USER MOD reduce.3.24.130724 H: found=0, std=0, add=1120, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1117 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 33 THR OG1 : rot 71:sc= 0.933 USER MOD Set 1.2: A 34 GLN : amide:sc= -0.0528 K(o=0.88,f=-4.5!) USER MOD Set 2.1: A 19 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 22 ASN : amide:sc= -0.909 K(o=-1.8,f=-3.9!) USER MOD Set 2.3: A 23 GLN : amide:sc= -0.91 K(o=-1.8,f=-3.8!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -165:sc= -0.186 (180deg=-0.802) USER MOD Single : A 2 THR OG1 : rot -120:sc= 0 USER MOD Single : A 5 GLN :FLIP amide:sc= -0.119 F(o=-3.2!,f=-0.12) USER MOD Single : A 6 ASN :FLIP amide:sc= -0.317 F(o=-1.8!,f=-0.32) USER MOD Single : A 9 GLN : amide:sc= -0.072 K(o=-0.072,f=-1.2!) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 SER OG : rot 140:sc= 0.355! USER MOD Single : A 14 GLN : amide:sc= 0 K(o=0,f=-0.96) USER MOD Single : A 15 LYS NZ :NH3+ -149:sc= -0.244 (180deg=-1.29!) USER MOD Single : A 16 HIS : no HD1:sc= -0.489 K(o=-0.49,f=-2.8) USER MOD Single : A 17 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 28 THR OG1 : rot 180:sc= -2.06! USER MOD Single : A 31 ASN : amide:sc= -4.8! C(o=-4.8!,f=-12!) USER MOD Single : A 37 GLN : amide:sc= -0.391 X(o=-0.39,f=-0.43) USER MOD Single : A 38 GLN : amide:sc= -1.7! C(o=-1.7!,f=-1.9!) USER MOD Single : A 41 LYS NZ :NH3+ 153:sc= -0.212 (180deg=-1.62!) USER MOD Single : A 43 SER OG : rot 166:sc= -2.74! USER MOD Single : A 44 ASN : amide:sc= -7.91! C(o=-7.9!,f=-8.8!) USER MOD Single : A 46 ASN :FLIP amide:sc= -0.307 F(o=-4.5!,f=-0.31) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 ASN :FLIP amide:sc= -2.65! C(o=-4!,f=-2.7!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= -4.38! C(o=-4.4!,f=-5.3!) USER MOD Single : A 64 GLN : amide:sc= -0.205 K(o=-0.2,f=-1.5!) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot -32:sc= 0.196 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 GLN :FLIP amide:sc= -0.129 F(o=-0.73,f=-0.13) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 TYR OH : rot 180:sc= -0.0561 USER MOD Single : A 82 SER OG : rot 180:sc= -1.33! USER MOD Single : A 85 SER OG : rot 180:sc= -1.24! USER MOD Single : A 86 GLN : amide:sc= -0.0639 K(o=-0.064,f=-1.1!) USER MOD Single : A 89 THR OG1 : rot 19:sc= -0.613 USER MOD Single : A 90 ASN :FLIP amide:sc= -2.52! C(o=-3.1!,f=-2.5!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN :FLIP amide:sc= -0.318 F(o=-1.1,f=-0.32) USER MOD Single : A 109 SER OG : rot 180:sc= 0.0817 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 ASN : amide:sc= -0.0373 X(o=-0.037,f=0) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 48:sc= 0.953 USER MOD Single : A 140 ASN : amide:sc= -0.656! C(o=-0.66!,f=-11!) USER MOD Single : A 141 LYS NZ :NH3+ -162:sc= -0.235 (180deg=-1.19!) USER MOD Single : A 143 CYS SG : rot 180:sc= -0.158 USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.802 -45.723 35.184 1.00 0.00 N ATOM 2 CA MET A 1 5.748 -46.730 35.490 1.00 0.00 C ATOM 3 C MET A 1 5.433 -47.529 34.230 1.00 0.00 C ATOM 4 O MET A 1 6.065 -47.341 33.190 1.00 0.00 O ATOM 5 CB MET A 1 4.487 -46.017 35.981 1.00 0.00 C ATOM 6 CG MET A 1 4.880 -44.799 36.816 1.00 0.00 C ATOM 7 SD MET A 1 3.399 -44.090 37.577 1.00 0.00 S ATOM 8 CE MET A 1 4.000 -44.090 39.284 1.00 0.00 C ATOM 0 H1 MET A 1 7.199 -45.356 36.072 1.00 0.00 H new ATOM 0 H2 MET A 1 7.557 -46.170 34.625 1.00 0.00 H new ATOM 0 H3 MET A 1 6.386 -44.940 34.640 1.00 0.00 H new ATOM 0 HA MET A 1 6.102 -47.407 36.268 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.878 -45.707 35.132 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.880 -46.699 36.577 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.596 -45.088 37.586 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.371 -44.056 36.187 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.230 -43.684 39.941 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.235 -45.110 39.587 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.897 -43.475 39.354 1.00 0.00 H new ATOM 18 N THR A 2 4.452 -48.419 34.332 1.00 0.00 N ATOM 19 CA THR A 2 4.058 -49.241 33.195 1.00 0.00 C ATOM 20 C THR A 2 3.666 -48.361 32.013 1.00 0.00 C ATOM 21 O THR A 2 2.484 -48.132 31.764 1.00 0.00 O ATOM 22 CB THR A 2 2.876 -50.135 33.581 1.00 0.00 C ATOM 23 OG1 THR A 2 3.161 -50.785 34.813 1.00 0.00 O ATOM 24 CG2 THR A 2 2.645 -51.181 32.490 1.00 0.00 C ATOM 0 H THR A 2 3.918 -48.589 35.185 1.00 0.00 H new ATOM 0 HA THR A 2 4.905 -49.864 32.908 1.00 0.00 H new ATOM 0 HB THR A 2 1.979 -49.526 33.689 1.00 0.00 H new ATOM 0 HG1 THR A 2 3.146 -51.756 34.682 1.00 0.00 H new ATOM 0 HG21 THR A 2 1.803 -51.816 32.767 1.00 0.00 H new ATOM 0 HG22 THR A 2 2.427 -50.681 31.547 1.00 0.00 H new ATOM 0 HG23 THR A 2 3.540 -51.793 32.378 1.00 0.00 H new ATOM 32 N VAL A 3 4.669 -47.871 31.289 1.00 0.00 N ATOM 33 CA VAL A 3 4.423 -47.015 30.133 1.00 0.00 C ATOM 34 C VAL A 3 3.263 -47.551 29.303 1.00 0.00 C ATOM 35 O VAL A 3 2.103 -47.463 29.703 1.00 0.00 O ATOM 36 CB VAL A 3 5.680 -46.937 29.265 1.00 0.00 C ATOM 37 CG1 VAL A 3 5.436 -45.985 28.094 1.00 0.00 C ATOM 38 CG2 VAL A 3 6.848 -46.419 30.106 1.00 0.00 C ATOM 0 H VAL A 3 5.654 -48.051 31.481 1.00 0.00 H new ATOM 0 HA VAL A 3 4.166 -46.019 30.492 1.00 0.00 H new ATOM 0 HB VAL A 3 5.917 -47.929 28.882 1.00 0.00 H new ATOM 0 HG11 VAL A 3 6.333 -45.930 27.476 1.00 0.00 H new ATOM 0 HG12 VAL A 3 4.604 -46.352 27.494 1.00 0.00 H new ATOM 0 HG13 VAL A 3 5.198 -44.992 28.476 1.00 0.00 H new ATOM 0 HG21 VAL A 3 7.744 -46.363 29.488 1.00 0.00 H new ATOM 0 HG22 VAL A 3 6.609 -45.427 30.489 1.00 0.00 H new ATOM 0 HG23 VAL A 3 7.024 -47.097 30.941 1.00 0.00 H new ATOM 48 N GLU A 4 3.589 -48.104 28.145 1.00 0.00 N ATOM 49 CA GLU A 4 2.571 -48.655 27.259 1.00 0.00 C ATOM 50 C GLU A 4 2.390 -50.146 27.521 1.00 0.00 C ATOM 51 O GLU A 4 1.435 -50.558 28.179 1.00 0.00 O ATOM 52 CB GLU A 4 2.974 -48.437 25.799 1.00 0.00 C ATOM 53 CG GLU A 4 2.583 -47.022 25.369 1.00 0.00 C ATOM 54 CD GLU A 4 1.064 -46.896 25.301 1.00 0.00 C ATOM 55 OE1 GLU A 4 0.481 -47.482 24.404 1.00 0.00 O ATOM 56 OE2 GLU A 4 0.507 -46.218 26.149 1.00 0.00 O ATOM 0 H GLU A 4 4.544 -48.184 27.797 1.00 0.00 H new ATOM 0 HA GLU A 4 1.628 -48.143 27.454 1.00 0.00 H new ATOM 0 HB2 GLU A 4 4.048 -48.581 25.682 1.00 0.00 H new ATOM 0 HB3 GLU A 4 2.482 -49.172 25.161 1.00 0.00 H new ATOM 0 HG2 GLU A 4 2.985 -46.295 26.075 1.00 0.00 H new ATOM 0 HG3 GLU A 4 3.018 -46.796 24.396 1.00 0.00 H new ATOM 63 N GLN A 5 3.315 -50.949 27.005 1.00 0.00 N ATOM 64 CA GLN A 5 3.248 -52.394 27.195 1.00 0.00 C ATOM 65 C GLN A 5 1.846 -52.912 26.890 1.00 0.00 C ATOM 66 O GLN A 5 1.593 -53.453 25.813 1.00 0.00 O ATOM 67 CB GLN A 5 3.622 -52.747 28.638 1.00 0.00 C ATOM 68 CG GLN A 5 4.657 -53.874 28.642 1.00 0.00 C ATOM 69 CD GLN A 5 6.046 -53.314 28.354 1.00 0.00 C ATOM 70 OE1 GLN A 5 6.167 -52.236 27.628 1.00 0.00 O flip ATOM 71 NE2 GLN A 5 7.046 -53.871 28.804 1.00 0.00 N flip ATOM 0 H GLN A 5 4.113 -50.628 26.457 1.00 0.00 H new ATOM 0 HA GLN A 5 3.953 -52.865 26.510 1.00 0.00 H new ATOM 0 HB2 GLN A 5 4.024 -51.870 29.145 1.00 0.00 H new ATOM 0 HB3 GLN A 5 2.733 -53.054 29.189 1.00 0.00 H new ATOM 0 HG2 GLN A 5 4.653 -54.378 29.609 1.00 0.00 H new ATOM 0 HG3 GLN A 5 4.395 -54.621 27.892 1.00 0.00 H new ATOM 0 HE21 GLN A 5 6.949 -54.713 29.371 1.00 0.00 H new ATOM 0 HE22 GLN A 5 7.972 -53.491 28.610 1.00 0.00 H new ATOM 80 N ASN A 6 0.940 -52.745 27.847 1.00 0.00 N ATOM 81 CA ASN A 6 -0.434 -53.200 27.675 1.00 0.00 C ATOM 82 C ASN A 6 -0.576 -54.645 28.141 1.00 0.00 C ATOM 83 O ASN A 6 0.364 -55.229 28.679 1.00 0.00 O ATOM 84 CB ASN A 6 -0.849 -53.088 26.207 1.00 0.00 C ATOM 85 CG ASN A 6 -2.340 -52.783 26.110 1.00 0.00 C ATOM 86 OD1 ASN A 6 -3.171 -53.730 25.765 1.00 0.00 O flip ATOM 87 ND2 ASN A 6 -2.760 -51.653 26.356 1.00 0.00 N flip ATOM 0 H ASN A 6 1.131 -52.300 28.745 1.00 0.00 H new ATOM 0 HA ASN A 6 -1.085 -52.567 28.278 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -0.276 -52.301 25.717 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -0.625 -54.018 25.685 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -2.110 -50.915 26.625 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -3.758 -51.455 26.291 1.00 0.00 H new ATOM 94 N VAL A 7 -1.757 -55.215 27.933 1.00 0.00 N ATOM 95 CA VAL A 7 -2.009 -56.592 28.338 1.00 0.00 C ATOM 96 C VAL A 7 -2.816 -57.324 27.272 1.00 0.00 C ATOM 97 O VAL A 7 -3.690 -56.740 26.631 1.00 0.00 O ATOM 98 CB VAL A 7 -2.772 -56.610 29.663 1.00 0.00 C ATOM 99 CG1 VAL A 7 -1.784 -56.461 30.820 1.00 0.00 C ATOM 100 CG2 VAL A 7 -3.768 -55.449 29.691 1.00 0.00 C ATOM 0 H VAL A 7 -2.549 -54.749 27.490 1.00 0.00 H new ATOM 0 HA VAL A 7 -1.052 -57.099 28.462 1.00 0.00 H new ATOM 0 HB VAL A 7 -3.309 -57.553 29.762 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -2.326 -56.474 31.765 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -1.072 -57.286 30.799 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -1.248 -55.517 30.722 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -4.313 -55.460 30.635 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -3.230 -54.506 29.593 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -4.471 -55.553 28.865 1.00 0.00 H new ATOM 110 N LEU A 8 -2.519 -58.605 27.087 1.00 0.00 N ATOM 111 CA LEU A 8 -3.227 -59.405 26.095 1.00 0.00 C ATOM 112 C LEU A 8 -3.509 -60.800 26.639 1.00 0.00 C ATOM 113 O LEU A 8 -2.625 -61.655 26.683 1.00 0.00 O ATOM 114 CB LEU A 8 -2.397 -59.511 24.817 1.00 0.00 C ATOM 115 CG LEU A 8 -3.298 -59.323 23.603 1.00 0.00 C ATOM 116 CD1 LEU A 8 -4.490 -60.274 23.710 1.00 0.00 C ATOM 117 CD2 LEU A 8 -3.789 -57.876 23.563 1.00 0.00 C ATOM 0 H LEU A 8 -1.799 -59.108 27.606 1.00 0.00 H new ATOM 0 HA LEU A 8 -4.174 -58.915 25.870 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -1.611 -58.756 24.819 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -1.906 -60.483 24.770 1.00 0.00 H new ATOM 0 HG LEU A 8 -2.744 -59.541 22.690 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.138 -60.144 22.844 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -4.132 -61.303 23.744 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.050 -60.054 24.619 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -4.435 -57.735 22.696 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -4.349 -57.657 24.472 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.934 -57.204 23.492 1.00 0.00 H new ATOM 129 N GLN A 9 -4.749 -61.016 27.052 1.00 0.00 N ATOM 130 CA GLN A 9 -5.153 -62.307 27.596 1.00 0.00 C ATOM 131 C GLN A 9 -4.743 -63.434 26.655 1.00 0.00 C ATOM 132 O GLN A 9 -4.150 -63.191 25.604 1.00 0.00 O ATOM 133 CB GLN A 9 -6.670 -62.328 27.801 1.00 0.00 C ATOM 134 CG GLN A 9 -7.043 -63.391 28.838 1.00 0.00 C ATOM 135 CD GLN A 9 -7.688 -62.729 30.051 1.00 0.00 C ATOM 136 OE1 GLN A 9 -8.775 -63.127 30.473 1.00 0.00 O ATOM 137 NE2 GLN A 9 -7.079 -61.737 30.640 1.00 0.00 N ATOM 0 H GLN A 9 -5.492 -60.318 27.022 1.00 0.00 H new ATOM 0 HA GLN A 9 -4.655 -62.455 28.554 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -7.014 -61.348 28.132 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -7.170 -62.539 26.856 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -7.730 -64.114 28.399 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -6.153 -63.942 29.143 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -6.179 -61.410 30.288 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -7.503 -61.289 31.452 1.00 0.00 H new ATOM 146 N GLN A 10 -5.060 -64.667 27.037 1.00 0.00 N ATOM 147 CA GLN A 10 -4.715 -65.821 26.215 1.00 0.00 C ATOM 148 C GLN A 10 -5.962 -66.632 25.878 1.00 0.00 C ATOM 149 O GLN A 10 -6.963 -66.087 25.413 1.00 0.00 O ATOM 150 CB GLN A 10 -3.711 -66.708 26.954 1.00 0.00 C ATOM 151 CG GLN A 10 -3.117 -67.727 25.982 1.00 0.00 C ATOM 152 CD GLN A 10 -1.667 -67.371 25.677 1.00 0.00 C ATOM 153 OE1 GLN A 10 -0.751 -68.062 26.119 1.00 0.00 O ATOM 154 NE2 GLN A 10 -1.403 -66.324 24.943 1.00 0.00 N ATOM 0 H GLN A 10 -5.551 -64.892 27.902 1.00 0.00 H new ATOM 0 HA GLN A 10 -4.268 -65.462 25.288 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -2.918 -66.097 27.385 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -4.203 -67.222 27.780 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -3.172 -68.727 26.412 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -3.698 -67.744 25.060 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -2.165 -65.752 24.577 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -0.435 -66.078 24.735 1.00 0.00 H new ATOM 163 N SER A 11 -5.894 -67.939 26.114 1.00 0.00 N ATOM 164 CA SER A 11 -7.026 -68.817 25.832 1.00 0.00 C ATOM 165 C SER A 11 -7.401 -69.622 27.071 1.00 0.00 C ATOM 166 O SER A 11 -8.110 -69.134 27.951 1.00 0.00 O ATOM 167 CB SER A 11 -6.675 -69.771 24.689 1.00 0.00 C ATOM 168 OG SER A 11 -5.533 -70.537 25.050 1.00 0.00 O ATOM 0 H SER A 11 -5.075 -68.411 26.497 1.00 0.00 H new ATOM 0 HA SER A 11 -7.877 -68.200 25.542 1.00 0.00 H new ATOM 0 HB2 SER A 11 -7.517 -70.430 24.478 1.00 0.00 H new ATOM 0 HB3 SER A 11 -6.476 -69.207 23.778 1.00 0.00 H new ATOM 0 HG SER A 11 -5.651 -71.462 24.749 1.00 0.00 H new ATOM 174 N ALA A 12 -6.920 -70.859 27.132 1.00 0.00 N ATOM 175 CA ALA A 12 -7.207 -71.729 28.266 1.00 0.00 C ATOM 176 C ALA A 12 -6.972 -70.995 29.583 1.00 0.00 C ATOM 177 O ALA A 12 -7.419 -71.439 30.640 1.00 0.00 O ATOM 178 CB ALA A 12 -6.314 -72.972 28.207 1.00 0.00 C ATOM 0 H ALA A 12 -6.332 -71.280 26.413 1.00 0.00 H new ATOM 0 HA ALA A 12 -8.254 -72.028 28.214 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -6.533 -73.618 29.057 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -6.505 -73.514 27.281 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -5.267 -72.670 28.241 1.00 0.00 H new ATOM 184 N ALA A 13 -6.262 -69.876 29.512 1.00 0.00 N ATOM 185 CA ALA A 13 -5.966 -69.093 30.707 1.00 0.00 C ATOM 186 C ALA A 13 -7.163 -68.240 31.116 1.00 0.00 C ATOM 187 O ALA A 13 -7.313 -67.890 32.287 1.00 0.00 O ATOM 188 CB ALA A 13 -4.759 -68.191 30.448 1.00 0.00 C ATOM 0 H ALA A 13 -5.882 -69.492 28.647 1.00 0.00 H new ATOM 0 HA ALA A 13 -5.743 -69.784 31.520 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -4.542 -67.608 31.343 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -3.894 -68.804 30.195 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -4.980 -67.517 29.621 1.00 0.00 H new ATOM 194 N GLN A 14 -8.010 -67.905 30.149 1.00 0.00 N ATOM 195 CA GLN A 14 -9.185 -67.086 30.430 1.00 0.00 C ATOM 196 C GLN A 14 -10.340 -67.950 30.926 1.00 0.00 C ATOM 197 O GLN A 14 -11.033 -67.589 31.876 1.00 0.00 O ATOM 198 CB GLN A 14 -9.609 -66.326 29.168 1.00 0.00 C ATOM 199 CG GLN A 14 -10.613 -67.163 28.370 1.00 0.00 C ATOM 200 CD GLN A 14 -10.878 -66.507 27.019 1.00 0.00 C ATOM 201 OE1 GLN A 14 -10.185 -66.792 26.043 1.00 0.00 O ATOM 202 NE2 GLN A 14 -11.847 -65.639 26.905 1.00 0.00 N ATOM 0 H GLN A 14 -7.908 -68.184 29.173 1.00 0.00 H new ATOM 0 HA GLN A 14 -8.926 -66.371 31.211 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -10.055 -65.370 29.441 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -8.736 -66.107 28.554 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -10.225 -68.171 28.225 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -11.545 -67.258 28.927 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -12.420 -65.405 27.716 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -12.031 -65.195 26.005 1.00 0.00 H new ATOM 211 N LYS A 15 -10.545 -69.089 30.274 1.00 0.00 N ATOM 212 CA LYS A 15 -11.624 -69.994 30.655 1.00 0.00 C ATOM 213 C LYS A 15 -11.459 -70.463 32.097 1.00 0.00 C ATOM 214 O LYS A 15 -12.438 -70.795 32.766 1.00 0.00 O ATOM 215 CB LYS A 15 -11.639 -71.207 29.724 1.00 0.00 C ATOM 216 CG LYS A 15 -10.581 -72.216 30.178 1.00 0.00 C ATOM 217 CD LYS A 15 -10.396 -73.284 29.099 1.00 0.00 C ATOM 218 CE LYS A 15 -11.576 -74.257 29.133 1.00 0.00 C ATOM 219 NZ LYS A 15 -11.652 -74.897 30.477 1.00 0.00 N ATOM 0 H LYS A 15 -9.983 -69.407 29.484 1.00 0.00 H new ATOM 0 HA LYS A 15 -12.567 -69.454 30.570 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -12.625 -71.671 29.731 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -11.441 -70.894 28.699 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -9.636 -71.707 30.367 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -10.885 -72.681 31.116 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -10.326 -72.815 28.117 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -9.463 -73.823 29.262 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -12.504 -73.728 28.917 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -11.456 -75.018 28.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -12.040 -75.857 30.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -10.700 -74.947 30.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -12.270 -74.333 31.095 1.00 0.00 H new ATOM 233 N HIS A 16 -10.219 -70.492 32.573 1.00 0.00 N ATOM 234 CA HIS A 16 -9.949 -70.929 33.939 1.00 0.00 C ATOM 235 C HIS A 16 -10.239 -69.812 34.936 1.00 0.00 C ATOM 236 O HIS A 16 -10.935 -70.020 35.930 1.00 0.00 O ATOM 237 CB HIS A 16 -8.490 -71.364 34.070 1.00 0.00 C ATOM 238 CG HIS A 16 -8.309 -72.115 35.360 1.00 0.00 C ATOM 239 ND1 HIS A 16 -9.373 -72.407 36.199 1.00 0.00 N ATOM 240 CD2 HIS A 16 -7.196 -72.640 35.968 1.00 0.00 C ATOM 241 CE1 HIS A 16 -8.883 -73.079 37.257 1.00 0.00 C ATOM 242 NE2 HIS A 16 -7.560 -73.249 37.165 1.00 0.00 N ATOM 0 H HIS A 16 -9.392 -70.221 32.040 1.00 0.00 H new ATOM 0 HA HIS A 16 -10.603 -71.772 34.161 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -8.209 -71.995 33.226 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -7.835 -70.493 34.048 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -6.191 -72.588 35.577 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -9.485 -73.437 38.079 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -6.949 -73.723 37.830 1.00 0.00 H new ATOM 250 N GLN A 17 -9.695 -68.628 34.670 1.00 0.00 N ATOM 251 CA GLN A 17 -9.898 -67.485 35.554 1.00 0.00 C ATOM 252 C GLN A 17 -11.383 -67.256 35.808 1.00 0.00 C ATOM 253 O GLN A 17 -11.794 -66.951 36.928 1.00 0.00 O ATOM 254 CB GLN A 17 -9.294 -66.228 34.927 1.00 0.00 C ATOM 255 CG GLN A 17 -7.876 -66.017 35.458 1.00 0.00 C ATOM 256 CD GLN A 17 -7.366 -64.643 35.038 1.00 0.00 C ATOM 257 OE1 GLN A 17 -8.014 -63.954 34.250 1.00 0.00 O ATOM 258 NE2 GLN A 17 -6.235 -64.201 35.518 1.00 0.00 N ATOM 0 H GLN A 17 -9.114 -68.436 33.854 1.00 0.00 H new ATOM 0 HA GLN A 17 -9.406 -67.696 36.503 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -9.275 -66.325 33.841 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -9.912 -65.361 35.159 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -7.869 -66.101 36.545 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -7.215 -66.794 35.074 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -5.700 -64.773 36.171 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -5.887 -63.283 35.240 1.00 0.00 H new ATOM 267 N GLN A 18 -12.183 -67.397 34.757 1.00 0.00 N ATOM 268 CA GLN A 18 -13.622 -67.194 34.868 1.00 0.00 C ATOM 269 C GLN A 18 -14.239 -68.166 35.871 1.00 0.00 C ATOM 270 O GLN A 18 -15.082 -67.778 36.679 1.00 0.00 O ATOM 271 CB GLN A 18 -14.279 -67.384 33.500 1.00 0.00 C ATOM 272 CG GLN A 18 -13.797 -66.288 32.545 1.00 0.00 C ATOM 273 CD GLN A 18 -14.885 -65.234 32.367 1.00 0.00 C ATOM 274 OE1 GLN A 18 -15.163 -64.465 33.288 1.00 0.00 O ATOM 275 NE2 GLN A 18 -15.520 -65.151 31.230 1.00 0.00 N ATOM 0 H GLN A 18 -11.861 -67.650 33.823 1.00 0.00 H new ATOM 0 HA GLN A 18 -13.795 -66.178 35.222 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -14.030 -68.366 33.098 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -15.364 -67.345 33.597 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -12.892 -65.825 32.937 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -13.540 -66.723 31.579 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -15.288 -65.789 30.469 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -16.248 -64.448 31.103 1.00 0.00 H new ATOM 284 N THR A 19 -13.823 -69.426 35.813 1.00 0.00 N ATOM 285 CA THR A 19 -14.361 -70.432 36.725 1.00 0.00 C ATOM 286 C THR A 19 -13.674 -70.358 38.078 1.00 0.00 C ATOM 287 O THR A 19 -14.314 -70.459 39.125 1.00 0.00 O ATOM 288 CB THR A 19 -14.196 -71.834 36.119 1.00 0.00 C ATOM 289 OG1 THR A 19 -15.404 -72.561 36.284 1.00 0.00 O ATOM 290 CG2 THR A 19 -13.052 -72.590 36.808 1.00 0.00 C ATOM 0 H THR A 19 -13.125 -69.773 35.155 1.00 0.00 H new ATOM 0 HA THR A 19 -15.422 -70.232 36.872 1.00 0.00 H new ATOM 0 HB THR A 19 -13.961 -71.732 35.060 1.00 0.00 H new ATOM 0 HG1 THR A 19 -15.303 -73.456 35.897 1.00 0.00 H new ATOM 0 HG21 THR A 19 -12.951 -73.581 36.364 1.00 0.00 H new ATOM 0 HG22 THR A 19 -12.121 -72.038 36.678 1.00 0.00 H new ATOM 0 HG23 THR A 19 -13.270 -72.689 37.871 1.00 0.00 H new ATOM 298 N PHE A 20 -12.371 -70.184 38.041 1.00 0.00 N ATOM 299 CA PHE A 20 -11.584 -70.100 39.263 1.00 0.00 C ATOM 300 C PHE A 20 -12.101 -68.978 40.157 1.00 0.00 C ATOM 301 O PHE A 20 -12.465 -69.203 41.313 1.00 0.00 O ATOM 302 CB PHE A 20 -10.116 -69.843 38.921 1.00 0.00 C ATOM 303 CG PHE A 20 -9.293 -69.924 40.181 1.00 0.00 C ATOM 304 CD1 PHE A 20 -9.275 -68.846 41.074 1.00 0.00 C ATOM 305 CD2 PHE A 20 -8.552 -71.078 40.460 1.00 0.00 C ATOM 306 CE1 PHE A 20 -8.517 -68.922 42.246 1.00 0.00 C ATOM 307 CE2 PHE A 20 -7.793 -71.154 41.633 1.00 0.00 C ATOM 308 CZ PHE A 20 -7.776 -70.076 42.525 1.00 0.00 C ATOM 0 H PHE A 20 -11.829 -70.097 37.181 1.00 0.00 H new ATOM 0 HA PHE A 20 -11.674 -71.046 39.796 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -9.765 -70.577 38.195 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -10.004 -68.861 38.461 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -9.847 -67.956 40.857 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -8.566 -71.909 39.771 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -8.503 -68.091 42.936 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -7.221 -72.044 41.850 1.00 0.00 H new ATOM 0 HZ PHE A 20 -7.190 -70.135 43.430 1.00 0.00 H new ATOM 318 N LEU A 21 -12.133 -67.772 39.608 1.00 0.00 N ATOM 319 CA LEU A 21 -12.608 -66.615 40.355 1.00 0.00 C ATOM 320 C LEU A 21 -14.084 -66.781 40.695 1.00 0.00 C ATOM 321 O LEU A 21 -14.519 -66.447 41.798 1.00 0.00 O ATOM 322 CB LEU A 21 -12.403 -65.337 39.535 1.00 0.00 C ATOM 323 CG LEU A 21 -10.935 -65.223 39.109 1.00 0.00 C ATOM 324 CD1 LEU A 21 -10.791 -64.102 38.074 1.00 0.00 C ATOM 325 CD2 LEU A 21 -10.066 -64.898 40.328 1.00 0.00 C ATOM 0 H LEU A 21 -11.837 -67.569 38.653 1.00 0.00 H new ATOM 0 HA LEU A 21 -12.037 -66.538 41.280 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -13.046 -65.351 38.655 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -12.689 -64.466 40.125 1.00 0.00 H new ATOM 0 HG LEU A 21 -10.612 -66.169 38.675 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -9.748 -64.019 37.770 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -11.406 -64.330 37.203 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -11.117 -63.159 38.512 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -9.023 -64.818 40.021 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -10.389 -63.953 40.764 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -10.166 -65.692 41.068 1.00 0.00 H new ATOM 337 N ASN A 22 -14.852 -67.310 39.746 1.00 0.00 N ATOM 338 CA ASN A 22 -16.276 -67.526 39.968 1.00 0.00 C ATOM 339 C ASN A 22 -16.476 -68.402 41.197 1.00 0.00 C ATOM 340 O ASN A 22 -17.370 -68.162 42.009 1.00 0.00 O ATOM 341 CB ASN A 22 -16.902 -68.201 38.746 1.00 0.00 C ATOM 342 CG ASN A 22 -18.343 -68.600 39.049 1.00 0.00 C ATOM 343 OD1 ASN A 22 -18.583 -69.492 39.863 1.00 0.00 O ATOM 344 ND2 ASN A 22 -19.321 -67.990 38.438 1.00 0.00 N ATOM 0 H ASN A 22 -14.516 -67.594 38.826 1.00 0.00 H new ATOM 0 HA ASN A 22 -16.760 -66.563 40.128 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -16.876 -67.523 37.893 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -16.323 -69.082 38.471 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -20.287 -68.252 38.634 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -19.120 -67.251 37.764 1.00 0.00 H new ATOM 351 N GLN A 23 -15.628 -69.416 41.330 1.00 0.00 N ATOM 352 CA GLN A 23 -15.709 -70.323 42.472 1.00 0.00 C ATOM 353 C GLN A 23 -15.594 -69.537 43.773 1.00 0.00 C ATOM 354 O GLN A 23 -16.384 -69.730 44.698 1.00 0.00 O ATOM 355 CB GLN A 23 -14.589 -71.367 42.408 1.00 0.00 C ATOM 356 CG GLN A 23 -15.167 -72.717 41.980 1.00 0.00 C ATOM 357 CD GLN A 23 -15.640 -72.650 40.532 1.00 0.00 C ATOM 358 OE1 GLN A 23 -16.630 -71.981 40.232 1.00 0.00 O ATOM 359 NE2 GLN A 23 -14.991 -73.310 39.612 1.00 0.00 N ATOM 0 H GLN A 23 -14.882 -69.631 40.668 1.00 0.00 H new ATOM 0 HA GLN A 23 -16.672 -70.832 42.439 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -13.822 -71.049 41.702 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -14.108 -71.459 43.382 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -14.412 -73.495 42.088 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -15.999 -72.988 42.630 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -14.172 -73.863 39.863 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -15.303 -73.273 38.642 1.00 0.00 H new ATOM 368 N LEU A 24 -14.605 -68.649 43.836 1.00 0.00 N ATOM 369 CA LEU A 24 -14.396 -67.837 45.031 1.00 0.00 C ATOM 370 C LEU A 24 -15.694 -67.154 45.451 1.00 0.00 C ATOM 371 O LEU A 24 -16.139 -67.279 46.589 1.00 0.00 O ATOM 372 CB LEU A 24 -13.330 -66.774 44.768 1.00 0.00 C ATOM 373 CG LEU A 24 -11.940 -67.382 44.954 1.00 0.00 C ATOM 374 CD1 LEU A 24 -10.904 -66.519 44.229 1.00 0.00 C ATOM 375 CD2 LEU A 24 -11.599 -67.437 46.448 1.00 0.00 C ATOM 0 H LEU A 24 -13.942 -68.474 43.081 1.00 0.00 H new ATOM 0 HA LEU A 24 -14.064 -68.495 45.833 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -13.434 -66.383 43.756 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -13.464 -65.934 45.449 1.00 0.00 H new ATOM 0 HG LEU A 24 -11.929 -68.391 44.541 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -9.913 -66.952 44.361 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.143 -66.479 43.166 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -10.917 -65.510 44.642 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -10.608 -67.871 46.579 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -11.611 -66.429 46.861 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -12.335 -68.051 46.967 1.00 0.00 H new ATOM 387 N ARG A 25 -16.307 -66.442 44.521 1.00 0.00 N ATOM 388 CA ARG A 25 -17.556 -65.758 44.801 1.00 0.00 C ATOM 389 C ARG A 25 -18.609 -66.770 45.214 1.00 0.00 C ATOM 390 O ARG A 25 -19.657 -66.417 45.753 1.00 0.00 O ATOM 391 CB ARG A 25 -18.028 -64.996 43.559 1.00 0.00 C ATOM 392 CG ARG A 25 -19.241 -64.135 43.916 1.00 0.00 C ATOM 393 CD ARG A 25 -20.518 -64.763 43.347 1.00 0.00 C ATOM 394 NE ARG A 25 -20.403 -66.218 43.312 1.00 0.00 N ATOM 395 CZ ARG A 25 -20.502 -66.899 42.171 1.00 0.00 C ATOM 396 NH1 ARG A 25 -20.702 -66.275 41.040 1.00 0.00 N ATOM 397 NH2 ARG A 25 -20.397 -68.199 42.182 1.00 0.00 N ATOM 0 H ARG A 25 -15.961 -66.323 43.569 1.00 0.00 H new ATOM 0 HA ARG A 25 -17.399 -65.047 45.613 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -17.223 -64.368 43.177 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -18.288 -65.698 42.766 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -19.324 -64.041 44.999 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -19.112 -63.129 43.517 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -21.374 -64.475 43.957 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -20.700 -64.383 42.342 1.00 0.00 H new ATOM 0 HE ARG A 25 -20.243 -66.726 44.182 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -20.784 -65.258 41.026 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -20.776 -66.805 40.172 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -20.240 -68.691 43.062 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -20.472 -68.724 41.311 1.00 0.00 H new ATOM 411 N GLU A 26 -18.331 -68.032 44.918 1.00 0.00 N ATOM 412 CA GLU A 26 -19.273 -69.100 45.222 1.00 0.00 C ATOM 413 C GLU A 26 -19.198 -69.579 46.678 1.00 0.00 C ATOM 414 O GLU A 26 -20.211 -69.585 47.377 1.00 0.00 O ATOM 415 CB GLU A 26 -19.030 -70.286 44.288 1.00 0.00 C ATOM 416 CG GLU A 26 -20.347 -71.029 44.056 1.00 0.00 C ATOM 417 CD GLU A 26 -20.120 -72.211 43.118 1.00 0.00 C ATOM 418 OE1 GLU A 26 -19.363 -73.095 43.485 1.00 0.00 O ATOM 419 OE2 GLU A 26 -20.708 -72.215 42.050 1.00 0.00 O ATOM 0 H GLU A 26 -17.467 -68.340 44.471 1.00 0.00 H new ATOM 0 HA GLU A 26 -20.270 -68.687 45.071 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -18.624 -69.938 43.338 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -18.291 -70.960 44.722 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -20.748 -71.380 45.007 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -21.086 -70.351 43.629 1.00 0.00 H new ATOM 426 N ILE A 27 -18.022 -70.027 47.122 1.00 0.00 N ATOM 427 CA ILE A 27 -17.897 -70.553 48.486 1.00 0.00 C ATOM 428 C ILE A 27 -17.816 -69.471 49.546 1.00 0.00 C ATOM 429 O ILE A 27 -18.471 -69.569 50.584 1.00 0.00 O ATOM 430 CB ILE A 27 -16.682 -71.488 48.611 1.00 0.00 C ATOM 431 CG1 ILE A 27 -15.377 -70.722 48.855 1.00 0.00 C ATOM 432 CG2 ILE A 27 -16.523 -72.260 47.326 1.00 0.00 C ATOM 433 CD1 ILE A 27 -14.964 -69.983 47.578 1.00 0.00 C ATOM 0 H ILE A 27 -17.162 -70.038 46.574 1.00 0.00 H new ATOM 0 HA ILE A 27 -18.814 -71.114 48.667 1.00 0.00 H new ATOM 0 HB ILE A 27 -16.866 -72.143 49.463 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -15.508 -70.012 49.671 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -14.590 -71.413 49.157 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -15.664 -72.926 47.405 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -17.422 -72.848 47.141 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -16.368 -71.565 46.501 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -14.036 -69.440 47.756 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -14.815 -70.703 46.773 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -15.747 -69.280 47.295 1.00 0.00 H new ATOM 445 N THR A 28 -16.989 -68.469 49.325 1.00 0.00 N ATOM 446 CA THR A 28 -16.836 -67.442 50.327 1.00 0.00 C ATOM 447 C THR A 28 -17.794 -66.272 50.088 1.00 0.00 C ATOM 448 O THR A 28 -17.881 -65.348 50.898 1.00 0.00 O ATOM 449 CB THR A 28 -15.378 -66.999 50.390 1.00 0.00 C ATOM 450 OG1 THR A 28 -15.249 -65.869 51.240 1.00 0.00 O ATOM 451 CG2 THR A 28 -14.869 -66.672 48.989 1.00 0.00 C ATOM 0 H THR A 28 -16.427 -68.347 48.482 1.00 0.00 H new ATOM 0 HA THR A 28 -17.105 -67.854 51.299 1.00 0.00 H new ATOM 0 HB THR A 28 -14.777 -67.812 50.798 1.00 0.00 H new ATOM 0 HG1 THR A 28 -14.310 -65.592 51.276 1.00 0.00 H new ATOM 0 HG21 THR A 28 -13.827 -66.357 49.045 1.00 0.00 H new ATOM 0 HG22 THR A 28 -14.947 -67.557 48.358 1.00 0.00 H new ATOM 0 HG23 THR A 28 -15.469 -65.868 48.562 1.00 0.00 H new ATOM 459 N GLY A 29 -18.545 -66.352 48.992 1.00 0.00 N ATOM 460 CA GLY A 29 -19.544 -65.333 48.661 1.00 0.00 C ATOM 461 C GLY A 29 -18.950 -63.946 48.419 1.00 0.00 C ATOM 462 O GLY A 29 -19.666 -63.034 48.005 1.00 0.00 O ATOM 0 H GLY A 29 -18.482 -67.113 48.315 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -20.088 -65.646 47.770 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -20.270 -65.271 49.472 1.00 0.00 H new ATOM 466 N ILE A 30 -17.662 -63.769 48.677 1.00 0.00 N ATOM 467 CA ILE A 30 -17.047 -62.461 48.468 1.00 0.00 C ATOM 468 C ILE A 30 -17.194 -62.034 47.012 1.00 0.00 C ATOM 469 O ILE A 30 -16.415 -62.443 46.150 1.00 0.00 O ATOM 470 CB ILE A 30 -15.572 -62.500 48.856 1.00 0.00 C ATOM 471 CG1 ILE A 30 -15.449 -63.076 50.264 1.00 0.00 C ATOM 472 CG2 ILE A 30 -14.999 -61.082 48.834 1.00 0.00 C ATOM 473 CD1 ILE A 30 -16.271 -62.232 51.238 1.00 0.00 C ATOM 0 H ILE A 30 -17.033 -64.494 49.023 1.00 0.00 H new ATOM 0 HA ILE A 30 -17.556 -61.734 49.100 1.00 0.00 H new ATOM 0 HB ILE A 30 -15.020 -63.121 48.150 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -15.799 -64.108 50.277 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -14.404 -63.090 50.572 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -13.945 -61.111 49.111 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -15.099 -60.665 47.832 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -15.544 -60.458 49.543 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -16.182 -62.645 52.243 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -15.901 -61.207 51.233 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -17.318 -62.241 50.934 1.00 0.00 H new ATOM 485 N ASN A 31 -18.207 -61.215 46.747 1.00 0.00 N ATOM 486 CA ASN A 31 -18.464 -60.741 45.392 1.00 0.00 C ATOM 487 C ASN A 31 -17.587 -59.540 45.054 1.00 0.00 C ATOM 488 O ASN A 31 -18.019 -58.625 44.354 1.00 0.00 O ATOM 489 CB ASN A 31 -19.938 -60.357 45.246 1.00 0.00 C ATOM 490 CG ASN A 31 -20.812 -61.347 46.008 1.00 0.00 C ATOM 491 OD1 ASN A 31 -20.529 -62.544 46.021 1.00 0.00 O ATOM 492 ND2 ASN A 31 -21.867 -60.918 46.647 1.00 0.00 N ATOM 0 H ASN A 31 -18.860 -60.867 47.449 1.00 0.00 H new ATOM 0 HA ASN A 31 -18.224 -61.548 44.700 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -20.099 -59.349 45.627 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -20.218 -60.348 44.192 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -22.457 -61.576 47.157 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -22.101 -59.925 46.636 1.00 0.00 H new ATOM 499 N ASP A 32 -16.354 -59.552 45.545 1.00 0.00 N ATOM 500 CA ASP A 32 -15.430 -58.459 45.273 1.00 0.00 C ATOM 501 C ASP A 32 -14.365 -58.908 44.280 1.00 0.00 C ATOM 502 O ASP A 32 -13.280 -59.340 44.669 1.00 0.00 O ATOM 503 CB ASP A 32 -14.763 -58.001 46.568 1.00 0.00 C ATOM 504 CG ASP A 32 -15.564 -56.867 47.196 1.00 0.00 C ATOM 505 OD1 ASP A 32 -16.778 -56.886 47.075 1.00 0.00 O ATOM 506 OD2 ASP A 32 -14.952 -55.994 47.791 1.00 0.00 O ATOM 0 H ASP A 32 -15.974 -60.298 46.127 1.00 0.00 H new ATOM 0 HA ASP A 32 -15.990 -57.627 44.845 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -14.692 -58.836 47.265 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -13.745 -57.669 46.364 1.00 0.00 H new ATOM 511 N THR A 33 -14.686 -58.805 42.995 1.00 0.00 N ATOM 512 CA THR A 33 -13.758 -59.209 41.944 1.00 0.00 C ATOM 513 C THR A 33 -12.347 -58.719 42.243 1.00 0.00 C ATOM 514 O THR A 33 -11.369 -59.413 41.963 1.00 0.00 O ATOM 515 CB THR A 33 -14.221 -58.642 40.601 1.00 0.00 C ATOM 516 OG1 THR A 33 -14.203 -57.222 40.655 1.00 0.00 O ATOM 517 CG2 THR A 33 -15.642 -59.126 40.307 1.00 0.00 C ATOM 0 H THR A 33 -15.579 -58.446 42.656 1.00 0.00 H new ATOM 0 HA THR A 33 -13.744 -60.298 41.901 1.00 0.00 H new ATOM 0 HB THR A 33 -13.551 -58.983 39.811 1.00 0.00 H new ATOM 0 HG1 THR A 33 -13.275 -56.907 40.677 1.00 0.00 H new ATOM 0 HG21 THR A 33 -15.973 -58.723 39.350 1.00 0.00 H new ATOM 0 HG22 THR A 33 -15.654 -60.215 40.265 1.00 0.00 H new ATOM 0 HG23 THR A 33 -16.313 -58.786 41.096 1.00 0.00 H new ATOM 525 N GLN A 34 -12.248 -57.524 42.808 1.00 0.00 N ATOM 526 CA GLN A 34 -10.953 -56.953 43.135 1.00 0.00 C ATOM 527 C GLN A 34 -10.183 -57.871 44.074 1.00 0.00 C ATOM 528 O GLN A 34 -9.001 -58.145 43.860 1.00 0.00 O ATOM 529 CB GLN A 34 -11.147 -55.589 43.795 1.00 0.00 C ATOM 530 CG GLN A 34 -11.189 -54.506 42.717 1.00 0.00 C ATOM 531 CD GLN A 34 -12.467 -54.633 41.896 1.00 0.00 C ATOM 532 OE1 GLN A 34 -12.548 -55.468 40.995 1.00 0.00 O ATOM 533 NE2 GLN A 34 -13.478 -53.847 42.154 1.00 0.00 N ATOM 0 H GLN A 34 -13.046 -56.935 43.048 1.00 0.00 H new ATOM 0 HA GLN A 34 -10.380 -56.838 42.215 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -12.072 -55.580 44.372 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -10.334 -55.391 44.493 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -11.141 -53.520 43.179 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -10.319 -54.596 42.066 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -13.409 -53.156 42.901 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -14.336 -53.925 41.609 1.00 0.00 H new ATOM 542 N ILE A 35 -10.855 -58.342 45.118 1.00 0.00 N ATOM 543 CA ILE A 35 -10.214 -59.222 46.082 1.00 0.00 C ATOM 544 C ILE A 35 -10.062 -60.629 45.509 1.00 0.00 C ATOM 545 O ILE A 35 -9.092 -61.326 45.807 1.00 0.00 O ATOM 546 CB ILE A 35 -11.024 -59.269 47.380 1.00 0.00 C ATOM 547 CG1 ILE A 35 -10.644 -58.074 48.261 1.00 0.00 C ATOM 548 CG2 ILE A 35 -10.710 -60.567 48.130 1.00 0.00 C ATOM 549 CD1 ILE A 35 -11.203 -56.782 47.660 1.00 0.00 C ATOM 0 H ILE A 35 -11.833 -58.131 45.316 1.00 0.00 H new ATOM 0 HA ILE A 35 -9.222 -58.826 46.299 1.00 0.00 H new ATOM 0 HB ILE A 35 -12.088 -59.229 47.145 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -11.035 -58.215 49.268 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -9.560 -58.005 48.347 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -11.286 -60.602 49.055 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -10.974 -61.421 47.506 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -9.646 -60.604 48.364 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -10.928 -55.938 48.292 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -10.790 -56.637 46.662 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -12.289 -56.850 47.597 1.00 0.00 H new ATOM 561 N LEU A 36 -11.017 -61.038 44.679 1.00 0.00 N ATOM 562 CA LEU A 36 -10.960 -62.362 44.067 1.00 0.00 C ATOM 563 C LEU A 36 -9.763 -62.451 43.127 1.00 0.00 C ATOM 564 O LEU A 36 -8.846 -63.242 43.347 1.00 0.00 O ATOM 565 CB LEU A 36 -12.246 -62.643 43.280 1.00 0.00 C ATOM 566 CG LEU A 36 -13.477 -62.472 44.179 1.00 0.00 C ATOM 567 CD1 LEU A 36 -14.630 -63.318 43.632 1.00 0.00 C ATOM 568 CD2 LEU A 36 -13.154 -62.932 45.601 1.00 0.00 C ATOM 0 H LEU A 36 -11.830 -60.480 44.417 1.00 0.00 H new ATOM 0 HA LEU A 36 -10.857 -63.104 44.859 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.313 -61.965 42.429 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -12.220 -63.656 42.879 1.00 0.00 H new ATOM 0 HG LEU A 36 -13.761 -61.420 44.194 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -15.505 -63.197 44.271 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -14.871 -62.993 42.620 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -14.335 -64.367 43.616 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -14.034 -62.807 46.232 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -12.864 -63.983 45.587 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -12.334 -62.335 45.999 1.00 0.00 H new ATOM 580 N GLN A 37 -9.778 -61.628 42.084 1.00 0.00 N ATOM 581 CA GLN A 37 -8.686 -61.617 41.120 1.00 0.00 C ATOM 582 C GLN A 37 -7.350 -61.479 41.843 1.00 0.00 C ATOM 583 O GLN A 37 -6.320 -61.946 41.359 1.00 0.00 O ATOM 584 CB GLN A 37 -8.865 -60.460 40.136 1.00 0.00 C ATOM 585 CG GLN A 37 -8.479 -59.150 40.817 1.00 0.00 C ATOM 586 CD GLN A 37 -9.138 -57.975 40.101 1.00 0.00 C ATOM 587 OE1 GLN A 37 -10.351 -57.977 39.892 1.00 0.00 O ATOM 588 NE2 GLN A 37 -8.408 -56.967 39.711 1.00 0.00 N ATOM 0 H GLN A 37 -10.528 -60.965 41.886 1.00 0.00 H new ATOM 0 HA GLN A 37 -8.696 -62.557 40.569 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -8.246 -60.620 39.253 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -9.899 -60.415 39.796 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -8.788 -59.169 41.862 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -7.396 -59.031 40.807 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -7.403 -56.968 39.885 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -8.842 -56.178 39.232 1.00 0.00 H new ATOM 597 N GLN A 38 -7.378 -60.839 43.009 1.00 0.00 N ATOM 598 CA GLN A 38 -6.165 -60.654 43.797 1.00 0.00 C ATOM 599 C GLN A 38 -5.818 -61.942 44.536 1.00 0.00 C ATOM 600 O GLN A 38 -4.651 -62.318 44.635 1.00 0.00 O ATOM 601 CB GLN A 38 -6.358 -59.519 44.806 1.00 0.00 C ATOM 602 CG GLN A 38 -5.139 -59.441 45.728 1.00 0.00 C ATOM 603 CD GLN A 38 -5.367 -60.304 46.966 1.00 0.00 C ATOM 604 OE1 GLN A 38 -6.393 -60.172 47.634 1.00 0.00 O ATOM 605 NE2 GLN A 38 -4.467 -61.182 47.312 1.00 0.00 N ATOM 0 H GLN A 38 -8.221 -60.443 43.426 1.00 0.00 H new ATOM 0 HA GLN A 38 -5.348 -60.397 43.122 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -6.492 -58.572 44.283 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -7.261 -59.690 45.393 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -4.249 -59.779 45.197 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -4.961 -58.407 46.023 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -3.618 -61.289 46.756 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -4.612 -61.762 48.138 1.00 0.00 H new ATOM 614 N ALA A 39 -6.844 -62.621 45.044 1.00 0.00 N ATOM 615 CA ALA A 39 -6.638 -63.872 45.760 1.00 0.00 C ATOM 616 C ALA A 39 -5.943 -64.883 44.856 1.00 0.00 C ATOM 617 O ALA A 39 -5.057 -65.616 45.293 1.00 0.00 O ATOM 618 CB ALA A 39 -7.982 -64.425 46.232 1.00 0.00 C ATOM 0 H ALA A 39 -7.818 -62.327 44.973 1.00 0.00 H new ATOM 0 HA ALA A 39 -6.006 -63.686 46.628 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -7.823 -65.361 46.767 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -8.459 -63.704 46.896 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -8.624 -64.605 45.370 1.00 0.00 H new ATOM 624 N LEU A 40 -6.345 -64.902 43.590 1.00 0.00 N ATOM 625 CA LEU A 40 -5.753 -65.812 42.617 1.00 0.00 C ATOM 626 C LEU A 40 -4.301 -65.417 42.346 1.00 0.00 C ATOM 627 O LEU A 40 -3.414 -66.268 42.277 1.00 0.00 O ATOM 628 CB LEU A 40 -6.564 -65.757 41.315 1.00 0.00 C ATOM 629 CG LEU A 40 -5.885 -66.588 40.220 1.00 0.00 C ATOM 630 CD1 LEU A 40 -4.643 -65.854 39.707 1.00 0.00 C ATOM 631 CD2 LEU A 40 -5.485 -67.958 40.779 1.00 0.00 C ATOM 0 H LEU A 40 -7.077 -64.299 43.214 1.00 0.00 H new ATOM 0 HA LEU A 40 -5.770 -66.827 43.013 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -7.572 -66.133 41.492 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.663 -64.723 40.985 1.00 0.00 H new ATOM 0 HG LEU A 40 -6.583 -66.730 39.395 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.164 -66.449 38.929 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.935 -64.887 39.297 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.944 -65.703 40.530 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -5.003 -68.544 39.996 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.793 -67.824 41.610 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -6.374 -68.482 41.129 1.00 0.00 H new ATOM 643 N LYS A 41 -4.068 -64.118 42.201 1.00 0.00 N ATOM 644 CA LYS A 41 -2.729 -63.612 41.940 1.00 0.00 C ATOM 645 C LYS A 41 -1.725 -64.235 42.900 1.00 0.00 C ATOM 646 O LYS A 41 -0.607 -64.573 42.510 1.00 0.00 O ATOM 647 CB LYS A 41 -2.711 -62.088 42.093 1.00 0.00 C ATOM 648 CG LYS A 41 -2.128 -61.449 40.831 1.00 0.00 C ATOM 649 CD LYS A 41 -3.049 -61.730 39.642 1.00 0.00 C ATOM 650 CE LYS A 41 -3.332 -60.425 38.897 1.00 0.00 C ATOM 651 NZ LYS A 41 -2.056 -59.682 38.693 1.00 0.00 N ATOM 0 H LYS A 41 -4.788 -63.398 42.260 1.00 0.00 H new ATOM 0 HA LYS A 41 -2.450 -63.879 40.921 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -3.722 -61.718 42.266 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -2.116 -61.807 42.962 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -2.018 -60.374 40.973 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -1.133 -61.848 40.635 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -2.583 -62.451 38.970 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -3.983 -62.173 39.988 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -3.800 -60.637 37.935 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -4.034 -59.814 39.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -2.135 -59.081 37.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -1.864 -59.087 39.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -1.277 -60.359 38.565 1.00 0.00 H new ATOM 665 N ASP A 42 -2.123 -64.380 44.160 1.00 0.00 N ATOM 666 CA ASP A 42 -1.235 -64.959 45.156 1.00 0.00 C ATOM 667 C ASP A 42 -1.351 -66.482 45.180 1.00 0.00 C ATOM 668 O ASP A 42 -0.351 -67.186 45.317 1.00 0.00 O ATOM 669 CB ASP A 42 -1.559 -64.396 46.540 1.00 0.00 C ATOM 670 CG ASP A 42 -0.274 -64.224 47.344 1.00 0.00 C ATOM 671 OD1 ASP A 42 0.609 -65.052 47.195 1.00 0.00 O ATOM 672 OD2 ASP A 42 -0.194 -63.267 48.097 1.00 0.00 O ATOM 0 H ASP A 42 -3.042 -64.108 44.510 1.00 0.00 H new ATOM 0 HA ASP A 42 -0.212 -64.696 44.887 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -2.068 -63.437 46.442 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -2.240 -65.066 47.065 1.00 0.00 H new ATOM 677 N SER A 43 -2.577 -66.980 45.053 1.00 0.00 N ATOM 678 CA SER A 43 -2.814 -68.421 45.073 1.00 0.00 C ATOM 679 C SER A 43 -2.141 -69.106 43.888 1.00 0.00 C ATOM 680 O SER A 43 -1.834 -70.297 43.942 1.00 0.00 O ATOM 681 CB SER A 43 -4.314 -68.698 45.023 1.00 0.00 C ATOM 682 OG SER A 43 -4.593 -69.540 43.913 1.00 0.00 O ATOM 0 H SER A 43 -3.417 -66.413 44.936 1.00 0.00 H new ATOM 0 HA SER A 43 -2.389 -68.819 45.994 1.00 0.00 H new ATOM 0 HB2 SER A 43 -4.640 -69.174 45.948 1.00 0.00 H new ATOM 0 HB3 SER A 43 -4.867 -67.763 44.934 1.00 0.00 H new ATOM 0 HG SER A 43 -5.500 -69.902 43.997 1.00 0.00 H new ATOM 688 N ASN A 44 -1.914 -68.349 42.825 1.00 0.00 N ATOM 689 CA ASN A 44 -1.271 -68.891 41.631 1.00 0.00 C ATOM 690 C ASN A 44 -1.943 -70.184 41.169 1.00 0.00 C ATOM 691 O ASN A 44 -1.267 -71.133 40.774 1.00 0.00 O ATOM 692 CB ASN A 44 0.214 -69.151 41.908 1.00 0.00 C ATOM 693 CG ASN A 44 0.397 -70.479 42.637 1.00 0.00 C ATOM 694 OD1 ASN A 44 0.358 -70.525 43.867 1.00 0.00 O ATOM 695 ND2 ASN A 44 0.605 -71.569 41.948 1.00 0.00 N ATOM 0 H ASN A 44 -2.163 -67.362 42.762 1.00 0.00 H new ATOM 0 HA ASN A 44 -1.373 -68.154 40.835 1.00 0.00 H new ATOM 0 HB2 ASN A 44 0.768 -69.165 40.969 1.00 0.00 H new ATOM 0 HB3 ASN A 44 0.625 -68.340 42.509 1.00 0.00 H new ATOM 0 HD21 ASN A 44 0.735 -72.459 42.429 1.00 0.00 H new ATOM 0 HD22 ASN A 44 0.637 -71.530 40.929 1.00 0.00 H new ATOM 702 N GLY A 45 -3.273 -70.214 41.197 1.00 0.00 N ATOM 703 CA GLY A 45 -4.004 -71.399 40.751 1.00 0.00 C ATOM 704 C GLY A 45 -4.520 -72.229 41.923 1.00 0.00 C ATOM 705 O GLY A 45 -5.187 -73.245 41.723 1.00 0.00 O ATOM 0 H GLY A 45 -3.860 -69.444 41.518 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -4.843 -71.093 40.126 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -3.353 -72.014 40.130 1.00 0.00 H new ATOM 709 N ASN A 46 -4.222 -71.796 43.141 1.00 0.00 N ATOM 710 CA ASN A 46 -4.683 -72.518 44.324 1.00 0.00 C ATOM 711 C ASN A 46 -5.963 -71.876 44.859 1.00 0.00 C ATOM 712 O ASN A 46 -5.988 -70.686 45.162 1.00 0.00 O ATOM 713 CB ASN A 46 -3.593 -72.505 45.395 1.00 0.00 C ATOM 714 CG ASN A 46 -2.411 -73.357 44.943 1.00 0.00 C ATOM 715 OD1 ASN A 46 -2.186 -73.521 43.668 1.00 0.00 O flip ATOM 716 ND2 ASN A 46 -1.677 -73.893 45.774 1.00 0.00 N flip ATOM 0 H ASN A 46 -3.671 -70.960 43.337 1.00 0.00 H new ATOM 0 HA ASN A 46 -4.898 -73.552 44.054 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -3.265 -71.482 45.580 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -3.990 -72.888 46.335 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -1.855 -73.764 46.770 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -0.892 -74.466 45.466 1.00 0.00 H new ATOM 723 N LEU A 47 -7.031 -72.661 44.962 1.00 0.00 N ATOM 724 CA LEU A 47 -8.303 -72.127 45.444 1.00 0.00 C ATOM 725 C LEU A 47 -8.365 -72.138 46.963 1.00 0.00 C ATOM 726 O LEU A 47 -8.475 -71.084 47.590 1.00 0.00 O ATOM 727 CB LEU A 47 -9.474 -72.931 44.876 1.00 0.00 C ATOM 728 CG LEU A 47 -10.773 -72.162 45.126 1.00 0.00 C ATOM 729 CD1 LEU A 47 -10.759 -70.858 44.327 1.00 0.00 C ATOM 730 CD2 LEU A 47 -11.969 -73.010 44.688 1.00 0.00 C ATOM 0 H LEU A 47 -7.044 -73.653 44.723 1.00 0.00 H new ATOM 0 HA LEU A 47 -8.377 -71.095 45.102 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -9.334 -73.097 43.808 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -9.521 -73.913 45.347 1.00 0.00 H new ATOM 0 HG LEU A 47 -10.857 -71.939 46.190 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -11.685 -70.312 44.506 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -9.911 -70.248 44.640 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -10.671 -71.083 43.264 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -12.892 -72.458 44.868 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -11.884 -73.238 43.625 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -11.985 -73.939 45.258 1.00 0.00 H new ATOM 742 N GLU A 48 -8.287 -73.322 47.559 1.00 0.00 N ATOM 743 CA GLU A 48 -8.330 -73.408 49.009 1.00 0.00 C ATOM 744 C GLU A 48 -7.462 -72.305 49.587 1.00 0.00 C ATOM 745 O GLU A 48 -7.629 -71.892 50.734 1.00 0.00 O ATOM 746 CB GLU A 48 -7.836 -74.776 49.482 1.00 0.00 C ATOM 747 CG GLU A 48 -9.036 -75.605 49.940 1.00 0.00 C ATOM 748 CD GLU A 48 -8.567 -76.920 50.552 1.00 0.00 C ATOM 749 OE1 GLU A 48 -7.365 -77.108 50.651 1.00 0.00 O ATOM 750 OE2 GLU A 48 -9.414 -77.720 50.913 1.00 0.00 O ATOM 0 H GLU A 48 -8.196 -74.214 47.073 1.00 0.00 H new ATOM 0 HA GLU A 48 -9.358 -73.287 49.351 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -7.311 -75.287 48.675 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -7.125 -74.658 50.300 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -9.618 -75.043 50.671 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -9.694 -75.804 49.094 1.00 0.00 H new ATOM 757 N LEU A 49 -6.544 -71.827 48.759 1.00 0.00 N ATOM 758 CA LEU A 49 -5.642 -70.758 49.145 1.00 0.00 C ATOM 759 C LEU A 49 -6.267 -69.417 48.807 1.00 0.00 C ATOM 760 O LEU A 49 -6.167 -68.463 49.576 1.00 0.00 O ATOM 761 CB LEU A 49 -4.316 -70.913 48.408 1.00 0.00 C ATOM 762 CG LEU A 49 -3.578 -72.123 48.972 1.00 0.00 C ATOM 763 CD1 LEU A 49 -3.137 -71.808 50.399 1.00 0.00 C ATOM 764 CD2 LEU A 49 -4.518 -73.335 48.989 1.00 0.00 C ATOM 0 H LEU A 49 -6.406 -72.168 47.808 1.00 0.00 H new ATOM 0 HA LEU A 49 -5.461 -70.808 50.219 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -4.491 -71.042 47.340 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -3.711 -70.014 48.526 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.710 -72.348 48.353 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.608 -72.666 50.814 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -2.475 -70.942 50.393 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -4.013 -71.591 51.011 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -3.990 -74.199 49.392 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -5.384 -73.115 49.613 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -4.849 -73.553 47.974 1.00 0.00 H new ATOM 776 N ALA A 50 -6.932 -69.359 47.657 1.00 0.00 N ATOM 777 CA ALA A 50 -7.591 -68.133 47.243 1.00 0.00 C ATOM 778 C ALA A 50 -8.752 -67.854 48.189 1.00 0.00 C ATOM 779 O ALA A 50 -8.814 -66.793 48.805 1.00 0.00 O ATOM 780 CB ALA A 50 -8.094 -68.252 45.803 1.00 0.00 C ATOM 0 H ALA A 50 -7.026 -70.138 47.005 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.880 -67.308 47.282 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -8.585 -67.324 45.511 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -7.252 -68.442 45.138 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -8.805 -69.076 45.733 1.00 0.00 H new ATOM 786 N VAL A 51 -9.651 -68.826 48.337 1.00 0.00 N ATOM 787 CA VAL A 51 -10.771 -68.663 49.251 1.00 0.00 C ATOM 788 C VAL A 51 -10.232 -68.282 50.613 1.00 0.00 C ATOM 789 O VAL A 51 -10.623 -67.275 51.203 1.00 0.00 O ATOM 790 CB VAL A 51 -11.546 -69.973 49.369 1.00 0.00 C ATOM 791 CG1 VAL A 51 -10.640 -71.070 49.920 1.00 0.00 C ATOM 792 CG2 VAL A 51 -12.730 -69.778 50.313 1.00 0.00 C ATOM 0 H VAL A 51 -9.625 -69.718 47.844 1.00 0.00 H new ATOM 0 HA VAL A 51 -11.438 -67.888 48.874 1.00 0.00 H new ATOM 0 HB VAL A 51 -11.903 -70.265 48.381 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -11.202 -72.000 50.000 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -9.794 -71.214 49.248 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -10.276 -70.780 50.906 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -13.285 -70.712 50.399 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -12.366 -69.481 51.296 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -13.386 -69.002 49.919 1.00 0.00 H new ATOM 802 N ALA A 52 -9.307 -69.099 51.083 1.00 0.00 N ATOM 803 CA ALA A 52 -8.668 -68.874 52.359 1.00 0.00 C ATOM 804 C ALA A 52 -8.115 -67.456 52.410 1.00 0.00 C ATOM 805 O ALA A 52 -8.288 -66.742 53.394 1.00 0.00 O ATOM 806 CB ALA A 52 -7.543 -69.889 52.523 1.00 0.00 C ATOM 0 H ALA A 52 -8.982 -69.931 50.591 1.00 0.00 H new ATOM 0 HA ALA A 52 -9.387 -68.993 53.169 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -7.049 -69.733 53.482 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -7.955 -70.898 52.486 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -6.819 -69.763 51.718 1.00 0.00 H new ATOM 812 N PHE A 53 -7.460 -67.052 51.330 1.00 0.00 N ATOM 813 CA PHE A 53 -6.893 -65.711 51.252 1.00 0.00 C ATOM 814 C PHE A 53 -7.928 -64.665 51.657 1.00 0.00 C ATOM 815 O PHE A 53 -7.577 -63.590 52.143 1.00 0.00 O ATOM 816 CB PHE A 53 -6.414 -65.432 49.828 1.00 0.00 C ATOM 817 CG PHE A 53 -4.907 -65.361 49.798 1.00 0.00 C ATOM 818 CD1 PHE A 53 -4.242 -64.314 50.448 1.00 0.00 C ATOM 819 CD2 PHE A 53 -4.173 -66.343 49.122 1.00 0.00 C ATOM 820 CE1 PHE A 53 -2.843 -64.251 50.421 1.00 0.00 C ATOM 821 CE2 PHE A 53 -2.775 -66.279 49.095 1.00 0.00 C ATOM 822 CZ PHE A 53 -2.110 -65.233 49.745 1.00 0.00 C ATOM 0 H PHE A 53 -7.308 -67.628 50.502 1.00 0.00 H new ATOM 0 HA PHE A 53 -6.049 -65.653 51.939 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -6.763 -66.217 49.157 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -6.838 -64.494 49.469 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -4.807 -63.556 50.970 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -4.686 -67.151 48.621 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -2.330 -63.444 50.922 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -2.210 -67.037 48.573 1.00 0.00 H new ATOM 0 HZ PHE A 53 -1.031 -65.184 49.725 1.00 0.00 H new ATOM 832 N LEU A 54 -9.203 -64.983 51.451 1.00 0.00 N ATOM 833 CA LEU A 54 -10.275 -64.054 51.800 1.00 0.00 C ATOM 834 C LEU A 54 -10.670 -64.211 53.264 1.00 0.00 C ATOM 835 O LEU A 54 -10.710 -63.236 54.012 1.00 0.00 O ATOM 836 CB LEU A 54 -11.496 -64.305 50.916 1.00 0.00 C ATOM 837 CG LEU A 54 -11.222 -63.765 49.504 1.00 0.00 C ATOM 838 CD1 LEU A 54 -10.306 -64.727 48.749 1.00 0.00 C ATOM 839 CD2 LEU A 54 -12.535 -63.633 48.731 1.00 0.00 C ATOM 0 H LEU A 54 -9.517 -65.866 51.049 1.00 0.00 H new ATOM 0 HA LEU A 54 -9.911 -63.039 51.639 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -11.715 -65.372 50.873 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -12.373 -63.816 51.341 1.00 0.00 H new ATOM 0 HG LEU A 54 -10.745 -62.789 49.592 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -10.116 -64.338 47.749 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -9.362 -64.827 49.285 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -10.786 -65.703 48.674 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -12.332 -63.250 47.731 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -13.012 -64.610 48.655 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -13.198 -62.945 49.255 1.00 0.00 H new ATOM 851 N THR A 55 -10.965 -65.443 53.665 1.00 0.00 N ATOM 852 CA THR A 55 -11.358 -65.705 55.044 1.00 0.00 C ATOM 853 C THR A 55 -10.128 -65.826 55.935 1.00 0.00 C ATOM 854 O THR A 55 -10.078 -65.250 57.022 1.00 0.00 O ATOM 855 CB THR A 55 -12.183 -66.991 55.125 1.00 0.00 C ATOM 856 OG1 THR A 55 -12.382 -67.332 56.489 1.00 0.00 O ATOM 857 CG2 THR A 55 -11.442 -68.125 54.418 1.00 0.00 C ATOM 0 H THR A 55 -10.940 -66.266 53.063 1.00 0.00 H new ATOM 0 HA THR A 55 -11.965 -64.869 55.392 1.00 0.00 H new ATOM 0 HB THR A 55 -13.147 -66.836 54.640 1.00 0.00 H new ATOM 0 HG1 THR A 55 -12.911 -68.155 56.547 1.00 0.00 H new ATOM 0 HG21 THR A 55 -12.033 -69.039 54.478 1.00 0.00 H new ATOM 0 HG22 THR A 55 -11.287 -67.861 53.372 1.00 0.00 H new ATOM 0 HG23 THR A 55 -10.477 -68.285 54.899 1.00 0.00 H new ATOM 865 N ALA A 56 -9.133 -66.574 55.470 1.00 0.00 N ATOM 866 CA ALA A 56 -7.907 -66.753 56.242 1.00 0.00 C ATOM 867 C ALA A 56 -7.620 -65.510 57.078 1.00 0.00 C ATOM 868 O ALA A 56 -7.883 -64.388 56.645 1.00 0.00 O ATOM 869 CB ALA A 56 -6.725 -67.015 55.307 1.00 0.00 C ATOM 0 H ALA A 56 -9.149 -67.061 54.574 1.00 0.00 H new ATOM 0 HA ALA A 56 -8.042 -67.609 56.903 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.817 -67.147 55.896 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -6.914 -67.917 54.725 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.600 -66.168 54.632 1.00 0.00 H new ATOM 875 N LYS A 57 -7.077 -65.714 58.274 1.00 0.00 N ATOM 876 CA LYS A 57 -6.760 -64.596 59.154 1.00 0.00 C ATOM 877 C LYS A 57 -5.252 -64.483 59.358 1.00 0.00 C ATOM 878 O LYS A 57 -4.573 -65.476 59.619 1.00 0.00 O ATOM 879 CB LYS A 57 -7.448 -64.779 60.508 1.00 0.00 C ATOM 880 CG LYS A 57 -7.227 -66.209 61.007 1.00 0.00 C ATOM 881 CD LYS A 57 -8.459 -67.058 60.686 1.00 0.00 C ATOM 882 CE LYS A 57 -8.208 -68.505 61.109 1.00 0.00 C ATOM 883 NZ LYS A 57 -7.719 -69.287 59.938 1.00 0.00 N ATOM 0 H LYS A 57 -6.849 -66.633 58.653 1.00 0.00 H new ATOM 0 HA LYS A 57 -7.122 -63.680 58.686 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -7.049 -64.066 61.229 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -8.515 -64.576 60.416 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -6.343 -66.638 60.534 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -7.044 -66.206 62.082 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -9.331 -66.662 61.206 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -8.676 -67.013 59.619 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -7.474 -68.538 61.914 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -9.126 -68.946 61.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -7.548 -70.272 60.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -8.434 -69.266 59.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -6.833 -68.870 59.587 1.00 0.00 H new ATOM 897 N ASN A 58 -4.738 -63.263 59.239 1.00 0.00 N ATOM 898 CA ASN A 58 -3.311 -63.021 59.416 1.00 0.00 C ATOM 899 C ASN A 58 -3.038 -61.521 59.498 1.00 0.00 C ATOM 900 O ASN A 58 -2.067 -61.023 58.929 1.00 0.00 O ATOM 901 CB ASN A 58 -2.526 -63.628 58.249 1.00 0.00 C ATOM 902 CG ASN A 58 -3.441 -63.822 57.044 1.00 0.00 C ATOM 903 OD1 ASN A 58 -4.241 -64.853 57.001 1.00 0.00 O flip ATOM 904 ND2 ASN A 58 -3.428 -63.012 56.117 1.00 0.00 N flip ATOM 0 H ASN A 58 -5.286 -62.430 59.022 1.00 0.00 H new ATOM 0 HA ASN A 58 -2.989 -63.492 60.345 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -1.694 -62.976 57.982 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -2.098 -64.585 58.548 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -2.803 -62.207 56.152 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -4.043 -63.146 55.314 1.00 0.00 H new ATOM 911 N ALA A 59 -3.906 -60.808 60.208 1.00 0.00 N ATOM 912 CA ALA A 59 -3.753 -59.366 60.356 1.00 0.00 C ATOM 913 C ALA A 59 -4.049 -58.662 59.037 1.00 0.00 C ATOM 914 O ALA A 59 -4.894 -59.109 58.261 1.00 0.00 O ATOM 915 CB ALA A 59 -2.329 -59.034 60.805 1.00 0.00 C ATOM 0 H ALA A 59 -4.716 -61.201 60.686 1.00 0.00 H new ATOM 0 HA ALA A 59 -4.460 -59.019 61.109 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -2.224 -57.954 60.913 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -2.128 -59.516 61.762 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -1.619 -59.395 60.061 1.00 0.00 H new ATOM 921 N LYS A 60 -3.347 -57.562 58.787 1.00 0.00 N ATOM 922 CA LYS A 60 -3.542 -56.809 57.554 1.00 0.00 C ATOM 923 C LYS A 60 -2.642 -57.354 56.449 1.00 0.00 C ATOM 924 O LYS A 60 -2.502 -58.567 56.294 1.00 0.00 O ATOM 925 CB LYS A 60 -3.224 -55.330 57.788 1.00 0.00 C ATOM 926 CG LYS A 60 -4.106 -54.472 56.881 1.00 0.00 C ATOM 927 CD LYS A 60 -3.500 -53.072 56.755 1.00 0.00 C ATOM 928 CE LYS A 60 -2.598 -53.015 55.519 1.00 0.00 C ATOM 929 NZ LYS A 60 -2.022 -51.647 55.391 1.00 0.00 N ATOM 0 H LYS A 60 -2.644 -57.175 59.416 1.00 0.00 H new ATOM 0 HA LYS A 60 -4.583 -56.912 57.247 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -3.396 -55.070 58.833 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -2.172 -55.135 57.580 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -4.191 -54.933 55.897 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -5.114 -54.408 57.291 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -4.292 -52.327 56.675 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -2.925 -52.831 57.649 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -1.799 -53.752 55.604 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -3.170 -53.266 54.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -1.409 -51.606 54.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -2.791 -50.954 55.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -1.463 -51.425 56.240 1.00 0.00 H new ATOM 943 N THR A 61 -2.032 -56.451 55.691 1.00 0.00 N ATOM 944 CA THR A 61 -1.144 -56.852 54.608 1.00 0.00 C ATOM 945 C THR A 61 -0.036 -55.822 54.420 1.00 0.00 C ATOM 946 O THR A 61 0.055 -55.167 53.382 1.00 0.00 O ATOM 947 CB THR A 61 -1.937 -57.004 53.309 1.00 0.00 C ATOM 948 OG1 THR A 61 -3.094 -56.182 53.363 1.00 0.00 O ATOM 949 CG2 THR A 61 -2.351 -58.465 53.139 1.00 0.00 C ATOM 0 H THR A 61 -2.135 -55.443 55.805 1.00 0.00 H new ATOM 0 HA THR A 61 -0.693 -57.810 54.866 1.00 0.00 H new ATOM 0 HB THR A 61 -1.319 -56.701 52.464 1.00 0.00 H new ATOM 0 HG1 THR A 61 -3.602 -56.277 52.530 1.00 0.00 H new ATOM 0 HG21 THR A 61 -2.917 -58.578 52.214 1.00 0.00 H new ATOM 0 HG22 THR A 61 -1.461 -59.093 53.099 1.00 0.00 H new ATOM 0 HG23 THR A 61 -2.971 -58.768 53.983 1.00 0.00 H new ATOM 957 N PRO A 62 0.795 -55.676 55.412 1.00 0.00 N ATOM 958 CA PRO A 62 1.927 -54.714 55.392 1.00 0.00 C ATOM 959 C PRO A 62 3.161 -55.291 54.703 1.00 0.00 C ATOM 960 O PRO A 62 3.237 -55.332 53.475 1.00 0.00 O ATOM 961 CB PRO A 62 2.192 -54.466 56.876 1.00 0.00 C ATOM 962 CG PRO A 62 1.778 -55.726 57.572 1.00 0.00 C ATOM 963 CD PRO A 62 0.743 -56.422 56.678 1.00 0.00 C ATOM 0 HA PRO A 62 1.696 -53.808 54.832 1.00 0.00 H new ATOM 0 HB2 PRO A 62 3.244 -54.246 57.055 1.00 0.00 H new ATOM 0 HB3 PRO A 62 1.621 -53.611 57.239 1.00 0.00 H new ATOM 0 HG2 PRO A 62 2.639 -56.373 57.739 1.00 0.00 H new ATOM 0 HG3 PRO A 62 1.353 -55.503 58.550 1.00 0.00 H new ATOM 0 HD2 PRO A 62 0.988 -57.474 56.530 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -0.253 -56.386 57.120 1.00 0.00 H new ATOM 971 N GLN A 63 4.125 -55.737 55.503 1.00 0.00 N ATOM 972 CA GLN A 63 5.350 -56.309 54.959 1.00 0.00 C ATOM 973 C GLN A 63 5.953 -55.385 53.907 1.00 0.00 C ATOM 974 O GLN A 63 6.040 -55.739 52.731 1.00 0.00 O ATOM 975 CB GLN A 63 5.054 -57.674 54.335 1.00 0.00 C ATOM 976 CG GLN A 63 6.367 -58.408 54.053 1.00 0.00 C ATOM 977 CD GLN A 63 6.869 -58.062 52.654 1.00 0.00 C ATOM 978 OE1 GLN A 63 6.091 -58.044 51.701 1.00 0.00 O ATOM 979 NE2 GLN A 63 8.132 -57.786 52.476 1.00 0.00 N ATOM 0 H GLN A 63 4.082 -55.714 56.522 1.00 0.00 H new ATOM 0 HA GLN A 63 6.066 -56.428 55.772 1.00 0.00 H new ATOM 0 HB2 GLN A 63 4.433 -58.265 55.008 1.00 0.00 H new ATOM 0 HB3 GLN A 63 4.491 -57.548 53.410 1.00 0.00 H new ATOM 0 HG2 GLN A 63 7.115 -58.130 54.796 1.00 0.00 H new ATOM 0 HG3 GLN A 63 6.217 -59.484 54.139 1.00 0.00 H new ATOM 0 HE21 GLN A 63 8.774 -57.802 53.268 1.00 0.00 H new ATOM 0 HE22 GLN A 63 8.477 -57.554 51.545 1.00 0.00 H new ATOM 988 N GLN A 64 6.368 -54.198 54.337 1.00 0.00 N ATOM 989 CA GLN A 64 6.962 -53.230 53.422 1.00 0.00 C ATOM 990 C GLN A 64 6.067 -53.027 52.203 1.00 0.00 C ATOM 991 O GLN A 64 6.213 -53.714 51.193 1.00 0.00 O ATOM 992 CB GLN A 64 8.340 -53.720 52.970 1.00 0.00 C ATOM 993 CG GLN A 64 9.349 -52.575 53.071 1.00 0.00 C ATOM 994 CD GLN A 64 9.886 -52.481 54.496 1.00 0.00 C ATOM 995 OE1 GLN A 64 10.058 -53.501 55.163 1.00 0.00 O ATOM 996 NE2 GLN A 64 10.162 -51.312 55.005 1.00 0.00 N ATOM 0 H GLN A 64 6.305 -53.885 55.306 1.00 0.00 H new ATOM 0 HA GLN A 64 7.067 -52.279 53.944 1.00 0.00 H new ATOM 0 HB2 GLN A 64 8.661 -54.557 53.590 1.00 0.00 H new ATOM 0 HB3 GLN A 64 8.289 -54.084 51.944 1.00 0.00 H new ATOM 0 HG2 GLN A 64 10.170 -52.740 52.374 1.00 0.00 H new ATOM 0 HG3 GLN A 64 8.875 -51.635 52.789 1.00 0.00 H new ATOM 0 HE21 GLN A 64 10.019 -50.468 54.451 1.00 0.00 H new ATOM 0 HE22 GLN A 64 10.521 -51.242 55.957 1.00 0.00 H new ATOM 1005 N GLU A 65 5.140 -52.080 52.305 1.00 0.00 N ATOM 1006 CA GLU A 65 4.228 -51.799 51.201 1.00 0.00 C ATOM 1007 C GLU A 65 4.726 -50.614 50.379 1.00 0.00 C ATOM 1008 O GLU A 65 4.044 -50.153 49.465 1.00 0.00 O ATOM 1009 CB GLU A 65 2.831 -51.493 51.743 1.00 0.00 C ATOM 1010 CG GLU A 65 2.032 -52.792 51.857 1.00 0.00 C ATOM 1011 CD GLU A 65 1.382 -53.125 50.518 1.00 0.00 C ATOM 1012 OE1 GLU A 65 1.865 -52.637 49.510 1.00 0.00 O ATOM 1013 OE2 GLU A 65 0.410 -53.863 50.521 1.00 0.00 O ATOM 0 H GLU A 65 5.001 -51.499 53.132 1.00 0.00 H new ATOM 0 HA GLU A 65 4.185 -52.679 50.559 1.00 0.00 H new ATOM 0 HB2 GLU A 65 2.905 -51.012 52.719 1.00 0.00 H new ATOM 0 HB3 GLU A 65 2.318 -50.795 51.082 1.00 0.00 H new ATOM 0 HG2 GLU A 65 2.688 -53.606 52.164 1.00 0.00 H new ATOM 0 HG3 GLU A 65 1.267 -52.691 52.627 1.00 0.00 H new ATOM 1020 N GLU A 66 5.916 -50.125 50.710 1.00 0.00 N ATOM 1021 CA GLU A 66 6.490 -48.992 49.994 1.00 0.00 C ATOM 1022 C GLU A 66 7.121 -49.446 48.681 1.00 0.00 C ATOM 1023 O GLU A 66 6.434 -49.594 47.670 1.00 0.00 O ATOM 1024 CB GLU A 66 7.548 -48.306 50.862 1.00 0.00 C ATOM 1025 CG GLU A 66 6.888 -47.746 52.123 1.00 0.00 C ATOM 1026 CD GLU A 66 6.293 -46.371 51.833 1.00 0.00 C ATOM 1027 OE1 GLU A 66 5.653 -46.229 50.804 1.00 0.00 O ATOM 1028 OE2 GLU A 66 6.486 -45.481 52.645 1.00 0.00 O ATOM 0 H GLU A 66 6.498 -50.492 51.463 1.00 0.00 H new ATOM 0 HA GLU A 66 5.689 -48.287 49.772 1.00 0.00 H new ATOM 0 HB2 GLU A 66 8.329 -49.017 51.132 1.00 0.00 H new ATOM 0 HB3 GLU A 66 8.028 -47.503 50.303 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.107 -48.424 52.467 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.622 -47.672 52.926 1.00 0.00 H new ATOM 1035 N THR A 67 8.432 -49.664 48.702 1.00 0.00 N ATOM 1036 CA THR A 67 9.143 -50.099 47.505 1.00 0.00 C ATOM 1037 C THR A 67 8.329 -51.139 46.743 1.00 0.00 C ATOM 1038 O THR A 67 8.297 -52.312 47.115 1.00 0.00 O ATOM 1039 CB THR A 67 10.502 -50.690 47.887 1.00 0.00 C ATOM 1040 OG1 THR A 67 11.353 -49.653 48.355 1.00 0.00 O ATOM 1041 CG2 THR A 67 11.131 -51.355 46.663 1.00 0.00 C ATOM 0 H THR A 67 9.020 -49.548 49.528 1.00 0.00 H new ATOM 0 HA THR A 67 9.293 -49.232 46.862 1.00 0.00 H new ATOM 0 HB THR A 67 10.368 -51.433 48.673 1.00 0.00 H new ATOM 0 HG1 THR A 67 12.223 -50.030 48.602 1.00 0.00 H new ATOM 0 HG21 THR A 67 12.099 -51.776 46.935 1.00 0.00 H new ATOM 0 HG22 THR A 67 10.477 -52.150 46.305 1.00 0.00 H new ATOM 0 HG23 THR A 67 11.266 -50.614 45.875 1.00 0.00 H new ATOM 1049 N THR A 68 7.675 -50.700 45.674 1.00 0.00 N ATOM 1050 CA THR A 68 6.865 -51.598 44.861 1.00 0.00 C ATOM 1051 C THR A 68 6.496 -50.929 43.541 1.00 0.00 C ATOM 1052 O THR A 68 6.925 -49.810 43.262 1.00 0.00 O ATOM 1053 CB THR A 68 5.590 -51.981 45.618 1.00 0.00 C ATOM 1054 OG1 THR A 68 5.937 -52.466 46.907 1.00 0.00 O ATOM 1055 CG2 THR A 68 4.841 -53.067 44.843 1.00 0.00 C ATOM 0 H THR A 68 7.690 -49.732 45.351 1.00 0.00 H new ATOM 0 HA THR A 68 7.445 -52.497 44.652 1.00 0.00 H new ATOM 0 HB THR A 68 4.948 -51.106 45.720 1.00 0.00 H new ATOM 0 HG1 THR A 68 6.804 -52.922 46.863 1.00 0.00 H new ATOM 0 HG21 THR A 68 3.934 -53.339 45.383 1.00 0.00 H new ATOM 0 HG22 THR A 68 4.577 -52.692 43.854 1.00 0.00 H new ATOM 0 HG23 THR A 68 5.478 -53.945 44.739 1.00 0.00 H new ATOM 1063 N TYR A 69 5.698 -51.621 42.735 1.00 0.00 N ATOM 1064 CA TYR A 69 5.280 -51.081 41.447 1.00 0.00 C ATOM 1065 C TYR A 69 3.909 -51.625 41.058 1.00 0.00 C ATOM 1066 O TYR A 69 3.657 -52.826 41.156 1.00 0.00 O ATOM 1067 CB TYR A 69 6.302 -51.446 40.369 1.00 0.00 C ATOM 1068 CG TYR A 69 6.099 -52.881 39.944 1.00 0.00 C ATOM 1069 CD1 TYR A 69 5.086 -53.203 39.034 1.00 0.00 C ATOM 1070 CD2 TYR A 69 6.925 -53.888 40.458 1.00 0.00 C ATOM 1071 CE1 TYR A 69 4.898 -54.532 38.637 1.00 0.00 C ATOM 1072 CE2 TYR A 69 6.737 -55.217 40.061 1.00 0.00 C ATOM 1073 CZ TYR A 69 5.724 -55.539 39.150 1.00 0.00 C ATOM 1074 OH TYR A 69 5.539 -56.850 38.760 1.00 0.00 O ATOM 0 H TYR A 69 5.331 -52.548 42.948 1.00 0.00 H new ATOM 0 HA TYR A 69 5.217 -49.996 41.533 1.00 0.00 H new ATOM 0 HB2 TYR A 69 6.193 -50.783 39.511 1.00 0.00 H new ATOM 0 HB3 TYR A 69 7.314 -51.309 40.751 1.00 0.00 H new ATOM 0 HD1 TYR A 69 4.449 -52.426 38.638 1.00 0.00 H new ATOM 0 HD2 TYR A 69 7.707 -53.639 41.160 1.00 0.00 H new ATOM 0 HE1 TYR A 69 4.116 -54.780 37.935 1.00 0.00 H new ATOM 0 HE2 TYR A 69 7.374 -55.994 40.458 1.00 0.00 H new ATOM 0 HH TYR A 69 6.197 -57.421 39.209 1.00 0.00 H new ATOM 1084 N TYR A 70 3.029 -50.733 40.617 1.00 0.00 N ATOM 1085 CA TYR A 70 1.686 -51.135 40.215 1.00 0.00 C ATOM 1086 C TYR A 70 1.534 -51.035 38.701 1.00 0.00 C ATOM 1087 O TYR A 70 2.505 -50.786 37.986 1.00 0.00 O ATOM 1088 CB TYR A 70 0.645 -50.238 40.890 1.00 0.00 C ATOM 1089 CG TYR A 70 0.681 -50.453 42.384 1.00 0.00 C ATOM 1090 CD1 TYR A 70 1.584 -49.732 43.176 1.00 0.00 C ATOM 1091 CD2 TYR A 70 -0.191 -51.372 42.977 1.00 0.00 C ATOM 1092 CE1 TYR A 70 1.612 -49.932 44.562 1.00 0.00 C ATOM 1093 CE2 TYR A 70 -0.163 -51.570 44.362 1.00 0.00 C ATOM 1094 CZ TYR A 70 0.740 -50.851 45.155 1.00 0.00 C ATOM 1095 OH TYR A 70 0.767 -51.048 46.520 1.00 0.00 O ATOM 0 H TYR A 70 3.219 -49.735 40.529 1.00 0.00 H new ATOM 0 HA TYR A 70 1.529 -52.169 40.523 1.00 0.00 H new ATOM 0 HB2 TYR A 70 0.847 -49.192 40.658 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -0.349 -50.464 40.504 1.00 0.00 H new ATOM 0 HD1 TYR A 70 2.258 -49.023 42.718 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -0.886 -51.929 42.366 1.00 0.00 H new ATOM 0 HE1 TYR A 70 2.307 -49.376 45.173 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -0.838 -52.278 44.820 1.00 0.00 H new ATOM 0 HH TYR A 70 0.097 -51.719 46.767 1.00 0.00 H new ATOM 1105 N GLN A 71 0.311 -51.223 38.219 1.00 0.00 N ATOM 1106 CA GLN A 71 0.047 -51.142 36.789 1.00 0.00 C ATOM 1107 C GLN A 71 -0.983 -50.055 36.502 1.00 0.00 C ATOM 1108 O GLN A 71 -1.260 -49.737 35.346 1.00 0.00 O ATOM 1109 CB GLN A 71 -0.465 -52.488 36.271 1.00 0.00 C ATOM 1110 CG GLN A 71 0.058 -52.719 34.852 1.00 0.00 C ATOM 1111 CD GLN A 71 -0.270 -54.137 34.394 1.00 0.00 C ATOM 1112 OE1 GLN A 71 -0.158 -55.128 35.236 1.00 0.00 O flip ATOM 1113 NE2 GLN A 71 -0.636 -54.348 33.238 1.00 0.00 N flip ATOM 0 H GLN A 71 -0.507 -51.431 38.792 1.00 0.00 H new ATOM 0 HA GLN A 71 0.977 -50.893 36.278 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.134 -53.293 36.928 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -1.555 -52.501 36.275 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.389 -51.996 34.170 1.00 0.00 H new ATOM 0 HG3 GLN A 71 1.136 -52.560 34.823 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -0.723 -53.573 32.581 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -0.852 -55.298 32.937 1.00 0.00 H new ATOM 1122 N THR A 72 -1.543 -49.486 37.565 1.00 0.00 N ATOM 1123 CA THR A 72 -2.538 -48.429 37.420 1.00 0.00 C ATOM 1124 C THR A 72 -1.856 -47.068 37.320 1.00 0.00 C ATOM 1125 O THR A 72 -1.414 -46.510 38.323 1.00 0.00 O ATOM 1126 CB THR A 72 -3.490 -48.438 38.620 1.00 0.00 C ATOM 1127 OG1 THR A 72 -3.950 -49.762 38.847 1.00 0.00 O ATOM 1128 CG2 THR A 72 -4.683 -47.523 38.336 1.00 0.00 C ATOM 0 H THR A 72 -1.327 -49.737 38.530 1.00 0.00 H new ATOM 0 HA THR A 72 -3.105 -48.610 36.507 1.00 0.00 H new ATOM 0 HB THR A 72 -2.963 -48.079 39.504 1.00 0.00 H new ATOM 0 HG1 THR A 72 -4.558 -49.770 39.616 1.00 0.00 H new ATOM 0 HG21 THR A 72 -5.359 -47.531 39.191 1.00 0.00 H new ATOM 0 HG22 THR A 72 -4.329 -46.507 38.163 1.00 0.00 H new ATOM 0 HG23 THR A 72 -5.212 -47.879 37.452 1.00 0.00 H new ATOM 1136 N ALA A 73 -1.771 -46.542 36.102 1.00 0.00 N ATOM 1137 CA ALA A 73 -1.135 -45.249 35.886 1.00 0.00 C ATOM 1138 C ALA A 73 -1.354 -44.776 34.450 1.00 0.00 C ATOM 1139 O ALA A 73 -0.993 -45.468 33.498 1.00 0.00 O ATOM 1140 CB ALA A 73 0.365 -45.354 36.168 1.00 0.00 C ATOM 0 H ALA A 73 -2.131 -46.987 35.258 1.00 0.00 H new ATOM 0 HA ALA A 73 -1.584 -44.525 36.566 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.835 -44.384 36.005 1.00 0.00 H new ATOM 0 HB2 ALA A 73 0.520 -45.663 37.202 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.810 -46.090 35.499 1.00 0.00 H new ATOM 1146 N LEU A 74 -1.945 -43.595 34.304 1.00 0.00 N ATOM 1147 CA LEU A 74 -2.206 -43.043 32.979 1.00 0.00 C ATOM 1148 C LEU A 74 -1.039 -42.193 32.488 1.00 0.00 C ATOM 1149 O LEU A 74 -0.838 -42.059 31.285 1.00 0.00 O ATOM 1150 CB LEU A 74 -3.467 -42.183 33.003 1.00 0.00 C ATOM 1151 CG LEU A 74 -3.743 -41.644 31.597 1.00 0.00 C ATOM 1152 CD1 LEU A 74 -4.054 -42.806 30.653 1.00 0.00 C ATOM 1153 CD2 LEU A 74 -4.940 -40.692 31.643 1.00 0.00 C ATOM 0 H LEU A 74 -2.250 -43.006 35.079 1.00 0.00 H new ATOM 0 HA LEU A 74 -2.340 -43.883 32.298 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -4.315 -42.772 33.351 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.344 -41.357 33.703 1.00 0.00 H new ATOM 0 HG LEU A 74 -2.864 -41.110 31.236 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -4.250 -42.420 29.653 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -3.202 -43.485 30.619 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -4.932 -43.343 31.013 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -5.138 -40.307 30.642 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -5.817 -41.228 32.006 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -4.719 -39.862 32.314 1.00 0.00 H new ATOM 1165 N PRO A 75 -0.279 -41.613 33.386 1.00 0.00 N ATOM 1166 CA PRO A 75 0.887 -40.754 33.018 1.00 0.00 C ATOM 1167 C PRO A 75 1.899 -41.499 32.152 1.00 0.00 C ATOM 1168 O PRO A 75 3.078 -41.588 32.492 1.00 0.00 O ATOM 1169 CB PRO A 75 1.509 -40.364 34.364 1.00 0.00 C ATOM 1170 CG PRO A 75 0.441 -40.587 35.383 1.00 0.00 C ATOM 1171 CD PRO A 75 -0.447 -41.706 34.843 1.00 0.00 C ATOM 0 HA PRO A 75 0.580 -39.893 32.425 1.00 0.00 H new ATOM 0 HB2 PRO A 75 2.388 -40.971 34.579 1.00 0.00 H new ATOM 0 HB3 PRO A 75 1.834 -39.323 34.358 1.00 0.00 H new ATOM 0 HG2 PRO A 75 0.874 -40.865 36.344 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -0.137 -39.677 35.545 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -0.137 -42.680 35.220 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -1.488 -41.567 35.136 1.00 0.00 H new ATOM 1179 N GLY A 76 1.426 -42.033 31.032 1.00 0.00 N ATOM 1180 CA GLY A 76 2.295 -42.771 30.122 1.00 0.00 C ATOM 1181 C GLY A 76 2.368 -42.084 28.763 1.00 0.00 C ATOM 1182 O GLY A 76 1.653 -42.450 27.830 1.00 0.00 O ATOM 0 H GLY A 76 0.453 -41.970 30.733 1.00 0.00 H new ATOM 0 HA2 GLY A 76 3.295 -42.848 30.549 1.00 0.00 H new ATOM 0 HA3 GLY A 76 1.921 -43.788 30.000 1.00 0.00 H new ATOM 1186 N ASN A 77 3.238 -41.086 28.658 1.00 0.00 N ATOM 1187 CA ASN A 77 3.398 -40.352 27.407 1.00 0.00 C ATOM 1188 C ASN A 77 4.769 -39.688 27.348 1.00 0.00 C ATOM 1189 O ASN A 77 5.249 -39.143 28.341 1.00 0.00 O ATOM 1190 CB ASN A 77 2.305 -39.287 27.284 1.00 0.00 C ATOM 1191 CG ASN A 77 1.321 -39.671 26.186 1.00 0.00 C ATOM 1192 OD1 ASN A 77 0.205 -40.103 26.473 1.00 0.00 O ATOM 1193 ND2 ASN A 77 1.671 -39.540 24.935 1.00 0.00 N ATOM 0 H ASN A 77 3.840 -40.768 29.418 1.00 0.00 H new ATOM 0 HA ASN A 77 3.313 -41.056 26.579 1.00 0.00 H new ATOM 0 HB2 ASN A 77 1.780 -39.182 28.233 1.00 0.00 H new ATOM 0 HB3 ASN A 77 2.753 -38.319 27.059 1.00 0.00 H new ATOM 0 HD21 ASN A 77 1.019 -39.796 24.194 1.00 0.00 H new ATOM 0 HD22 ASN A 77 2.596 -39.182 24.699 1.00 0.00 H new ATOM 1200 N ASP A 78 5.394 -39.734 26.175 1.00 0.00 N ATOM 1201 CA ASP A 78 6.708 -39.130 25.998 1.00 0.00 C ATOM 1202 C ASP A 78 6.676 -38.099 24.876 1.00 0.00 C ATOM 1203 O ASP A 78 5.607 -37.727 24.392 1.00 0.00 O ATOM 1204 CB ASP A 78 7.743 -40.208 25.674 1.00 0.00 C ATOM 1205 CG ASP A 78 7.347 -41.526 26.330 1.00 0.00 C ATOM 1206 OD1 ASP A 78 6.946 -41.496 27.481 1.00 0.00 O ATOM 1207 OD2 ASP A 78 7.454 -42.549 25.671 1.00 0.00 O ATOM 0 H ASP A 78 5.014 -40.180 25.340 1.00 0.00 H new ATOM 0 HA ASP A 78 6.985 -38.632 26.927 1.00 0.00 H new ATOM 0 HB2 ASP A 78 7.819 -40.338 24.594 1.00 0.00 H new ATOM 0 HB3 ASP A 78 8.726 -39.898 26.027 1.00 0.00 H new ATOM 1212 N ARG A 79 7.854 -37.640 24.468 1.00 0.00 N ATOM 1213 CA ARG A 79 7.947 -36.649 23.403 1.00 0.00 C ATOM 1214 C ARG A 79 9.108 -36.974 22.468 1.00 0.00 C ATOM 1215 O ARG A 79 8.930 -37.662 21.463 1.00 0.00 O ATOM 1216 CB ARG A 79 8.143 -35.256 24.005 1.00 0.00 C ATOM 1217 CG ARG A 79 8.801 -35.384 25.381 1.00 0.00 C ATOM 1218 CD ARG A 79 9.688 -34.164 25.637 1.00 0.00 C ATOM 1219 NE ARG A 79 9.935 -34.009 27.066 1.00 0.00 N ATOM 1220 CZ ARG A 79 9.060 -33.389 27.851 1.00 0.00 C ATOM 1221 NH1 ARG A 79 7.957 -32.907 27.344 1.00 0.00 N ATOM 1222 NH2 ARG A 79 9.301 -33.263 29.127 1.00 0.00 N ATOM 0 H ARG A 79 8.750 -37.935 24.855 1.00 0.00 H new ATOM 0 HA ARG A 79 7.021 -36.669 22.829 1.00 0.00 H new ATOM 0 HB2 ARG A 79 8.765 -34.648 23.348 1.00 0.00 H new ATOM 0 HB3 ARG A 79 7.183 -34.748 24.095 1.00 0.00 H new ATOM 0 HG2 ARG A 79 8.038 -35.461 26.155 1.00 0.00 H new ATOM 0 HG3 ARG A 79 9.396 -36.296 25.428 1.00 0.00 H new ATOM 0 HD2 ARG A 79 10.634 -34.276 25.108 1.00 0.00 H new ATOM 0 HD3 ARG A 79 9.208 -33.268 25.245 1.00 0.00 H new ATOM 0 HE ARG A 79 10.794 -34.383 27.470 1.00 0.00 H new ATOM 0 HH11 ARG A 79 7.768 -33.007 26.347 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.285 -32.431 27.945 1.00 0.00 H new ATOM 0 HH21 ARG A 79 10.162 -33.641 29.523 1.00 0.00 H new ATOM 0 HH22 ARG A 79 8.629 -32.787 29.728 1.00 0.00 H new ATOM 1236 N TYR A 80 10.293 -36.473 22.803 1.00 0.00 N ATOM 1237 CA TYR A 80 11.474 -36.715 21.986 1.00 0.00 C ATOM 1238 C TYR A 80 11.388 -35.938 20.679 1.00 0.00 C ATOM 1239 O TYR A 80 10.307 -35.529 20.255 1.00 0.00 O ATOM 1240 CB TYR A 80 11.615 -38.209 21.683 1.00 0.00 C ATOM 1241 CG TYR A 80 11.375 -39.012 22.940 1.00 0.00 C ATOM 1242 CD1 TYR A 80 12.019 -38.659 24.133 1.00 0.00 C ATOM 1243 CD2 TYR A 80 10.511 -40.113 22.912 1.00 0.00 C ATOM 1244 CE1 TYR A 80 11.798 -39.407 25.296 1.00 0.00 C ATOM 1245 CE2 TYR A 80 10.290 -40.861 24.074 1.00 0.00 C ATOM 1246 CZ TYR A 80 10.935 -40.508 25.265 1.00 0.00 C ATOM 1247 OH TYR A 80 10.719 -41.246 26.411 1.00 0.00 O ATOM 0 H TYR A 80 10.459 -35.900 23.630 1.00 0.00 H new ATOM 0 HA TYR A 80 12.348 -36.378 22.544 1.00 0.00 H new ATOM 0 HB2 TYR A 80 10.902 -38.502 20.912 1.00 0.00 H new ATOM 0 HB3 TYR A 80 12.611 -38.418 21.292 1.00 0.00 H new ATOM 0 HD1 TYR A 80 12.686 -37.810 24.156 1.00 0.00 H new ATOM 0 HD2 TYR A 80 10.014 -40.386 21.993 1.00 0.00 H new ATOM 0 HE1 TYR A 80 12.293 -39.134 26.216 1.00 0.00 H new ATOM 0 HE2 TYR A 80 9.622 -41.710 24.052 1.00 0.00 H new ATOM 0 HH TYR A 80 10.093 -41.975 26.218 1.00 0.00 H new ATOM 1257 N ILE A 81 12.538 -35.739 20.047 1.00 0.00 N ATOM 1258 CA ILE A 81 12.597 -35.009 18.784 1.00 0.00 C ATOM 1259 C ILE A 81 12.321 -33.528 19.011 1.00 0.00 C ATOM 1260 O ILE A 81 11.249 -33.153 19.485 1.00 0.00 O ATOM 1261 CB ILE A 81 11.574 -35.576 17.797 1.00 0.00 C ATOM 1262 CG1 ILE A 81 11.656 -37.106 17.792 1.00 0.00 C ATOM 1263 CG2 ILE A 81 11.876 -35.047 16.394 1.00 0.00 C ATOM 1264 CD1 ILE A 81 10.576 -37.672 16.870 1.00 0.00 C ATOM 0 H ILE A 81 13.441 -36.071 20.386 1.00 0.00 H new ATOM 0 HA ILE A 81 13.598 -35.123 18.369 1.00 0.00 H new ATOM 0 HB ILE A 81 10.572 -35.269 18.097 1.00 0.00 H new ATOM 0 HG12 ILE A 81 12.642 -37.427 17.455 1.00 0.00 H new ATOM 0 HG13 ILE A 81 11.524 -37.491 18.803 1.00 0.00 H new ATOM 0 HG21 ILE A 81 11.149 -35.450 15.689 1.00 0.00 H new ATOM 0 HG22 ILE A 81 11.817 -33.959 16.395 1.00 0.00 H new ATOM 0 HG23 ILE A 81 12.878 -35.355 16.097 1.00 0.00 H new ATOM 0 HD11 ILE A 81 10.634 -38.760 16.866 1.00 0.00 H new ATOM 0 HD12 ILE A 81 9.594 -37.362 17.227 1.00 0.00 H new ATOM 0 HD13 ILE A 81 10.729 -37.297 15.858 1.00 0.00 H new ATOM 1276 N SER A 82 13.294 -32.690 18.669 1.00 0.00 N ATOM 1277 CA SER A 82 13.141 -31.251 18.840 1.00 0.00 C ATOM 1278 C SER A 82 14.455 -30.532 18.558 1.00 0.00 C ATOM 1279 O SER A 82 14.463 -29.354 18.197 1.00 0.00 O ATOM 1280 CB SER A 82 12.684 -30.944 20.267 1.00 0.00 C ATOM 1281 OG SER A 82 12.921 -32.077 21.092 1.00 0.00 O ATOM 0 H SER A 82 14.189 -32.980 18.275 1.00 0.00 H new ATOM 0 HA SER A 82 12.391 -30.897 18.132 1.00 0.00 H new ATOM 0 HB2 SER A 82 13.222 -30.079 20.655 1.00 0.00 H new ATOM 0 HB3 SER A 82 11.624 -30.690 20.275 1.00 0.00 H new ATOM 0 HG SER A 82 12.630 -31.882 22.007 1.00 0.00 H new ATOM 1287 N VAL A 83 15.565 -31.244 18.723 1.00 0.00 N ATOM 1288 CA VAL A 83 16.878 -30.657 18.481 1.00 0.00 C ATOM 1289 C VAL A 83 17.595 -31.390 17.352 1.00 0.00 C ATOM 1290 O VAL A 83 17.462 -32.605 17.205 1.00 0.00 O ATOM 1291 CB VAL A 83 17.724 -30.720 19.755 1.00 0.00 C ATOM 1292 CG1 VAL A 83 17.662 -32.132 20.343 1.00 0.00 C ATOM 1293 CG2 VAL A 83 19.175 -30.371 19.417 1.00 0.00 C ATOM 0 H VAL A 83 15.583 -32.219 19.021 1.00 0.00 H new ATOM 0 HA VAL A 83 16.740 -29.616 18.190 1.00 0.00 H new ATOM 0 HB VAL A 83 17.337 -30.008 20.484 1.00 0.00 H new ATOM 0 HG11 VAL A 83 18.265 -32.175 21.250 1.00 0.00 H new ATOM 0 HG12 VAL A 83 16.628 -32.381 20.582 1.00 0.00 H new ATOM 0 HG13 VAL A 83 18.049 -32.846 19.616 1.00 0.00 H new ATOM 0 HG21 VAL A 83 19.780 -30.415 20.322 1.00 0.00 H new ATOM 0 HG22 VAL A 83 19.560 -31.084 18.688 1.00 0.00 H new ATOM 0 HG23 VAL A 83 19.219 -29.365 18.999 1.00 0.00 H new ATOM 1303 N GLY A 84 18.354 -30.644 16.555 1.00 0.00 N ATOM 1304 CA GLY A 84 19.087 -31.235 15.442 1.00 0.00 C ATOM 1305 C GLY A 84 20.592 -31.116 15.657 1.00 0.00 C ATOM 1306 O GLY A 84 21.209 -31.977 16.285 1.00 0.00 O ATOM 0 H GLY A 84 18.477 -29.637 16.658 1.00 0.00 H new ATOM 0 HA2 GLY A 84 18.813 -32.285 15.337 1.00 0.00 H new ATOM 0 HA3 GLY A 84 18.808 -30.738 14.513 1.00 0.00 H new ATOM 1310 N SER A 85 21.179 -30.044 15.132 1.00 0.00 N ATOM 1311 CA SER A 85 22.614 -29.822 15.275 1.00 0.00 C ATOM 1312 C SER A 85 23.091 -28.744 14.309 1.00 0.00 C ATOM 1313 O SER A 85 23.874 -29.014 13.399 1.00 0.00 O ATOM 1314 CB SER A 85 23.373 -31.121 15.004 1.00 0.00 C ATOM 1315 OG SER A 85 22.607 -31.939 14.130 1.00 0.00 O ATOM 0 H SER A 85 20.687 -29.321 14.608 1.00 0.00 H new ATOM 0 HA SER A 85 22.809 -29.491 16.295 1.00 0.00 H new ATOM 0 HB2 SER A 85 24.344 -30.902 14.559 1.00 0.00 H new ATOM 0 HB3 SER A 85 23.563 -31.647 15.940 1.00 0.00 H new ATOM 0 HG SER A 85 23.092 -32.772 13.953 1.00 0.00 H new ATOM 1321 N GLN A 86 22.617 -27.519 14.513 1.00 0.00 N ATOM 1322 CA GLN A 86 23.007 -26.407 13.653 1.00 0.00 C ATOM 1323 C GLN A 86 23.219 -26.890 12.220 1.00 0.00 C ATOM 1324 O GLN A 86 22.686 -27.925 11.819 1.00 0.00 O ATOM 1325 CB GLN A 86 24.299 -25.772 14.179 1.00 0.00 C ATOM 1326 CG GLN A 86 24.042 -24.310 14.558 1.00 0.00 C ATOM 1327 CD GLN A 86 25.172 -23.799 15.446 1.00 0.00 C ATOM 1328 OE1 GLN A 86 25.666 -24.530 16.304 1.00 0.00 O ATOM 1329 NE2 GLN A 86 25.613 -22.582 15.291 1.00 0.00 N ATOM 0 H GLN A 86 21.968 -27.272 15.260 1.00 0.00 H new ATOM 0 HA GLN A 86 22.209 -25.665 13.659 1.00 0.00 H new ATOM 0 HB2 GLN A 86 24.659 -26.324 15.047 1.00 0.00 H new ATOM 0 HB3 GLN A 86 25.078 -25.829 13.419 1.00 0.00 H new ATOM 0 HG2 GLN A 86 23.970 -23.699 13.658 1.00 0.00 H new ATOM 0 HG3 GLN A 86 23.089 -24.222 15.080 1.00 0.00 H new ATOM 0 HE21 GLN A 86 25.202 -21.978 14.579 1.00 0.00 H new ATOM 0 HE22 GLN A 86 26.369 -22.234 15.881 1.00 0.00 H new ATOM 1338 N ALA A 87 24.000 -26.134 11.454 1.00 0.00 N ATOM 1339 CA ALA A 87 24.277 -26.495 10.067 1.00 0.00 C ATOM 1340 C ALA A 87 25.728 -26.188 9.714 1.00 0.00 C ATOM 1341 O ALA A 87 26.330 -25.268 10.268 1.00 0.00 O ATOM 1342 CB ALA A 87 23.348 -25.720 9.130 1.00 0.00 C ATOM 0 H ALA A 87 24.450 -25.274 11.767 1.00 0.00 H new ATOM 0 HA ALA A 87 24.104 -27.565 9.948 1.00 0.00 H new ATOM 0 HB1 ALA A 87 23.561 -25.995 8.097 1.00 0.00 H new ATOM 0 HB2 ALA A 87 22.311 -25.962 9.363 1.00 0.00 H new ATOM 0 HB3 ALA A 87 23.509 -24.650 9.261 1.00 0.00 H new ATOM 1348 N ASP A 88 26.283 -26.963 8.787 1.00 0.00 N ATOM 1349 CA ASP A 88 27.665 -26.758 8.369 1.00 0.00 C ATOM 1350 C ASP A 88 27.857 -25.336 7.855 1.00 0.00 C ATOM 1351 O ASP A 88 28.972 -24.815 7.841 1.00 0.00 O ATOM 1352 CB ASP A 88 28.039 -27.757 7.271 1.00 0.00 C ATOM 1353 CG ASP A 88 27.353 -27.376 5.962 1.00 0.00 C ATOM 1354 OD1 ASP A 88 26.146 -27.528 5.883 1.00 0.00 O ATOM 1355 OD2 ASP A 88 28.047 -26.940 5.059 1.00 0.00 O ATOM 0 H ASP A 88 25.803 -27.730 8.316 1.00 0.00 H new ATOM 0 HA ASP A 88 28.313 -26.915 9.231 1.00 0.00 H new ATOM 0 HB2 ASP A 88 29.120 -27.771 7.134 1.00 0.00 H new ATOM 0 HB3 ASP A 88 27.742 -28.763 7.567 1.00 0.00 H new ATOM 1360 N THR A 89 26.759 -24.712 7.438 1.00 0.00 N ATOM 1361 CA THR A 89 26.816 -23.347 6.928 1.00 0.00 C ATOM 1362 C THR A 89 27.849 -23.236 5.811 1.00 0.00 C ATOM 1363 O THR A 89 28.552 -24.200 5.506 1.00 0.00 O ATOM 1364 CB THR A 89 27.176 -22.386 8.062 1.00 0.00 C ATOM 1365 OG1 THR A 89 28.426 -22.762 8.622 1.00 0.00 O ATOM 1366 CG2 THR A 89 26.094 -22.444 9.143 1.00 0.00 C ATOM 0 H THR A 89 25.827 -25.126 7.443 1.00 0.00 H new ATOM 0 HA THR A 89 25.838 -23.084 6.526 1.00 0.00 H new ATOM 0 HB THR A 89 27.244 -21.371 7.671 1.00 0.00 H new ATOM 0 HG1 THR A 89 28.908 -23.337 7.991 1.00 0.00 H new ATOM 0 HG21 THR A 89 26.350 -21.759 9.951 1.00 0.00 H new ATOM 0 HG22 THR A 89 25.135 -22.155 8.713 1.00 0.00 H new ATOM 0 HG23 THR A 89 26.025 -23.459 9.535 1.00 0.00 H new ATOM 1374 N ASN A 90 27.937 -22.057 5.203 1.00 0.00 N ATOM 1375 CA ASN A 90 28.888 -21.836 4.120 1.00 0.00 C ATOM 1376 C ASN A 90 28.933 -20.357 3.760 1.00 0.00 C ATOM 1377 O ASN A 90 29.046 -19.989 2.591 1.00 0.00 O ATOM 1378 CB ASN A 90 28.484 -22.658 2.893 1.00 0.00 C ATOM 1379 CG ASN A 90 29.356 -23.904 2.792 1.00 0.00 C ATOM 1380 OD1 ASN A 90 30.389 -23.905 1.994 1.00 0.00 O flip ATOM 1381 ND2 ASN A 90 29.090 -24.905 3.458 1.00 0.00 N flip ATOM 0 H ASN A 90 27.366 -21.246 5.440 1.00 0.00 H new ATOM 0 HA ASN A 90 29.878 -22.152 4.449 1.00 0.00 H new ATOM 0 HB2 ASN A 90 27.434 -22.943 2.965 1.00 0.00 H new ATOM 0 HB3 ASN A 90 28.589 -22.056 1.991 1.00 0.00 H new ATOM 0 HD21 ASN A 90 28.283 -24.903 4.081 1.00 0.00 H new ATOM 0 HD22 ASN A 90 29.677 -25.736 3.386 1.00 0.00 H new ATOM 1388 N VAL A 91 28.831 -19.516 4.780 1.00 0.00 N ATOM 1389 CA VAL A 91 28.848 -18.075 4.578 1.00 0.00 C ATOM 1390 C VAL A 91 30.080 -17.449 5.222 1.00 0.00 C ATOM 1391 O VAL A 91 31.187 -17.544 4.695 1.00 0.00 O ATOM 1392 CB VAL A 91 27.593 -17.463 5.193 1.00 0.00 C ATOM 1393 CG1 VAL A 91 26.422 -17.629 4.225 1.00 0.00 C ATOM 1394 CG2 VAL A 91 27.274 -18.184 6.506 1.00 0.00 C ATOM 0 H VAL A 91 28.736 -19.806 5.753 1.00 0.00 H new ATOM 0 HA VAL A 91 28.877 -17.877 3.507 1.00 0.00 H new ATOM 0 HB VAL A 91 27.757 -16.403 5.387 1.00 0.00 H new ATOM 0 HG11 VAL A 91 25.524 -17.193 4.662 1.00 0.00 H new ATOM 0 HG12 VAL A 91 26.651 -17.124 3.287 1.00 0.00 H new ATOM 0 HG13 VAL A 91 26.255 -18.689 4.035 1.00 0.00 H new ATOM 0 HG21 VAL A 91 26.378 -17.751 6.950 1.00 0.00 H new ATOM 0 HG22 VAL A 91 27.106 -19.243 6.308 1.00 0.00 H new ATOM 0 HG23 VAL A 91 28.111 -18.072 7.195 1.00 0.00 H new ATOM 1404 N ILE A 92 29.867 -16.805 6.365 1.00 0.00 N ATOM 1405 CA ILE A 92 30.952 -16.155 7.089 1.00 0.00 C ATOM 1406 C ILE A 92 32.029 -15.659 6.136 1.00 0.00 C ATOM 1407 O ILE A 92 31.777 -15.428 4.954 1.00 0.00 O ATOM 1408 CB ILE A 92 31.563 -17.118 8.109 1.00 0.00 C ATOM 1409 CG1 ILE A 92 32.145 -16.314 9.273 1.00 0.00 C ATOM 1410 CG2 ILE A 92 32.672 -17.952 7.459 1.00 0.00 C ATOM 1411 CD1 ILE A 92 31.197 -16.395 10.473 1.00 0.00 C ATOM 0 H ILE A 92 28.953 -16.720 6.809 1.00 0.00 H new ATOM 0 HA ILE A 92 30.536 -15.295 7.613 1.00 0.00 H new ATOM 0 HB ILE A 92 30.786 -17.791 8.473 1.00 0.00 H new ATOM 0 HG12 ILE A 92 33.126 -16.704 9.544 1.00 0.00 H new ATOM 0 HG13 ILE A 92 32.286 -15.275 8.977 1.00 0.00 H new ATOM 0 HG21 ILE A 92 33.096 -18.632 8.198 1.00 0.00 H new ATOM 0 HG22 ILE A 92 32.257 -18.528 6.632 1.00 0.00 H new ATOM 0 HG23 ILE A 92 33.453 -17.290 7.084 1.00 0.00 H new ATOM 0 HD11 ILE A 92 31.611 -15.822 11.303 1.00 0.00 H new ATOM 0 HD12 ILE A 92 30.226 -15.984 10.198 1.00 0.00 H new ATOM 0 HD13 ILE A 92 31.079 -17.436 10.774 1.00 0.00 H new ATOM 1423 N ASP A 93 33.224 -15.492 6.673 1.00 0.00 N ATOM 1424 CA ASP A 93 34.354 -15.016 5.881 1.00 0.00 C ATOM 1425 C ASP A 93 34.072 -13.619 5.333 1.00 0.00 C ATOM 1426 O ASP A 93 33.353 -13.463 4.347 1.00 0.00 O ATOM 1427 CB ASP A 93 34.623 -15.976 4.719 1.00 0.00 C ATOM 1428 CG ASP A 93 35.474 -17.148 5.195 1.00 0.00 C ATOM 1429 OD1 ASP A 93 34.953 -17.973 5.929 1.00 0.00 O ATOM 1430 OD2 ASP A 93 36.632 -17.206 4.819 1.00 0.00 O ATOM 0 H ASP A 93 33.441 -15.677 7.652 1.00 0.00 H new ATOM 0 HA ASP A 93 35.232 -14.973 6.526 1.00 0.00 H new ATOM 0 HB2 ASP A 93 33.680 -16.342 4.314 1.00 0.00 H new ATOM 0 HB3 ASP A 93 35.134 -15.449 3.913 1.00 0.00 H new ATOM 1435 N LEU A 94 34.642 -12.606 5.981 1.00 0.00 N ATOM 1436 CA LEU A 94 34.442 -11.226 5.550 1.00 0.00 C ATOM 1437 C LEU A 94 35.382 -10.876 4.399 1.00 0.00 C ATOM 1438 O LEU A 94 35.778 -9.722 4.238 1.00 0.00 O ATOM 1439 CB LEU A 94 34.689 -10.273 6.721 1.00 0.00 C ATOM 1440 CG LEU A 94 33.361 -9.953 7.407 1.00 0.00 C ATOM 1441 CD1 LEU A 94 32.620 -11.254 7.722 1.00 0.00 C ATOM 1442 CD2 LEU A 94 33.630 -9.194 8.707 1.00 0.00 C ATOM 0 H LEU A 94 35.241 -12.713 6.800 1.00 0.00 H new ATOM 0 HA LEU A 94 33.413 -11.121 5.205 1.00 0.00 H new ATOM 0 HB2 LEU A 94 35.378 -10.726 7.433 1.00 0.00 H new ATOM 0 HB3 LEU A 94 35.157 -9.355 6.364 1.00 0.00 H new ATOM 0 HG LEU A 94 32.750 -9.339 6.745 1.00 0.00 H new ATOM 0 HD11 LEU A 94 31.673 -11.024 8.211 1.00 0.00 H new ATOM 0 HD12 LEU A 94 32.428 -11.797 6.796 1.00 0.00 H new ATOM 0 HD13 LEU A 94 33.230 -11.869 8.383 1.00 0.00 H new ATOM 0 HD21 LEU A 94 32.684 -8.965 9.197 1.00 0.00 H new ATOM 0 HD22 LEU A 94 34.241 -9.809 9.367 1.00 0.00 H new ATOM 0 HD23 LEU A 94 34.157 -8.266 8.484 1.00 0.00 H new ATOM 1454 N THR A 95 35.732 -11.878 3.599 1.00 0.00 N ATOM 1455 CA THR A 95 36.623 -11.665 2.464 1.00 0.00 C ATOM 1456 C THR A 95 36.004 -12.229 1.189 1.00 0.00 C ATOM 1457 O THR A 95 36.291 -11.762 0.086 1.00 0.00 O ATOM 1458 CB THR A 95 37.974 -12.337 2.722 1.00 0.00 C ATOM 1459 OG1 THR A 95 38.599 -12.631 1.481 1.00 0.00 O ATOM 1460 CG2 THR A 95 37.760 -13.631 3.508 1.00 0.00 C ATOM 0 H THR A 95 35.414 -12.840 3.714 1.00 0.00 H new ATOM 0 HA THR A 95 36.774 -10.593 2.339 1.00 0.00 H new ATOM 0 HB THR A 95 38.610 -11.666 3.299 1.00 0.00 H new ATOM 0 HG1 THR A 95 39.465 -13.060 1.644 1.00 0.00 H new ATOM 0 HG21 THR A 95 38.722 -14.109 3.691 1.00 0.00 H new ATOM 0 HG22 THR A 95 37.281 -13.403 4.460 1.00 0.00 H new ATOM 0 HG23 THR A 95 37.124 -14.305 2.934 1.00 0.00 H new ATOM 1468 N GLY A 96 35.151 -13.237 1.348 1.00 0.00 N ATOM 1469 CA GLY A 96 34.495 -13.859 0.203 1.00 0.00 C ATOM 1470 C GLY A 96 33.482 -12.909 -0.426 1.00 0.00 C ATOM 1471 O GLY A 96 33.167 -13.018 -1.611 1.00 0.00 O ATOM 0 H GLY A 96 34.899 -13.638 2.252 1.00 0.00 H new ATOM 0 HA2 GLY A 96 35.242 -14.144 -0.538 1.00 0.00 H new ATOM 0 HA3 GLY A 96 33.994 -14.774 0.519 1.00 0.00 H new ATOM 1475 N ASP A 97 32.974 -11.978 0.374 1.00 0.00 N ATOM 1476 CA ASP A 97 31.998 -11.014 -0.118 1.00 0.00 C ATOM 1477 C ASP A 97 32.346 -10.582 -1.538 1.00 0.00 C ATOM 1478 O ASP A 97 31.553 -10.758 -2.463 1.00 0.00 O ATOM 1479 CB ASP A 97 31.961 -9.790 0.799 1.00 0.00 C ATOM 1480 CG ASP A 97 33.289 -9.650 1.534 1.00 0.00 C ATOM 1481 OD1 ASP A 97 34.270 -9.319 0.888 1.00 0.00 O ATOM 1482 OD2 ASP A 97 33.308 -9.875 2.733 1.00 0.00 O ATOM 0 H ASP A 97 33.220 -11.871 1.358 1.00 0.00 H new ATOM 0 HA ASP A 97 31.016 -11.488 -0.124 1.00 0.00 H new ATOM 0 HB2 ASP A 97 31.764 -8.892 0.213 1.00 0.00 H new ATOM 0 HB3 ASP A 97 31.147 -9.888 1.517 1.00 0.00 H new ATOM 1487 N ASP A 98 33.539 -10.017 -1.704 1.00 0.00 N ATOM 1488 CA ASP A 98 33.985 -9.564 -3.016 1.00 0.00 C ATOM 1489 C ASP A 98 35.447 -9.946 -3.240 1.00 0.00 C ATOM 1490 O ASP A 98 36.252 -9.931 -2.308 1.00 0.00 O ATOM 1491 CB ASP A 98 33.826 -8.045 -3.125 1.00 0.00 C ATOM 1492 CG ASP A 98 32.844 -7.701 -4.241 1.00 0.00 C ATOM 1493 OD1 ASP A 98 31.820 -8.360 -4.328 1.00 0.00 O ATOM 1494 OD2 ASP A 98 33.129 -6.781 -4.990 1.00 0.00 O ATOM 0 H ASP A 98 34.210 -9.863 -0.951 1.00 0.00 H new ATOM 0 HA ASP A 98 33.373 -10.046 -3.778 1.00 0.00 H new ATOM 0 HB2 ASP A 98 33.469 -7.640 -2.178 1.00 0.00 H new ATOM 0 HB3 ASP A 98 34.793 -7.583 -3.325 1.00 0.00 H new ATOM 1499 N LYS A 99 35.783 -10.288 -4.480 1.00 0.00 N ATOM 1500 CA LYS A 99 37.152 -10.673 -4.811 1.00 0.00 C ATOM 1501 C LYS A 99 37.981 -9.444 -5.172 1.00 0.00 C ATOM 1502 O LYS A 99 39.078 -9.248 -4.648 1.00 0.00 O ATOM 1503 CB LYS A 99 37.150 -11.654 -5.985 1.00 0.00 C ATOM 1504 CG LYS A 99 36.591 -10.961 -7.229 1.00 0.00 C ATOM 1505 CD LYS A 99 36.035 -12.011 -8.193 1.00 0.00 C ATOM 1506 CE LYS A 99 34.510 -12.040 -8.091 1.00 0.00 C ATOM 1507 NZ LYS A 99 34.001 -13.334 -8.629 1.00 0.00 N ATOM 0 H LYS A 99 35.133 -10.307 -5.266 1.00 0.00 H new ATOM 0 HA LYS A 99 37.596 -11.153 -3.939 1.00 0.00 H new ATOM 0 HB2 LYS A 99 38.162 -12.009 -6.178 1.00 0.00 H new ATOM 0 HB3 LYS A 99 36.547 -12.528 -5.741 1.00 0.00 H new ATOM 0 HG2 LYS A 99 35.806 -10.260 -6.946 1.00 0.00 H new ATOM 0 HG3 LYS A 99 37.374 -10.382 -7.718 1.00 0.00 H new ATOM 0 HD2 LYS A 99 36.337 -11.779 -9.214 1.00 0.00 H new ATOM 0 HD3 LYS A 99 36.445 -12.992 -7.954 1.00 0.00 H new ATOM 0 HE2 LYS A 99 34.202 -11.919 -7.052 1.00 0.00 H new ATOM 0 HE3 LYS A 99 34.081 -11.208 -8.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 32.963 -13.355 -8.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 34.284 -13.431 -9.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 34.400 -14.120 -8.078 1.00 0.00 H new ATOM 1521 N ASP A 100 37.447 -8.618 -6.066 1.00 0.00 N ATOM 1522 CA ASP A 100 38.144 -7.409 -6.487 1.00 0.00 C ATOM 1523 C ASP A 100 38.538 -6.573 -5.274 1.00 0.00 C ATOM 1524 O ASP A 100 39.447 -5.746 -5.347 1.00 0.00 O ATOM 1525 CB ASP A 100 37.249 -6.581 -7.409 1.00 0.00 C ATOM 1526 CG ASP A 100 38.033 -5.403 -7.978 1.00 0.00 C ATOM 1527 OD1 ASP A 100 39.241 -5.525 -8.098 1.00 0.00 O ATOM 1528 OD2 ASP A 100 37.415 -4.396 -8.283 1.00 0.00 O ATOM 0 H ASP A 100 36.540 -8.762 -6.510 1.00 0.00 H new ATOM 0 HA ASP A 100 39.046 -7.701 -7.026 1.00 0.00 H new ATOM 0 HB2 ASP A 100 36.873 -7.204 -8.221 1.00 0.00 H new ATOM 0 HB3 ASP A 100 36.381 -6.219 -6.858 1.00 0.00 H new ATOM 1533 N ASP A 101 37.850 -6.798 -4.159 1.00 0.00 N ATOM 1534 CA ASP A 101 38.141 -6.059 -2.938 1.00 0.00 C ATOM 1535 C ASP A 101 39.549 -6.380 -2.448 1.00 0.00 C ATOM 1536 O ASP A 101 40.322 -5.479 -2.122 1.00 0.00 O ATOM 1537 CB ASP A 101 37.121 -6.411 -1.854 1.00 0.00 C ATOM 1538 CG ASP A 101 36.004 -5.372 -1.833 1.00 0.00 C ATOM 1539 OD1 ASP A 101 35.378 -5.184 -2.862 1.00 0.00 O ATOM 1540 OD2 ASP A 101 35.793 -4.779 -0.789 1.00 0.00 O ATOM 0 H ASP A 101 37.095 -7.479 -4.077 1.00 0.00 H new ATOM 0 HA ASP A 101 38.077 -4.992 -3.154 1.00 0.00 H new ATOM 0 HB2 ASP A 101 36.705 -7.401 -2.042 1.00 0.00 H new ATOM 0 HB3 ASP A 101 37.611 -6.451 -0.881 1.00 0.00 H new ATOM 1545 N LEU A 102 39.885 -7.666 -2.410 1.00 0.00 N ATOM 1546 CA LEU A 102 41.213 -8.073 -1.969 1.00 0.00 C ATOM 1547 C LEU A 102 42.234 -7.738 -3.036 1.00 0.00 C ATOM 1548 O LEU A 102 43.284 -7.163 -2.753 1.00 0.00 O ATOM 1549 CB LEU A 102 41.256 -9.575 -1.663 1.00 0.00 C ATOM 1550 CG LEU A 102 40.290 -9.923 -0.520 1.00 0.00 C ATOM 1551 CD1 LEU A 102 40.416 -8.897 0.610 1.00 0.00 C ATOM 1552 CD2 LEU A 102 38.850 -9.933 -1.042 1.00 0.00 C ATOM 0 H LEU A 102 39.267 -8.433 -2.675 1.00 0.00 H new ATOM 0 HA LEU A 102 41.450 -7.530 -1.054 1.00 0.00 H new ATOM 0 HB2 LEU A 102 40.990 -10.141 -2.556 1.00 0.00 H new ATOM 0 HB3 LEU A 102 42.270 -9.867 -1.391 1.00 0.00 H new ATOM 0 HG LEU A 102 40.544 -10.911 -0.135 1.00 0.00 H new ATOM 0 HD11 LEU A 102 39.726 -9.155 1.414 1.00 0.00 H new ATOM 0 HD12 LEU A 102 41.437 -8.900 0.992 1.00 0.00 H new ATOM 0 HD13 LEU A 102 40.175 -7.905 0.229 1.00 0.00 H new ATOM 0 HD21 LEU A 102 38.169 -10.180 -0.227 1.00 0.00 H new ATOM 0 HD22 LEU A 102 38.600 -8.949 -1.438 1.00 0.00 H new ATOM 0 HD23 LEU A 102 38.755 -10.677 -1.833 1.00 0.00 H new ATOM 1564 N GLN A 103 41.904 -8.078 -4.264 1.00 0.00 N ATOM 1565 CA GLN A 103 42.787 -7.780 -5.376 1.00 0.00 C ATOM 1566 C GLN A 103 43.281 -6.353 -5.226 1.00 0.00 C ATOM 1567 O GLN A 103 44.301 -5.961 -5.793 1.00 0.00 O ATOM 1568 CB GLN A 103 42.029 -7.920 -6.691 1.00 0.00 C ATOM 1569 CG GLN A 103 42.977 -8.418 -7.785 1.00 0.00 C ATOM 1570 CD GLN A 103 43.360 -9.872 -7.527 1.00 0.00 C ATOM 1571 OE1 GLN A 103 42.459 -10.705 -7.085 1.00 0.00 O flip ATOM 1572 NE2 GLN A 103 44.511 -10.257 -7.734 1.00 0.00 N flip ATOM 0 H GLN A 103 41.040 -8.556 -4.518 1.00 0.00 H new ATOM 0 HA GLN A 103 43.628 -8.473 -5.379 1.00 0.00 H new ATOM 0 HB2 GLN A 103 41.199 -8.617 -6.571 1.00 0.00 H new ATOM 0 HB3 GLN A 103 41.600 -6.960 -6.978 1.00 0.00 H new ATOM 0 HG2 GLN A 103 42.498 -8.328 -8.760 1.00 0.00 H new ATOM 0 HG3 GLN A 103 43.873 -7.797 -7.811 1.00 0.00 H new ATOM 0 HE21 GLN A 103 45.213 -9.603 -8.080 1.00 0.00 H new ATOM 0 HE22 GLN A 103 44.762 -11.230 -7.560 1.00 0.00 H new ATOM 1581 N ARG A 104 42.533 -5.589 -4.440 1.00 0.00 N ATOM 1582 CA ARG A 104 42.873 -4.195 -4.186 1.00 0.00 C ATOM 1583 C ARG A 104 43.861 -4.099 -3.032 1.00 0.00 C ATOM 1584 O ARG A 104 44.861 -3.385 -3.115 1.00 0.00 O ATOM 1585 CB ARG A 104 41.608 -3.400 -3.849 1.00 0.00 C ATOM 1586 CG ARG A 104 41.907 -1.902 -3.935 1.00 0.00 C ATOM 1587 CD ARG A 104 40.913 -1.238 -4.889 1.00 0.00 C ATOM 1588 NE ARG A 104 41.357 0.111 -5.220 1.00 0.00 N ATOM 1589 CZ ARG A 104 40.861 1.174 -4.595 1.00 0.00 C ATOM 1590 NH1 ARG A 104 39.956 1.026 -3.666 1.00 0.00 N ATOM 1591 NH2 ARG A 104 41.284 2.369 -4.908 1.00 0.00 N ATOM 0 H ARG A 104 41.688 -5.911 -3.968 1.00 0.00 H new ATOM 0 HA ARG A 104 43.331 -3.777 -5.083 1.00 0.00 H new ATOM 0 HB2 ARG A 104 40.807 -3.662 -4.540 1.00 0.00 H new ATOM 0 HB3 ARG A 104 41.261 -3.655 -2.848 1.00 0.00 H new ATOM 0 HG2 ARG A 104 41.837 -1.449 -2.946 1.00 0.00 H new ATOM 0 HG3 ARG A 104 42.926 -1.743 -4.287 1.00 0.00 H new ATOM 0 HD2 ARG A 104 40.819 -1.831 -5.799 1.00 0.00 H new ATOM 0 HD3 ARG A 104 39.925 -1.201 -4.429 1.00 0.00 H new ATOM 0 HE ARG A 104 42.062 0.241 -5.945 1.00 0.00 H new ATOM 0 HH11 ARG A 104 39.628 0.093 -3.418 1.00 0.00 H new ATOM 0 HH12 ARG A 104 39.577 1.844 -3.188 1.00 0.00 H new ATOM 0 HH21 ARG A 104 41.994 2.486 -5.631 1.00 0.00 H new ATOM 0 HH22 ARG A 104 40.904 3.186 -4.429 1.00 0.00 H new ATOM 1605 N ALA A 105 43.581 -4.833 -1.959 1.00 0.00 N ATOM 1606 CA ALA A 105 44.460 -4.830 -0.798 1.00 0.00 C ATOM 1607 C ALA A 105 45.884 -5.171 -1.225 1.00 0.00 C ATOM 1608 O ALA A 105 46.839 -4.492 -0.847 1.00 0.00 O ATOM 1609 CB ALA A 105 43.970 -5.852 0.230 1.00 0.00 C ATOM 0 H ALA A 105 42.760 -5.432 -1.871 1.00 0.00 H new ATOM 0 HA ALA A 105 44.449 -3.837 -0.348 1.00 0.00 H new ATOM 0 HB1 ALA A 105 44.633 -5.844 1.095 1.00 0.00 H new ATOM 0 HB2 ALA A 105 42.959 -5.595 0.545 1.00 0.00 H new ATOM 0 HB3 ALA A 105 43.969 -6.846 -0.217 1.00 0.00 H new ATOM 1615 N ILE A 106 46.015 -6.224 -2.028 1.00 0.00 N ATOM 1616 CA ILE A 106 47.324 -6.641 -2.514 1.00 0.00 C ATOM 1617 C ILE A 106 47.935 -5.543 -3.356 1.00 0.00 C ATOM 1618 O ILE A 106 49.023 -5.041 -3.073 1.00 0.00 O ATOM 1619 CB ILE A 106 47.199 -7.917 -3.349 1.00 0.00 C ATOM 1620 CG1 ILE A 106 46.172 -8.851 -2.707 1.00 0.00 C ATOM 1621 CG2 ILE A 106 48.556 -8.618 -3.417 1.00 0.00 C ATOM 1622 CD1 ILE A 106 46.626 -9.217 -1.291 1.00 0.00 C ATOM 0 H ILE A 106 45.237 -6.799 -2.353 1.00 0.00 H new ATOM 0 HA ILE A 106 47.967 -6.840 -1.656 1.00 0.00 H new ATOM 0 HB ILE A 106 46.873 -7.660 -4.357 1.00 0.00 H new ATOM 0 HG12 ILE A 106 45.196 -8.367 -2.673 1.00 0.00 H new ATOM 0 HG13 ILE A 106 46.060 -9.753 -3.308 1.00 0.00 H new ATOM 0 HG21 ILE A 106 48.467 -9.527 -4.012 1.00 0.00 H new ATOM 0 HG22 ILE A 106 49.286 -7.953 -3.878 1.00 0.00 H new ATOM 0 HG23 ILE A 106 48.884 -8.875 -2.410 1.00 0.00 H new ATOM 0 HD11 ILE A 106 45.893 -9.883 -0.835 1.00 0.00 H new ATOM 0 HD12 ILE A 106 47.593 -9.718 -1.337 1.00 0.00 H new ATOM 0 HD13 ILE A 106 46.716 -8.311 -0.692 1.00 0.00 H new ATOM 1634 N ALA A 107 47.210 -5.180 -4.387 1.00 0.00 N ATOM 1635 CA ALA A 107 47.648 -4.130 -5.296 1.00 0.00 C ATOM 1636 C ALA A 107 48.174 -2.939 -4.504 1.00 0.00 C ATOM 1637 O ALA A 107 49.216 -2.371 -4.831 1.00 0.00 O ATOM 1638 CB ALA A 107 46.485 -3.684 -6.184 1.00 0.00 C ATOM 0 H ALA A 107 46.309 -5.594 -4.624 1.00 0.00 H new ATOM 0 HA ALA A 107 48.447 -4.523 -5.925 1.00 0.00 H new ATOM 0 HB1 ALA A 107 46.824 -2.899 -6.860 1.00 0.00 H new ATOM 0 HB2 ALA A 107 46.125 -4.533 -6.765 1.00 0.00 H new ATOM 0 HB3 ALA A 107 45.677 -3.302 -5.560 1.00 0.00 H new ATOM 1644 N LEU A 108 47.445 -2.570 -3.455 1.00 0.00 N ATOM 1645 CA LEU A 108 47.846 -1.449 -2.614 1.00 0.00 C ATOM 1646 C LEU A 108 49.271 -1.652 -2.113 1.00 0.00 C ATOM 1647 O LEU A 108 50.055 -0.706 -2.042 1.00 0.00 O ATOM 1648 CB LEU A 108 46.893 -1.320 -1.423 1.00 0.00 C ATOM 1649 CG LEU A 108 46.290 0.087 -1.398 1.00 0.00 C ATOM 1650 CD1 LEU A 108 45.193 0.153 -0.334 1.00 0.00 C ATOM 1651 CD2 LEU A 108 47.383 1.105 -1.065 1.00 0.00 C ATOM 0 H LEU A 108 46.579 -3.028 -3.169 1.00 0.00 H new ATOM 0 HA LEU A 108 47.804 -0.535 -3.206 1.00 0.00 H new ATOM 0 HB2 LEU A 108 46.101 -2.065 -1.496 1.00 0.00 H new ATOM 0 HB3 LEU A 108 47.428 -1.514 -0.493 1.00 0.00 H new ATOM 0 HG LEU A 108 45.864 0.316 -2.375 1.00 0.00 H new ATOM 0 HD11 LEU A 108 44.763 1.155 -0.316 1.00 0.00 H new ATOM 0 HD12 LEU A 108 44.414 -0.572 -0.569 1.00 0.00 H new ATOM 0 HD13 LEU A 108 45.619 -0.077 0.643 1.00 0.00 H new ATOM 0 HD21 LEU A 108 46.954 2.107 -1.047 1.00 0.00 H new ATOM 0 HD22 LEU A 108 47.809 0.875 -0.088 1.00 0.00 H new ATOM 0 HD23 LEU A 108 48.166 1.059 -1.822 1.00 0.00 H new ATOM 1663 N SER A 109 49.601 -2.894 -1.769 1.00 0.00 N ATOM 1664 CA SER A 109 50.939 -3.204 -1.283 1.00 0.00 C ATOM 1665 C SER A 109 51.936 -3.173 -2.431 1.00 0.00 C ATOM 1666 O SER A 109 53.003 -2.570 -2.323 1.00 0.00 O ATOM 1667 CB SER A 109 50.956 -4.582 -0.618 1.00 0.00 C ATOM 1668 OG SER A 109 49.624 -4.972 -0.310 1.00 0.00 O ATOM 0 H SER A 109 48.968 -3.692 -1.817 1.00 0.00 H new ATOM 0 HA SER A 109 51.223 -2.452 -0.546 1.00 0.00 H new ATOM 0 HB2 SER A 109 51.417 -5.313 -1.282 1.00 0.00 H new ATOM 0 HB3 SER A 109 51.558 -4.553 0.290 1.00 0.00 H new ATOM 0 HG SER A 109 49.632 -5.855 0.115 1.00 0.00 H new ATOM 1674 N LEU A 110 51.576 -3.812 -3.535 1.00 0.00 N ATOM 1675 CA LEU A 110 52.446 -3.830 -4.700 1.00 0.00 C ATOM 1676 C LEU A 110 52.917 -2.416 -4.997 1.00 0.00 C ATOM 1677 O LEU A 110 53.897 -2.209 -5.714 1.00 0.00 O ATOM 1678 CB LEU A 110 51.692 -4.383 -5.909 1.00 0.00 C ATOM 1679 CG LEU A 110 52.158 -5.812 -6.198 1.00 0.00 C ATOM 1680 CD1 LEU A 110 53.660 -5.813 -6.494 1.00 0.00 C ATOM 1681 CD2 LEU A 110 51.877 -6.694 -4.980 1.00 0.00 C ATOM 0 H LEU A 110 50.698 -4.319 -3.648 1.00 0.00 H new ATOM 0 HA LEU A 110 53.305 -4.469 -4.496 1.00 0.00 H new ATOM 0 HB2 LEU A 110 50.619 -4.372 -5.717 1.00 0.00 H new ATOM 0 HB3 LEU A 110 51.867 -3.750 -6.779 1.00 0.00 H new ATOM 0 HG LEU A 110 51.620 -6.201 -7.062 1.00 0.00 H new ATOM 0 HD11 LEU A 110 53.990 -6.831 -6.699 1.00 0.00 H new ATOM 0 HD12 LEU A 110 53.860 -5.185 -7.362 1.00 0.00 H new ATOM 0 HD13 LEU A 110 54.201 -5.424 -5.632 1.00 0.00 H new ATOM 0 HD21 LEU A 110 52.208 -7.712 -5.184 1.00 0.00 H new ATOM 0 HD22 LEU A 110 52.415 -6.304 -4.116 1.00 0.00 H new ATOM 0 HD23 LEU A 110 50.807 -6.695 -4.771 1.00 0.00 H new ATOM 1693 N ALA A 111 52.203 -1.446 -4.437 1.00 0.00 N ATOM 1694 CA ALA A 111 52.541 -0.041 -4.640 1.00 0.00 C ATOM 1695 C ALA A 111 53.551 0.423 -3.597 1.00 0.00 C ATOM 1696 O ALA A 111 54.646 0.872 -3.938 1.00 0.00 O ATOM 1697 CB ALA A 111 51.282 0.815 -4.543 1.00 0.00 C ATOM 0 H ALA A 111 51.390 -1.605 -3.842 1.00 0.00 H new ATOM 0 HA ALA A 111 52.982 0.068 -5.631 1.00 0.00 H new ATOM 0 HB1 ALA A 111 51.542 1.863 -4.695 1.00 0.00 H new ATOM 0 HB2 ALA A 111 50.570 0.503 -5.307 1.00 0.00 H new ATOM 0 HB3 ALA A 111 50.834 0.692 -3.557 1.00 0.00 H new ATOM 1703 N GLU A 112 53.183 0.304 -2.324 1.00 0.00 N ATOM 1704 CA GLU A 112 54.079 0.710 -1.248 1.00 0.00 C ATOM 1705 C GLU A 112 55.466 0.136 -1.499 1.00 0.00 C ATOM 1706 O GLU A 112 56.473 0.673 -1.033 1.00 0.00 O ATOM 1707 CB GLU A 112 53.548 0.209 0.098 1.00 0.00 C ATOM 1708 CG GLU A 112 52.111 0.696 0.294 1.00 0.00 C ATOM 1709 CD GLU A 112 52.085 2.218 0.376 1.00 0.00 C ATOM 1710 OE1 GLU A 112 52.954 2.772 1.029 1.00 0.00 O ATOM 1711 OE2 GLU A 112 51.197 2.809 -0.216 1.00 0.00 O ATOM 0 H GLU A 112 52.283 -0.065 -2.016 1.00 0.00 H new ATOM 0 HA GLU A 112 54.134 1.798 -1.221 1.00 0.00 H new ATOM 0 HB2 GLU A 112 53.582 -0.880 0.132 1.00 0.00 H new ATOM 0 HB3 GLU A 112 54.180 0.573 0.908 1.00 0.00 H new ATOM 0 HG2 GLU A 112 51.487 0.357 -0.533 1.00 0.00 H new ATOM 0 HG3 GLU A 112 51.694 0.267 1.205 1.00 0.00 H new ATOM 1718 N SER A 113 55.506 -0.954 -2.256 1.00 0.00 N ATOM 1719 CA SER A 113 56.768 -1.599 -2.587 1.00 0.00 C ATOM 1720 C SER A 113 57.359 -0.970 -3.841 1.00 0.00 C ATOM 1721 O SER A 113 58.541 -0.629 -3.878 1.00 0.00 O ATOM 1722 CB SER A 113 56.553 -3.096 -2.811 1.00 0.00 C ATOM 1723 OG SER A 113 57.797 -3.709 -3.122 1.00 0.00 O ATOM 0 H SER A 113 54.682 -1.407 -2.650 1.00 0.00 H new ATOM 0 HA SER A 113 57.461 -1.462 -1.757 1.00 0.00 H new ATOM 0 HB2 SER A 113 56.124 -3.551 -1.918 1.00 0.00 H new ATOM 0 HB3 SER A 113 55.843 -3.255 -3.623 1.00 0.00 H new ATOM 0 HG SER A 113 57.662 -4.669 -3.265 1.00 0.00 H new ATOM 1729 N ASN A 114 56.524 -0.803 -4.864 1.00 0.00 N ATOM 1730 CA ASN A 114 56.982 -0.197 -6.106 1.00 0.00 C ATOM 1731 C ASN A 114 57.809 1.042 -5.792 1.00 0.00 C ATOM 1732 O ASN A 114 58.531 1.559 -6.644 1.00 0.00 O ATOM 1733 CB ASN A 114 55.785 0.186 -6.979 1.00 0.00 C ATOM 1734 CG ASN A 114 56.162 0.076 -8.454 1.00 0.00 C ATOM 1735 OD1 ASN A 114 56.222 1.084 -9.156 1.00 0.00 O ATOM 1736 ND2 ASN A 114 56.420 -1.096 -8.967 1.00 0.00 N ATOM 0 H ASN A 114 55.541 -1.075 -4.857 1.00 0.00 H new ATOM 0 HA ASN A 114 57.596 -0.916 -6.648 1.00 0.00 H new ATOM 0 HB2 ASN A 114 54.941 -0.468 -6.761 1.00 0.00 H new ATOM 0 HB3 ASN A 114 55.468 1.204 -6.751 1.00 0.00 H new ATOM 0 HD21 ASN A 114 56.672 -1.177 -9.952 1.00 0.00 H new ATOM 0 HD22 ASN A 114 56.370 -1.931 -8.383 1.00 0.00 H new ATOM 1743 N ARG A 115 57.703 1.503 -4.549 1.00 0.00 N ATOM 1744 CA ARG A 115 58.450 2.673 -4.105 1.00 0.00 C ATOM 1745 C ARG A 115 59.640 2.230 -3.263 1.00 0.00 C ATOM 1746 O ARG A 115 60.719 2.817 -3.333 1.00 0.00 O ATOM 1747 CB ARG A 115 57.550 3.591 -3.267 1.00 0.00 C ATOM 1748 CG ARG A 115 56.900 4.662 -4.154 1.00 0.00 C ATOM 1749 CD ARG A 115 55.634 4.096 -4.798 1.00 0.00 C ATOM 1750 NE ARG A 115 55.218 4.936 -5.915 1.00 0.00 N ATOM 1751 CZ ARG A 115 54.307 5.892 -5.758 1.00 0.00 C ATOM 1752 NH1 ARG A 115 53.759 6.088 -4.590 1.00 0.00 N ATOM 1753 NH2 ARG A 115 53.957 6.632 -6.774 1.00 0.00 N ATOM 0 H ARG A 115 57.108 1.085 -3.834 1.00 0.00 H new ATOM 0 HA ARG A 115 58.801 3.219 -4.981 1.00 0.00 H new ATOM 0 HB2 ARG A 115 56.778 3.001 -2.774 1.00 0.00 H new ATOM 0 HB3 ARG A 115 58.137 4.068 -2.482 1.00 0.00 H new ATOM 0 HG2 ARG A 115 56.655 5.542 -3.559 1.00 0.00 H new ATOM 0 HG3 ARG A 115 57.600 4.984 -4.925 1.00 0.00 H new ATOM 0 HD2 ARG A 115 55.818 3.080 -5.147 1.00 0.00 H new ATOM 0 HD3 ARG A 115 54.835 4.040 -4.059 1.00 0.00 H new ATOM 0 HE ARG A 115 55.634 4.787 -6.834 1.00 0.00 H new ATOM 0 HH11 ARG A 115 54.029 5.508 -3.796 1.00 0.00 H new ATOM 0 HH12 ARG A 115 53.060 6.822 -4.471 1.00 0.00 H new ATOM 0 HH21 ARG A 115 54.382 6.477 -7.688 1.00 0.00 H new ATOM 0 HH22 ARG A 115 53.258 7.365 -6.654 1.00 0.00 H new ATOM 1767 N ALA A 116 59.430 1.185 -2.468 1.00 0.00 N ATOM 1768 CA ALA A 116 60.487 0.660 -1.613 1.00 0.00 C ATOM 1769 C ALA A 116 61.181 -0.523 -2.284 1.00 0.00 C ATOM 1770 O ALA A 116 61.689 -1.419 -1.610 1.00 0.00 O ATOM 1771 CB ALA A 116 59.899 0.215 -0.273 1.00 0.00 C ATOM 0 H ALA A 116 58.542 0.688 -2.399 1.00 0.00 H new ATOM 0 HA ALA A 116 61.220 1.449 -1.445 1.00 0.00 H new ATOM 0 HB1 ALA A 116 60.694 -0.176 0.361 1.00 0.00 H new ATOM 0 HB2 ALA A 116 59.429 1.067 0.219 1.00 0.00 H new ATOM 0 HB3 ALA A 116 59.154 -0.563 -0.443 1.00 0.00 H new ATOM 1777 N PHE A 117 61.199 -0.520 -3.613 1.00 0.00 N ATOM 1778 CA PHE A 117 61.834 -1.601 -4.359 1.00 0.00 C ATOM 1779 C PHE A 117 63.201 -1.167 -4.880 1.00 0.00 C ATOM 1780 O PHE A 117 64.160 -1.939 -4.850 1.00 0.00 O ATOM 1781 CB PHE A 117 60.947 -2.016 -5.535 1.00 0.00 C ATOM 1782 CG PHE A 117 61.710 -2.966 -6.428 1.00 0.00 C ATOM 1783 CD1 PHE A 117 61.676 -4.343 -6.175 1.00 0.00 C ATOM 1784 CD2 PHE A 117 62.450 -2.470 -7.509 1.00 0.00 C ATOM 1785 CE1 PHE A 117 62.384 -5.224 -7.002 1.00 0.00 C ATOM 1786 CE2 PHE A 117 63.157 -3.352 -8.334 1.00 0.00 C ATOM 1787 CZ PHE A 117 63.124 -4.729 -8.081 1.00 0.00 C ATOM 0 H PHE A 117 60.785 0.211 -4.191 1.00 0.00 H new ATOM 0 HA PHE A 117 61.968 -2.448 -3.687 1.00 0.00 H new ATOM 0 HB2 PHE A 117 60.039 -2.494 -5.169 1.00 0.00 H new ATOM 0 HB3 PHE A 117 60.639 -1.137 -6.100 1.00 0.00 H new ATOM 0 HD1 PHE A 117 61.104 -4.725 -5.342 1.00 0.00 H new ATOM 0 HD2 PHE A 117 62.475 -1.408 -7.706 1.00 0.00 H new ATOM 0 HE1 PHE A 117 62.359 -6.286 -6.807 1.00 0.00 H new ATOM 0 HE2 PHE A 117 63.729 -2.970 -9.167 1.00 0.00 H new ATOM 0 HZ PHE A 117 63.670 -5.409 -8.719 1.00 0.00 H new ATOM 1797 N ARG A 118 63.282 0.070 -5.360 1.00 0.00 N ATOM 1798 CA ARG A 118 64.537 0.593 -5.888 1.00 0.00 C ATOM 1799 C ARG A 118 65.724 0.009 -5.129 1.00 0.00 C ATOM 1800 O ARG A 118 66.775 -0.255 -5.710 1.00 0.00 O ATOM 1801 CB ARG A 118 64.558 2.118 -5.776 1.00 0.00 C ATOM 1802 CG ARG A 118 63.873 2.545 -4.478 1.00 0.00 C ATOM 1803 CD ARG A 118 64.712 3.621 -3.789 1.00 0.00 C ATOM 1804 NE ARG A 118 65.040 4.685 -4.732 1.00 0.00 N ATOM 1805 CZ ARG A 118 64.280 5.772 -4.836 1.00 0.00 C ATOM 1806 NH1 ARG A 118 63.222 5.903 -4.083 1.00 0.00 N ATOM 1807 NH2 ARG A 118 64.593 6.709 -5.689 1.00 0.00 N ATOM 0 H ARG A 118 62.500 0.724 -5.394 1.00 0.00 H new ATOM 0 HA ARG A 118 64.614 0.306 -6.937 1.00 0.00 H new ATOM 0 HB2 ARG A 118 65.586 2.480 -5.793 1.00 0.00 H new ATOM 0 HB3 ARG A 118 64.049 2.563 -6.631 1.00 0.00 H new ATOM 0 HG2 ARG A 118 62.875 2.928 -4.690 1.00 0.00 H new ATOM 0 HG3 ARG A 118 63.752 1.686 -3.819 1.00 0.00 H new ATOM 0 HD2 ARG A 118 64.164 4.033 -2.941 1.00 0.00 H new ATOM 0 HD3 ARG A 118 65.627 3.181 -3.393 1.00 0.00 H new ATOM 0 HE ARG A 118 65.867 4.594 -5.322 1.00 0.00 H new ATOM 0 HH11 ARG A 118 62.978 5.172 -3.415 1.00 0.00 H new ATOM 0 HH12 ARG A 118 62.639 6.736 -4.163 1.00 0.00 H new ATOM 0 HH21 ARG A 118 65.421 6.608 -6.276 1.00 0.00 H new ATOM 0 HH22 ARG A 118 64.010 7.542 -5.768 1.00 0.00 H new ATOM 1821 N GLU A 119 65.547 -0.188 -3.825 1.00 0.00 N ATOM 1822 CA GLU A 119 66.611 -0.741 -2.995 1.00 0.00 C ATOM 1823 C GLU A 119 67.978 -0.398 -3.578 1.00 0.00 C ATOM 1824 O GLU A 119 68.783 -1.285 -3.862 1.00 0.00 O ATOM 1825 CB GLU A 119 66.461 -2.261 -2.898 1.00 0.00 C ATOM 1826 CG GLU A 119 66.810 -2.722 -1.482 1.00 0.00 C ATOM 1827 CD GLU A 119 67.221 -4.192 -1.497 1.00 0.00 C ATOM 1828 OE1 GLU A 119 66.604 -4.952 -2.225 1.00 0.00 O ATOM 1829 OE2 GLU A 119 68.146 -4.536 -0.781 1.00 0.00 O ATOM 0 H GLU A 119 64.684 0.025 -3.325 1.00 0.00 H new ATOM 0 HA GLU A 119 66.534 -0.305 -1.999 1.00 0.00 H new ATOM 0 HB2 GLU A 119 65.440 -2.552 -3.145 1.00 0.00 H new ATOM 0 HB3 GLU A 119 67.115 -2.748 -3.621 1.00 0.00 H new ATOM 0 HG2 GLU A 119 67.621 -2.113 -1.082 1.00 0.00 H new ATOM 0 HG3 GLU A 119 65.953 -2.582 -0.824 1.00 0.00 H new ATOM 1836 N THR A 120 68.231 0.894 -3.758 1.00 0.00 N ATOM 1837 CA THR A 120 69.502 1.348 -4.312 1.00 0.00 C ATOM 1838 C THR A 120 70.672 0.795 -3.501 1.00 0.00 C ATOM 1839 O THR A 120 70.619 0.745 -2.273 1.00 0.00 O ATOM 1840 CB THR A 120 69.553 2.878 -4.307 1.00 0.00 C ATOM 1841 OG1 THR A 120 70.871 3.306 -4.621 1.00 0.00 O ATOM 1842 CG2 THR A 120 69.157 3.400 -2.925 1.00 0.00 C ATOM 0 H THR A 120 67.577 1.642 -3.530 1.00 0.00 H new ATOM 0 HA THR A 120 69.582 0.983 -5.336 1.00 0.00 H new ATOM 0 HB THR A 120 68.858 3.268 -5.050 1.00 0.00 H new ATOM 0 HG1 THR A 120 70.906 4.285 -4.620 1.00 0.00 H new ATOM 0 HG21 THR A 120 69.194 4.489 -2.923 1.00 0.00 H new ATOM 0 HG22 THR A 120 68.145 3.071 -2.688 1.00 0.00 H new ATOM 0 HG23 THR A 120 69.849 3.012 -2.178 1.00 0.00 H new ATOM 1850 N GLY A 121 71.725 0.384 -4.200 1.00 0.00 N ATOM 1851 CA GLY A 121 72.904 -0.163 -3.538 1.00 0.00 C ATOM 1852 C GLY A 121 74.168 0.147 -4.334 1.00 0.00 C ATOM 1853 O GLY A 121 74.647 -0.686 -5.105 1.00 0.00 O ATOM 0 H GLY A 121 71.786 0.419 -5.218 1.00 0.00 H new ATOM 0 HA2 GLY A 121 72.989 0.255 -2.535 1.00 0.00 H new ATOM 0 HA3 GLY A 121 72.795 -1.242 -3.426 1.00 0.00 H new ATOM 1857 N ILE A 122 74.701 1.349 -4.143 1.00 0.00 N ATOM 1858 CA ILE A 122 75.909 1.759 -4.849 1.00 0.00 C ATOM 1859 C ILE A 122 77.028 2.069 -3.859 1.00 0.00 C ATOM 1860 O ILE A 122 76.774 2.522 -2.743 1.00 0.00 O ATOM 1861 CB ILE A 122 75.619 2.999 -5.698 1.00 0.00 C ATOM 1862 CG1 ILE A 122 76.577 3.036 -6.891 1.00 0.00 C ATOM 1863 CG2 ILE A 122 75.815 4.257 -4.850 1.00 0.00 C ATOM 1864 CD1 ILE A 122 76.516 4.413 -7.555 1.00 0.00 C ATOM 0 H ILE A 122 74.319 2.052 -3.510 1.00 0.00 H new ATOM 0 HA ILE A 122 76.227 0.941 -5.495 1.00 0.00 H new ATOM 0 HB ILE A 122 74.591 2.959 -6.057 1.00 0.00 H new ATOM 0 HG12 ILE A 122 77.594 2.825 -6.560 1.00 0.00 H new ATOM 0 HG13 ILE A 122 76.309 2.262 -7.610 1.00 0.00 H new ATOM 0 HG21 ILE A 122 75.608 5.140 -5.455 1.00 0.00 H new ATOM 0 HG22 ILE A 122 75.134 4.232 -4.000 1.00 0.00 H new ATOM 0 HG23 ILE A 122 76.843 4.297 -4.490 1.00 0.00 H new ATOM 0 HD11 ILE A 122 77.199 4.438 -8.404 1.00 0.00 H new ATOM 0 HD12 ILE A 122 75.500 4.606 -7.900 1.00 0.00 H new ATOM 0 HD13 ILE A 122 76.806 5.178 -6.834 1.00 0.00 H new ATOM 1876 N THR A 123 78.265 1.825 -4.278 1.00 0.00 N ATOM 1877 CA THR A 123 79.415 2.084 -3.418 1.00 0.00 C ATOM 1878 C THR A 123 79.474 3.560 -3.035 1.00 0.00 C ATOM 1879 O THR A 123 78.990 4.422 -3.768 1.00 0.00 O ATOM 1880 CB THR A 123 80.707 1.691 -4.138 1.00 0.00 C ATOM 1881 OG1 THR A 123 80.847 2.470 -5.318 1.00 0.00 O ATOM 1882 CG2 THR A 123 80.658 0.208 -4.506 1.00 0.00 C ATOM 0 H THR A 123 78.497 1.452 -5.199 1.00 0.00 H new ATOM 0 HA THR A 123 79.309 1.487 -2.512 1.00 0.00 H new ATOM 0 HB THR A 123 81.558 1.871 -3.481 1.00 0.00 H new ATOM 0 HG1 THR A 123 81.675 2.220 -5.779 1.00 0.00 H new ATOM 0 HG21 THR A 123 81.579 -0.070 -5.019 1.00 0.00 H new ATOM 0 HG22 THR A 123 80.553 -0.388 -3.600 1.00 0.00 H new ATOM 0 HG23 THR A 123 79.807 0.024 -5.162 1.00 0.00 H new ATOM 1890 N ASP A 124 80.072 3.842 -1.881 1.00 0.00 N ATOM 1891 CA ASP A 124 80.189 5.218 -1.410 1.00 0.00 C ATOM 1892 C ASP A 124 81.599 5.488 -0.893 1.00 0.00 C ATOM 1893 O ASP A 124 81.882 6.564 -0.363 1.00 0.00 O ATOM 1894 CB ASP A 124 79.173 5.476 -0.297 1.00 0.00 C ATOM 1895 CG ASP A 124 79.517 4.634 0.927 1.00 0.00 C ATOM 1896 OD1 ASP A 124 80.602 4.810 1.456 1.00 0.00 O ATOM 1897 OD2 ASP A 124 78.689 3.827 1.317 1.00 0.00 O ATOM 0 H ASP A 124 80.480 3.143 -1.260 1.00 0.00 H new ATOM 0 HA ASP A 124 79.988 5.889 -2.245 1.00 0.00 H new ATOM 0 HB2 ASP A 124 79.171 6.533 -0.033 1.00 0.00 H new ATOM 0 HB3 ASP A 124 78.169 5.233 -0.646 1.00 0.00 H new ATOM 1902 N GLU A 125 82.479 4.505 -1.051 1.00 0.00 N ATOM 1903 CA GLU A 125 83.858 4.645 -0.598 1.00 0.00 C ATOM 1904 C GLU A 125 84.648 5.531 -1.557 1.00 0.00 C ATOM 1905 O GLU A 125 85.591 6.213 -1.155 1.00 0.00 O ATOM 1906 CB GLU A 125 84.520 3.269 -0.507 1.00 0.00 C ATOM 1907 CG GLU A 125 84.201 2.634 0.848 1.00 0.00 C ATOM 1908 CD GLU A 125 85.057 3.272 1.937 1.00 0.00 C ATOM 1909 OE1 GLU A 125 86.263 3.329 1.758 1.00 0.00 O ATOM 1910 OE2 GLU A 125 84.495 3.692 2.935 1.00 0.00 O ATOM 0 H GLU A 125 82.264 3.608 -1.487 1.00 0.00 H new ATOM 0 HA GLU A 125 83.853 5.110 0.388 1.00 0.00 H new ATOM 0 HB2 GLU A 125 84.163 2.628 -1.313 1.00 0.00 H new ATOM 0 HB3 GLU A 125 85.599 3.365 -0.630 1.00 0.00 H new ATOM 0 HG2 GLU A 125 83.144 2.765 1.081 1.00 0.00 H new ATOM 0 HG3 GLU A 125 84.388 1.561 0.809 1.00 0.00 H new ATOM 1917 N GLU A 126 84.255 5.514 -2.826 1.00 0.00 N ATOM 1918 CA GLU A 126 84.932 6.317 -3.836 1.00 0.00 C ATOM 1919 C GLU A 126 84.826 7.802 -3.502 1.00 0.00 C ATOM 1920 O GLU A 126 85.825 8.521 -3.505 1.00 0.00 O ATOM 1921 CB GLU A 126 84.312 6.056 -5.211 1.00 0.00 C ATOM 1922 CG GLU A 126 85.175 6.701 -6.296 1.00 0.00 C ATOM 1923 CD GLU A 126 85.611 5.649 -7.311 1.00 0.00 C ATOM 1924 OE1 GLU A 126 84.877 5.431 -8.260 1.00 0.00 O ATOM 1925 OE2 GLU A 126 86.672 5.078 -7.124 1.00 0.00 O ATOM 0 H GLU A 126 83.476 4.957 -3.178 1.00 0.00 H new ATOM 0 HA GLU A 126 85.985 6.035 -3.851 1.00 0.00 H new ATOM 0 HB2 GLU A 126 84.231 4.983 -5.387 1.00 0.00 H new ATOM 0 HB3 GLU A 126 83.301 6.462 -5.248 1.00 0.00 H new ATOM 0 HG2 GLU A 126 84.614 7.490 -6.796 1.00 0.00 H new ATOM 0 HG3 GLU A 126 86.051 7.168 -5.846 1.00 0.00 H new ATOM 1932 N GLN A 127 83.610 8.255 -3.214 1.00 0.00 N ATOM 1933 CA GLN A 127 83.389 9.656 -2.879 1.00 0.00 C ATOM 1934 C GLN A 127 84.036 9.994 -1.540 1.00 0.00 C ATOM 1935 O GLN A 127 84.462 11.126 -1.314 1.00 0.00 O ATOM 1936 CB GLN A 127 81.889 9.948 -2.810 1.00 0.00 C ATOM 1937 CG GLN A 127 81.112 8.785 -3.428 1.00 0.00 C ATOM 1938 CD GLN A 127 79.635 9.146 -3.538 1.00 0.00 C ATOM 1939 OE1 GLN A 127 79.135 9.386 -4.636 1.00 0.00 O ATOM 1940 NE2 GLN A 127 78.904 9.199 -2.458 1.00 0.00 N ATOM 0 H GLN A 127 82.769 7.677 -3.206 1.00 0.00 H new ATOM 0 HA GLN A 127 83.843 10.271 -3.656 1.00 0.00 H new ATOM 0 HB2 GLN A 127 81.584 10.093 -1.774 1.00 0.00 H new ATOM 0 HB3 GLN A 127 81.663 10.873 -3.341 1.00 0.00 H new ATOM 0 HG2 GLN A 127 81.513 8.552 -4.415 1.00 0.00 H new ATOM 0 HG3 GLN A 127 81.232 7.891 -2.816 1.00 0.00 H new ATOM 0 HE21 GLN A 127 79.322 8.999 -1.549 1.00 0.00 H new ATOM 0 HE22 GLN A 127 77.915 9.440 -2.523 1.00 0.00 H new ATOM 1949 N ALA A 128 84.106 9.006 -0.654 1.00 0.00 N ATOM 1950 CA ALA A 128 84.706 9.213 0.659 1.00 0.00 C ATOM 1951 C ALA A 128 86.163 9.641 0.520 1.00 0.00 C ATOM 1952 O ALA A 128 86.590 10.630 1.114 1.00 0.00 O ATOM 1953 CB ALA A 128 84.627 7.925 1.480 1.00 0.00 C ATOM 0 H ALA A 128 83.758 8.062 -0.819 1.00 0.00 H new ATOM 0 HA ALA A 128 84.154 10.002 1.169 1.00 0.00 H new ATOM 0 HB1 ALA A 128 85.078 8.089 2.459 1.00 0.00 H new ATOM 0 HB2 ALA A 128 83.583 7.636 1.605 1.00 0.00 H new ATOM 0 HB3 ALA A 128 85.164 7.130 0.962 1.00 0.00 H new ATOM 1959 N ILE A 129 86.921 8.888 -0.269 1.00 0.00 N ATOM 1960 CA ILE A 129 88.331 9.195 -0.481 1.00 0.00 C ATOM 1961 C ILE A 129 88.492 10.586 -1.087 1.00 0.00 C ATOM 1962 O ILE A 129 89.158 11.449 -0.517 1.00 0.00 O ATOM 1963 CB ILE A 129 88.952 8.157 -1.416 1.00 0.00 C ATOM 1964 CG1 ILE A 129 89.306 6.899 -0.619 1.00 0.00 C ATOM 1965 CG2 ILE A 129 90.221 8.733 -2.050 1.00 0.00 C ATOM 1966 CD1 ILE A 129 89.521 5.730 -1.580 1.00 0.00 C ATOM 0 H ILE A 129 86.586 8.065 -0.770 1.00 0.00 H new ATOM 0 HA ILE A 129 88.839 9.170 0.483 1.00 0.00 H new ATOM 0 HB ILE A 129 88.238 7.902 -2.200 1.00 0.00 H new ATOM 0 HG12 ILE A 129 90.207 7.070 -0.030 1.00 0.00 H new ATOM 0 HG13 ILE A 129 88.506 6.664 0.084 1.00 0.00 H new ATOM 0 HG21 ILE A 129 90.663 7.992 -2.716 1.00 0.00 H new ATOM 0 HG22 ILE A 129 89.970 9.628 -2.618 1.00 0.00 H new ATOM 0 HG23 ILE A 129 90.935 8.989 -1.267 1.00 0.00 H new ATOM 0 HD11 ILE A 129 89.773 4.834 -1.013 1.00 0.00 H new ATOM 0 HD12 ILE A 129 88.608 5.554 -2.149 1.00 0.00 H new ATOM 0 HD13 ILE A 129 90.335 5.967 -2.265 1.00 0.00 H new ATOM 1978 N SER A 130 87.876 10.792 -2.246 1.00 0.00 N ATOM 1979 CA SER A 130 87.956 12.081 -2.924 1.00 0.00 C ATOM 1980 C SER A 130 87.768 13.221 -1.928 1.00 0.00 C ATOM 1981 O SER A 130 88.419 14.262 -2.030 1.00 0.00 O ATOM 1982 CB SER A 130 86.881 12.166 -4.007 1.00 0.00 C ATOM 1983 OG SER A 130 86.246 13.436 -3.940 1.00 0.00 O ATOM 0 H SER A 130 87.320 10.089 -2.733 1.00 0.00 H new ATOM 0 HA SER A 130 88.941 12.171 -3.381 1.00 0.00 H new ATOM 0 HB2 SER A 130 87.327 12.021 -4.991 1.00 0.00 H new ATOM 0 HB3 SER A 130 86.147 11.372 -3.870 1.00 0.00 H new ATOM 0 HG SER A 130 85.557 13.494 -4.635 1.00 0.00 H new ATOM 1989 N ARG A 131 86.874 13.017 -0.967 1.00 0.00 N ATOM 1990 CA ARG A 131 86.606 14.034 0.043 1.00 0.00 C ATOM 1991 C ARG A 131 87.869 14.343 0.839 1.00 0.00 C ATOM 1992 O ARG A 131 88.307 15.492 0.904 1.00 0.00 O ATOM 1993 CB ARG A 131 85.506 13.553 0.992 1.00 0.00 C ATOM 1994 CG ARG A 131 84.561 14.712 1.310 1.00 0.00 C ATOM 1995 CD ARG A 131 83.686 15.006 0.089 1.00 0.00 C ATOM 1996 NE ARG A 131 83.554 16.445 -0.103 1.00 0.00 N ATOM 1997 CZ ARG A 131 83.384 16.964 -1.315 1.00 0.00 C ATOM 1998 NH1 ARG A 131 83.337 16.182 -2.360 1.00 0.00 N ATOM 1999 NH2 ARG A 131 83.264 18.255 -1.460 1.00 0.00 N ATOM 0 H ARG A 131 86.326 12.163 -0.866 1.00 0.00 H new ATOM 0 HA ARG A 131 86.277 14.942 -0.462 1.00 0.00 H new ATOM 0 HB2 ARG A 131 84.951 12.733 0.536 1.00 0.00 H new ATOM 0 HB3 ARG A 131 85.947 13.168 1.911 1.00 0.00 H new ATOM 0 HG2 ARG A 131 83.936 14.461 2.167 1.00 0.00 H new ATOM 0 HG3 ARG A 131 85.134 15.598 1.582 1.00 0.00 H new ATOM 0 HD2 ARG A 131 84.125 14.552 -0.800 1.00 0.00 H new ATOM 0 HD3 ARG A 131 82.701 14.558 0.222 1.00 0.00 H new ATOM 0 HE ARG A 131 83.593 17.064 0.707 1.00 0.00 H new ATOM 0 HH11 ARG A 131 83.431 15.173 -2.246 1.00 0.00 H new ATOM 0 HH12 ARG A 131 83.207 16.581 -3.290 1.00 0.00 H new ATOM 0 HH21 ARG A 131 83.301 18.865 -0.644 1.00 0.00 H new ATOM 0 HH22 ARG A 131 83.134 18.654 -2.390 1.00 0.00 H new ATOM 2013 N VAL A 132 88.451 13.312 1.444 1.00 0.00 N ATOM 2014 CA VAL A 132 89.664 13.492 2.232 1.00 0.00 C ATOM 2015 C VAL A 132 90.650 14.392 1.493 1.00 0.00 C ATOM 2016 O VAL A 132 91.353 15.194 2.106 1.00 0.00 O ATOM 2017 CB VAL A 132 90.311 12.135 2.513 1.00 0.00 C ATOM 2018 CG1 VAL A 132 91.335 12.282 3.640 1.00 0.00 C ATOM 2019 CG2 VAL A 132 89.229 11.137 2.934 1.00 0.00 C ATOM 0 H VAL A 132 88.106 12.353 1.404 1.00 0.00 H new ATOM 0 HA VAL A 132 89.398 13.965 3.177 1.00 0.00 H new ATOM 0 HB VAL A 132 90.811 11.775 1.614 1.00 0.00 H new ATOM 0 HG11 VAL A 132 91.796 11.315 3.841 1.00 0.00 H new ATOM 0 HG12 VAL A 132 92.103 12.996 3.343 1.00 0.00 H new ATOM 0 HG13 VAL A 132 90.836 12.640 4.541 1.00 0.00 H new ATOM 0 HG21 VAL A 132 89.686 10.168 3.135 1.00 0.00 H new ATOM 0 HG22 VAL A 132 88.732 11.498 3.834 1.00 0.00 H new ATOM 0 HG23 VAL A 132 88.498 11.034 2.132 1.00 0.00 H new ATOM 2029 N LEU A 133 90.686 14.258 0.170 1.00 0.00 N ATOM 2030 CA LEU A 133 91.581 15.070 -0.648 1.00 0.00 C ATOM 2031 C LEU A 133 91.139 16.532 -0.611 1.00 0.00 C ATOM 2032 O LEU A 133 91.570 17.305 0.251 1.00 0.00 O ATOM 2033 CB LEU A 133 91.571 14.558 -2.091 1.00 0.00 C ATOM 2034 CG LEU A 133 92.907 13.882 -2.409 1.00 0.00 C ATOM 2035 CD1 LEU A 133 93.092 12.666 -1.502 1.00 0.00 C ATOM 2036 CD2 LEU A 133 92.912 13.430 -3.873 1.00 0.00 C ATOM 0 H LEU A 133 90.110 13.600 -0.355 1.00 0.00 H new ATOM 0 HA LEU A 133 92.593 14.996 -0.250 1.00 0.00 H new ATOM 0 HB2 LEU A 133 90.753 13.851 -2.230 1.00 0.00 H new ATOM 0 HB3 LEU A 133 91.398 15.385 -2.779 1.00 0.00 H new ATOM 0 HG LEU A 133 93.721 14.588 -2.241 1.00 0.00 H new ATOM 0 HD11 LEU A 133 94.043 12.185 -1.728 1.00 0.00 H new ATOM 0 HD12 LEU A 133 93.086 12.985 -0.460 1.00 0.00 H new ATOM 0 HD13 LEU A 133 92.279 11.960 -1.670 1.00 0.00 H new ATOM 0 HD21 LEU A 133 93.863 12.948 -4.102 1.00 0.00 H new ATOM 0 HD22 LEU A 133 92.098 12.724 -4.039 1.00 0.00 H new ATOM 0 HD23 LEU A 133 92.779 14.296 -4.522 1.00 0.00 H new ATOM 2048 N GLU A 134 90.265 16.907 -1.538 1.00 0.00 N ATOM 2049 CA GLU A 134 89.770 18.277 -1.574 1.00 0.00 C ATOM 2050 C GLU A 134 89.675 18.816 -0.158 1.00 0.00 C ATOM 2051 O GLU A 134 90.176 19.894 0.127 1.00 0.00 O ATOM 2052 CB GLU A 134 88.397 18.325 -2.244 1.00 0.00 C ATOM 2053 CG GLU A 134 88.575 18.437 -3.761 1.00 0.00 C ATOM 2054 CD GLU A 134 87.221 18.335 -4.456 1.00 0.00 C ATOM 2055 OE1 GLU A 134 86.453 17.461 -4.089 1.00 0.00 O ATOM 2056 OE2 GLU A 134 86.975 19.131 -5.347 1.00 0.00 O ATOM 0 H GLU A 134 89.890 16.294 -2.262 1.00 0.00 H new ATOM 0 HA GLU A 134 90.460 18.892 -2.151 1.00 0.00 H new ATOM 0 HB2 GLU A 134 87.829 17.428 -1.999 1.00 0.00 H new ATOM 0 HB3 GLU A 134 87.827 19.175 -1.870 1.00 0.00 H new ATOM 0 HG2 GLU A 134 89.050 19.386 -4.010 1.00 0.00 H new ATOM 0 HG3 GLU A 134 89.236 17.647 -4.117 1.00 0.00 H new ATOM 2063 N ALA A 135 89.046 18.052 0.731 1.00 0.00 N ATOM 2064 CA ALA A 135 88.917 18.474 2.120 1.00 0.00 C ATOM 2065 C ALA A 135 90.189 19.185 2.568 1.00 0.00 C ATOM 2066 O ALA A 135 90.193 20.398 2.776 1.00 0.00 O ATOM 2067 CB ALA A 135 88.665 17.261 3.017 1.00 0.00 C ATOM 0 H ALA A 135 88.623 17.149 0.517 1.00 0.00 H new ATOM 0 HA ALA A 135 88.074 19.160 2.201 1.00 0.00 H new ATOM 0 HB1 ALA A 135 88.570 17.588 4.053 1.00 0.00 H new ATOM 0 HB2 ALA A 135 87.745 16.764 2.708 1.00 0.00 H new ATOM 0 HB3 ALA A 135 89.500 16.565 2.931 1.00 0.00 H new ATOM 2073 N SER A 136 91.272 18.424 2.698 1.00 0.00 N ATOM 2074 CA SER A 136 92.550 18.997 3.102 1.00 0.00 C ATOM 2075 C SER A 136 93.086 19.890 1.991 1.00 0.00 C ATOM 2076 O SER A 136 94.241 20.302 2.020 1.00 0.00 O ATOM 2077 CB SER A 136 93.558 17.885 3.398 1.00 0.00 C ATOM 2078 OG SER A 136 94.783 18.175 2.738 1.00 0.00 O ATOM 0 H SER A 136 91.290 17.418 2.531 1.00 0.00 H new ATOM 0 HA SER A 136 92.401 19.589 4.005 1.00 0.00 H new ATOM 0 HB2 SER A 136 93.721 17.802 4.473 1.00 0.00 H new ATOM 0 HB3 SER A 136 93.168 16.925 3.060 1.00 0.00 H new ATOM 0 HG SER A 136 95.035 19.106 2.910 1.00 0.00 H new ATOM 2084 N ILE A 137 92.221 20.161 1.013 1.00 0.00 N ATOM 2085 CA ILE A 137 92.557 20.994 -0.147 1.00 0.00 C ATOM 2086 C ILE A 137 93.448 20.227 -1.110 1.00 0.00 C ATOM 2087 O ILE A 137 94.425 20.753 -1.643 1.00 0.00 O ATOM 2088 CB ILE A 137 93.185 22.330 0.283 1.00 0.00 C ATOM 2089 CG1 ILE A 137 94.725 22.284 0.218 1.00 0.00 C ATOM 2090 CG2 ILE A 137 92.720 22.672 1.702 1.00 0.00 C ATOM 2091 CD1 ILE A 137 95.323 23.185 1.304 1.00 0.00 C ATOM 0 H ILE A 137 91.264 19.809 1.001 1.00 0.00 H new ATOM 0 HA ILE A 137 91.634 21.239 -0.673 1.00 0.00 H new ATOM 0 HB ILE A 137 92.856 23.104 -0.410 1.00 0.00 H new ATOM 0 HG12 ILE A 137 95.072 21.260 0.352 1.00 0.00 H new ATOM 0 HG13 ILE A 137 95.066 22.610 -0.765 1.00 0.00 H new ATOM 0 HG21 ILE A 137 93.163 23.619 2.012 1.00 0.00 H new ATOM 0 HG22 ILE A 137 91.633 22.757 1.718 1.00 0.00 H new ATOM 0 HG23 ILE A 137 93.033 21.884 2.387 1.00 0.00 H new ATOM 0 HD11 ILE A 137 96.411 23.146 1.251 1.00 0.00 H new ATOM 0 HD12 ILE A 137 94.988 24.211 1.150 1.00 0.00 H new ATOM 0 HD13 ILE A 137 94.995 22.839 2.285 1.00 0.00 H new ATOM 2103 N ALA A 138 93.069 18.974 -1.332 1.00 0.00 N ATOM 2104 CA ALA A 138 93.802 18.085 -2.241 1.00 0.00 C ATOM 2105 C ALA A 138 95.022 18.777 -2.840 1.00 0.00 C ATOM 2106 O ALA A 138 96.162 18.414 -2.546 1.00 0.00 O ATOM 2107 CB ALA A 138 92.885 17.626 -3.376 1.00 0.00 C ATOM 0 H ALA A 138 92.254 18.544 -0.895 1.00 0.00 H new ATOM 0 HA ALA A 138 94.140 17.227 -1.659 1.00 0.00 H new ATOM 0 HB1 ALA A 138 93.437 16.967 -4.046 1.00 0.00 H new ATOM 0 HB2 ALA A 138 92.032 17.089 -2.960 1.00 0.00 H new ATOM 0 HB3 ALA A 138 92.531 18.494 -3.932 1.00 0.00 H new ATOM 2113 N GLU A 139 94.773 19.768 -3.690 1.00 0.00 N ATOM 2114 CA GLU A 139 95.852 20.503 -4.338 1.00 0.00 C ATOM 2115 C GLU A 139 96.310 21.673 -3.474 1.00 0.00 C ATOM 2116 O GLU A 139 95.493 22.372 -2.876 1.00 0.00 O ATOM 2117 CB GLU A 139 95.371 21.034 -5.687 1.00 0.00 C ATOM 2118 CG GLU A 139 95.736 20.039 -6.788 1.00 0.00 C ATOM 2119 CD GLU A 139 97.235 20.091 -7.062 1.00 0.00 C ATOM 2120 OE1 GLU A 139 97.862 21.048 -6.637 1.00 0.00 O ATOM 2121 OE2 GLU A 139 97.735 19.174 -7.694 1.00 0.00 O ATOM 0 H GLU A 139 93.836 20.080 -3.945 1.00 0.00 H new ATOM 0 HA GLU A 139 96.692 19.823 -4.481 1.00 0.00 H new ATOM 0 HB2 GLU A 139 94.292 21.188 -5.665 1.00 0.00 H new ATOM 0 HB3 GLU A 139 95.827 22.002 -5.892 1.00 0.00 H new ATOM 0 HG2 GLU A 139 95.447 19.031 -6.489 1.00 0.00 H new ATOM 0 HG3 GLU A 139 95.183 20.272 -7.698 1.00 0.00 H new ATOM 2128 N ASN A 140 97.621 21.887 -3.421 1.00 0.00 N ATOM 2129 CA ASN A 140 98.174 22.981 -2.633 1.00 0.00 C ATOM 2130 C ASN A 140 99.186 23.773 -3.454 1.00 0.00 C ATOM 2131 O ASN A 140 100.314 24.000 -3.016 1.00 0.00 O ATOM 2132 CB ASN A 140 98.852 22.429 -1.378 1.00 0.00 C ATOM 2133 CG ASN A 140 99.656 21.180 -1.726 1.00 0.00 C ATOM 2134 OD1 ASN A 140 99.387 20.529 -2.736 1.00 0.00 O ATOM 2135 ND2 ASN A 140 100.631 20.805 -0.944 1.00 0.00 N ATOM 0 H ASN A 140 98.315 21.322 -3.910 1.00 0.00 H new ATOM 0 HA ASN A 140 97.359 23.644 -2.343 1.00 0.00 H new ATOM 0 HB2 ASN A 140 99.508 23.185 -0.946 1.00 0.00 H new ATOM 0 HB3 ASN A 140 98.102 22.190 -0.624 1.00 0.00 H new ATOM 0 HD21 ASN A 140 101.173 19.970 -1.169 1.00 0.00 H new ATOM 0 HD22 ASN A 140 100.851 21.346 -0.108 1.00 0.00 H new ATOM 2142 N LYS A 141 98.776 24.191 -4.647 1.00 0.00 N ATOM 2143 CA LYS A 141 99.654 24.957 -5.524 1.00 0.00 C ATOM 2144 C LYS A 141 99.873 26.360 -4.968 1.00 0.00 C ATOM 2145 O LYS A 141 100.421 26.528 -3.878 1.00 0.00 O ATOM 2146 CB LYS A 141 99.042 25.050 -6.924 1.00 0.00 C ATOM 2147 CG LYS A 141 100.080 25.599 -7.904 1.00 0.00 C ATOM 2148 CD LYS A 141 99.921 24.901 -9.258 1.00 0.00 C ATOM 2149 CE LYS A 141 100.868 25.536 -10.276 1.00 0.00 C ATOM 2150 NZ LYS A 141 100.760 27.020 -10.195 1.00 0.00 N ATOM 0 H LYS A 141 97.846 24.013 -5.027 1.00 0.00 H new ATOM 0 HA LYS A 141 100.615 24.447 -5.582 1.00 0.00 H new ATOM 0 HB2 LYS A 141 98.704 24.066 -7.250 1.00 0.00 H new ATOM 0 HB3 LYS A 141 98.166 25.698 -6.906 1.00 0.00 H new ATOM 0 HG2 LYS A 141 99.953 26.675 -8.020 1.00 0.00 H new ATOM 0 HG3 LYS A 141 101.085 25.437 -7.515 1.00 0.00 H new ATOM 0 HD2 LYS A 141 100.138 23.838 -9.158 1.00 0.00 H new ATOM 0 HD3 LYS A 141 98.890 24.985 -9.603 1.00 0.00 H new ATOM 0 HE2 LYS A 141 101.894 25.224 -10.079 1.00 0.00 H new ATOM 0 HE3 LYS A 141 100.619 25.197 -11.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 101.151 27.444 -11.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 99.761 27.291 -10.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 101.293 27.362 -9.370 1.00 0.00 H new ATOM 2164 N ALA A 142 99.440 27.363 -5.723 1.00 0.00 N ATOM 2165 CA ALA A 142 99.590 28.750 -5.298 1.00 0.00 C ATOM 2166 C ALA A 142 100.956 28.968 -4.653 1.00 0.00 C ATOM 2167 O ALA A 142 101.904 28.227 -4.916 1.00 0.00 O ATOM 2168 CB ALA A 142 98.487 29.110 -4.300 1.00 0.00 C ATOM 0 H ALA A 142 98.985 27.243 -6.628 1.00 0.00 H new ATOM 0 HA ALA A 142 99.510 29.392 -6.175 1.00 0.00 H new ATOM 0 HB1 ALA A 142 98.605 30.147 -3.986 1.00 0.00 H new ATOM 0 HB2 ALA A 142 97.513 28.982 -4.772 1.00 0.00 H new ATOM 0 HB3 ALA A 142 98.557 28.458 -3.430 1.00 0.00 H new ATOM 2174 N CYS A 143 101.048 29.987 -3.805 1.00 0.00 N ATOM 2175 CA CYS A 143 102.302 30.294 -3.126 1.00 0.00 C ATOM 2176 C CYS A 143 103.407 30.576 -4.139 1.00 0.00 C ATOM 2177 O CYS A 143 103.657 31.729 -4.494 1.00 0.00 O ATOM 2178 CB CYS A 143 102.712 29.119 -2.236 1.00 0.00 C ATOM 2179 SG CYS A 143 104.313 29.472 -1.468 1.00 0.00 S ATOM 0 H CYS A 143 100.275 30.611 -3.572 1.00 0.00 H new ATOM 0 HA CYS A 143 102.153 31.183 -2.513 1.00 0.00 H new ATOM 0 HB2 CYS A 143 101.957 28.951 -1.468 1.00 0.00 H new ATOM 0 HB3 CYS A 143 102.774 28.206 -2.827 1.00 0.00 H new ATOM 0 HG CYS A 143 104.660 28.474 -0.710 1.00 0.00 H new ATOM 2185 N LEU A 144 104.063 29.519 -4.602 1.00 0.00 N ATOM 2186 CA LEU A 144 105.140 29.667 -5.575 1.00 0.00 C ATOM 2187 C LEU A 144 104.628 30.359 -6.835 1.00 0.00 C ATOM 2188 O LEU A 144 103.770 29.830 -7.540 1.00 0.00 O ATOM 2189 CB LEU A 144 105.708 28.293 -5.938 1.00 0.00 C ATOM 2190 CG LEU A 144 107.130 28.162 -5.386 1.00 0.00 C ATOM 2191 CD1 LEU A 144 108.008 29.277 -5.959 1.00 0.00 C ATOM 2192 CD2 LEU A 144 107.095 28.275 -3.860 1.00 0.00 C ATOM 0 H LEU A 144 103.871 28.557 -4.323 1.00 0.00 H new ATOM 0 HA LEU A 144 105.926 30.278 -5.132 1.00 0.00 H new ATOM 0 HB2 LEU A 144 105.074 27.507 -5.528 1.00 0.00 H new ATOM 0 HB3 LEU A 144 105.714 28.165 -7.020 1.00 0.00 H new ATOM 0 HG LEU A 144 107.542 27.194 -5.672 1.00 0.00 H new ATOM 0 HD11 LEU A 144 109.020 29.182 -5.565 1.00 0.00 H new ATOM 0 HD12 LEU A 144 108.033 29.198 -7.046 1.00 0.00 H new ATOM 0 HD13 LEU A 144 107.597 30.246 -5.675 1.00 0.00 H new ATOM 0 HD21 LEU A 144 108.107 28.182 -3.465 1.00 0.00 H new ATOM 0 HD22 LEU A 144 106.682 29.243 -3.576 1.00 0.00 H new ATOM 0 HD23 LEU A 144 106.471 27.481 -3.451 1.00 0.00 H new ATOM 2204 N LYS A 145 105.162 31.544 -7.110 1.00 0.00 N ATOM 2205 CA LYS A 145 104.751 32.300 -8.287 1.00 0.00 C ATOM 2206 C LYS A 145 105.788 33.368 -8.630 1.00 0.00 C ATOM 2207 O LYS A 145 105.621 34.122 -9.587 1.00 0.00 O ATOM 2208 CB LYS A 145 103.396 32.963 -8.035 1.00 0.00 C ATOM 2209 CG LYS A 145 102.900 33.622 -9.323 1.00 0.00 C ATOM 2210 CD LYS A 145 101.389 33.846 -9.234 1.00 0.00 C ATOM 2211 CE LYS A 145 101.079 34.768 -8.055 1.00 0.00 C ATOM 2212 NZ LYS A 145 99.625 35.094 -8.049 1.00 0.00 N ATOM 0 H LYS A 145 105.875 31.999 -6.539 1.00 0.00 H new ATOM 0 HA LYS A 145 104.667 31.610 -9.127 1.00 0.00 H new ATOM 0 HB2 LYS A 145 102.675 32.221 -7.693 1.00 0.00 H new ATOM 0 HB3 LYS A 145 103.486 33.708 -7.245 1.00 0.00 H new ATOM 0 HG2 LYS A 145 103.411 34.573 -9.477 1.00 0.00 H new ATOM 0 HG3 LYS A 145 103.135 32.991 -10.180 1.00 0.00 H new ATOM 0 HD2 LYS A 145 101.021 34.287 -10.161 1.00 0.00 H new ATOM 0 HD3 LYS A 145 100.876 32.892 -9.108 1.00 0.00 H new ATOM 0 HE2 LYS A 145 101.358 34.285 -7.119 1.00 0.00 H new ATOM 0 HE3 LYS A 145 101.667 35.682 -8.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 99.413 35.721 -7.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 99.373 35.571 -8.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 99.073 34.217 -7.958 1.00 0.00 H new ATOM 2226 N ARG A 146 106.856 33.423 -7.841 1.00 0.00 N ATOM 2227 CA ARG A 146 107.913 34.400 -8.071 1.00 0.00 C ATOM 2228 C ARG A 146 109.199 33.978 -7.367 1.00 0.00 C ATOM 2229 O ARG A 146 109.201 32.916 -6.766 1.00 0.00 O ATOM 2230 CB ARG A 146 107.475 35.774 -7.558 1.00 0.00 C ATOM 2231 CG ARG A 146 107.626 35.828 -6.036 1.00 0.00 C ATOM 2232 CD ARG A 146 107.053 37.147 -5.512 1.00 0.00 C ATOM 2233 NE ARG A 146 107.991 37.774 -4.587 1.00 0.00 N ATOM 2234 CZ ARG A 146 107.727 38.955 -4.037 1.00 0.00 C ATOM 2235 NH1 ARG A 146 106.617 39.579 -4.327 1.00 0.00 N ATOM 2236 NH2 ARG A 146 108.578 39.492 -3.206 1.00 0.00 N ATOM 2237 OXT ARG A 146 110.164 34.720 -7.440 1.00 0.00 O ATOM 0 H ARG A 146 107.012 32.807 -7.043 1.00 0.00 H new ATOM 0 HA ARG A 146 108.102 34.455 -9.143 1.00 0.00 H new ATOM 0 HB2 ARG A 146 108.078 36.555 -8.021 1.00 0.00 H new ATOM 0 HB3 ARG A 146 106.439 35.964 -7.837 1.00 0.00 H new ATOM 0 HG2 ARG A 146 107.106 34.986 -5.578 1.00 0.00 H new ATOM 0 HG3 ARG A 146 108.677 35.741 -5.761 1.00 0.00 H new ATOM 0 HD2 ARG A 146 106.849 37.819 -6.345 1.00 0.00 H new ATOM 0 HD3 ARG A 146 106.103 36.965 -5.010 1.00 0.00 H new ATOM 0 HE ARG A 146 108.864 37.298 -4.359 1.00 0.00 H new ATOM 0 HH11 ARG A 146 105.951 39.160 -4.976 1.00 0.00 H new ATOM 0 HH12 ARG A 146 106.416 40.485 -3.904 1.00 0.00 H new ATOM 0 HH21 ARG A 146 109.445 39.006 -2.979 1.00 0.00 H new ATOM 0 HH22 ARG A 146 108.376 40.398 -2.784 1.00 0.00 H new TER 2251 ARG A 146