -3.735 -19.025 1.00 0.00 C ATOM 24 OG SER A 3 7.933 -4.226 -18.480 1.00 0.00 O ATOM 0 H SER A 3 9.210 -3.138 -21.681 1.00 0.00 H new ATOM 0 HA SER A 3 8.126 -1.854 -19.240 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.555 -4.463 -19.726 1.00 0.00 H new ATOM 0 HB3 SER A 3 9.881 -3.610 -18.230 1.00 0.00 H new ATOM 0 HG SER A 3 8.099 -5.081 -18.031 1.00 0.00 H new ATOM 30 N GLY A 4 10.371 -0.846 -18.562 1.00 0.00 N ATOM 31 CA GLY A 4 11.546 -0.011 -18.392 1.00 0.00 C ATOM 32 C GLY A 4 12.585 -0.649 -17.491 1.00 0.00 C ATOM 33 O GLY A 4 13.115 -0.002 -16.588 1.00 0.00 O ATOM 0 H GLY A 4 9.718 -0.831 -17.779 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.989 0.190 -19.367 1.00 0.00 H new ATOM 0 HA3 GLY A 4 11.248 0.950 -17.973 1.00 0.00 H new ATOM 37 N SER A 5 12.876 -1.923 -17.735 1.00 0.00 N ATOM 38 CA SER A 5 13.854 -2.650 -16.936 1.00 0.00 C ATOM 39 C SER A 5 14.986 -3.181 -17.811 1.00 0.00 C ATOM 40 O SER A 5 14.776 -3.523 -18.975 1.00 0.00 O ATOM 41 CB SER A 5 13.181 -3.808 -16.196 1.00 0.00 C ATOM 42 OG SER A 5 12.275 -3.330 -15.217 1.00 0.00 O ATOM 0 H SER A 5 12.448 -2.473 -18.480 1.00 0.00 H new ATOM 0 HA SER A 5 14.276 -1.958 -16.207 1.00 0.00 H new ATOM 0 HB2 SER A 5 12.651 -4.440 -16.909 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.940 -4.430 -15.721 1.00 0.00 H new ATOM 0 HG SER A 5 11.857 -4.089 -14.760 1.00 0.00 H new ATOM 48 N SER A 6 16.185 -3.246 -17.242 1.00 0.00 N ATOM 49 CA SER A 6 17.351 -3.731 -17.971 1.00 0.00 C ATOM 50 C SER A 6 17.923 -4.981 -17.310 1.00 0.00 C ATOM 51 O SER A 6 18.308 -4.959 -16.142 1.00 0.00 O ATOM 52 CB SER A 6 18.424 -2.642 -18.042 1.00 0.00 C ATOM 53 OG SER A 6 19.421 -2.969 -18.994 1.00 0.00 O ATOM 0 H SER A 6 16.375 -2.969 -16.279 1.00 0.00 H new ATOM 0 HA SER A 6 17.036 -3.987 -18.982 1.00 0.00 H new ATOM 0 HB2 SER A 6 17.963 -1.690 -18.306 1.00 0.00 H new ATOM 0 HB3 SER A 6 18.882 -2.514 -17.061 1.00 0.00 H new ATOM 0 HG SER A 6 20.093 -2.257 -19.021 1.00 0.00 H new ATOM 59 N GLY A 7 17.976 -6.072 -18.069 1.00 0.00 N ATOM 60 CA GLY A 7 18.502 -7.318 -17.541 1.00 0.00 C ATOM 61 C GLY A 7 17.583 -7.946 -16.512 1.00 0.00 C ATOM 62 O GLY A 7 17.369 -7.386 -15.437 1.00 0.00 O ATOM 0 H GLY A 7 17.664 -6.115 -19.039 1.00 0.00 H new ATOM 0 HA2 GLY A 7 18.657 -8.019 -18.361 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.477 -7.135 -17.089 1.00 0.00 H new ATOM 66 N SER A 8 17.036 -9.111 -16.843 1.00 0.00 N ATOM 67 CA SER A 8 16.129 -9.813 -15.942 1.00 0.00 C ATOM 68 C SER A 8 16.797 -11.055 -15.359 1.00 0.00 C ATOM 69 O SER A 8 16.589 -12.170 -15.838 1.00 0.00 O ATOM 70 CB SER A 8 14.848 -10.208 -16.679 1.00 0.00 C ATOM 71 OG SER A 8 15.136 -11.026 -17.800 1.00 0.00 O ATOM 0 H SER A 8 17.205 -9.589 -17.728 1.00 0.00 H new ATOM 0 HA SER A 8 15.876 -9.139 -15.124 1.00 0.00 H new ATOM 0 HB2 SER A 8 14.182 -10.739 -15.999 1.00 0.00 H new ATOM 0 HB3 SER A 8 14.321 -9.311 -17.005 1.00 0.00 H new ATOM 0 HG SER A 8 15.805 -11.697 -17.552 1.00 0.00 H new ATOM 77 N LEU A 9 17.602 -10.853 -14.321 1.00 0.00 N ATOM 78 CA LEU A 9 18.301 -11.956 -13.670 1.00 0.00 C ATOM 79 C LEU A 9 17.723 -12.226 -12.285 1.00 0.00 C ATOM 80 O LEU A 9 17.445 -11.297 -11.526 1.00 0.00 O ATOM 81 CB LEU A 9 19.795 -11.643 -13.559 1.00 0.00 C ATOM 82 CG LEU A 9 20.659 -12.070 -14.746 1.00 0.00 C ATOM 83 CD1 LEU A 9 20.304 -13.482 -15.185 1.00 0.00 C ATOM 84 CD2 LEU A 9 20.498 -11.093 -15.902 1.00 0.00 C ATOM 0 H LEU A 9 17.787 -9.937 -13.913 1.00 0.00 H new ATOM 0 HA LEU A 9 18.166 -12.849 -14.280 1.00 0.00 H new ATOM 0 HB2 LEU A 9 19.911 -10.568 -13.418 1.00 0.00 H new ATOM 0 HB3 LEU A 9 20.181 -12.126 -12.661 1.00 0.00 H new ATOM 0 HG LEU A 9 21.703 -12.061 -14.432 1.00 0.00 H new ATOM 0 HD11 LEU A 9 20.929 -13.768 -16.031 1.00 0.00 H new ATOM 0 HD12 LEU A 9 20.472 -14.173 -14.359 1.00 0.00 H new ATOM 0 HD13 LEU A 9 19.255 -13.518 -15.480 1.00 0.00 H new ATOM 0 HD21 LEU A 9 21.120 -11.413 -16.738 1.00 0.00 H new ATOM 0 HD22 LEU A 9 19.454 -11.069 -16.215 1.00 0.00 H new ATOM 0 HD23 LEU A 9 20.804 -10.097 -15.582 1.00 0.00 H new ATOM 96 N GLU A 10 17.546 -13.503 -11.961 1.00 0.00 N ATOM 97 CA GLU A 10 17.002 -13.894 -10.666 1.00 0.00 C ATOM 98 C GLU A 10 18.055 -13.758 -9.570 1.00 0.00 C ATOM 99 O GLU A 10 18.878 -14.650 -9.371 1.00 0.00 O ATOM 100 CB GLU A 10 16.488 -15.335 -10.718 1.00 0.00 C ATOM 101 CG GLU A 10 15.192 -15.491 -11.497 1.00 0.00 C ATOM 102 CD GLU A 10 13.983 -15.005 -10.720 1.00 0.00 C ATOM 103 OE1 GLU A 10 14.051 -13.895 -10.152 1.00 0.00 O ATOM 104 OE2 GLU A 10 12.971 -15.735 -10.680 1.00 0.00 O ATOM 0 H GLU A 10 17.771 -14.284 -12.577 1.00 0.00 H new ATOM 0 HA GLU A 10 16.172 -13.227 -10.433 1.00 0.00 H new ATOM 0 HB2 GLU A 10 17.252 -15.968 -11.169 1.00 0.00 H new ATOM 0 HB3 GLU A 10 16.336 -15.695 -9.700 1.00 0.00 H new ATOM 0 HG2 GLU A 10 15.265 -14.936 -12.432 1.00 0.00 H new ATOM 0 HG3 GLU A 10 15.054 -16.540 -11.759 1.00 0.00 H new ATOM 111 N ASN A 11 18.022 -12.633 -8.863 1.00 0.00 N ATOM 112 CA ASN A 11 18.973 -12.378 -7.788 1.00 0.00 C ATOM 113 C ASN A 11 18.253 -12.202 -6.454 1.00 0.00 C ATOM 114 O ASN A 11 17.036 -12.015 -6.413 1.00 0.00 O ATOM 115 CB ASN A 11 19.805 -11.132 -8.099 1.00 0.00 C ATOM 116 CG ASN A 11 21.067 -11.055 -7.262 1.00 0.00 C ATOM 117 OD1 ASN A 11 21.675 -12.076 -6.940 1.00 0.00 O ATOM 118 ND2 ASN A 11 21.467 -9.840 -6.905 1.00 0.00 N ATOM 0 H ASN A 11 17.347 -11.884 -9.015 1.00 0.00 H new ATOM 0 HA ASN A 11 19.636 -13.240 -7.712 1.00 0.00 H new ATOM 0 HB2 ASN A 11 20.073 -11.132 -9.156 1.00 0.00 H new ATOM 0 HB3 ASN A 11 19.201 -10.242 -7.923 1.00 0.00 H new ATOM 0 HD21 ASN A 11 22.309 -9.726 -6.341 1.00 0.00 H new ATOM 0 HD22 ASN A 11 20.932 -9.021 -7.195 1.00 0.00 H new ATOM 125 N LEU A 12 19.012 -12.263 -5.366 1.00 0.00 N ATOM 126 CA LEU A 12 18.447 -12.110 -4.030 1.00 0.00 C ATOM 127 C LEU A 12 19.221 -11.069 -3.227 1.00 0.00 C ATOM 128 O LEU A 12 20.058 -11.411 -2.393 1.00 0.00 O ATOM 129 CB LEU A 12 18.458 -13.450 -3.293 1.00 0.00 C ATOM 130 CG LEU A 12 17.421 -14.476 -3.750 1.00 0.00 C ATOM 131 CD1 LEU A 12 17.908 -15.212 -4.989 1.00 0.00 C ATOM 132 CD2 LEU A 12 17.114 -15.460 -2.630 1.00 0.00 C ATOM 0 H LEU A 12 20.020 -12.417 -5.382 1.00 0.00 H new ATOM 0 HA LEU A 12 17.417 -11.769 -4.135 1.00 0.00 H new ATOM 0 HB2 LEU A 12 19.449 -13.892 -3.399 1.00 0.00 H new ATOM 0 HB3 LEU A 12 18.307 -13.259 -2.231 1.00 0.00 H new ATOM 0 HG LEU A 12 16.503 -13.947 -4.004 1.00 0.00 H new ATOM 0 HD11 LEU A 12 17.157 -15.938 -5.300 1.00 0.00 H new ATOM 0 HD12 LEU A 12 18.076 -14.497 -5.794 1.00 0.00 H new ATOM 0 HD13 LEU A 12 18.840 -15.729 -4.762 1.00 0.00 H new ATOM 0 HD21 LEU A 12 16.374 -16.183 -2.973 1.00 0.00 H new ATOM 0 HD22 LEU A 12 18.027 -15.983 -2.345 1.00 0.00 H new ATOM 0 HD23 LEU A 12 16.721 -14.920 -1.769 1.00 0.00 H new ATOM 144 N ALA A 13 18.933 -9.797 -3.484 1.00 0.00 N ATOM 145 CA ALA A 13 19.599 -8.706 -2.783 1.00 0.00 C ATOM 146 C ALA A 13 18.674 -8.073 -1.749 1.00 0.00 C ATOM 147 O ALA A 13 18.870 -6.926 -1.345 1.00 0.00 O ATOM 148 CB ALA A 13 20.082 -7.658 -3.775 1.00 0.00 C ATOM 0 H ALA A 13 18.243 -9.497 -4.173 1.00 0.00 H new ATOM 0 HA ALA A 13 20.461 -9.117 -2.258 1.00 0.00 H new ATOM 0 HB1 ALA A 13 20.577 -6.849 -3.238 1.00 0.00 H new ATOM 0 HB2 ALA A 13 20.785 -8.114 -4.473 1.00 0.00 H new ATOM 0 HB3 ALA A 13 19.231 -7.259 -4.326 1.00 0.00 H new ATOM 154 N THR A 14 17.664 -8.826 -1.325 1.00 0.00 N ATOM 155 CA THR A 14 16.708 -8.337 -0.339 1.00 0.00 C ATOM 156 C THR A 14 16.363 -6.873 -0.587 1.00 0.00 C ATOM 157 O THR A 14 16.442 -6.045 0.320 1.00 0.00 O ATOM 158 CB THR A 14 17.251 -8.490 1.094 1.00 0.00 C ATOM 159 OG1 THR A 14 17.957 -9.729 1.221 1.00 0.00 O ATOM 160 CG2 THR A 14 16.119 -8.439 2.109 1.00 0.00 C ATOM 0 H THR A 14 17.487 -9.777 -1.649 1.00 0.00 H new ATOM 0 HA THR A 14 15.808 -8.942 -0.444 1.00 0.00 H new ATOM 0 HB THR A 14 17.933 -7.663 1.291 1.00 0.00 H new ATOM 0 HG1 THR A 14 18.300 -9.818 2.135 1.00 0.00 H new ATOM 0 HG21 THR A 14 16.526 -8.549 3.114 1.00 0.00 H new ATOM 0 HG22 THR A 14 15.602 -7.483 2.030 1.00 0.00 H new ATOM 0 HG23 THR A 14 15.416 -9.249 1.912 1.00 0.00 H new ATOM 168 N ALA A 15 15.980 -6.561 -1.820 1.00 0.00 N ATOM 169 CA ALA A 15 15.620 -5.196 -2.186 1.00 0.00 C ATOM 170 C ALA A 15 14.487 -4.674 -1.309 1.00 0.00 C ATOM 171 O ALA A 15 13.788 -5.433 -0.638 1.00 0.00 O ATOM 172 CB ALA A 15 15.228 -5.129 -3.654 1.00 0.00 C ATOM 0 H ALA A 15 15.911 -7.235 -2.583 1.00 0.00 H new ATOM 0 HA ALA A 15 16.491 -4.561 -2.025 1.00 0.00 H new ATOM 0 HB1 ALA A 15 14.962 -4.104 -3.913 1.00 0.00 H new ATOM 0 HB2 ALA A 15 16.067 -5.453 -4.270 1.00 0.00 H new ATOM 0 HB3 ALA A 15 14.374 -5.782 -3.833 1.00 0.00 H new ATOM 178 N PRO A 16 14.299 -3.346 -1.313 1.00 0.00 N ATOM 179 CA PRO A 16 13.252 -2.692 -0.523 1.00 0.00 C ATOM 180 C PRO A 16 11.854 -2.990 -1.055 1.00 0.00 C ATOM 181 O PRO A 16 10.943 -3.308 -0.290 1.00 0.00 O ATOM 182 CB PRO A 16 13.573 -1.203 -0.670 1.00 0.00 C ATOM 183 CG PRO A 16 14.315 -1.101 -1.958 1.00 0.00 C ATOM 184 CD PRO A 16 15.095 -2.380 -2.090 1.00 0.00 C ATOM 0 HA PRO A 16 13.244 -3.040 0.510 1.00 0.00 H new ATOM 0 HB2 PRO A 16 12.664 -0.602 -0.688 1.00 0.00 H new ATOM 0 HB3 PRO A 16 14.176 -0.844 0.164 1.00 0.00 H new ATOM 0 HG2 PRO A 16 13.628 -0.975 -2.795 1.00 0.00 H new ATOM 0 HG3 PRO A 16 14.980 -0.237 -1.958 1.00 0.00 H new ATOM 0 HD2 PRO A 16 15.193 -2.685 -3.132 1.00 0.00 H new ATOM 0 HD3 PRO A 16 16.104 -2.278 -1.692 1.00 0.00 H new ATOM 192 N VAL A 17 11.691 -2.886 -2.370 1.00 0.00 N ATOM 193 CA VAL A 17 10.404 -3.146 -3.004 1.00 0.00 C ATOM 194 C VAL A 17 9.802 -4.456 -2.509 1.00 0.00 C ATOM 195 O VAL A 17 8.596 -4.553 -2.290 1.00 0.00 O ATOM 196 CB VAL A 17 10.535 -3.200 -4.538 1.00 0.00 C ATOM 197 CG1 VAL A 17 11.040 -4.564 -4.982 1.00 0.00 C ATOM 198 CG2 VAL A 17 9.203 -2.874 -5.197 1.00 0.00 C ATOM 0 H VAL A 17 12.434 -2.623 -3.017 1.00 0.00 H new ATOM 0 HA VAL A 17 9.745 -2.322 -2.732 1.00 0.00 H new ATOM 0 HB VAL A 17 11.262 -2.451 -4.851 1.00 0.00 H new ATOM 0 HG11 VAL A 17 11.126 -4.584 -6.068 1.00 0.00 H new ATOM 0 HG12 VAL A 17 12.017 -4.753 -4.537 1.00 0.00 H new ATOM 0 HG13 VAL A 17 10.339 -5.334 -4.660 1.00 0.00 H new ATOM 0 HG21 VAL A 17 9.313 -2.917 -6.281 1.00 0.00 H new ATOM 0 HG22 VAL A 17 8.453 -3.599 -4.880 1.00 0.00 H new ATOM 0 HG23 VAL A 17 8.887 -1.873 -4.903 1.00 0.00 H new ATOM 208 N ASN A 18 10.653 -5.463 -2.335 1.00 0.00 N ATOM 209 CA ASN A 18 10.205 -6.769 -1.866 1.00 0.00 C ATOM 210 C ASN A 18 9.555 -6.659 -0.490 1.00 0.00 C ATOM 211 O ASN A 18 8.479 -7.208 -0.256 1.00 0.00 O ATOM 212 CB ASN A 18 11.382 -7.745 -1.810 1.00 0.00 C ATOM 213 CG ASN A 18 11.792 -8.236 -3.185 1.00 0.00 C ATOM 214 OD1 ASN A 18 11.011 -8.179 -4.135 1.00 0.00 O ATOM 215 ND2 ASN A 18 13.022 -8.723 -3.297 1.00 0.00 N ATOM 0 H ASN A 18 11.656 -5.399 -2.512 1.00 0.00 H new ATOM 0 HA ASN A 18 9.463 -7.145 -2.570 1.00 0.00 H new ATOM 0 HB2 ASN A 18 12.232 -7.258 -1.333 1.00 0.00 H new ATOM 0 HB3 ASN A 18 11.113 -8.599 -1.188 1.00 0.00 H new ATOM 0 HD21 ASN A 18 13.353 -9.069 -4.197 1.00 0.00 H new ATOM 0 HD22 ASN A 18 13.636 -8.751 -2.483 1.00 0.00 H new ATOM 222 N GLN A 19 10.217 -5.947 0.416 1.00 0.00 N ATOM 223 CA GLN A 19 9.703 -5.765 1.769 1.00 0.00 C ATOM 224 C GLN A 19 8.318 -5.128 1.744 1.00 0.00 C ATOM 225 O GLN A 19 7.542 -5.270 2.689 1.00 0.00 O ATOM 226 CB GLN A 19 10.662 -4.900 2.589 1.00 0.00 C ATOM 227 CG GLN A 19 12.027 -5.535 2.799 1.00 0.00 C ATOM 228 CD GLN A 19 12.843 -4.826 3.861 1.00 0.00 C ATOM 229 OE1 GLN A 19 12.319 -4.432 4.903 1.00 0.00 O ATOM 230 NE2 GLN A 19 14.135 -4.661 3.603 1.00 0.00 N ATOM 0 H GLN A 19 11.110 -5.487 0.238 1.00 0.00 H new ATOM 0 HA GLN A 19 9.622 -6.747 2.235 1.00 0.00 H new ATOM 0 HB2 GLN A 19 10.790 -3.940 2.089 1.00 0.00 H new ATOM 0 HB3 GLN A 19 10.213 -4.695 3.561 1.00 0.00 H new ATOM 0 HG2 GLN A 19 11.898 -6.580 3.083 1.00 0.00 H new ATOM 0 HG3 GLN A 19 12.576 -5.526 1.858 1.00 0.00 H new ATOM 0 HE21 GLN A 19 14.528 -5.003 2.726 1.00 0.00 H new ATOM 0 HE22 GLN A 19 14.735 -4.192 4.282 1.00 0.00 H new ATOM 239 N ILE A 20 8.015 -4.424 0.658 1.00 0.00 N ATOM 240 CA ILE A 20 6.723 -3.766 0.511 1.00 0.00 C ATOM 241 C ILE A 20 5.681 -4.721 -0.061 1.00 0.00 C ATOM 242 O ILE A 20 4.533 -4.738 0.380 1.00 0.00 O ATOM 243 CB ILE A 20 6.823 -2.527 -0.399 1.00 0.00 C ATOM 244 CG1 ILE A 20 7.761 -1.488 0.219 1.00 0.00 C ATOM 245 CG2 ILE A 20 5.444 -1.931 -0.635 1.00 0.00 C ATOM 246 CD1 ILE A 20 8.246 -0.449 -0.769 1.00 0.00 C ATOM 0 H ILE A 20 8.647 -4.295 -0.132 1.00 0.00 H new ATOM 0 HA ILE A 20 6.414 -3.451 1.508 1.00 0.00 H new ATOM 0 HB ILE A 20 7.234 -2.833 -1.361 1.00 0.00 H new ATOM 0 HG12 ILE A 20 7.246 -0.986 1.038 1.00 0.00 H new ATOM 0 HG13 ILE A 20 8.622 -1.998 0.650 1.00 0.00 H new ATOM 0 HG21 ILE A 20 5.531 -1.056 -1.280 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.804 -2.672 -1.114 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.007 -1.636 0.319 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.906 0.255 -0.262 1.00 0.00 H new ATOM 0 HD12 ILE A 20 8.790 -0.940 -1.576 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.392 0.088 -1.181 1.00 0.00 H new ATOM 258 N GLN A 21 6.092 -5.515 -1.045 1.00 0.00 N ATOM 259 CA GLN A 21 5.193 -6.474 -1.677 1.00 0.00 C ATOM 260 C GLN A 21 4.643 -7.461 -0.652 1.00 0.00 C ATOM 261 O GLN A 21 3.488 -7.877 -0.737 1.00 0.00 O ATOM 262 CB GLN A 21 5.921 -7.229 -2.790 1.00 0.00 C ATOM 263 CG GLN A 21 6.373 -6.338 -3.935 1.00 0.00 C ATOM 264 CD GLN A 21 6.423 -7.071 -5.261 1.00 0.00 C ATOM 265 OE1 GLN A 21 6.748 -8.257 -5.316 1.00 0.00 O ATOM 266 NE2 GLN A 21 6.101 -6.366 -6.340 1.00 0.00 N ATOM 0 H GLN A 21 7.040 -5.513 -1.421 1.00 0.00 H new ATOM 0 HA GLN A 21 4.357 -5.922 -2.108 1.00 0.00 H new ATOM 0 HB2 GLN A 21 6.791 -7.732 -2.367 1.00 0.00 H new ATOM 0 HB3 GLN A 21 5.263 -8.004 -3.182 1.00 0.00 H new ATOM 0 HG2 GLN A 21 5.695 -5.489 -4.019 1.00 0.00 H new ATOM 0 HG3 GLN A 21 7.361 -5.936 -3.709 1.00 0.00 H new ATOM 0 HE21 GLN A 21 5.837 -5.385 -6.248 1.00 0.00 H new ATOM 0 HE22 GLN A 21 6.117 -6.806 -7.260 1.00 0.00 H new ATOM 275 N GLU A 22 5.478 -7.831 0.314 1.00 0.00 N ATOM 276 CA GLU A 22 5.073 -8.770 1.354 1.00 0.00 C ATOM 277 C GLU A 22 4.074 -8.126 2.310 1.00 0.00 C ATOM 278 O GLU A 22 3.187 -8.794 2.843 1.00 0.00 O ATOM 279 CB GLU A 22 6.296 -9.261 2.131 1.00 0.00 C ATOM 280 CG GLU A 22 6.833 -8.246 3.126 1.00 0.00 C ATOM 281 CD GLU A 22 7.761 -8.868 4.151 1.00 0.00 C ATOM 282 OE1 GLU A 22 8.517 -9.793 3.785 1.00 0.00 O ATOM 283 OE2 GLU A 22 7.731 -8.430 5.321 1.00 0.00 O ATOM 0 H GLU A 22 6.438 -7.496 0.398 1.00 0.00 H new ATOM 0 HA GLU A 22 4.591 -9.621 0.873 1.00 0.00 H new ATOM 0 HB2 GLU A 22 6.035 -10.176 2.663 1.00 0.00 H new ATOM 0 HB3 GLU A 22 7.086 -9.518 1.425 1.00 0.00 H new ATOM 0 HG2 GLU A 22 7.366 -7.462 2.588 1.00 0.00 H new ATOM 0 HG3 GLU A 22 5.998 -7.769 3.639 1.00 0.00 H new ATOM 290 N THR A 23 4.224 -6.822 2.524 1.00 0.00 N ATOM 291 CA THR A 23 3.337 -6.087 3.417 1.00 0.00 C ATOM 292 C THR A 23 1.956 -5.909 2.796 1.00 0.00 C ATOM 293 O THR A 23 0.938 -6.140 3.449 1.00 0.00 O ATOM 294 CB THR A 23 3.913 -4.702 3.765 1.00 0.00 C ATOM 295 OG1 THR A 23 5.223 -4.843 4.326 1.00 0.00 O ATOM 296 CG2 THR A 23 3.011 -3.972 4.749 1.00 0.00 C ATOM 0 H THR A 23 4.952 -6.254 2.091 1.00 0.00 H new ATOM 0 HA THR A 23 3.249 -6.676 4.330 1.00 0.00 H new ATOM 0 HB THR A 23 3.972 -4.117 2.847 1.00 0.00 H new ATOM 0 HG1 THR A 23 5.871 -4.998 3.608 1.00 0.00 H new ATOM 0 HG21 THR A 23 3.439 -2.996 4.980 1.00 0.00 H new ATOM 0 HG22 THR A 23 2.023 -3.840 4.308 1.00 0.00 H new ATOM 0 HG23 THR A 23 2.924 -4.556 5.665 1.00 0.00 H new ATOM 304 N ILE A 24 1.929 -5.500 1.533 1.00 0.00 N ATOM 305 CA ILE A 24 0.672 -5.293 0.824 1.00 0.00 C ATOM 306 C ILE A 24 -0.040 -6.618 0.570 1.00 0.00 C ATOM 307 O ILE A 24 -1.269 -6.687 0.587 1.00 0.00 O ATOM 308 CB ILE A 24 0.895 -4.577 -0.521 1.00 0.00 C ATOM 309 CG1 ILE A 24 1.815 -5.407 -1.419 1.00 0.00 C ATOM 310 CG2 ILE A 24 1.479 -3.191 -0.293 1.00 0.00 C ATOM 311 CD1 ILE A 24 2.003 -4.818 -2.800 1.00 0.00 C ATOM 0 H ILE A 24 2.763 -5.305 0.979 1.00 0.00 H new ATOM 0 HA ILE A 24 0.050 -4.665 1.461 1.00 0.00 H new ATOM 0 HB ILE A 24 -0.067 -4.467 -1.021 1.00 0.00 H new ATOM 0 HG12 ILE A 24 2.788 -5.503 -0.938 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.406 -6.413 -1.514 1.00 0.00 H new ATOM 0 HG21 ILE A 24 1.631 -2.698 -1.253 1.00 0.00 H new ATOM 0 HG22 ILE A 24 0.791 -2.601 0.313 1.00 0.00 H new ATOM 0 HG23 ILE A 24 2.434 -3.279 0.225 1.00 0.00 H new ATOM 0 HD11 ILE A 24 2.666 -5.458 -3.381 1.00 0.00 H new ATOM 0 HD12 ILE A 24 1.037 -4.747 -3.300 1.00 0.00 H new ATOM 0 HD13 ILE A 24 2.441 -3.824 -2.715 1.00 0.00 H new ATOM 323 N SER A 25 0.741 -7.667 0.336 1.00 0.00 N ATOM 324 CA SER A 25 0.186 -8.991 0.077 1.00 0.00 C ATOM 325 C SER A 25 -0.439 -9.575 1.340 1.00 0.00 C ATOM 326 O SER A 25 -1.521 -10.160 1.297 1.00 0.00 O ATOM 327 CB SER A 25 1.273 -9.929 -0.449 1.00 0.00 C ATOM 328 OG SER A 25 0.725 -11.176 -0.840 1.00 0.00 O ATOM 0 H SER A 25 1.760 -7.626 0.320 1.00 0.00 H new ATOM 0 HA SER A 25 -0.593 -8.890 -0.679 1.00 0.00 H new ATOM 0 HB2 SER A 25 1.777 -9.467 -1.298 1.00 0.00 H new ATOM 0 HB3 SER A 25 2.027 -10.085 0.322 1.00 0.00 H new ATOM 0 HG SER A 25 1.440 -11.757 -1.174 1.00 0.00 H new ATOM 334 N ASP A 26 0.251 -9.412 2.464 1.00 0.00 N ATOM 335 CA ASP A 26 -0.235 -9.921 3.741 1.00 0.00 C ATOM 336 C ASP A 26 -1.357 -9.043 4.285 1.00 0.00 C ATOM 337 O ASP A 26 -2.371 -9.543 4.769 1.00 0.00 O ATOM 338 CB ASP A 26 0.909 -9.995 4.753 1.00 0.00 C ATOM 339 CG ASP A 26 0.486 -10.640 6.058 1.00 0.00 C ATOM 340 OD1 ASP A 26 -0.456 -11.460 6.037 1.00 0.00 O ATOM 341 OD2 ASP A 26 1.098 -10.327 7.100 1.00 0.00 O ATOM 0 H ASP A 26 1.149 -8.931 2.516 1.00 0.00 H new ATOM 0 HA ASP A 26 -0.630 -10.924 3.578 1.00 0.00 H new ATOM 0 HB2 ASP A 26 1.735 -10.561 4.322 1.00 0.00 H new ATOM 0 HB3 ASP A 26 1.280 -8.990 4.951 1.00 0.00 H new ATOM 346 N ASN A 27 -1.167 -7.730 4.202 1.00 0.00 N ATOM 347 CA ASN A 27 -2.163 -6.781 4.687 1.00 0.00 C ATOM 348 C ASN A 27 -3.192 -6.471 3.605 1.00 0.00 C ATOM 349 O ASN A 27 -2.948 -6.694 2.418 1.00 0.00 O ATOM 350 CB ASN A 27 -1.485 -5.489 5.147 1.00 0.00 C ATOM 351 CG ASN A 27 -0.645 -5.689 6.394 1.00 0.00 C ATOM 352 OD1 ASN A 27 -1.093 -5.416 7.508 1.00 0.00 O ATOM 353 ND2 ASN A 27 0.580 -6.168 6.212 1.00 0.00 N ATOM 0 H ASN A 27 -0.333 -7.299 3.804 1.00 0.00 H new ATOM 0 HA ASN A 27 -2.678 -7.235 5.534 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.854 -5.107 4.344 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -2.245 -4.732 5.342 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.191 -6.324 7.014 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.910 -6.380 5.270 1.00 0.00 H new ATOM 360 N CYS A 28 -4.344 -5.956 4.021 1.00 0.00 N ATOM 361 CA CYS A 28 -5.411 -5.614 3.089 1.00 0.00 C ATOM 362 C CYS A 28 -5.181 -4.234 2.481 1.00 0.00 C ATOM 363 O CYS A 28 -5.172 -4.075 1.260 1.00 0.00 O ATOM 364 CB CYS A 28 -6.767 -5.652 3.797 1.00 0.00 C ATOM 365 SG CYS A 28 -8.192 -5.780 2.669 1.00 0.00 S ATOM 0 H CYS A 28 -4.562 -5.766 4.999 1.00 0.00 H new ATOM 0 HA CYS A 28 -5.407 -6.351 2.286 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -6.783 -6.499 4.483 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -6.875 -4.751 4.401 1.00 0.00 H new ATOM 370 N VAL A 29 -4.995 -3.238 3.341 1.00 0.00 N ATOM 371 CA VAL A 29 -4.763 -1.871 2.889 1.00 0.00 C ATOM 372 C VAL A 29 -3.507 -1.287 3.526 1.00 0.00 C ATOM 373 O VAL A 29 -3.232 -1.514 4.705 1.00 0.00 O ATOM 374 CB VAL A 29 -5.962 -0.961 3.217 1.00 0.00 C ATOM 375 CG1 VAL A 29 -5.699 0.460 2.742 1.00 0.00 C ATOM 376 CG2 VAL A 29 -7.236 -1.513 2.595 1.00 0.00 C ATOM 0 H VAL A 29 -5.000 -3.352 4.355 1.00 0.00 H new ATOM 0 HA VAL A 29 -4.632 -1.913 1.808 1.00 0.00 H new ATOM 0 HB VAL A 29 -6.094 -0.939 4.299 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.557 1.088 2.982 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -4.812 0.851 3.239 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -5.540 0.460 1.664 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -8.073 -0.858 2.837 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -7.119 -1.567 1.513 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -7.431 -2.510 2.989 1.00 0.00 H new ATOM 386 N VAL A 30 -2.746 -0.534 2.738 1.00 0.00 N ATOM 387 CA VAL A 30 -1.519 0.085 3.225 1.00 0.00 C ATOM 388 C VAL A 30 -1.432 1.545 2.797 1.00 0.00 C ATOM 389 O VAL A 30 -1.491 1.859 1.608 1.00 0.00 O ATOM 390 CB VAL A 30 -0.273 -0.663 2.714 1.00 0.00 C ATOM 391 CG1 VAL A 30 0.997 0.022 3.197 1.00 0.00 C ATOM 392 CG2 VAL A 30 -0.306 -2.118 3.157 1.00 0.00 C ATOM 0 H VAL A 30 -2.958 -0.338 1.760 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.547 0.030 4.313 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.278 -0.639 1.624 1.00 0.00 H new ATOM 0 HG11 VAL A 30 1.867 -0.521 2.826 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.022 1.046 2.825 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.013 0.032 4.287 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.582 -2.631 2.787 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.326 -2.166 4.246 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.197 -2.600 2.756 1.00 0.00 H new ATOM 402 N ILE A 31 -1.293 2.435 3.775 1.00 0.00 N ATOM 403 CA ILE A 31 -1.196 3.863 3.499 1.00 0.00 C ATOM 404 C ILE A 31 0.194 4.394 3.830 1.00 0.00 C ATOM 405 O ILE A 31 0.571 4.493 4.998 1.00 0.00 O ATOM 406 CB ILE A 31 -2.243 4.662 4.298 1.00 0.00 C ATOM 407 CG1 ILE A 31 -3.656 4.200 3.935 1.00 0.00 C ATOM 408 CG2 ILE A 31 -2.083 6.152 4.037 1.00 0.00 C ATOM 409 CD1 ILE A 31 -4.733 4.811 4.804 1.00 0.00 C ATOM 0 H ILE A 31 -1.245 2.192 4.764 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.387 3.993 2.434 1.00 0.00 H new ATOM 0 HB ILE A 31 -2.084 4.480 5.361 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -3.855 4.451 2.893 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -3.707 3.114 4.017 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -2.830 6.704 4.608 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -1.086 6.470 4.341 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -2.219 6.352 2.974 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.708 4.439 4.490 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -4.559 4.539 5.845 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -4.709 5.896 4.704 1.00 0.00 H new ATOM 421 N PHE A 32 0.952 4.737 2.795 1.00 0.00 N ATOM 422 CA PHE A 32 2.302 5.260 2.975 1.00 0.00 C ATOM 423 C PHE A 32 2.311 6.783 2.885 1.00 0.00 C ATOM 424 O PHE A 32 2.065 7.355 1.823 1.00 0.00 O ATOM 425 CB PHE A 32 3.245 4.670 1.924 1.00 0.00 C ATOM 426 CG PHE A 32 3.485 3.197 2.094 1.00 0.00 C ATOM 427 CD1 PHE A 32 4.344 2.730 3.076 1.00 0.00 C ATOM 428 CD2 PHE A 32 2.852 2.279 1.271 1.00 0.00 C ATOM 429 CE1 PHE A 32 4.567 1.375 3.235 1.00 0.00 C ATOM 430 CE2 PHE A 32 3.071 0.923 1.426 1.00 0.00 C ATOM 431 CZ PHE A 32 3.930 0.471 2.408 1.00 0.00 C ATOM 0 H PHE A 32 0.655 4.663 1.822 1.00 0.00 H new ATOM 0 HA PHE A 32 2.648 4.970 3.967 1.00 0.00 H new ATOM 0 HB2 PHE A 32 2.830 4.850 0.933 1.00 0.00 H new ATOM 0 HB3 PHE A 32 4.200 5.193 1.970 1.00 0.00 H new ATOM 0 HD1 PHE A 32 4.845 3.433 3.725 1.00 0.00 H new ATOM 0 HD2 PHE A 32 2.180 2.627 0.500 1.00 0.00 H new ATOM 0 HE1 PHE A 32 5.238 1.024 4.005 1.00 0.00 H new ATOM 0 HE2 PHE A 32 2.570 0.217 0.779 1.00 0.00 H new ATOM 0 HZ PHE A 32 4.103 -0.588 2.529 1.00 0.00 H new ATOM 441 N SER A 33 2.598 7.434 4.008 1.00 0.00 N ATOM 442 CA SER A 33 2.635 8.891 4.058 1.00 0.00 C ATOM 443 C SER A 33 4.016 9.385 4.480 1.00 0.00 C ATOM 444 O SER A 33 4.819 8.628 5.027 1.00 0.00 O ATOM 445 CB SER A 33 1.575 9.417 5.029 1.00 0.00 C ATOM 446 OG SER A 33 1.949 10.677 5.558 1.00 0.00 O ATOM 0 H SER A 33 2.808 6.976 4.895 1.00 0.00 H new ATOM 0 HA SER A 33 2.422 9.269 3.058 1.00 0.00 H new ATOM 0 HB2 SER A 33 0.618 9.504 4.515 1.00 0.00 H new ATOM 0 HB3 SER A 33 1.436 8.704 5.842 1.00 0.00 H new ATOM 0 HG SER A 33 1.341 10.919 6.288 1.00 0.00 H new ATOM 452 N LYS A 34 4.286 10.660 4.221 1.00 0.00 N ATOM 453 CA LYS A 34 5.569 11.257 4.573 1.00 0.00 C ATOM 454 C LYS A 34 5.374 12.465 5.484 1.00 0.00 C ATOM 455 O LYS A 34 6.159 13.414 5.452 1.00 0.00 O ATOM 456 CB LYS A 34 6.324 11.675 3.309 1.00 0.00 C ATOM 457 CG LYS A 34 5.606 12.736 2.494 1.00 0.00 C ATOM 458 CD LYS A 34 6.039 12.708 1.037 1.00 0.00 C ATOM 459 CE LYS A 34 7.506 13.080 0.885 1.00 0.00 C ATOM 460 NZ LYS A 34 7.697 14.554 0.789 1.00 0.00 N ATOM 0 H LYS A 34 3.633 11.300 3.768 1.00 0.00 H new ATOM 0 HA LYS A 34 6.155 10.510 5.109 1.00 0.00 H new ATOM 0 HB2 LYS A 34 7.308 12.050 3.591 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.485 10.796 2.685 1.00 0.00 H new ATOM 0 HG2 LYS A 34 4.529 12.578 2.558 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.810 13.720 2.916 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.870 11.713 0.625 1.00 0.00 H new ATOM 0 HD3 LYS A 34 5.425 13.400 0.460 1.00 0.00 H new ATOM 0 HE2 LYS A 34 8.068 12.696 1.736 1.00 0.00 H new ATOM 0 HE3 LYS A 34 7.911 12.602 -0.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.710 14.767 0.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 7.181 14.918 -0.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 7.333 15.008 1.651 1.00 0.00 H new ATOM 474 N THR A 35 4.324 12.423 6.298 1.00 0.00 N ATOM 475 CA THR A 35 4.026 13.514 7.218 1.00 0.00 C ATOM 476 C THR A 35 4.419 14.860 6.621 1.00 0.00 C ATOM 477 O THR A 35 5.094 15.663 7.265 1.00 0.00 O ATOM 478 CB THR A 35 4.756 13.329 8.562 1.00 0.00 C ATOM 479 OG1 THR A 35 6.173 13.347 8.357 1.00 0.00 O ATOM 480 CG2 THR A 35 4.351 12.020 9.222 1.00 0.00 C ATOM 0 H THR A 35 3.666 11.645 6.339 1.00 0.00 H new ATOM 0 HA THR A 35 2.950 13.497 7.391 1.00 0.00 H new ATOM 0 HB THR A 35 4.474 14.152 9.219 1.00 0.00 H new ATOM 0 HG1 THR A 35 6.629 13.230 9.216 1.00 0.00 H new ATOM 0 HG21 THR A 35 4.879 11.911 10.169 1.00 0.00 H new ATOM 0 HG22 THR A 35 3.276 12.021 9.404 1.00 0.00 H new ATOM 0 HG23 THR A 35 4.607 11.188 8.566 1.00 0.00 H new ATOM 488 N SER A 36 3.990 15.102 5.386 1.00 0.00 N ATOM 489 CA SER A 36 4.300 16.351 4.700 1.00 0.00 C ATOM 490 C SER A 36 3.054 16.929 4.036 1.00 0.00 C ATOM 491 O SER A 36 2.791 18.129 4.124 1.00 0.00 O ATOM 492 CB SER A 36 5.392 16.125 3.653 1.00 0.00 C ATOM 493 OG SER A 36 5.903 17.357 3.175 1.00 0.00 O ATOM 0 H SER A 36 3.427 14.450 4.840 1.00 0.00 H new ATOM 0 HA SER A 36 4.660 17.065 5.441 1.00 0.00 H new ATOM 0 HB2 SER A 36 6.200 15.536 4.087 1.00 0.00 H new ATOM 0 HB3 SER A 36 4.989 15.548 2.821 1.00 0.00 H new ATOM 0 HG SER A 36 6.600 17.185 2.508 1.00 0.00 H new ATOM 499 N CYS A 37 2.292 16.067 3.372 1.00 0.00 N ATOM 500 CA CYS A 37 1.073 16.491 2.691 1.00 0.00 C ATOM 501 C CYS A 37 -0.131 16.395 3.622 1.00 0.00 C ATOM 502 O CYS A 37 -0.063 15.768 4.679 1.00 0.00 O ATOM 503 CB CYS A 37 0.838 15.639 1.443 1.00 0.00 C ATOM 504 SG CYS A 37 1.810 16.150 0.007 1.00 0.00 S ATOM 0 H CYS A 37 2.496 15.071 3.290 1.00 0.00 H new ATOM 0 HA CYS A 37 1.196 17.532 2.393 1.00 0.00 H new ATOM 0 HB2 CYS A 37 1.072 14.600 1.676 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.220 15.677 1.184 1.00 0.00 H new ATOM 0 HG CYS A 37 1.544 15.369 -0.997 1.00 0.00 H new ATOM 510 N SER A 38 -1.233 17.021 3.222 1.00 0.00 N ATOM 511 CA SER A 38 -2.452 17.011 4.023 1.00 0.00 C ATOM 512 C SER A 38 -3.327 15.814 3.665 1.00 0.00 C ATOM 513 O SER A 38 -3.991 15.236 4.526 1.00 0.00 O ATOM 514 CB SER A 38 -3.234 18.309 3.818 1.00 0.00 C ATOM 515 OG SER A 38 -4.018 18.251 2.638 1.00 0.00 O ATOM 0 H SER A 38 -1.307 17.542 2.348 1.00 0.00 H new ATOM 0 HA SER A 38 -2.167 16.930 5.072 1.00 0.00 H new ATOM 0 HB2 SER A 38 -3.879 18.489 4.678 1.00 0.00 H new ATOM 0 HB3 SER A 38 -2.542 19.149 3.758 1.00 0.00 H new ATOM 0 HG SER A 38 -4.510 19.092 2.530 1.00 0.00 H new ATOM 521 N TYR A 39 -3.323 15.448 2.388 1.00 0.00 N ATOM 522 CA TYR A 39 -4.119 14.322 1.913 1.00 0.00 C ATOM 523 C TYR A 39 -3.820 13.064 2.723 1.00 0.00 C ATOM 524 O TYR A 39 -4.603 12.113 2.725 1.00 0.00 O ATOM 525 CB TYR A 39 -3.843 14.064 0.431 1.00 0.00 C ATOM 526 CG TYR A 39 -4.326 15.173 -0.477 1.00 0.00 C ATOM 527 CD1 TYR A 39 -5.646 15.219 -0.908 1.00 0.00 C ATOM 528 CD2 TYR A 39 -3.463 16.175 -0.902 1.00 0.00 C ATOM 529 CE1 TYR A 39 -6.092 16.229 -1.737 1.00 0.00 C ATOM 530 CE2 TYR A 39 -3.900 17.190 -1.731 1.00 0.00 C ATOM 531 CZ TYR A 39 -5.216 17.213 -2.146 1.00 0.00 C ATOM 532 OH TYR A 39 -5.656 18.222 -2.972 1.00 0.00 O ATOM 0 H TYR A 39 -2.778 15.914 1.663 1.00 0.00 H new ATOM 0 HA TYR A 39 -5.172 14.574 2.041 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -2.771 13.930 0.288 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -4.323 13.131 0.138 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -6.335 14.451 -0.589 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -2.433 16.160 -0.579 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -7.121 16.249 -2.064 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -3.216 17.961 -2.053 1.00 0.00 H new ATOM 0 HH TYR A 39 -4.915 18.833 -3.165 1.00 0.00 H new ATOM 542 N CYS A 40 -2.684 13.067 3.411 1.00 0.00 N ATOM 543 CA CYS A 40 -2.280 11.927 4.226 1.00 0.00 C ATOM 544 C CYS A 40 -3.397 11.520 5.182 1.00 0.00 C ATOM 545 O CYS A 40 -3.651 10.332 5.388 1.00 0.00 O ATOM 546 CB CYS A 40 -1.013 12.261 5.015 1.00 0.00 C ATOM 547 SG CYS A 40 -1.223 13.592 6.221 1.00 0.00 S ATOM 0 H CYS A 40 -2.026 13.846 3.421 1.00 0.00 H new ATOM 0 HA CYS A 40 -2.073 11.090 3.559 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -0.675 11.365 5.535 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -0.225 12.540 4.315 1.00 0.00 H new ATOM 0 HG CYS A 40 -0.955 14.733 5.659 1.00 0.00 H new ATOM 553 N THR A 41 -4.061 12.513 5.765 1.00 0.00 N ATOM 554 CA THR A 41 -5.148 12.259 6.702 1.00 0.00 C ATOM 555 C THR A 41 -6.401 11.785 5.974 1.00 0.00 C ATOM 556 O THR A 41 -7.070 10.850 6.414 1.00 0.00 O ATOM 557 CB THR A 41 -5.489 13.517 7.522 1.00 0.00 C ATOM 558 OG1 THR A 41 -6.183 13.148 8.719 1.00 0.00 O ATOM 559 CG2 THR A 41 -6.345 14.477 6.709 1.00 0.00 C ATOM 0 H THR A 41 -3.865 13.501 5.605 1.00 0.00 H new ATOM 0 HA THR A 41 -4.806 11.476 7.379 1.00 0.00 H new ATOM 0 HB THR A 41 -4.557 14.018 7.783 1.00 0.00 H new ATOM 0 HG1 THR A 41 -6.395 13.953 9.236 1.00 0.00 H new ATOM 0 HG21 THR A 41 -6.573 15.358 7.309 1.00 0.00 H new ATOM 0 HG22 THR A 41 -5.803 14.779 5.813 1.00 0.00 H new ATOM 0 HG23 THR A 41 -7.273 13.983 6.422 1.00 0.00 H new ATOM 567 N MET A 42 -6.714 12.437 4.858 1.00 0.00 N ATOM 568 CA MET A 42 -7.887 12.080 4.069 1.00 0.00 C ATOM 569 C MET A 42 -8.014 10.565 3.938 1.00 0.00 C ATOM 570 O MET A 42 -9.078 9.999 4.186 1.00 0.00 O ATOM 571 CB MET A 42 -7.807 12.718 2.681 1.00 0.00 C ATOM 572 CG MET A 42 -8.438 14.100 2.610 1.00 0.00 C ATOM 573 SD MET A 42 -8.492 14.753 0.931 1.00 0.00 S ATOM 574 CE MET A 42 -9.482 13.505 0.113 1.00 0.00 C ATOM 0 H MET A 42 -6.172 13.214 4.481 1.00 0.00 H new ATOM 0 HA MET A 42 -8.770 12.458 4.585 1.00 0.00 H new ATOM 0 HB2 MET A 42 -6.761 12.789 2.383 1.00 0.00 H new ATOM 0 HB3 MET A 42 -8.300 12.065 1.961 1.00 0.00 H new ATOM 0 HG2 MET A 42 -9.451 14.054 3.010 1.00 0.00 H new ATOM 0 HG3 MET A 42 -7.875 14.785 3.244 1.00 0.00 H new ATOM 0 HE1 MET A 42 -9.972 13.942 -0.757 1.00 0.00 H new ATOM 0 HE2 MET A 42 -8.841 12.684 -0.207 1.00 0.00 H new ATOM 0 HE3 MET A 42 -10.236 13.129 0.804 1.00 0.00 H new ATOM 584 N ALA A 43 -6.923 9.916 3.546 1.00 0.00 N ATOM 585 CA ALA A 43 -6.913 8.467 3.384 1.00 0.00 C ATOM 586 C ALA A 43 -7.305 7.767 4.681 1.00 0.00 C ATOM 587 O ALA A 43 -8.263 6.996 4.717 1.00 0.00 O ATOM 588 CB ALA A 43 -5.541 7.998 2.922 1.00 0.00 C ATOM 0 H ALA A 43 -6.035 10.370 3.335 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.649 8.205 2.624 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.547 6.914 2.805 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.299 8.465 1.967 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.792 8.279 3.663 1.00 0.00 H new ATOM 594 N LYS A 44 -6.557 8.041 5.745 1.00 0.00 N ATOM 595 CA LYS A 44 -6.826 7.438 7.045 1.00 0.00 C ATOM 596 C LYS A 44 -8.287 7.625 7.440 1.00 0.00 C ATOM 597 O LYS A 44 -8.990 6.658 7.736 1.00 0.00 O ATOM 598 CB LYS A 44 -5.916 8.050 8.112 1.00 0.00 C ATOM 599 CG LYS A 44 -4.440 7.996 7.757 1.00 0.00 C ATOM 600 CD LYS A 44 -3.593 8.741 8.776 1.00 0.00 C ATOM 601 CE LYS A 44 -2.200 9.028 8.239 1.00 0.00 C ATOM 602 NZ LYS A 44 -2.147 10.318 7.496 1.00 0.00 N ATOM 0 H LYS A 44 -5.760 8.677 5.732 1.00 0.00 H new ATOM 0 HA LYS A 44 -6.622 6.370 6.971 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -6.205 9.089 8.271 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -6.074 7.527 9.055 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -4.116 6.957 7.703 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -4.287 8.429 6.769 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -4.082 9.678 9.042 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -3.518 8.151 9.689 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -1.491 9.056 9.066 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -1.890 8.217 7.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -1.192 10.723 7.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -2.375 10.152 6.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -2.837 10.981 7.903 1.00 0.00 H new ATOM 616 N LYS A 45 -8.740 8.874 7.441 1.00 0.00 N ATOM 617 CA LYS A 45 -10.118 9.189 7.796 1.00 0.00 C ATOM 618 C LYS A 45 -11.096 8.432 6.904 1.00 0.00 C ATOM 619 O LYS A 45 -12.085 7.875 7.382 1.00 0.00 O ATOM 620 CB LYS A 45 -10.366 10.695 7.680 1.00 0.00 C ATOM 621 CG LYS A 45 -11.756 11.118 8.120 1.00 0.00 C ATOM 622 CD LYS A 45 -11.911 12.630 8.101 1.00 0.00 C ATOM 623 CE LYS A 45 -13.298 13.054 8.558 1.00 0.00 C ATOM 624 NZ LYS A 45 -14.347 12.674 7.572 1.00 0.00 N ATOM 0 H LYS A 45 -8.171 9.686 7.199 1.00 0.00 H new ATOM 0 HA LYS A 45 -10.280 8.879 8.828 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -9.627 11.224 8.282 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -10.213 11.001 6.645 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -12.500 10.667 7.463 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -11.950 10.744 9.125 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -11.160 13.082 8.748 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -11.729 13.003 7.093 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -13.520 12.593 9.520 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -13.316 14.133 8.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -15.239 13.151 7.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -14.048 12.961 6.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -14.488 11.644 7.595 1.00 0.00 H new ATOM 638 N LEU A 46 -10.814 8.414 5.606 1.00 0.00 N ATOM 639 CA LEU A 46 -11.668 7.723 4.646 1.00 0.00 C ATOM 640 C LEU A 46 -11.939 6.289 5.091 1.00 0.00 C ATOM 641 O LEU A 46 -13.080 5.918 5.366 1.00 0.00 O ATOM 642 CB LEU A 46 -11.019 7.726 3.261 1.00 0.00 C ATOM 643 CG LEU A 46 -11.662 6.812 2.217 1.00 0.00 C ATOM 644 CD1 LEU A 46 -13.024 7.347 1.805 1.00 0.00 C ATOM 645 CD2 LEU A 46 -10.754 6.667 1.004 1.00 0.00 C ATOM 0 H LEU A 46 -10.000 8.870 5.194 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.619 8.254 4.596 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -11.031 8.746 2.878 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -9.973 7.439 3.371 1.00 0.00 H new ATOM 0 HG LEU A 46 -11.802 5.827 2.661 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -13.466 6.683 1.062 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -13.674 7.398 2.678 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -12.910 8.344 1.379 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -11.227 6.013 0.271 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -10.582 7.647 0.559 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -9.801 6.237 1.312 1.00 0.00 H new ATOM 657 N PHE A 47 -10.881 5.488 5.163 1.00 0.00 N ATOM 658 CA PHE A 47 -11.004 4.095 5.576 1.00 0.00 C ATOM 659 C PHE A 47 -11.550 3.995 6.997 1.00 0.00 C ATOM 660 O PHE A 47 -12.441 3.192 7.277 1.00 0.00 O ATOM 661 CB PHE A 47 -9.646 3.394 5.489 1.00 0.00 C ATOM 662 CG PHE A 47 -9.159 3.202 4.081 1.00 0.00 C ATOM 663 CD1 PHE A 47 -9.649 2.168 3.300 1.00 0.00 C ATOM 664 CD2 PHE A 47 -8.211 4.055 3.540 1.00 0.00 C ATOM 665 CE1 PHE A 47 -9.204 1.989 2.003 1.00 0.00 C ATOM 666 CE2 PHE A 47 -7.762 3.881 2.244 1.00 0.00 C ATOM 667 CZ PHE A 47 -8.258 2.846 1.476 1.00 0.00 C ATOM 0 H PHE A 47 -9.929 5.780 4.941 1.00 0.00 H new ATOM 0 HA PHE A 47 -11.704 3.602 4.901 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -8.910 3.976 6.043 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -9.716 2.422 5.976 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -10.387 1.494 3.709 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -7.818 4.865 4.137 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -9.596 1.181 1.403 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -7.024 4.554 1.833 1.00 0.00 H new ATOM 0 HZ PHE A 47 -7.906 2.707 0.464 1.00 0.00 H new ATOM 677 N HIS A 48 -11.011 4.817 7.891 1.00 0.00 N ATOM 678 CA HIS A 48 -11.444 4.822 9.284 1.00 0.00 C ATOM 679 C HIS A 48 -12.967 4.847 9.379 1.00 0.00 C ATOM 680 O HIS A 48 -13.567 4.040 10.090 1.00 0.00 O ATOM 681 CB HIS A 48 -10.856 6.028 10.019 1.00 0.00 C ATOM 682 CG HIS A 48 -10.872 5.886 11.510 1.00 0.00 C ATOM 683 ND1 HIS A 48 -10.067 6.632 12.345 1.00 0.00 N ATOM 684 CD2 HIS A 48 -11.604 5.081 12.315 1.00 0.00 C ATOM 685 CE1 HIS A 48 -10.301 6.290 13.599 1.00 0.00 C ATOM 686 NE2 HIS A 48 -11.230 5.351 13.608 1.00 0.00 N ATOM 0 H HIS A 48 -10.274 5.488 7.676 1.00 0.00 H new ATOM 0 HA HIS A 48 -11.083 3.908 9.754 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -9.829 6.180 9.688 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -11.416 6.921 9.741 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -12.344 4.361 11.999 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -9.815 6.707 14.469 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -11.608 4.900 14.441 1.00 0.00 H new ATOM 694 N ASP A 49 -13.584 5.777 8.660 1.00 0.00 N ATOM 695 CA ASP A 49 -15.037 5.907 8.663 1.00 0.00 C ATOM 696 C ASP A 49 -15.694 4.672 8.056 1.00 0.00 C ATOM 697 O ASP A 49 -16.828 4.331 8.391 1.00 0.00 O ATOM 698 CB ASP A 49 -15.461 7.157 7.891 1.00 0.00 C ATOM 699 CG ASP A 49 -14.906 8.430 8.501 1.00 0.00 C ATOM 700 OD1 ASP A 49 -14.729 8.467 9.736 1.00 0.00 O ATOM 701 OD2 ASP A 49 -14.650 9.389 7.742 1.00 0.00 O ATOM 0 H ASP A 49 -13.101 6.452 8.067 1.00 0.00 H new ATOM 0 HA ASP A 49 -15.366 6.000 9.698 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -15.123 7.075 6.858 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -16.549 7.214 7.866 1.00 0.00 H new ATOM 706 N MET A 50 -14.974 4.005 7.159 1.00 0.00 N ATOM 707 CA MET A 50 -15.488 2.808 6.504 1.00 0.00 C ATOM 708 C MET A 50 -15.330 1.586 7.405 1.00 0.00 C ATOM 709 O MET A 50 -15.896 0.528 7.135 1.00 0.00 O ATOM 710 CB MET A 50 -14.762 2.575 5.178 1.00 0.00 C ATOM 711 CG MET A 50 -14.921 3.718 4.189 1.00 0.00 C ATOM 712 SD MET A 50 -13.520 3.863 3.063 1.00 0.00 S ATOM 713 CE MET A 50 -13.508 2.230 2.327 1.00 0.00 C ATOM 0 H MET A 50 -14.033 4.273 6.870 1.00 0.00 H new ATOM 0 HA MET A 50 -16.549 2.958 6.307 1.00 0.00 H new ATOM 0 HB2 MET A 50 -13.701 2.422 5.376 1.00 0.00 H new ATOM 0 HB3 MET A 50 -15.137 1.658 4.724 1.00 0.00 H new ATOM 0 HG2 MET A 50 -15.833 3.569 3.611 1.00 0.00 H new ATOM 0 HG3 MET A 50 -15.040 4.653 4.736 1.00 0.00 H new ATOM 0 HE1 MET A 50 -12.843 2.225 1.464 1.00 0.00 H new ATOM 0 HE2 MET A 50 -13.157 1.503 3.060 1.00 0.00 H new ATOM 0 HE3 MET A 50 -14.517 1.967 2.009 1.00 0.00 H new ATOM 723 N ASN A 51 -14.558 1.741 8.475 1.00 0.00 N ATOM 724 CA ASN A 51 -14.326 0.650 9.415 1.00 0.00 C ATOM 725 C ASN A 51 -13.546 -0.481 8.752 1.00 0.00 C ATOM 726 O ASN A 51 -13.803 -1.658 9.006 1.00 0.00 O ATOM 727 CB ASN A 51 -15.657 0.121 9.952 1.00 0.00 C ATOM 728 CG ASN A 51 -16.519 1.219 10.546 1.00 0.00 C ATOM 729 OD1 ASN A 51 -16.125 1.881 11.507 1.00 0.00 O ATOM 730 ND2 ASN A 51 -17.701 1.417 9.976 1.00 0.00 N ATOM 0 H ASN A 51 -14.082 2.611 8.713 1.00 0.00 H new ATOM 0 HA ASN A 51 -13.735 1.037 10.245 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -16.202 -0.369 9.145 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -15.464 -0.636 10.712 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -18.324 2.142 10.332 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -17.986 0.845 9.181 1.00 0.00 H new ATOM 737 N VAL A 52 -12.592 -0.117 7.902 1.00 0.00 N ATOM 738 CA VAL A 52 -11.773 -1.100 7.204 1.00 0.00 C ATOM 739 C VAL A 52 -10.337 -1.081 7.714 1.00 0.00 C ATOM 740 O VAL A 52 -9.526 -0.262 7.285 1.00 0.00 O ATOM 741 CB VAL A 52 -11.770 -0.851 5.684 1.00 0.00 C ATOM 742 CG1 VAL A 52 -10.847 -1.837 4.983 1.00 0.00 C ATOM 743 CG2 VAL A 52 -13.182 -0.941 5.127 1.00 0.00 C ATOM 0 H VAL A 52 -12.367 0.853 7.680 1.00 0.00 H new ATOM 0 HA VAL A 52 -12.213 -2.077 7.404 1.00 0.00 H new ATOM 0 HB VAL A 52 -11.395 0.155 5.499 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -10.858 -1.646 3.910 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -9.832 -1.718 5.363 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -11.189 -2.854 5.174 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -13.161 -0.762 4.052 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -13.588 -1.934 5.322 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -13.811 -0.191 5.607 1.00 0.00 H new ATOM 753 N ASN A 53 -10.029 -1.990 8.634 1.00 0.00 N ATOM 754 CA ASN A 53 -8.689 -2.078 9.204 1.00 0.00 C ATOM 755 C ASN A 53 -7.631 -1.726 8.162 1.00 0.00 C ATOM 756 O ASN A 53 -7.485 -2.416 7.153 1.00 0.00 O ATOM 757 CB ASN A 53 -8.436 -3.485 9.750 1.00 0.00 C ATOM 758 CG ASN A 53 -9.398 -3.855 10.862 1.00 0.00 C ATOM 759 OD1 ASN A 53 -9.309 -3.335 11.974 1.00 0.00 O ATOM 760 ND2 ASN A 53 -10.325 -4.759 10.565 1.00 0.00 N ATOM 0 H ASN A 53 -10.689 -2.676 9.001 1.00 0.00 H new ATOM 0 HA ASN A 53 -8.621 -1.361 10.022 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -8.527 -4.208 8.939 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -7.413 -3.549 10.122 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -11.000 -5.048 11.272 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -10.361 -5.164 9.629 1.00 0.00 H new ATOM 767 N TYR A 54 -6.896 -0.650 8.415 1.00 0.00 N ATOM 768 CA TYR A 54 -5.852 -0.205 7.499 1.00 0.00 C ATOM 769 C TYR A 54 -4.486 -0.228 8.177 1.00 0.00 C ATOM 770 O TYR A 54 -4.381 -0.449 9.384 1.00 0.00 O ATOM 771 CB TYR A 54 -6.157 1.205 6.991 1.00 0.00 C ATOM 772 CG TYR A 54 -6.056 2.270 8.060 1.00 0.00 C ATOM 773 CD1 TYR A 54 -7.146 2.579 8.864 1.00 0.00 C ATOM 774 CD2 TYR A 54 -4.872 2.966 8.265 1.00 0.00 C ATOM 775 CE1 TYR A 54 -7.059 3.552 9.842 1.00 0.00 C ATOM 776 CE2 TYR A 54 -4.775 3.938 9.241 1.00 0.00 C ATOM 777 CZ TYR A 54 -5.871 4.228 10.027 1.00 0.00 C ATOM 778 OH TYR A 54 -5.779 5.197 10.999 1.00 0.00 O ATOM 0 H TYR A 54 -7.003 -0.069 9.247 1.00 0.00 H new ATOM 0 HA TYR A 54 -5.830 -0.892 6.653 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -5.468 1.448 6.182 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -7.162 1.220 6.569 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -8.077 2.050 8.723 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -4.012 2.743 7.651 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -7.916 3.782 10.458 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -3.846 4.468 9.388 1.00 0.00 H new ATOM 0 HH TYR A 54 -4.875 5.575 10.999 1.00 0.00 H new ATOM 788 N LYS A 55 -3.439 0.003 7.392 1.00 0.00 N ATOM 789 CA LYS A 55 -2.077 0.011 7.914 1.00 0.00 C ATOM 790 C LYS A 55 -1.282 1.180 7.342 1.00 0.00 C ATOM 791 O LYS A 55 -0.882 1.160 6.178 1.00 0.00 O ATOM 792 CB LYS A 55 -1.375 -1.308 7.585 1.00 0.00 C ATOM 793 CG LYS A 55 -0.320 -1.706 8.602 1.00 0.00 C ATOM 794 CD LYS A 55 1.011 -1.029 8.319 1.00 0.00 C ATOM 795 CE LYS A 55 2.181 -1.883 8.784 1.00 0.00 C ATOM 796 NZ LYS A 55 3.352 -1.052 9.177 1.00 0.00 N ATOM 0 H LYS A 55 -3.508 0.187 6.391 1.00 0.00 H new ATOM 0 HA LYS A 55 -2.130 0.126 8.997 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -2.121 -2.100 7.519 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.909 -1.227 6.603 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.659 -1.439 9.603 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -0.189 -2.788 8.587 1.00 0.00 H new ATOM 0 HD2 LYS A 55 1.102 -0.836 7.250 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.043 -0.062 8.821 1.00 0.00 H new ATOM 0 HE2 LYS A 55 1.870 -2.495 9.630 1.00 0.00 H new ATOM 0 HE3 LYS A 55 2.472 -2.566 7.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 3.844 -1.501 9.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 4.004 -0.968 8.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 3.027 -0.105 9.459 1.00 0.00 H new ATOM 810 N VAL A 56 -1.055 2.196 8.167 1.00 0.00 N ATOM 811 CA VAL A 56 -0.305 3.372 7.744 1.00 0.00 C ATOM 812 C VAL A 56 1.179 3.221 8.059 1.00 0.00 C ATOM 813 O VAL A 56 1.553 2.621 9.067 1.00 0.00 O ATOM 814 CB VAL A 56 -0.834 4.650 8.421 1.00 0.00 C ATOM 815 CG1 VAL A 56 -0.127 4.884 9.747 1.00 0.00 C ATOM 816 CG2 VAL A 56 -0.669 5.849 7.500 1.00 0.00 C ATOM 0 H VAL A 56 -1.380 2.229 9.133 1.00 0.00 H new ATOM 0 HA VAL A 56 -0.438 3.460 6.666 1.00 0.00 H new ATOM 0 HB VAL A 56 -1.897 4.520 8.622 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -0.514 5.791 10.211 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -0.303 4.035 10.408 1.00 0.00 H new ATOM 0 HG13 VAL A 56 0.944 4.993 9.574 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -1.048 6.743 7.995 1.00 0.00 H new ATOM 0 HG22 VAL A 56 0.387 5.985 7.265 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -1.227 5.680 6.579 1.00 0.00 H new ATOM 826 N VAL A 57 2.022 3.770 7.190 1.00 0.00 N ATOM 827 CA VAL A 57 3.467 3.698 7.376 1.00 0.00 C ATOM 828 C VAL A 57 4.135 5.015 7.001 1.00 0.00 C ATOM 829 O VAL A 57 4.202 5.376 5.827 1.00 0.00 O ATOM 830 CB VAL A 57 4.085 2.564 6.537 1.00 0.00 C ATOM 831 CG1 VAL A 57 5.572 2.436 6.825 1.00 0.00 C ATOM 832 CG2 VAL A 57 3.366 1.250 6.805 1.00 0.00 C ATOM 0 H VAL A 57 1.729 4.270 6.350 1.00 0.00 H new ATOM 0 HA VAL A 57 3.641 3.494 8.433 1.00 0.00 H new ATOM 0 HB VAL A 57 3.964 2.809 5.482 1.00 0.00 H new ATOM 0 HG11 VAL A 57 5.991 1.630 6.223 1.00 0.00 H new ATOM 0 HG12 VAL A 57 6.073 3.372 6.577 1.00 0.00 H new ATOM 0 HG13 VAL A 57 5.720 2.214 7.882 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.816 0.460 6.204 1.00 0.00 H new ATOM 0 HG22 VAL A 57 3.453 0.996 7.861 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.313 1.351 6.542 1.00 0.00 H new ATOM 842 N GLU A 58 4.630 5.729 8.008 1.00 0.00 N ATOM 843 CA GLU A 58 5.294 7.007 7.783 1.00 0.00 C ATOM 844 C GLU A 58 6.717 6.799 7.272 1.00 0.00 C ATOM 845 O GLU A 58 7.570 6.260 7.978 1.00 0.00 O ATOM 846 CB GLU A 58 5.319 7.828 9.074 1.00 0.00 C ATOM 847 CG GLU A 58 3.938 8.166 9.608 1.00 0.00 C ATOM 848 CD GLU A 58 3.921 8.340 11.115 1.00 0.00 C ATOM 849 OE1 GLU A 58 4.504 7.489 11.818 1.00 0.00 O ATOM 850 OE2 GLU A 58 3.324 9.329 11.590 1.00 0.00 O ATOM 0 H GLU A 58 4.583 5.444 8.986 1.00 0.00 H new ATOM 0 HA GLU A 58 4.731 7.551 7.025 1.00 0.00 H new ATOM 0 HB2 GLU A 58 5.868 7.275 9.836 1.00 0.00 H new ATOM 0 HB3 GLU A 58 5.867 8.753 8.895 1.00 0.00 H new ATOM 0 HG2 GLU A 58 3.585 9.083 9.136 1.00 0.00 H new ATOM 0 HG3 GLU A 58 3.241 7.375 9.329 1.00 0.00 H new ATOM 857 N LEU A 59 6.965 7.230 6.040 1.00 0.00 N ATOM 858 CA LEU A 59 8.284 7.091 5.433 1.00 0.00 C ATOM 859 C LEU A 59 9.214 8.211 5.888 1.00 0.00 C ATOM 860 O LEU A 59 10.315 7.957 6.378 1.00 0.00 O ATOM 861 CB LEU A 59 8.168 7.098 3.907 1.00 0.00 C ATOM 862 CG LEU A 59 7.332 5.975 3.293 1.00 0.00 C ATOM 863 CD1 LEU A 59 7.134 6.211 1.804 1.00 0.00 C ATOM 864 CD2 LEU A 59 7.991 4.625 3.537 1.00 0.00 C ATOM 0 H LEU A 59 6.271 7.678 5.442 1.00 0.00 H new ATOM 0 HA LEU A 59 8.706 6.139 5.755 1.00 0.00 H new ATOM 0 HB2 LEU A 59 7.740 8.052 3.599 1.00 0.00 H new ATOM 0 HB3 LEU A 59 9.172 7.048 3.486 1.00 0.00 H new ATOM 0 HG LEU A 59 6.354 5.972 3.774 1.00 0.00 H new ATOM 0 HD11 LEU A 59 6.537 5.402 1.384 1.00 0.00 H new ATOM 0 HD12 LEU A 59 6.619 7.159 1.651 1.00 0.00 H new ATOM 0 HD13 LEU A 59 8.104 6.241 1.308 1.00 0.00 H new ATOM 0 HD21 LEU A 59 7.382 3.837 3.093 1.00 0.00 H new ATOM 0 HD22 LEU A 59 8.982 4.617 3.083 1.00 0.00 H new ATOM 0 HD23 LEU A 59 8.081 4.453 4.610 1.00 0.00 H new ATOM 876 N ASP A 60 8.764 9.450 5.726 1.00 0.00 N ATOM 877 CA ASP A 60 9.554 10.609 6.123 1.00 0.00 C ATOM 878 C ASP A 60 10.317 10.330 7.414 1.00 0.00 C ATOM 879 O ASP A 60 11.462 10.756 7.576 1.00 0.00 O ATOM 880 CB ASP A 60 8.652 11.831 6.304 1.00 0.00 C ATOM 881 CG ASP A 60 9.438 13.125 6.382 1.00 0.00 C ATOM 882 OD1 ASP A 60 10.011 13.408 7.455 1.00 0.00 O ATOM 883 OD2 ASP A 60 9.481 13.855 5.369 1.00 0.00 O ATOM 0 H ASP A 60 7.855 9.678 5.322 1.00 0.00 H new ATOM 0 HA ASP A 60 10.275 10.814 5.332 1.00 0.00 H new ATOM 0 HB2 ASP A 60 7.949 11.886 5.473 1.00 0.00 H new ATOM 0 HB3 ASP A 60 8.062 11.712 7.213 1.00 0.00 H new ATOM 888 N LEU A 61 9.677 9.613 8.331 1.00 0.00 N ATOM 889 CA LEU A 61 10.294 9.277 9.609 1.00 0.00 C ATOM 890 C LEU A 61 11.219 8.072 9.467 1.00 0.00 C ATOM 891 O LEU A 61 12.271 8.005 10.105 1.00 0.00 O ATOM 892 CB LEU A 61 9.218 8.988 10.657 1.00 0.00 C ATOM 893 CG LEU A 61 8.024 9.942 10.674 1.00 0.00 C ATOM 894 CD1 LEU A 61 6.972 9.464 11.663 1.00 0.00 C ATOM 895 CD2 LEU A 61 8.474 11.355 11.013 1.00 0.00 C ATOM 0 H LEU A 61 8.730 9.253 8.213 1.00 0.00 H new ATOM 0 HA LEU A 61 10.888 10.131 9.934 1.00 0.00 H new ATOM 0 HB2 LEU A 61 8.846 7.976 10.497 1.00 0.00 H new ATOM 0 HB3 LEU A 61 9.685 9.005 11.642 1.00 0.00 H new ATOM 0 HG LEU A 61 7.579 9.953 9.679 1.00 0.00 H new ATOM 0 HD11 LEU A 61 6.130 10.156 11.661 1.00 0.00 H new ATOM 0 HD12 LEU A 61 6.627 8.471 11.375 1.00 0.00 H new ATOM 0 HD13 LEU A 61 7.405 9.422 12.663 1.00 0.00 H new ATOM 0 HD21 LEU A 61 7.610 12.020 11.020 1.00 0.00 H new ATOM 0 HD22 LEU A 61 8.945 11.361 11.996 1.00 0.00 H new ATOM 0 HD23 LEU A 61 9.190 11.698 10.266 1.00 0.00 H new ATOM 907 N LEU A 62 10.822 7.124 8.626 1.00 0.00 N ATOM 908 CA LEU A 62 11.616 5.922 8.397 1.00 0.00 C ATOM 909 C LEU A 62 13.043 6.281 7.994 1.00 0.00 C ATOM 910 O LEU A 62 13.258 7.043 7.052 1.00 0.00 O ATOM 911 CB LEU A 62 10.970 5.058 7.313 1.00 0.00 C ATOM 912 CG LEU A 62 9.878 4.096 7.784 1.00 0.00 C ATOM 913 CD1 LEU A 62 9.128 3.517 6.594 1.00 0.00 C ATOM 914 CD2 LEU A 62 10.476 2.984 8.633 1.00 0.00 C ATOM 0 H LEU A 62 9.955 7.164 8.091 1.00 0.00 H new ATOM 0 HA LEU A 62 11.652 5.357 9.329 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.544 5.717 6.557 1.00 0.00 H new ATOM 0 HB3 LEU A 62 11.753 4.477 6.825 1.00 0.00 H new ATOM 0 HG LEU A 62 9.170 4.653 8.398 1.00 0.00 H new ATOM 0 HD11 LEU A 62 8.355 2.835 6.948 1.00 0.00 H new ATOM 0 HD12 LEU A 62 8.667 4.325 6.026 1.00 0.00 H new ATOM 0 HD13 LEU A 62 9.824 2.975 5.954 1.00 0.00 H new ATOM 0 HD21 LEU A 62 9.684 2.309 8.959 1.00 0.00 H new ATOM 0 HD22 LEU A 62 11.206 2.429 8.044 1.00 0.00 H new ATOM 0 HD23 LEU A 62 10.967 3.416 9.505 1.00 0.00 H new ATOM 926 N GLU A 63 14.013 5.724 8.712 1.00 0.00 N ATOM 927 CA GLU A 63 15.419 5.984 8.428 1.00 0.00 C ATOM 928 C GLU A 63 15.726 5.761 6.950 1.00 0.00 C ATOM 929 O GLU A 63 16.428 6.554 6.323 1.00 0.00 O ATOM 930 CB GLU A 63 16.311 5.085 9.286 1.00 0.00 C ATOM 931 CG GLU A 63 17.741 4.987 8.782 1.00 0.00 C ATOM 932 CD GLU A 63 18.706 4.516 9.852 1.00 0.00 C ATOM 933 OE1 GLU A 63 18.847 5.217 10.876 1.00 0.00 O ATOM 934 OE2 GLU A 63 19.321 3.444 9.666 1.00 0.00 O ATOM 0 H GLU A 63 13.851 5.090 9.494 1.00 0.00 H new ATOM 0 HA GLU A 63 15.625 7.026 8.671 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.320 5.465 10.308 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.878 4.085 9.322 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.778 4.300 7.937 1.00 0.00 H new ATOM 0 HG3 GLU A 63 18.060 5.962 8.414 1.00 0.00 H new ATOM 941 N TYR A 64 15.194 4.675 6.399 1.00 0.00 N ATOM 942 CA TYR A 64 15.412 4.345 4.996 1.00 0.00 C ATOM 943 C TYR A 64 14.227 4.785 4.142 1.00 0.00 C ATOM 944 O TYR A 64 13.801 4.070 3.235 1.00 0.00 O ATOM 945 CB TYR A 64 15.641 2.841 4.834 1.00 0.00 C ATOM 946 CG TYR A 64 14.768 1.995 5.732 1.00 0.00 C ATOM 947 CD1 TYR A 64 13.485 1.631 5.343 1.00 0.00 C ATOM 948 CD2 TYR A 64 15.225 1.561 6.971 1.00 0.00 C ATOM 949 CE1 TYR A 64 12.682 0.859 6.161 1.00 0.00 C ATOM 950 CE2 TYR A 64 14.430 0.788 7.794 1.00 0.00 C ATOM 951 CZ TYR A 64 13.160 0.439 7.385 1.00 0.00 C ATOM 952 OH TYR A 64 12.364 -0.330 8.203 1.00 0.00 O ATOM 0 H TYR A 64 14.609 4.009 6.903 1.00 0.00 H new ATOM 0 HA TYR A 64 16.299 4.880 4.657 1.00 0.00 H new ATOM 0 HB2 TYR A 64 15.456 2.564 3.796 1.00 0.00 H new ATOM 0 HB3 TYR A 64 16.687 2.617 5.043 1.00 0.00 H new ATOM 0 HD1 TYR A 64 13.109 1.957 4.385 1.00 0.00 H new ATOM 0 HD2 TYR A 64 16.219 1.833 7.295 1.00 0.00 H new ATOM 0 HE1 TYR A 64 11.686 0.586 5.844 1.00 0.00 H new ATOM 0 HE2 TYR A 64 14.801 0.458 8.753 1.00 0.00 H new ATOM 0 HH TYR A 64 12.850 -0.542 9.027 1.00 0.00 H new ATOM 962 N GLY A 65 13.699 5.968 4.438 1.00 0.00 N ATOM 963 CA GLY A 65 12.569 6.485 3.689 1.00 0.00 C ATOM 964 C GLY A 65 12.901 6.725 2.230 1.00 0.00 C ATOM 965 O GLY A 65 12.212 6.228 1.340 1.00 0.00 O ATOM 0 H GLY A 65 14.034 6.578 5.184 1.00 0.00 H new ATOM 0 HA2 GLY A 65 11.739 5.782 3.759 1.00 0.00 H new ATOM 0 HA3 GLY A 65 12.235 7.419 4.141 1.00 0.00 H new ATOM 969 N ASN A 66 13.959 7.491 1.984 1.00 0.00 N ATOM 970 CA ASN A 66 14.380 7.798 0.622 1.00 0.00 C ATOM 971 C ASN A 66 14.462 6.529 -0.221 1.00 0.00 C ATOM 972 O ASN A 66 14.365 6.580 -1.447 1.00 0.00 O ATOM 973 CB ASN A 66 15.736 8.506 0.632 1.00 0.00 C ATOM 974 CG ASN A 66 16.719 7.858 1.589 1.00 0.00 C ATOM 975 OD1 ASN A 66 16.826 8.255 2.750 1.00 0.00 O ATOM 976 ND2 ASN A 66 17.443 6.855 1.105 1.00 0.00 N ATOM 0 H ASN A 66 14.540 7.910 2.710 1.00 0.00 H new ATOM 0 HA ASN A 66 13.636 8.460 0.179 1.00 0.00 H new ATOM 0 HB2 ASN A 66 16.154 8.499 -0.375 1.00 0.00 H new ATOM 0 HB3 ASN A 66 15.596 9.550 0.911 1.00 0.00 H new ATOM 0 HD21 ASN A 66 18.121 6.381 1.702 1.00 0.00 H new ATOM 0 HD22 ASN A 66 17.321 6.559 0.136 1.00 0.00 H new ATOM 983 N GLN A 67 14.641 5.393 0.445 1.00 0.00 N ATOM 984 CA GLN A 67 14.736 4.111 -0.243 1.00 0.00 C ATOM 985 C GLN A 67 13.355 3.610 -0.654 1.00 0.00 C ATOM 986 O GLN A 67 13.018 3.589 -1.838 1.00 0.00 O ATOM 987 CB GLN A 67 15.421 3.077 0.652 1.00 0.00 C ATOM 988 CG GLN A 67 16.939 3.146 0.609 1.00 0.00 C ATOM 989 CD GLN A 67 17.525 2.378 -0.560 1.00 0.00 C ATOM 990 OE1 GLN A 67 16.800 1.921 -1.444 1.00 0.00 O ATOM 991 NE2 GLN A 67 18.845 2.232 -0.570 1.00 0.00 N ATOM 0 H GLN A 67 14.723 5.334 1.460 1.00 0.00 H new ATOM 0 HA GLN A 67 15.333 4.254 -1.143 1.00 0.00 H new ATOM 0 HB2 GLN A 67 15.088 3.221 1.680 1.00 0.00 H new ATOM 0 HB3 GLN A 67 15.102 2.079 0.350 1.00 0.00 H new ATOM 0 HG2 GLN A 67 17.250 4.189 0.546 1.00 0.00 H new ATOM 0 HG3 GLN A 67 17.344 2.748 1.540 1.00 0.00 H new ATOM 0 HE21 GLN A 67 19.408 2.627 0.183 1.00 0.00 H new ATOM 0 HE22 GLN A 67 19.296 1.725 -1.331 1.00 0.00 H new ATOM 1000 N PHE A 68 12.560 3.207 0.331 1.00 0.00 N ATOM 1001 CA PHE A 68 11.216 2.705 0.072 1.00 0.00 C ATOM 1002 C PHE A 68 10.408 3.709 -0.745 1.00 0.00 C ATOM 1003 O PHE A 68 9.368 3.371 -1.309 1.00 0.00 O ATOM 1004 CB PHE A 68 10.497 2.406 1.390 1.00 0.00 C ATOM 1005 CG PHE A 68 10.900 1.098 2.009 1.00 0.00 C ATOM 1006 CD1 PHE A 68 12.231 0.719 2.055 1.00 0.00 C ATOM 1007 CD2 PHE A 68 9.946 0.248 2.544 1.00 0.00 C ATOM 1008 CE1 PHE A 68 12.605 -0.484 2.624 1.00 0.00 C ATOM 1009 CE2 PHE A 68 10.313 -0.956 3.115 1.00 0.00 C ATOM 1010 CZ PHE A 68 11.644 -1.323 3.154 1.00 0.00 C ATOM 0 H PHE A 68 12.823 3.218 1.316 1.00 0.00 H new ATOM 0 HA PHE A 68 11.304 1.783 -0.503 1.00 0.00 H new ATOM 0 HB2 PHE A 68 10.700 3.211 2.096 1.00 0.00 H new ATOM 0 HB3 PHE A 68 9.421 2.400 1.215 1.00 0.00 H new ATOM 0 HD1 PHE A 68 12.986 1.371 1.641 1.00 0.00 H new ATOM 0 HD2 PHE A 68 8.904 0.529 2.515 1.00 0.00 H new ATOM 0 HE1 PHE A 68 13.647 -0.767 2.654 1.00 0.00 H new ATOM 0 HE2 PHE A 68 9.560 -1.609 3.530 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.933 -2.264 3.598 1.00 0.00 H new ATOM 1020 N GLN A 69 10.895 4.944 -0.802 1.00 0.00 N ATOM 1021 CA GLN A 69 10.217 5.998 -1.548 1.00 0.00 C ATOM 1022 C GLN A 69 10.328 5.758 -3.051 1.00 0.00 C ATOM 1023 O GLN A 69 9.339 5.845 -3.777 1.00 0.00 O ATOM 1024 CB GLN A 69 10.807 7.364 -1.193 1.00 0.00 C ATOM 1025 CG GLN A 69 10.112 8.040 -0.023 1.00 0.00 C ATOM 1026 CD GLN A 69 10.423 9.522 0.063 1.00 0.00 C ATOM 1027 OE1 GLN A 69 10.548 10.202 -0.956 1.00 0.00 O ATOM 1028 NE2 GLN A 69 10.548 10.031 1.283 1.00 0.00 N ATOM 0 H GLN A 69 11.756 5.240 -0.341 1.00 0.00 H new ATOM 0 HA GLN A 69 9.163 5.983 -1.272 1.00 0.00 H new ATOM 0 HB2 GLN A 69 11.864 7.244 -0.957 1.00 0.00 H new ATOM 0 HB3 GLN A 69 10.747 8.014 -2.066 1.00 0.00 H new ATOM 0 HG2 GLN A 69 9.035 7.903 -0.117 1.00 0.00 H new ATOM 0 HG3 GLN A 69 10.415 7.554 0.905 1.00 0.00 H new ATOM 0 HE21 GLN A 69 10.436 9.431 2.100 1.00 0.00 H new ATOM 0 HE22 GLN A 69 10.756 11.022 1.403 1.00 0.00 H new ATOM 1037 N ASP A 70 11.538 5.457 -3.509 1.00 0.00 N ATOM 1038 CA ASP A 70 11.779 5.204 -4.925 1.00 0.00 C ATOM 1039 C ASP A 70 11.040 3.952 -5.386 1.00 0.00 C ATOM 1040 O ASP A 70 10.316 3.978 -6.381 1.00 0.00 O ATOM 1041 CB ASP A 70 13.277 5.054 -5.191 1.00 0.00 C ATOM 1042 CG ASP A 70 13.589 4.874 -6.663 1.00 0.00 C ATOM 1043 OD1 ASP A 70 12.902 4.064 -7.321 1.00 0.00 O ATOM 1044 OD2 ASP A 70 14.519 5.544 -7.159 1.00 0.00 O ATOM 0 H ASP A 70 12.368 5.382 -2.920 1.00 0.00 H new ATOM 0 HA ASP A 70 11.402 6.056 -5.490 1.00 0.00 H new ATOM 0 HB2 ASP A 70 13.799 5.935 -4.817 1.00 0.00 H new ATOM 0 HB3 ASP A 70 13.658 4.197 -4.635 1.00 0.00 H new ATOM 1049 N ALA A 71 11.228 2.857 -4.657 1.00 0.00 N ATOM 1050 CA ALA A 71 10.579 1.596 -4.991 1.00 0.00 C ATOM 1051 C ALA A 71 9.083 1.790 -5.215 1.00 0.00 C ATOM 1052 O ALA A 71 8.513 1.256 -6.167 1.00 0.00 O ATOM 1053 CB ALA A 71 10.821 0.571 -3.892 1.00 0.00 C ATOM 0 H ALA A 71 11.825 2.818 -3.831 1.00 0.00 H new ATOM 0 HA ALA A 71 11.014 1.227 -5.920 1.00 0.00 H new ATOM 0 HB1 ALA A 71 10.331 -0.366 -4.154 1.00 0.00 H new ATOM 0 HB2 ALA A 71 11.892 0.402 -3.782 1.00 0.00 H new ATOM 0 HB3 ALA A 71 10.414 0.943 -2.952 1.00 0.00 H new ATOM 1059 N LEU A 72 8.452 2.557 -4.333 1.00 0.00 N ATOM 1060 CA LEU A 72 7.022 2.822 -4.434 1.00 0.00 C ATOM 1061 C LEU A 72 6.696 3.565 -5.726 1.00 0.00 C ATOM 1062 O LEU A 72 5.851 3.129 -6.509 1.00 0.00 O ATOM 1063 CB LEU A 72 6.547 3.637 -3.230 1.00 0.00 C ATOM 1064 CG LEU A 72 6.300 2.850 -1.942 1.00 0.00 C ATOM 1065 CD1 LEU A 72 5.986 3.794 -0.792 1.00 0.00 C ATOM 1066 CD2 LEU A 72 5.171 1.850 -2.137 1.00 0.00 C ATOM 0 H LEU A 72 8.909 3.006 -3.539 1.00 0.00 H new ATOM 0 HA LEU A 72 6.500 1.865 -4.445 1.00 0.00 H new ATOM 0 HB2 LEU A 72 7.288 4.409 -3.024 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.623 4.147 -3.503 1.00 0.00 H new ATOM 0 HG LEU A 72 7.208 2.299 -1.695 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.813 3.216 0.116 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.826 4.471 -0.637 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.093 4.372 -1.030 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.009 1.299 -1.211 1.00 0.00 H new ATOM 0 HD22 LEU A 72 4.258 2.380 -2.408 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.436 1.153 -2.932 1.00 0.00 H new ATOM 1078 N TYR A 73 7.371 4.688 -5.942 1.00 0.00 N ATOM 1079 CA TYR A 73 7.153 5.492 -7.139 1.00 0.00 C ATOM 1080 C TYR A 73 7.001 4.605 -8.371 1.00 0.00 C ATOM 1081 O TYR A 73 6.247 4.924 -9.291 1.00 0.00 O ATOM 1082 CB TYR A 73 8.313 6.469 -7.341 1.00 0.00 C ATOM 1083 CG TYR A 73 8.378 7.052 -8.734 1.00 0.00 C ATOM 1084 CD1 TYR A 73 8.950 6.339 -9.781 1.00 0.00 C ATOM 1085 CD2 TYR A 73 7.869 8.316 -9.005 1.00 0.00 C ATOM 1086 CE1 TYR A 73 9.013 6.868 -11.055 1.00 0.00 C ATOM 1087 CE2 TYR A 73 7.926 8.852 -10.276 1.00 0.00 C ATOM 1088 CZ TYR A 73 8.499 8.124 -11.298 1.00 0.00 C ATOM 1089 OH TYR A 73 8.559 8.655 -12.566 1.00 0.00 O ATOM 0 H TYR A 73 8.074 5.062 -5.304 1.00 0.00 H new ATOM 0 HA TYR A 73 6.230 6.056 -7.003 1.00 0.00 H new ATOM 0 HB2 TYR A 73 8.222 7.281 -6.620 1.00 0.00 H new ATOM 0 HB3 TYR A 73 9.251 5.956 -7.127 1.00 0.00 H new ATOM 0 HD1 TYR A 73 9.352 5.354 -9.595 1.00 0.00 H new ATOM 0 HD2 TYR A 73 7.421 8.890 -8.207 1.00 0.00 H new ATOM 0 HE1 TYR A 73 9.462 6.301 -11.857 1.00 0.00 H new ATOM 0 HE2 TYR A 73 7.524 9.836 -10.469 1.00 0.00 H new ATOM 0 HH TYR A 73 8.152 9.547 -12.567 1.00 0.00 H new ATOM 1099 N LYS A 74 7.722 3.489 -8.381 1.00 0.00 N ATOM 1100 CA LYS A 74 7.667 2.553 -9.498 1.00 0.00 C ATOM 1101 C LYS A 74 6.418 1.681 -9.416 1.00 0.00 C ATOM 1102 O LYS A 74 5.812 1.351 -10.435 1.00 0.00 O ATOM 1103 CB LYS A 74 8.918 1.671 -9.512 1.00 0.00 C ATOM 1104 CG LYS A 74 10.216 2.455 -9.420 1.00 0.00 C ATOM 1105 CD LYS A 74 11.411 1.535 -9.235 1.00 0.00 C ATOM 1106 CE LYS A 74 11.976 1.080 -10.572 1.00 0.00 C ATOM 1107 NZ LYS A 74 13.026 2.008 -11.074 1.00 0.00 N ATOM 0 H LYS A 74 8.351 3.211 -7.628 1.00 0.00 H new ATOM 0 HA LYS A 74 7.626 3.130 -10.422 1.00 0.00 H new ATOM 0 HB2 LYS A 74 8.867 0.970 -8.679 1.00 0.00 H new ATOM 0 HB3 LYS A 74 8.925 1.079 -10.427 1.00 0.00 H new ATOM 0 HG2 LYS A 74 10.349 3.048 -10.325 1.00 0.00 H new ATOM 0 HG3 LYS A 74 10.161 3.154 -8.586 1.00 0.00 H new ATOM 0 HD2 LYS A 74 12.185 2.052 -8.669 1.00 0.00 H new ATOM 0 HD3 LYS A 74 11.115 0.665 -8.649 1.00 0.00 H new ATOM 0 HE2 LYS A 74 12.395 0.079 -10.468 1.00 0.00 H new ATOM 0 HE3 LYS A 74 11.170 1.013 -11.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 13.386 1.664 -11.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 12.620 2.957 -11.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 13.807 2.052 -10.388 1.00 0.00 H new ATOM 1121 N MET A 75 6.039 1.312 -8.197 1.00 0.00 N ATOM 1122 CA MET A 75 4.860 0.480 -7.983 1.00 0.00 C ATOM 1123 C MET A 75 3.593 1.330 -7.953 1.00 0.00 C ATOM 1124 O MET A 75 2.480 0.805 -7.988 1.00 0.00 O ATOM 1125 CB MET A 75 4.993 -0.304 -6.676 1.00 0.00 C ATOM 1126 CG MET A 75 6.295 -1.080 -6.563 1.00 0.00 C ATOM 1127 SD MET A 75 6.126 -2.579 -5.575 1.00 0.00 S ATOM 1128 CE MET A 75 5.468 -1.908 -4.051 1.00 0.00 C ATOM 0 H MET A 75 6.530 1.575 -7.343 1.00 0.00 H new ATOM 0 HA MET A 75 4.786 -0.222 -8.813 1.00 0.00 H new ATOM 0 HB2 MET A 75 4.918 0.388 -5.837 1.00 0.00 H new ATOM 0 HB3 MET A 75 4.157 -0.998 -6.592 1.00 0.00 H new ATOM 0 HG2 MET A 75 6.644 -1.345 -7.561 1.00 0.00 H new ATOM 0 HG3 MET A 75 7.057 -0.440 -6.118 1.00 0.00 H new ATOM 0 HE1 MET A 75 5.376 -2.705 -3.313 1.00 0.00 H new ATOM 0 HE2 MET A 75 6.140 -1.138 -3.672 1.00 0.00 H new ATOM 0 HE3 MET A 75 4.487 -1.472 -4.239 1.00 0.00 H new ATOM 1138 N THR A 76 3.770 2.646 -7.888 1.00 0.00 N ATOM 1139 CA THR A 76 2.642 3.568 -7.852 1.00 0.00 C ATOM 1140 C THR A 76 2.552 4.377 -9.140 1.00 0.00 C ATOM 1141 O THR A 76 1.469 4.796 -9.548 1.00 0.00 O ATOM 1142 CB THR A 76 2.744 4.535 -6.657 1.00 0.00 C ATOM 1143 OG1 THR A 76 3.831 5.446 -6.857 1.00 0.00 O ATOM 1144 CG2 THR A 76 2.949 3.770 -5.358 1.00 0.00 C ATOM 0 H THR A 76 4.684 3.097 -7.859 1.00 0.00 H new ATOM 0 HA THR A 76 1.742 2.962 -7.743 1.00 0.00 H new ATOM 0 HB THR A 76 1.810 5.093 -6.588 1.00 0.00 H new ATOM 0 HG1 THR A 76 3.705 6.235 -6.289 1.00 0.00 H new ATOM 0 HG21 THR A 76 3.018 4.474 -4.528 1.00 0.00 H new ATOM 0 HG22 THR A 76 2.106 3.098 -5.195 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.870 3.189 -5.419 1.00 0.00 H new ATOM 1152 N GLY A 77 3.698 4.594 -9.779 1.00 0.00 N ATOM 1153 CA GLY A 77 3.726 5.353 -11.016 1.00 0.00 C ATOM 1154 C GLY A 77 2.955 6.655 -10.915 1.00 0.00 C ATOM 1155 O GLY A 77 2.409 7.138 -11.906 1.00 0.00 O ATOM 0 H GLY A 77 4.607 4.258 -9.462 1.00 0.00 H new ATOM 0 HA2 GLY A 77 4.761 5.567 -11.284 1.00 0.00 H new ATOM 0 HA3 GLY A 77 3.307 4.748 -11.820 1.00 0.00 H new ATOM 1159 N GLU A 78 2.909 7.222 -9.714 1.00 0.00 N ATOM 1160 CA GLU A 78 2.196 8.474 -9.488 1.00 0.00 C ATOM 1161 C GLU A 78 3.131 9.536 -8.915 1.00 0.00 C ATOM 1162 O GLU A 78 3.104 10.693 -9.335 1.00 0.00 O ATOM 1163 CB GLU A 78 1.017 8.251 -8.539 1.00 0.00 C ATOM 1164 CG GLU A 78 -0.104 9.262 -8.714 1.00 0.00 C ATOM 1165 CD GLU A 78 -1.085 8.863 -9.800 1.00 0.00 C ATOM 1166 OE1 GLU A 78 -1.836 7.888 -9.592 1.00 0.00 O ATOM 1167 OE2 GLU A 78 -1.100 9.527 -10.857 1.00 0.00 O ATOM 0 H GLU A 78 3.356 6.835 -8.883 1.00 0.00 H new ATOM 0 HA GLU A 78 1.818 8.826 -10.448 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.619 7.249 -8.697 1.00 0.00 H new ATOM 0 HB3 GLU A 78 1.376 8.293 -7.511 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.638 9.374 -7.770 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.324 10.235 -8.955 1.00 0.00 H new ATOM 1174 N ARG A 79 3.955 9.134 -7.954 1.00 0.00 N ATOM 1175 CA ARG A 79 4.896 10.051 -7.322 1.00 0.00 C ATOM 1176 C ARG A 79 4.164 11.068 -6.452 1.00 0.00 C ATOM 1177 O ARG A 79 4.426 12.269 -6.527 1.00 0.00 O ATOM 1178 CB ARG A 79 5.726 10.775 -8.383 1.00 0.00 C ATOM 1179 CG ARG A 79 6.931 11.509 -7.818 1.00 0.00 C ATOM 1180 CD ARG A 79 7.259 12.751 -8.632 1.00 0.00 C ATOM 1181 NE ARG A 79 6.573 13.936 -8.124 1.00 0.00 N ATOM 1182 CZ ARG A 79 6.967 14.609 -7.049 1.00 0.00 C ATOM 1183 NH1 ARG A 79 8.038 14.216 -6.372 1.00 0.00 N ATOM 1184 NH2 ARG A 79 6.290 15.678 -6.648 1.00 0.00 N ATOM 0 H ARG A 79 3.990 8.180 -7.596 1.00 0.00 H new ATOM 0 HA ARG A 79 5.561 9.467 -6.686 1.00 0.00 H new ATOM 0 HB2 ARG A 79 6.067 10.050 -9.122 1.00 0.00 H new ATOM 0 HB3 ARG A 79 5.089 11.488 -8.906 1.00 0.00 H new ATOM 0 HG2 ARG A 79 6.734 11.792 -6.784 1.00 0.00 H new ATOM 0 HG3 ARG A 79 7.793 10.842 -7.807 1.00 0.00 H new ATOM 0 HD2 ARG A 79 8.336 12.921 -8.616 1.00 0.00 H new ATOM 0 HD3 ARG A 79 6.977 12.587 -9.672 1.00 0.00 H new ATOM 0 HE ARG A 79 5.746 14.265 -8.622 1.00 0.00 H new ATOM 0 HH11 ARG A 79 8.561 13.395 -6.677 1.00 0.00 H new ATOM 0 HH12 ARG A 79 8.338 14.735 -5.547 1.00 0.00 H new ATOM 0 HH21 ARG A 79 5.466 15.984 -7.166 1.00 0.00 H new ATOM 0 HH22 ARG A 79 6.594 16.194 -5.822 1.00 0.00 H new ATOM 1198 N THR A 80 3.244 10.579 -5.625 1.00 0.00 N ATOM 1199 CA THR A 80 2.472 11.445 -4.743 1.00 0.00 C ATOM 1200 C THR A 80 2.025 10.696 -3.493 1.00 0.00 C ATOM 1201 O THR A 80 2.115 9.470 -3.425 1.00 0.00 O ATOM 1202 CB THR A 80 1.233 12.015 -5.457 1.00 0.00 C ATOM 1203 OG1 THR A 80 0.166 12.195 -4.519 1.00 0.00 O ATOM 1204 CG2 THR A 80 0.780 11.089 -6.576 1.00 0.00 C ATOM 0 H THR A 80 3.016 9.588 -5.548 1.00 0.00 H new ATOM 0 HA THR A 80 3.126 12.268 -4.456 1.00 0.00 H new ATOM 0 HB THR A 80 1.502 12.979 -5.890 1.00 0.00 H new ATOM 0 HG1 THR A 80 -0.618 12.559 -4.981 1.00 0.00 H new ATOM 0 HG21 THR A 80 -0.097 11.512 -7.066 1.00 0.00 H new ATOM 0 HG22 THR A 80 1.584 10.977 -7.304 1.00 0.00 H new ATOM 0 HG23 THR A 80 0.528 10.113 -6.161 1.00 0.00 H new ATOM 1212 N VAL A 81 1.541 11.441 -2.504 1.00 0.00 N ATOM 1213 CA VAL A 81 1.077 10.847 -1.255 1.00 0.00 C ATOM 1214 C VAL A 81 -0.226 11.489 -0.792 1.00 0.00 C ATOM 1215 O VAL A 81 -0.573 12.602 -1.188 1.00 0.00 O ATOM 1216 CB VAL A 81 2.131 10.987 -0.141 1.00 0.00 C ATOM 1217 CG1 VAL A 81 3.062 9.785 -0.132 1.00 0.00 C ATOM 1218 CG2 VAL A 81 2.916 12.279 -0.311 1.00 0.00 C ATOM 0 H VAL A 81 1.460 12.457 -2.543 1.00 0.00 H new ATOM 0 HA VAL A 81 0.907 9.789 -1.452 1.00 0.00 H new ATOM 0 HB VAL A 81 1.617 11.024 0.819 1.00 0.00 H new ATOM 0 HG11 VAL A 81 3.800 9.902 0.662 1.00 0.00 H new ATOM 0 HG12 VAL A 81 2.483 8.878 0.041 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.571 9.712 -1.093 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.657 12.362 0.485 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.420 12.274 -1.277 1.00 0.00 H new ATOM 0 HG23 VAL A 81 2.234 13.128 -0.262 1.00 0.00 H new ATOM 1228 N PRO A 82 -0.965 10.774 0.069 1.00 0.00 N ATOM 1229 CA PRO A 82 -0.561 9.448 0.547 1.00 0.00 C ATOM 1230 C PRO A 82 -0.635 8.390 -0.548 1.00 0.00 C ATOM 1231 O PRO A 82 -1.073 8.668 -1.665 1.00 0.00 O ATOM 1232 CB PRO A 82 -1.576 9.145 1.652 1.00 0.00 C ATOM 1233 CG PRO A 82 -2.775 9.956 1.298 1.00 0.00 C ATOM 1234 CD PRO A 82 -2.252 11.204 0.641 1.00 0.00 C ATOM 0 HA PRO A 82 0.475 9.435 0.885 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.814 8.082 1.690 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -1.188 9.420 2.633 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -3.433 9.407 0.624 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -3.359 10.198 2.186 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -2.932 11.568 -0.129 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -2.122 12.013 1.360 1.00 0.00 H new ATOM 1242 N ARG A 83 -0.205 7.176 -0.221 1.00 0.00 N ATOM 1243 CA ARG A 83 -0.221 6.076 -1.178 1.00 0.00 C ATOM 1244 C ARG A 83 -1.073 4.919 -0.663 1.00 0.00 C ATOM 1245 O ARG A 83 -0.756 4.310 0.359 1.00 0.00 O ATOM 1246 CB ARG A 83 1.203 5.591 -1.455 1.00 0.00 C ATOM 1247 CG ARG A 83 1.903 6.358 -2.565 1.00 0.00 C ATOM 1248 CD ARG A 83 3.409 6.388 -2.356 1.00 0.00 C ATOM 1249 NE ARG A 83 4.122 6.765 -3.574 1.00 0.00 N ATOM 1250 CZ ARG A 83 5.439 6.933 -3.632 1.00 0.00 C ATOM 1251 NH1 ARG A 83 6.181 6.759 -2.548 1.00 0.00 N ATOM 1252 NH2 ARG A 83 6.015 7.277 -4.777 1.00 0.00 N ATOM 0 H ARG A 83 0.159 6.929 0.699 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.659 6.442 -2.106 1.00 0.00 H new ATOM 0 HB2 ARG A 83 1.791 5.675 -0.541 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.173 4.534 -1.719 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.677 5.897 -3.526 1.00 0.00 H new ATOM 0 HG3 ARG A 83 1.519 7.378 -2.603 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.651 7.093 -1.561 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.749 5.406 -2.026 1.00 0.00 H new ATOM 0 HE ARG A 83 3.580 6.907 -4.426 1.00 0.00 H new ATOM 0 HH11 ARG A 83 5.742 6.495 -1.666 1.00 0.00 H new ATOM 0 HH12 ARG A 83 7.192 6.889 -2.596 1.00 0.00 H new ATOM 0 HH21 ARG A 83 5.447 7.413 -5.613 1.00 0.00 H new ATOM 0 HH22 ARG A 83 7.026 7.406 -4.821 1.00 0.00 H new ATOM 1266 N ILE A 84 -2.154 4.623 -1.376 1.00 0.00 N ATOM 1267 CA ILE A 84 -3.050 3.540 -0.991 1.00 0.00 C ATOM 1268 C ILE A 84 -2.781 2.285 -1.813 1.00 0.00 C ATOM 1269 O ILE A 84 -2.539 2.359 -3.018 1.00 0.00 O ATOM 1270 CB ILE A 84 -4.527 3.944 -1.160 1.00 0.00 C ATOM 1271 CG1 ILE A 84 -4.855 5.145 -0.270 1.00 0.00 C ATOM 1272 CG2 ILE A 84 -5.438 2.771 -0.833 1.00 0.00 C ATOM 1273 CD1 ILE A 84 -4.605 6.479 -0.938 1.00 0.00 C ATOM 0 H ILE A 84 -2.431 5.118 -2.224 1.00 0.00 H new ATOM 0 HA ILE A 84 -2.857 3.330 0.061 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.694 4.229 -2.199 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.901 5.089 0.031 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -4.258 5.086 0.640 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -6.478 3.072 -0.957 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -5.218 1.941 -1.505 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -5.272 2.457 0.198 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -4.859 7.284 -0.249 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -3.553 6.556 -1.214 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -5.222 6.559 -1.833 1.00 0.00 H new ATOM 1285 N PHE A 85 -2.825 1.132 -1.154 1.00 0.00 N ATOM 1286 CA PHE A 85 -2.587 -0.141 -1.824 1.00 0.00 C ATOM 1287 C PHE A 85 -3.642 -1.170 -1.429 1.00 0.00 C ATOM 1288 O PHE A 85 -3.776 -1.520 -0.256 1.00 0.00 O ATOM 1289 CB PHE A 85 -1.192 -0.668 -1.483 1.00 0.00 C ATOM 1290 CG PHE A 85 -0.097 -0.035 -2.293 1.00 0.00 C ATOM 1291 CD1 PHE A 85 0.389 1.220 -1.965 1.00 0.00 C ATOM 1292 CD2 PHE A 85 0.447 -0.696 -3.383 1.00 0.00 C ATOM 1293 CE1 PHE A 85 1.396 1.805 -2.709 1.00 0.00 C ATOM 1294 CE2 PHE A 85 1.455 -0.116 -4.131 1.00 0.00 C ATOM 1295 CZ PHE A 85 1.930 1.136 -3.793 1.00 0.00 C ATOM 0 H PHE A 85 -3.023 1.053 -0.157 1.00 0.00 H new ATOM 0 HA PHE A 85 -2.652 0.026 -2.899 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -0.996 -0.496 -0.425 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -1.172 -1.747 -1.639 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -0.024 1.748 -1.118 1.00 0.00 H new ATOM 0 HD2 PHE A 85 0.079 -1.675 -3.651 1.00 0.00 H new ATOM 0 HE1 PHE A 85 1.765 2.784 -2.443 1.00 0.00 H new ATOM 0 HE2 PHE A 85 1.870 -0.641 -4.978 1.00 0.00 H new ATOM 0 HZ PHE A 85 2.718 1.591 -4.375 1.00 0.00 H new ATOM 1305 N VAL A 86 -4.390 -1.651 -2.417 1.00 0.00 N ATOM 1306 CA VAL A 86 -5.434 -2.640 -2.174 1.00 0.00 C ATOM 1307 C VAL A 86 -5.102 -3.966 -2.848 1.00 0.00 C ATOM 1308 O VAL A 86 -4.907 -4.025 -4.062 1.00 0.00 O ATOM 1309 CB VAL A 86 -6.803 -2.148 -2.680 1.00 0.00 C ATOM 1310 CG1 VAL A 86 -7.842 -3.252 -2.569 1.00 0.00 C ATOM 1311 CG2 VAL A 86 -7.242 -0.911 -1.910 1.00 0.00 C ATOM 0 H VAL A 86 -4.293 -1.372 -3.393 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.486 -2.787 -1.095 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.707 -1.878 -3.732 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -8.803 -2.885 -2.931 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -7.530 -4.107 -3.169 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -7.939 -3.557 -1.527 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.211 -0.577 -2.280 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.322 -1.152 -0.850 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -6.508 -0.117 -2.047 1.00 0.00 H new ATOM 1321 N ASN A 87 -5.039 -5.029 -2.053 1.00 0.00 N ATOM 1322 CA ASN A 87 -4.731 -6.356 -2.573 1.00 0.00 C ATOM 1323 C ASN A 87 -3.419 -6.344 -3.351 1.00 0.00 C ATOM 1324 O ASN A 87 -3.280 -7.025 -4.366 1.00 0.00 O ATOM 1325 CB ASN A 87 -5.866 -6.851 -3.473 1.00 0.00 C ATOM 1326 CG ASN A 87 -6.946 -7.577 -2.694 1.00 0.00 C ATOM 1327 OD1 ASN A 87 -6.707 -8.071 -1.592 1.00 0.00 O ATOM 1328 ND2 ASN A 87 -8.142 -7.646 -3.267 1.00 0.00 N ATOM 0 H ASN A 87 -5.197 -4.997 -1.046 1.00 0.00 H new ATOM 0 HA ASN A 87 -4.625 -7.035 -1.727 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -6.307 -6.003 -3.997 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -5.459 -7.518 -4.233 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -8.908 -8.123 -2.792 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -8.294 -7.222 -4.182 1.00 0.00 H new ATOM 1335 N GLY A 88 -2.457 -5.564 -2.867 1.00 0.00 N ATOM 1336 CA GLY A 88 -1.168 -5.477 -3.529 1.00 0.00 C ATOM 1337 C GLY A 88 -1.259 -4.820 -4.891 1.00 0.00 C ATOM 1338 O GLY A 88 -0.632 -5.271 -5.851 1.00 0.00 O ATOM 0 H GLY A 88 -2.547 -4.991 -2.028 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -0.478 -4.912 -2.902 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -0.751 -6.478 -3.639 1.00 0.00 H new ATOM 1342 N THR A 89 -2.044 -3.751 -4.980 1.00 0.00 N ATOM 1343 CA THR A 89 -2.218 -3.032 -6.236 1.00 0.00 C ATOM 1344 C THR A 89 -2.489 -1.552 -5.990 1.00 0.00 C ATOM 1345 O THR A 89 -3.250 -1.192 -5.092 1.00 0.00 O ATOM 1346 CB THR A 89 -3.373 -3.623 -7.066 1.00 0.00 C ATOM 1347 OG1 THR A 89 -2.953 -4.841 -7.692 1.00 0.00 O ATOM 1348 CG2 THR A 89 -3.836 -2.636 -8.127 1.00 0.00 C ATOM 0 H THR A 89 -2.570 -3.364 -4.196 1.00 0.00 H new ATOM 0 HA THR A 89 -1.287 -3.140 -6.793 1.00 0.00 H new ATOM 0 HB THR A 89 -4.206 -3.829 -6.394 1.00 0.00 H new ATOM 0 HG1 THR A 89 -2.091 -5.120 -7.319 1.00 0.00 H new ATOM 0 HG21 THR A 89 -4.652 -3.075 -8.701 1.00 0.00 H new ATOM 0 HG22 THR A 89 -4.182 -1.721 -7.646 1.00 0.00 H new ATOM 0 HG23 THR A 89 -3.006 -2.404 -8.795 1.00 0.00 H new ATOM 1356 N PHE A 90 -1.862 -0.699 -6.793 1.00 0.00 N ATOM 1357 CA PHE A 90 -2.036 0.743 -6.662 1.00 0.00 C ATOM 1358 C PHE A 90 -3.305 1.204 -7.372 1.00 0.00 C ATOM 1359 O PHE A 90 -3.286 1.506 -8.566 1.00 0.00 O ATOM 1360 CB PHE A 90 -0.822 1.479 -7.233 1.00 0.00 C ATOM 1361 CG PHE A 90 -0.942 2.974 -7.165 1.00 0.00 C ATOM 1362 CD1 PHE A 90 -1.512 3.685 -8.209 1.00 0.00 C ATOM 1363 CD2 PHE A 90 -0.484 3.670 -6.057 1.00 0.00 C ATOM 1364 CE1 PHE A 90 -1.622 5.061 -8.150 1.00 0.00 C ATOM 1365 CE2 PHE A 90 -0.592 5.046 -5.992 1.00 0.00 C ATOM 1366 CZ PHE A 90 -1.163 5.743 -7.039 1.00 0.00 C ATOM 0 H PHE A 90 -1.229 -0.981 -7.541 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.128 0.978 -5.602 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.070 1.169 -6.689 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.682 1.180 -8.272 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.874 3.157 -9.079 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -0.038 3.130 -5.235 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -2.066 5.603 -8.972 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.230 5.576 -5.123 1.00 0.00 H new ATOM 0 HZ PHE A 90 -1.251 6.818 -6.990 1.00 0.00 H new ATOM 1376 N ILE A 91 -4.406 1.256 -6.630 1.00 0.00 N ATOM 1377 CA ILE A 91 -5.684 1.681 -7.189 1.00 0.00 C ATOM 1378 C ILE A 91 -5.737 3.196 -7.350 1.00 0.00 C ATOM 1379 O ILE A 91 -6.545 3.722 -8.114 1.00 0.00 O ATOM 1380 CB ILE A 91 -6.862 1.229 -6.306 1.00 0.00 C ATOM 1381 CG1 ILE A 91 -6.913 2.058 -5.021 1.00 0.00 C ATOM 1382 CG2 ILE A 91 -6.743 -0.253 -5.982 1.00 0.00 C ATOM 1383 CD1 ILE A 91 -5.798 1.739 -4.051 1.00 0.00 C ATOM 0 H ILE A 91 -4.439 1.009 -5.641 1.00 0.00 H new ATOM 0 HA ILE A 91 -5.772 1.211 -8.168 1.00 0.00 H new ATOM 0 HB ILE A 91 -7.790 1.388 -6.855 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -6.867 3.116 -5.279 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -7.871 1.891 -4.528 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -7.583 -0.557 -5.357 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -6.751 -0.829 -6.907 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -5.810 -0.435 -5.449 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.898 2.364 -3.164 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.855 0.689 -3.763 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -4.836 1.933 -4.526 1.00 0.00 H new ATOM 1395 N GLY A 92 -4.867 3.894 -6.625 1.00 0.00 N ATOM 1396 CA GLY A 92 -4.830 5.342 -6.704 1.00 0.00 C ATOM 1397 C GLY A 92 -4.349 5.981 -5.416 1.00 0.00 C ATOM 1398 O GLY A 92 -3.702 5.330 -4.596 1.00 0.00 O ATOM 0 H GLY A 92 -4.188 3.482 -5.985 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.174 5.642 -7.522 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -5.826 5.715 -6.941 1.00 0.00 H new ATOM 1402 N GLY A 93 -4.664 7.260 -5.237 1.00 0.00 N ATOM 1403 CA GLY A 93 -4.250 7.965 -4.038 1.00 0.00 C ATOM 1404 C GLY A 93 -5.426 8.485 -3.235 1.00 0.00 C ATOM 1405 O GLY A 93 -6.555 8.027 -3.409 1.00 0.00 O ATOM 0 H GLY A 93 -5.198 7.821 -5.901 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -3.656 7.297 -3.415 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -3.606 8.800 -4.315 1.00 0.00 H new ATOM 1409 N ALA A 94 -5.162 9.442 -2.353 1.00 0.00 N ATOM 1410 CA ALA A 94 -6.207 10.024 -1.521 1.00 0.00 C ATOM 1411 C ALA A 94 -7.434 10.384 -2.352 1.00 0.00 C ATOM 1412 O ALA A 94 -8.521 9.844 -2.141 1.00 0.00 O ATOM 1413 CB ALA A 94 -5.681 11.253 -0.794 1.00 0.00 C ATOM 0 H ALA A 94 -4.232 9.831 -2.196 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.506 9.279 -0.783 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -6.473 11.677 -0.176 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -4.840 10.969 -0.161 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.353 11.994 -1.523 1.00 0.00 H new ATOM 1419 N THR A 95 -7.254 11.301 -3.298 1.00 0.00 N ATOM 1420 CA THR A 95 -8.347 11.734 -4.160 1.00 0.00 C ATOM 1421 C THR A 95 -8.994 10.548 -4.866 1.00 0.00 C ATOM 1422 O THR A 95 -10.129 10.179 -4.565 1.00 0.00 O ATOM 1423 CB THR A 95 -7.861 12.744 -5.217 1.00 0.00 C ATOM 1424 OG1 THR A 95 -6.961 13.684 -4.620 1.00 0.00 O ATOM 1425 CG2 THR A 95 -9.036 13.484 -5.838 1.00 0.00 C ATOM 0 H THR A 95 -6.362 11.758 -3.486 1.00 0.00 H new ATOM 0 HA THR A 95 -9.084 12.217 -3.518 1.00 0.00 H new ATOM 0 HB THR A 95 -7.342 12.193 -6.002 1.00 0.00 H new ATOM 0 HG1 THR A 95 -6.656 14.321 -5.299 1.00 0.00 H new ATOM 0 HG21 THR A 95 -8.669 14.192 -6.581 1.00 0.00 H new ATOM 0 HG22 THR A 95 -9.704 12.769 -6.317 1.00 0.00 H new ATOM 0 HG23 THR A 95 -9.578 14.023 -5.061 1.00 0.00 H new ATOM 1433 N ASP A 96 -8.265 9.955 -5.805 1.00 0.00 N ATOM 1434 CA ASP A 96 -8.768 8.809 -6.553 1.00 0.00 C ATOM 1435 C ASP A 96 -9.468 7.820 -5.626 1.00 0.00 C ATOM 1436 O ASP A 96 -10.670 7.582 -5.749 1.00 0.00 O ATOM 1437 CB ASP A 96 -7.623 8.113 -7.291 1.00 0.00 C ATOM 1438 CG ASP A 96 -8.115 7.229 -8.420 1.00 0.00 C ATOM 1439 OD1 ASP A 96 -8.835 7.740 -9.302 1.00 0.00 O ATOM 1440 OD2 ASP A 96 -7.780 6.025 -8.421 1.00 0.00 O ATOM 0 H ASP A 96 -7.324 10.249 -6.066 1.00 0.00 H new ATOM 0 HA ASP A 96 -9.493 9.171 -7.282 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -6.943 8.865 -7.692 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -7.052 7.511 -6.584 1.00 0.00 H new ATOM 1445 N THR A 97 -8.708 7.246 -4.699 1.00 0.00 N ATOM 1446 CA THR A 97 -9.255 6.281 -3.753 1.00 0.00 C ATOM 1447 C THR A 97 -10.584 6.763 -3.183 1.00 0.00 C ATOM 1448 O THR A 97 -11.529 5.986 -3.042 1.00 0.00 O ATOM 1449 CB THR A 97 -8.278 6.017 -2.592 1.00 0.00 C ATOM 1450 OG1 THR A 97 -7.038 5.511 -3.101 1.00 0.00 O ATOM 1451 CG2 THR A 97 -8.868 5.023 -1.603 1.00 0.00 C ATOM 0 H THR A 97 -7.712 7.432 -4.583 1.00 0.00 H new ATOM 0 HA THR A 97 -9.413 5.354 -4.303 1.00 0.00 H new ATOM 0 HB THR A 97 -8.101 6.960 -2.074 1.00 0.00 H new ATOM 0 HG1 THR A 97 -6.543 6.236 -3.536 1.00 0.00 H new ATOM 0 HG21 THR A 97 -8.160 4.853 -0.792 1.00 0.00 H new ATOM 0 HG22 THR A 97 -9.797 5.423 -1.196 1.00 0.00 H new ATOM 0 HG23 THR A 97 -9.071 4.081 -2.112 1.00 0.00 H new ATOM 1459 N HIS A 98 -10.652 8.050 -2.857 1.00 0.00 N ATOM 1460 CA HIS A 98 -11.867 8.636 -2.303 1.00 0.00 C ATOM 1461 C HIS A 98 -13.021 8.532 -3.296 1.00 0.00 C ATOM 1462 O HIS A 98 -14.162 8.272 -2.911 1.00 0.00 O ATOM 1463 CB HIS A 98 -11.630 10.099 -1.930 1.00 0.00 C ATOM 1464 CG HIS A 98 -12.798 10.741 -1.249 1.00 0.00 C ATOM 1465 ND1 HIS A 98 -13.967 10.067 -0.963 1.00 0.00 N ATOM 1466 CD2 HIS A 98 -12.974 12.004 -0.794 1.00 0.00 C ATOM 1467 CE1 HIS A 98 -14.811 10.887 -0.364 1.00 0.00 C ATOM 1468 NE2 HIS A 98 -14.232 12.069 -0.248 1.00 0.00 N ATOM 0 H HIS A 98 -9.880 8.707 -2.967 1.00 0.00 H new ATOM 0 HA HIS A 98 -12.132 8.079 -1.404 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -10.760 10.162 -1.277 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -11.392 10.661 -2.833 1.00 0.00 H new ATOM 0 HD1 HIS A 98 -14.151 9.088 -1.180 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -12.258 12.810 -0.850 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -15.805 10.635 -0.026 1.00 0.00 H new ATOM 1476 N ARG A 99 -12.717 8.738 -4.573 1.00 0.00 N ATOM 1477 CA ARG A 99 -13.729 8.670 -5.620 1.00 0.00 C ATOM 1478 C ARG A 99 -14.191 7.232 -5.837 1.00 0.00 C ATOM 1479 O ARG A 99 -15.389 6.956 -5.906 1.00 0.00 O ATOM 1480 CB ARG A 99 -13.181 9.244 -6.927 1.00 0.00 C ATOM 1481 CG ARG A 99 -14.262 9.701 -7.893 1.00 0.00 C ATOM 1482 CD ARG A 99 -13.800 9.593 -9.338 1.00 0.00 C ATOM 1483 NE ARG A 99 -14.802 10.100 -10.272 1.00 0.00 N ATOM 1484 CZ ARG A 99 -14.789 9.841 -11.575 1.00 0.00 C ATOM 1485 NH1 ARG A 99 -13.831 9.087 -12.095 1.00 0.00 N ATOM 1486 NH2 ARG A 99 -15.736 10.338 -12.360 1.00 0.00 N ATOM 0 H ARG A 99 -11.778 8.953 -4.908 1.00 0.00 H new ATOM 0 HA ARG A 99 -14.585 9.264 -5.302 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -12.530 10.088 -6.698 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -12.565 8.489 -7.415 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -15.158 9.097 -7.750 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -14.535 10.733 -7.673 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -12.872 10.150 -9.464 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -13.581 8.551 -9.572 1.00 0.00 H new ATOM 0 HE ARG A 99 -15.552 10.685 -9.904 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -13.101 8.704 -11.494 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -13.824 8.890 -13.096 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -16.474 10.919 -11.963 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -15.726 10.139 -13.360 1.00 0.00 H new ATOM 1500 N LEU A 100 -13.232 6.318 -5.945 1.00 0.00 N ATOM 1501 CA LEU A 100 -13.539 4.908 -6.155 1.00 0.00 C ATOM 1502 C LEU A 100 -14.679 4.457 -5.246 1.00 0.00 C ATOM 1503 O LEU A 100 -15.651 3.855 -5.704 1.00 0.00 O ATOM 1504 CB LEU A 100 -12.298 4.052 -5.899 1.00 0.00 C ATOM 1505 CG LEU A 100 -11.066 4.387 -6.740 1.00 0.00 C ATOM 1506 CD1 LEU A 100 -9.829 3.714 -6.166 1.00 0.00 C ATOM 1507 CD2 LEU A 100 -11.279 3.969 -8.188 1.00 0.00 C ATOM 0 H LEU A 100 -12.236 6.529 -5.891 1.00 0.00 H new ATOM 0 HA LEU A 100 -13.853 4.781 -7.191 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -12.030 4.142 -4.846 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -12.559 3.008 -6.073 1.00 0.00 H new ATOM 0 HG LEU A 100 -10.913 5.466 -6.713 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -8.962 3.964 -6.778 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -9.666 4.062 -5.146 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -9.971 2.633 -6.162 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -10.392 4.215 -8.772 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -11.457 2.895 -8.234 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -12.140 4.498 -8.596 1.00 0.00 H new ATOM 1519 N HIS A 101 -14.553 4.755 -3.957 1.00 0.00 N ATOM 1520 CA HIS A 101 -15.574 4.383 -2.984 1.00 0.00 C ATOM 1521 C HIS A 101 -16.929 4.969 -3.367 1.00 0.00 C ATOM 1522 O HIS A 101 -17.967 4.335 -3.179 1.00 0.00 O ATOM 1523 CB HIS A 101 -15.174 4.860 -1.587 1.00 0.00 C ATOM 1524 CG HIS A 101 -15.985 4.243 -0.489 1.00 0.00 C ATOM 1525 ND1 HIS A 101 -16.228 2.888 -0.403 1.00 0.00 N ATOM 1526 CD2 HIS A 101 -16.608 4.803 0.574 1.00 0.00 C ATOM 1527 CE1 HIS A 101 -16.967 2.642 0.664 1.00 0.00 C ATOM 1528 NE2 HIS A 101 -17.211 3.788 1.275 1.00 0.00 N ATOM 0 H HIS A 101 -13.755 5.253 -3.562 1.00 0.00 H new ATOM 0 HA HIS A 101 -15.658 3.296 -2.979 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -14.121 4.632 -1.422 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -15.277 5.944 -1.539 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -16.627 5.853 0.824 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -17.313 1.670 0.983 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -17.758 3.900 2.128 1.00 0.00 H new ATOM 1536 N LYS A 102 -16.912 6.184 -3.904 1.00 0.00 N ATOM 1537 CA LYS A 102 -18.138 6.858 -4.314 1.00 0.00 C ATOM 1538 C LYS A 102 -18.812 6.110 -5.460 1.00 0.00 C ATOM 1539 O LYS A 102 -19.951 5.660 -5.333 1.00 0.00 O ATOM 1540 CB LYS A 102 -17.837 8.297 -4.738 1.00 0.00 C ATOM 1541 CG LYS A 102 -17.190 9.130 -3.645 1.00 0.00 C ATOM 1542 CD LYS A 102 -17.536 10.603 -3.788 1.00 0.00 C ATOM 1543 CE LYS A 102 -16.570 11.315 -4.722 1.00 0.00 C ATOM 1544 NZ LYS A 102 -16.787 12.788 -4.726 1.00 0.00 N ATOM 0 H LYS A 102 -16.061 6.723 -4.066 1.00 0.00 H new ATOM 0 HA LYS A 102 -18.818 6.872 -3.462 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -17.180 8.281 -5.608 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -18.765 8.777 -5.048 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -17.519 8.771 -2.670 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -16.108 9.004 -3.683 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -18.552 10.704 -4.169 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -17.514 11.080 -2.808 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -15.546 11.100 -4.418 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -16.691 10.927 -5.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -16.109 13.237 -5.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -17.756 12.995 -5.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -16.647 13.162 -3.766 1.00 0.00 H new ATOM 1558 N GLU A 103 -18.102 5.980 -6.575 1.00 0.00 N ATOM 1559 CA GLU A 103 -18.633 5.285 -7.742 1.00 0.00 C ATOM 1560 C GLU A 103 -18.833 3.801 -7.448 1.00 0.00 C ATOM 1561 O GLU A 103 -19.632 3.130 -8.100 1.00 0.00 O ATOM 1562 CB GLU A 103 -17.693 5.457 -8.937 1.00 0.00 C ATOM 1563 CG GLU A 103 -17.833 6.799 -9.634 1.00 0.00 C ATOM 1564 CD GLU A 103 -18.859 6.773 -10.751 1.00 0.00 C ATOM 1565 OE1 GLU A 103 -20.061 6.938 -10.456 1.00 0.00 O ATOM 1566 OE2 GLU A 103 -18.459 6.587 -11.919 1.00 0.00 O ATOM 0 H GLU A 103 -17.158 6.346 -6.696 1.00 0.00 H new ATOM 0 HA GLU A 103 -19.601 5.723 -7.984 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -16.664 5.339 -8.599 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -17.885 4.662 -9.657 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -18.117 7.556 -8.903 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -16.866 7.095 -10.041 1.00 0.00 H new ATOM 1573 N GLY A 104 -18.101 3.296 -6.460 1.00 0.00 N ATOM 1574 CA GLY A 104 -18.212 1.895 -6.096 1.00 0.00 C ATOM 1575 C GLY A 104 -17.139 1.042 -6.742 1.00 0.00 C ATOM 1576 O GLY A 104 -17.279 -0.178 -6.838 1.00 0.00 O ATOM 0 H GLY A 104 -17.433 3.831 -5.905 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -18.146 1.798 -5.012 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -19.194 1.523 -6.390 1.00 0.00 H new ATOM 1580 N LYS A 105 -16.065 1.683 -7.190 1.00 0.00 N ATOM 1581 CA LYS A 105 -14.963 0.976 -7.832 1.00 0.00 C ATOM 1582 C LYS A 105 -13.889 0.605 -6.815 1.00 0.00 C ATOM 1583 O LYS A 105 -12.798 0.165 -7.181 1.00 0.00 O ATOM 1584 CB LYS A 105 -14.354 1.837 -8.941 1.00 0.00 C ATOM 1585 CG LYS A 105 -15.389 2.506 -9.829 1.00 0.00 C ATOM 1586 CD LYS A 105 -14.758 3.554 -10.729 1.00 0.00 C ATOM 1587 CE LYS A 105 -14.745 4.924 -10.067 1.00 0.00 C ATOM 1588 NZ LYS A 105 -13.588 5.746 -10.516 1.00 0.00 N ATOM 0 H LYS A 105 -15.934 2.692 -7.120 1.00 0.00 H new ATOM 0 HA LYS A 105 -15.358 0.059 -8.268 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -13.724 2.604 -8.490 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -13.706 1.215 -9.558 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -15.887 1.753 -10.440 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -16.155 2.971 -9.209 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -13.738 3.258 -10.974 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -15.309 3.608 -11.668 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -15.673 5.447 -10.297 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -14.707 4.804 -8.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -13.316 6.405 -9.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -12.785 5.123 -10.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -13.854 6.285 -11.365 1.00 0.00 H new ATOM 1602 N LEU A 106 -14.204 0.783 -5.536 1.00 0.00 N ATOM 1603 CA LEU A 106 -13.266 0.465 -4.466 1.00 0.00 C ATOM 1604 C LEU A 106 -13.758 -0.722 -3.644 1.00 0.00 C ATOM 1605 O LEU A 106 -12.984 -1.615 -3.296 1.00 0.00 O ATOM 1606 CB LEU A 106 -13.066 1.680 -3.558 1.00 0.00 C ATOM 1607 CG LEU A 106 -11.785 1.691 -2.723 1.00 0.00 C ATOM 1608 CD1 LEU A 106 -11.394 3.117 -2.366 1.00 0.00 C ATOM 1609 CD2 LEU A 106 -11.961 0.853 -1.465 1.00 0.00 C ATOM 0 H LEU A 106 -15.102 1.146 -5.216 1.00 0.00 H new ATOM 0 HA LEU A 106 -12.312 0.198 -4.921 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -13.080 2.577 -4.177 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -13.918 1.747 -2.881 1.00 0.00 H new ATOM 0 HG LEU A 106 -10.982 1.254 -3.317 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -10.480 3.106 -1.772 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -11.226 3.688 -3.279 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -12.195 3.581 -1.791 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -11.040 0.872 -0.883 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -12.776 1.261 -0.867 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -12.193 -0.175 -1.742 1.00 0.00 H new ATOM 1621 N LEU A 107 -15.051 -0.728 -3.340 1.00 0.00 N ATOM 1622 CA LEU A 107 -15.649 -1.808 -2.562 1.00 0.00 C ATOM 1623 C LEU A 107 -15.440 -3.154 -3.248 1.00 0.00 C ATOM 1624 O LEU A 107 -15.097 -4.154 -2.616 1.00 0.00 O ATOM 1625 CB LEU A 107 -17.144 -1.551 -2.361 1.00 0.00 C ATOM 1626 CG LEU A 107 -17.766 -2.158 -1.103 1.00 0.00 C ATOM 1627 CD1 LEU A 107 -18.108 -3.623 -1.330 1.00 0.00 C ATOM 1628 CD2 LEU A 107 -16.826 -2.006 0.084 1.00 0.00 C ATOM 0 H LEU A 107 -15.706 0.002 -3.620 1.00 0.00 H new ATOM 0 HA LEU A 107 -15.158 -1.837 -1.589 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -17.307 -0.474 -2.339 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -17.679 -1.937 -3.229 1.00 0.00 H new ATOM 0 HG LEU A 107 -18.688 -1.621 -0.882 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -18.550 -4.038 -0.424 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -18.819 -3.708 -2.152 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -17.201 -4.174 -1.577 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -17.285 -2.444 0.970 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -15.887 -2.517 -0.128 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -16.632 -0.948 0.261 1.00 0.00 H new ATOM 1640 N PRO A 108 -15.649 -3.183 -4.572 1.00 0.00 N ATOM 1641 CA PRO A 108 -15.487 -4.399 -5.373 1.00 0.00 C ATOM 1642 C PRO A 108 -14.175 -5.118 -5.077 1.00 0.00 C ATOM 1643 O PRO A 108 -14.082 -6.339 -5.203 1.00 0.00 O ATOM 1644 CB PRO A 108 -15.500 -3.880 -6.813 1.00 0.00 C ATOM 1645 CG PRO A 108 -16.279 -2.612 -6.752 1.00 0.00 C ATOM 1646 CD PRO A 108 -16.060 -2.029 -5.390 1.00 0.00 C ATOM 0 HA PRO A 108 -16.266 -5.132 -5.163 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -14.489 -3.706 -7.180 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -15.965 -4.598 -7.488 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -15.949 -1.919 -7.526 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -17.338 -2.801 -6.925 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -15.291 -1.256 -5.405 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -16.968 -1.568 -5.002 1.00 0.00 H new ATOM 1654 N LEU A 109 -13.163 -4.352 -4.684 1.00 0.00 N ATOM 1655 CA LEU A 109 -11.855 -4.916 -4.369 1.00 0.00 C ATOM 1656 C LEU A 109 -11.777 -5.325 -2.902 1.00 0.00 C ATOM 1657 O LEU A 109 -11.322 -6.421 -2.575 1.00 0.00 O ATOM 1658 CB LEU A 109 -10.752 -3.905 -4.688 1.00 0.00 C ATOM 1659 CG LEU A 109 -10.737 -3.356 -6.115 1.00 0.00 C ATOM 1660 CD1 LEU A 109 -9.766 -2.191 -6.229 1.00 0.00 C ATOM 1661 CD2 LEU A 109 -10.376 -4.453 -7.105 1.00 0.00 C ATOM 0 H LEU A 109 -13.223 -3.340 -4.576 1.00 0.00 H new ATOM 0 HA LEU A 109 -11.713 -5.806 -4.983 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.845 -3.066 -3.998 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -9.788 -4.374 -4.491 1.00 0.00 H new ATOM 0 HG LEU A 109 -11.737 -2.993 -6.354 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -9.769 -1.814 -7.252 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -10.070 -1.396 -5.548 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -8.762 -2.527 -5.969 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -10.370 -4.044 -8.115 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -9.388 -4.847 -6.867 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -11.111 -5.256 -7.043 1.00 0.00 H new ATOM 1673 N VAL A 110 -12.225 -4.436 -2.020 1.00 0.00 N ATOM 1674 CA VAL A 110 -12.209 -4.706 -0.587 1.00 0.00 C ATOM 1675 C VAL A 110 -12.718 -6.111 -0.287 1.00 0.00 C ATOM 1676 O VAL A 110 -12.168 -6.814 0.562 1.00 0.00 O ATOM 1677 CB VAL A 110 -13.066 -3.685 0.185 1.00 0.00 C ATOM 1678 CG1 VAL A 110 -13.110 -4.036 1.665 1.00 0.00 C ATOM 1679 CG2 VAL A 110 -12.531 -2.276 -0.022 1.00 0.00 C ATOM 0 H VAL A 110 -12.603 -3.523 -2.273 1.00 0.00 H new ATOM 0 HA VAL A 110 -11.173 -4.621 -0.260 1.00 0.00 H new ATOM 0 HB VAL A 110 -14.084 -3.723 -0.203 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -13.720 -3.304 2.195 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -13.543 -5.028 1.791 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -12.099 -4.028 2.071 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -13.148 -1.568 0.530 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -11.504 -2.220 0.338 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -12.557 -2.029 -1.083 1.00 0.00 H new ATOM 1689 N HIS A 111 -13.772 -6.516 -0.989 1.00 0.00 N ATOM 1690 CA HIS A 111 -14.355 -7.839 -0.798 1.00 0.00 C ATOM 1691 C HIS A 111 -13.371 -8.930 -1.208 1.00 0.00 C ATOM 1692 O HIS A 111 -13.156 -9.893 -0.472 1.00 0.00 O ATOM 1693 CB HIS A 111 -15.647 -7.971 -1.604 1.00 0.00 C ATOM 1694 CG HIS A 111 -16.822 -7.294 -0.968 1.00 0.00 C ATOM 1695 ND1 HIS A 111 -17.881 -6.787 -1.691 1.00 0.00 N ATOM 1696 CD2 HIS A 111 -17.102 -7.044 0.333 1.00 0.00 C ATOM 1697 CE1 HIS A 111 -18.761 -6.253 -0.863 1.00 0.00 C ATOM 1698 NE2 HIS A 111 -18.312 -6.396 0.371 1.00 0.00 N ATOM 0 H HIS A 111 -14.239 -5.947 -1.695 1.00 0.00 H new ATOM 0 HA HIS A 111 -14.583 -7.960 0.261 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -15.490 -7.551 -2.598 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -15.876 -9.028 -1.737 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -16.488 -7.305 1.182 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -19.690 -5.780 -1.147 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -18.787 -6.077 1.215 1.00 0.00 H new ATOM 1706 N GLN A 112 -12.779 -8.774 -2.388 1.00 0.00 N ATOM 1707 CA GLN A 112 -11.820 -9.747 -2.896 1.00 0.00 C ATOM 1708 C GLN A 112 -10.690 -9.971 -1.897 1.00 0.00 C ATOM 1709 O GLN A 112 -10.176 -11.082 -1.763 1.00 0.00 O ATOM 1710 CB GLN A 112 -11.248 -9.280 -4.235 1.00 0.00 C ATOM 1711 CG GLN A 112 -12.299 -9.107 -5.320 1.00 0.00 C ATOM 1712 CD GLN A 112 -11.747 -9.347 -6.711 1.00 0.00 C ATOM 1713 OE1 GLN A 112 -10.670 -8.861 -7.056 1.00 0.00 O ATOM 1714 NE2 GLN A 112 -12.485 -10.099 -7.519 1.00 0.00 N ATOM 0 H GLN A 112 -12.947 -7.983 -3.010 1.00 0.00 H new ATOM 0 HA GLN A 112 -12.343 -10.692 -3.042 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -10.730 -8.332 -4.088 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -10.504 -10.001 -4.574 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -13.122 -9.797 -5.136 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -12.710 -8.099 -5.265 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -13.372 -10.482 -7.191 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -12.165 -10.294 -8.468 1.00 0.00 H new ATOM 1723 N CYS A 113 -10.307 -8.908 -1.197 1.00 0.00 N ATOM 1724 CA CYS A 113 -9.237 -8.987 -0.210 1.00 0.00 C ATOM 1725 C CYS A 113 -9.577 -9.997 0.882 1.00 0.00 C ATOM 1726 O CYS A 113 -8.803 -10.914 1.157 1.00 0.00 O ATOM 1727 CB CYS A 113 -8.986 -7.612 0.413 1.00 0.00 C ATOM 1728 SG CYS A 113 -7.752 -7.616 1.753 1.00 0.00 S ATOM 0 H CYS A 113 -10.722 -7.982 -1.295 1.00 0.00 H new ATOM 0 HA CYS A 113 -8.332 -9.319 -0.719 1.00 0.00 H new ATOM 0 HB2 CYS A 113 -8.657 -6.926 -0.368 1.00 0.00 H new ATOM 0 HB3 CYS A 113 -9.927 -7.224 0.802 1.00 0.00 H new ATOM 1733 N TYR A 114 -10.740 -9.822 1.500 1.00 0.00 N ATOM 1734 CA TYR A 114 -11.182 -10.717 2.563 1.00 0.00 C ATOM 1735 C TYR A 114 -12.387 -11.540 2.117 1.00 0.00 C ATOM 1736 O TYR A 114 -13.272 -11.851 2.915 1.00 0.00 O ATOM 1737 CB TYR A 114 -11.534 -9.916 3.818 1.00 0.00 C ATOM 1738 CG TYR A 114 -12.967 -9.433 3.846 1.00 0.00 C ATOM 1739 CD1 TYR A 114 -13.373 -8.359 3.063 1.00 0.00 C ATOM 1740 CD2 TYR A 114 -13.913 -10.048 4.656 1.00 0.00 C ATOM 1741 CE1 TYR A 114 -14.681 -7.913 3.085 1.00 0.00 C ATOM 1742 CE2 TYR A 114 -15.223 -9.609 4.684 1.00 0.00 C ATOM 1743 CZ TYR A 114 -15.602 -8.542 3.897 1.00 0.00 C ATOM 1744 OH TYR A 114 -16.905 -8.101 3.923 1.00 0.00 O ATOM 0 H TYR A 114 -11.393 -9.069 1.283 1.00 0.00 H new ATOM 0 HA TYR A 114 -10.364 -11.400 2.792 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -11.351 -10.534 4.697 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -10.868 -9.056 3.889 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -12.654 -7.864 2.426 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -13.620 -10.883 5.274 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -14.980 -7.077 2.470 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -15.946 -10.099 5.319 1.00 0.00 H new ATOM 0 HH TYR A 114 -17.424 -8.652 4.545 1.00 0.00 H new ATOM 1754 N LEU A 115 -12.414 -11.889 0.835 1.00 0.00 N ATOM 1755 CA LEU A 115 -13.510 -12.676 0.280 1.00 0.00 C ATOM 1756 C LEU A 115 -13.613 -14.031 0.974 1.00 0.00 C ATOM 1757 O LEU A 115 -12.682 -14.836 0.929 1.00 0.00 O ATOM 1758 CB LEU A 115 -13.310 -12.875 -1.224 1.00 0.00 C ATOM 1759 CG LEU A 115 -14.584 -13.001 -2.059 1.00 0.00 C ATOM 1760 CD1 LEU A 115 -15.475 -14.105 -1.511 1.00 0.00 C ATOM 1761 CD2 LEU A 115 -15.333 -11.677 -2.093 1.00 0.00 C ATOM 0 H LEU A 115 -11.690 -11.640 0.161 1.00 0.00 H new ATOM 0 HA LEU A 115 -14.438 -12.130 0.448 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -12.730 -12.036 -1.607 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -12.710 -13.773 -1.375 1.00 0.00 H new ATOM 0 HG LEU A 115 -14.302 -13.262 -3.079 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -16.377 -14.180 -2.118 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -14.939 -15.053 -1.540 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -15.749 -13.874 -0.482 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -16.237 -11.786 -2.692 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -15.603 -11.386 -1.078 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -14.696 -10.910 -2.533 1.00 0.00 H new ATOM 1773 N LYS A 116 -14.751 -14.277 1.614 1.00 0.00 N ATOM 1774 CA LYS A 116 -14.979 -15.535 2.315 1.00 0.00 C ATOM 1775 C LYS A 116 -14.744 -16.724 1.389 1.00 0.00 C ATOM 1776 O LYS A 116 -14.320 -16.559 0.245 1.00 0.00 O ATOM 1777 CB LYS A 116 -16.404 -15.582 2.871 1.00 0.00 C ATOM 1778 CG LYS A 116 -17.476 -15.608 1.795 1.00 0.00 C ATOM 1779 CD LYS A 116 -18.851 -15.315 2.372 1.00 0.00 C ATOM 1780 CE LYS A 116 -19.540 -16.586 2.843 1.00 0.00 C ATOM 1781 NZ LYS A 116 -20.119 -17.357 1.708 1.00 0.00 N ATOM 0 H LYS A 116 -15.531 -13.621 1.662 1.00 0.00 H new ATOM 0 HA LYS A 116 -14.271 -15.595 3.142 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -16.511 -16.466 3.500 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -16.564 -14.714 3.511 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -17.239 -14.873 1.026 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -17.484 -16.585 1.311 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -18.756 -14.621 3.207 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -19.466 -14.824 1.618 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -18.824 -17.210 3.378 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -20.330 -16.330 3.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -20.580 -18.216 2.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -20.821 -16.771 1.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -19.362 -17.623 1.047 1.00 0.00 H new ATOM 1795 N LYS A 117 -15.023 -17.922 1.890 1.00 0.00 N ATOM 1796 CA LYS A 117 -14.845 -19.140 1.108 1.00 0.00 C ATOM 1797 C LYS A 117 -15.665 -19.086 -0.177 1.00 0.00 C ATOM 1798 O LYS A 117 -16.885 -18.927 -0.139 1.00 0.00 O ATOM 1799 CB LYS A 117 -15.249 -20.364 1.932 1.00 0.00 C ATOM 1800 CG LYS A 117 -14.117 -20.935 2.768 1.00 0.00 C ATOM 1801 CD LYS A 117 -13.309 -21.959 1.989 1.00 0.00 C ATOM 1802 CE LYS A 117 -14.032 -23.295 1.909 1.00 0.00 C ATOM 1803 NZ LYS A 117 -13.499 -24.149 0.811 1.00 0.00 N ATOM 0 H LYS A 117 -15.374 -18.076 2.835 1.00 0.00 H new ATOM 0 HA LYS A 117 -13.791 -19.220 0.843 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -16.074 -20.092 2.590 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -15.619 -21.138 1.260 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -13.463 -20.127 3.096 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -14.525 -21.399 3.666 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -13.120 -21.586 0.983 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -12.338 -22.097 2.465 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -13.931 -23.820 2.859 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -15.097 -23.123 1.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -14.017 -25.050 0.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -13.618 -23.659 -0.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -12.489 -24.335 0.975 1.00 0.00 H new ATOM 1817 N SER A 118 -14.987 -19.220 -1.313 1.00 0.00 N ATOM 1818 CA SER A 118 -15.654 -19.183 -2.609 1.00 0.00 C ATOM 1819 C SER A 118 -15.109 -20.271 -3.530 1.00 0.00 C ATOM 1820 O SER A 118 -13.898 -20.475 -3.622 1.00 0.00 O ATOM 1821 CB SER A 118 -15.474 -17.811 -3.260 1.00 0.00 C ATOM 1822 OG SER A 118 -15.901 -17.828 -4.612 1.00 0.00 O ATOM 0 H SER A 118 -13.977 -19.355 -1.362 1.00 0.00 H new ATOM 0 HA SER A 118 -16.717 -19.364 -2.449 1.00 0.00 H new ATOM 0 HB2 SER A 118 -16.042 -17.064 -2.705 1.00 0.00 H new ATOM 0 HB3 SER A 118 -14.426 -17.516 -3.210 1.00 0.00 H new ATOM 0 HG SER A 118 -15.777 -16.939 -5.005 1.00 0.00 H new ATOM 1828 N LYS A 119 -16.012 -20.967 -4.212 1.00 0.00 N ATOM 1829 CA LYS A 119 -15.626 -22.034 -5.128 1.00 0.00 C ATOM 1830 C LYS A 119 -15.503 -21.508 -6.554 1.00 0.00 C ATOM 1831 O LYS A 119 -16.286 -20.660 -6.983 1.00 0.00 O ATOM 1832 CB LYS A 119 -16.647 -23.172 -5.079 1.00 0.00 C ATOM 1833 CG LYS A 119 -18.023 -22.776 -5.587 1.00 0.00 C ATOM 1834 CD LYS A 119 -18.887 -23.995 -5.863 1.00 0.00 C ATOM 1835 CE LYS A 119 -19.417 -24.607 -4.576 1.00 0.00 C ATOM 1836 NZ LYS A 119 -20.362 -25.726 -4.841 1.00 0.00 N ATOM 0 H LYS A 119 -17.018 -20.811 -4.148 1.00 0.00 H new ATOM 0 HA LYS A 119 -14.654 -22.414 -4.814 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -16.276 -24.008 -5.673 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -16.736 -23.525 -4.052 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -18.514 -22.140 -4.851 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -17.920 -22.188 -6.499 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -19.723 -23.712 -6.503 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -18.305 -24.739 -6.408 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -18.582 -24.971 -3.977 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -19.920 -23.839 -3.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -20.700 -26.116 -3.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -21.171 -25.374 -5.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -19.875 -26.471 -5.379 1.00 0.00 H new ATOM 1850 N ARG A 120 -14.516 -22.017 -7.285 1.00 0.00 N ATOM 1851 CA ARG A 120 -14.292 -21.599 -8.664 1.00 0.00 C ATOM 1852 C ARG A 120 -14.049 -22.805 -9.565 1.00 0.00 C ATOM 1853 O ARG A 120 -14.021 -23.945 -9.101 1.00 0.00 O ATOM 1854 CB ARG A 120 -13.100 -20.643 -8.741 1.00 0.00 C ATOM 1855 CG ARG A 120 -13.464 -19.192 -8.469 1.00 0.00 C ATOM 1856 CD ARG A 120 -12.529 -18.238 -9.195 1.00 0.00 C ATOM 1857 NE ARG A 120 -12.634 -16.874 -8.683 1.00 0.00 N ATOM 1858 CZ ARG A 120 -12.184 -15.808 -9.335 1.00 0.00 C ATOM 1859 NH1 ARG A 120 -11.601 -15.947 -10.518 1.00 0.00 N ATOM 1860 NH2 ARG A 120 -12.316 -14.599 -8.804 1.00 0.00 N ATOM 0 H ARG A 120 -13.859 -22.719 -6.945 1.00 0.00 H new ATOM 0 HA ARG A 120 -15.187 -21.083 -9.011 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -12.344 -20.960 -8.023 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -12.650 -20.716 -9.731 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -14.491 -19.008 -8.785 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -13.421 -19.000 -7.397 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -11.502 -18.587 -9.090 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -12.760 -18.244 -10.260 1.00 0.00 H new ATOM 0 HE ARG A 120 -13.077 -16.732 -7.775 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -11.497 -16.874 -10.930 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -11.256 -15.126 -11.016 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -12.763 -14.488 -7.894 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -11.970 -13.781 -9.306 1.00 0.00 H new ATOM 1874 N LYS A 121 -13.875 -22.547 -10.857 1.00 0.00 N ATOM 1875 CA LYS A 121 -13.634 -23.610 -11.825 1.00 0.00 C ATOM 1876 C LYS A 121 -13.197 -23.034 -13.168 1.00 0.00 C ATOM 1877 O LYS A 121 -13.877 -22.181 -13.738 1.00 0.00 O ATOM 1878 CB LYS A 121 -14.896 -24.457 -12.008 1.00 0.00 C ATOM 1879 CG LYS A 121 -14.720 -25.607 -12.984 1.00 0.00 C ATOM 1880 CD LYS A 121 -15.009 -25.176 -14.412 1.00 0.00 C ATOM 1881 CE LYS A 121 -15.276 -26.373 -15.312 1.00 0.00 C ATOM 1882 NZ LYS A 121 -15.745 -25.957 -16.663 1.00 0.00 N ATOM 0 H LYS A 121 -13.897 -21.609 -11.258 1.00 0.00 H new ATOM 0 HA LYS A 121 -12.832 -24.241 -11.442 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -15.199 -24.856 -11.040 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -15.706 -23.816 -12.357 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -13.701 -25.989 -12.917 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -15.386 -26.425 -12.708 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -15.872 -24.510 -14.425 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -14.163 -24.609 -14.800 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -14.366 -26.964 -15.410 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -16.025 -27.015 -14.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -15.916 -26.801 -17.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -16.628 -25.414 -16.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -15.019 -25.365 -17.115 1.00 0.00 H new ATOM 1896 N GLU A 122 -12.059 -23.507 -13.668 1.00 0.00 N ATOM 1897 CA GLU A 122 -11.533 -23.038 -14.944 1.00 0.00 C ATOM 1898 C GLU A 122 -11.118 -24.213 -15.826 1.00 0.00 C ATOM 1899 O GLU A 122 -10.596 -25.216 -15.338 1.00 0.00 O ATOM 1900 CB GLU A 122 -10.338 -22.109 -14.719 1.00 0.00 C ATOM 1901 CG GLU A 122 -9.214 -22.747 -13.919 1.00 0.00 C ATOM 1902 CD GLU A 122 -9.471 -22.718 -12.425 1.00 0.00 C ATOM 1903 OE1 GLU A 122 -10.178 -23.620 -11.928 1.00 0.00 O ATOM 1904 OE2 GLU A 122 -8.967 -21.794 -11.753 1.00 0.00 O ATOM 0 H GLU A 122 -11.485 -24.214 -13.209 1.00 0.00 H new ATOM 0 HA GLU A 122 -12.323 -22.485 -15.452 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -9.949 -21.790 -15.686 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -10.678 -21.212 -14.201 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -9.085 -23.780 -14.242 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -8.280 -22.227 -14.133 1.00 0.00 H new ATOM 1911 N PHE A 123 -11.355 -24.081 -17.127 1.00 0.00 N ATOM 1912 CA PHE A 123 -11.008 -25.131 -18.077 1.00 0.00 C ATOM 1913 C PHE A 123 -9.494 -25.277 -18.199 1.00 0.00 C ATOM 1914 O PHE A 123 -8.753 -24.308 -18.034 1.00 0.00 O ATOM 1915 CB PHE A 123 -11.614 -24.827 -19.449 1.00 0.00 C ATOM 1916 CG PHE A 123 -11.595 -26.000 -20.387 1.00 0.00 C ATOM 1917 CD1 PHE A 123 -12.290 -27.159 -20.082 1.00 0.00 C ATOM 1918 CD2 PHE A 123 -10.880 -25.945 -21.572 1.00 0.00 C ATOM 1919 CE1 PHE A 123 -12.275 -28.241 -20.943 1.00 0.00 C ATOM 1920 CE2 PHE A 123 -10.861 -27.023 -22.437 1.00 0.00 C ATOM 1921 CZ PHE A 123 -11.558 -28.173 -22.121 1.00 0.00 C ATOM 0 H PHE A 123 -11.786 -23.257 -17.547 1.00 0.00 H new ATOM 0 HA PHE A 123 -11.417 -26.071 -17.706 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -12.644 -24.495 -19.317 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -11.068 -24.000 -19.903 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -12.850 -27.218 -19.161 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -10.331 -25.049 -21.823 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -12.823 -29.138 -20.694 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -10.302 -26.966 -23.359 1.00 0.00 H new ATOM 0 HZ PHE A 123 -11.542 -29.017 -22.794 1.00 0.00 H new ATOM 1931 N GLN A 124 -9.044 -26.494 -18.486 1.00 0.00 N ATOM 1932 CA GLN A 124 -7.619 -26.766 -18.628 1.00 0.00 C ATOM 1933 C GLN A 124 -7.182 -26.640 -20.084 1.00 0.00 C ATOM 1934 O GLN A 124 -7.674 -27.359 -20.954 1.00 0.00 O ATOM 1935 CB GLN A 124 -7.291 -28.166 -18.104 1.00 0.00 C ATOM 1936 CG GLN A 124 -5.839 -28.567 -18.309 1.00 0.00 C ATOM 1937 CD GLN A 124 -5.499 -28.805 -19.767 1.00 0.00 C ATOM 1938 OE1 GLN A 124 -4.575 -28.197 -20.308 1.00 0.00 O ATOM 1939 NE2 GLN A 124 -6.246 -29.694 -20.412 1.00 0.00 N ATOM 0 H GLN A 124 -9.645 -27.306 -18.625 1.00 0.00 H new ATOM 0 HA GLN A 124 -7.074 -26.028 -18.040 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -7.525 -28.211 -17.040 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -7.934 -28.891 -18.603 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -5.191 -27.786 -17.912 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -5.632 -29.473 -17.739 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -7.002 -30.175 -19.924 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -6.064 -29.896 -21.395 1.00 0.00 H new ATOM 1948 N SER A 125 -6.257 -25.722 -20.342 1.00 0.00 N ATOM 1949 CA SER A 125 -5.757 -25.499 -21.693 1.00 0.00 C ATOM 1950 C SER A 125 -4.356 -26.081 -21.858 1.00 0.00 C ATOM 1951 O SER A 125 -3.403 -25.619 -21.233 1.00 0.00 O ATOM 1952 CB SER A 125 -5.741 -24.003 -22.013 1.00 0.00 C ATOM 1953 OG SER A 125 -4.899 -23.299 -21.116 1.00 0.00 O ATOM 0 H SER A 125 -5.838 -25.120 -19.633 1.00 0.00 H new ATOM 0 HA SER A 125 -6.426 -26.005 -22.389 1.00 0.00 H new ATOM 0 HB2 SER A 125 -5.397 -23.850 -23.036 1.00 0.00 H new ATOM 0 HB3 SER A 125 -6.754 -23.604 -21.955 1.00 0.00 H new ATOM 0 HG SER A 125 -4.118 -23.850 -20.900 1.00 0.00 H new ATOM 1959 N GLY A 126 -4.241 -27.099 -22.705 1.00 0.00 N ATOM 1960 CA GLY A 126 -2.954 -27.729 -22.937 1.00 0.00 C ATOM 1961 C GLY A 126 -2.006 -26.839 -23.717 1.00 0.00 C ATOM 1962 O GLY A 126 -2.393 -25.798 -24.249 1.00 0.00 O ATOM 0 H GLY A 126 -5.016 -27.499 -23.235 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -2.501 -27.987 -21.980 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -3.102 -28.662 -23.481 1.00 0.00 H new ATOM 1966 N PRO A 127 -0.731 -27.249 -23.791 1.00 0.00 N ATOM 1967 CA PRO A 127 0.302 -26.495 -24.508 1.00 0.00 C ATOM 1968 C PRO A 127 0.101 -26.529 -26.019 1.00 0.00 C ATOM 1969 O PRO A 127 0.485 -27.491 -26.684 1.00 0.00 O ATOM 1970 CB PRO A 127 1.597 -27.216 -24.125 1.00 0.00 C ATOM 1971 CG PRO A 127 1.173 -28.602 -23.784 1.00 0.00 C ATOM 1972 CD PRO A 127 -0.199 -28.479 -23.181 1.00 0.00 C ATOM 0 HA PRO A 127 0.292 -25.438 -24.244 1.00 0.00 H new ATOM 0 HB2 PRO A 127 2.311 -27.212 -24.949 1.00 0.00 H new ATOM 0 HB3 PRO A 127 2.084 -26.732 -23.279 1.00 0.00 H new ATOM 0 HG2 PRO A 127 1.154 -29.234 -24.672 1.00 0.00 H new ATOM 0 HG3 PRO A 127 1.868 -29.061 -23.081 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -0.820 -29.344 -23.415 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -0.155 -28.402 -22.095 1.00 0.00 H new ATOM 1980 N SER A 128 -0.504 -25.474 -26.555 1.00 0.00 N ATOM 1981 CA SER A 128 -0.759 -25.385 -27.988 1.00 0.00 C ATOM 1982 C SER A 128 0.381 -24.661 -28.699 1.00 0.00 C ATOM 1983 O SER A 128 1.249 -24.068 -28.059 1.00 0.00 O ATOM 1984 CB SER A 128 -2.080 -24.659 -28.248 1.00 0.00 C ATOM 1985 OG SER A 128 -1.980 -23.284 -27.918 1.00 0.00 O ATOM 0 H SER A 128 -0.827 -24.669 -26.018 1.00 0.00 H new ATOM 0 HA SER A 128 -0.825 -26.398 -28.384 1.00 0.00 H new ATOM 0 HB2 SER A 128 -2.357 -24.765 -29.297 1.00 0.00 H new ATOM 0 HB3 SER A 128 -2.874 -25.120 -27.661 1.00 0.00 H new ATOM 0 HG SER A 128 -2.837 -22.842 -28.095 1.00 0.00 H new ATOM 1991 N SER A 129 0.370 -24.714 -30.027 1.00 0.00 N ATOM 1992 CA SER A 129 1.404 -24.068 -30.826 1.00 0.00 C ATOM 1993 C SER A 129 0.821 -22.916 -31.639 1.00 0.00 C ATOM 1994 O SER A 129 0.490 -23.075 -32.813 1.00 0.00 O ATOM 1995 CB SER A 129 2.065 -25.083 -31.761 1.00 0.00 C ATOM 1996 OG SER A 129 2.931 -24.441 -32.681 1.00 0.00 O ATOM 0 H SER A 129 -0.344 -25.198 -30.572 1.00 0.00 H new ATOM 0 HA SER A 129 2.156 -23.667 -30.147 1.00 0.00 H new ATOM 0 HB2 SER A 129 2.627 -25.810 -31.175 1.00 0.00 H new ATOM 0 HB3 SER A 129 1.298 -25.635 -32.304 1.00 0.00 H new ATOM 0 HG SER A 129 3.342 -25.111 -33.266 1.00 0.00 H new ATOM 2002 N GLY A 130 0.699 -21.754 -31.004 1.00 0.00 N ATOM 2003 CA GLY A 130 0.156 -20.591 -31.682 1.00 0.00 C ATOM 2004 C GLY A 130 1.201 -19.521 -31.926 1.00 0.00 C ATOM 2005 O GLY A 130 2.400 -19.777 -31.806 1.00 0.00 O ATOM 0 H GLY A 130 0.966 -21.597 -30.032 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -0.274 -20.898 -32.635 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -0.655 -20.173 -31.086 1.00 0.00 H new TER 2009 GLY A 130