USER MOD reduce.3.24.130724 H: found=0, std=0, add=1209, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1208 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 NoAdj-H: A 67 LYS HZ1 : A 67 LYS NZ : A 60 PHE CE1 :(NH2R) USER MOD NoAdj-H: A 67 LYS HZ3 : A 67 LYS NZ : A 60 PHE CE1 :(NH2R) USER MOD Set 1.1: A 161 SER OG : rot 29:sc= -3.91! USER MOD Set 1.2: A 163 LYS NZ :NH3+ 166:sc= -0.397! (180deg=0) USER MOD Set 2.1: A 70 ASN : amide:sc= -14.3! C(o=-14!,f=-21!) USER MOD Set 2.2: A 100 THR OG1 : rot -165:sc= 0.86 USER MOD Set 2.3: A 101 SER OG : rot 180:sc= -0.125 USER MOD Set 3.1: A 75 ASN : amide:sc= -26.4! C(o=-30!,f=-35!) USER MOD Set 3.2: A 96 LYS NZ :NH3+ -113:sc= -3.9! (180deg=-0.0365) USER MOD Set 4.1: A 87 THR OG1 : rot 8:sc= 0.263 USER MOD Set 4.2: A 106 ASN : amide:sc= -38.9! C(o=-39!,f=-40!) USER MOD Set 5.1: A 79 ASN : amide:sc= 0.0622 K(o=-3.7,f=-9.3) USER MOD Set 5.2: A 83 ASN :FLIP amide:sc= -3.8! C(o=-7.2!,f=-3.7!) USER MOD Set 6.1: A 10 THR OG1 : rot -23:sc= 1.07 USER MOD Set 6.2: A 15 ASN :FLIP amide:sc= -4.83! C(o=-7.8!,f=-3.8!) USER MOD Single : A 6 HIS :FLIP no HD1:sc= -24.9! C(o=-33!,f=-25!) USER MOD Single : A 11 THR OG1 : rot -130:sc= -1.49! USER MOD Single : A 12 SER OG : rot 140:sc= -2.69! USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 GLN : amide:sc= -0.408 X(o=-0.41,f=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot -101:sc= 0.0571 USER MOD Single : A 30 GLN : amide:sc= -0.182 X(o=-0.18,f=-0.19) USER MOD Single : A 31 ASN :FLIP amide:sc= -7.94! C(o=-8.8!,f=-7.9!) USER MOD Single : A 35 TYR OH : rot 110:sc= -0.151 USER MOD Single : A 37 ASN : amide:sc= -11.9! C(o=-12!,f=-23!) USER MOD Single : A 38 SER OG : rot -99:sc= 0.12 USER MOD Single : A 41 TYR OH : rot -119:sc= 1.23 USER MOD Single : A 42 ASN : amide:sc= -11.6! C(o=-12!,f=-24!) USER MOD Single : A 43 ASN :FLIP amide:sc= -2.57! C(o=-7!,f=-2.6!) USER MOD Single : A 44 THR OG1 : rot 180:sc= -3.7! USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 HIS : no HD1:sc= -26.9! C(o=-27!,f=-33!) USER MOD Single : A 54 MET CE :methyl 144:sc= -0.289 (180deg=-1.1) USER MOD Single : A 56 GLN :FLIP amide:sc= -0.652 F(o=-1.4,f=-0.65) USER MOD Single : A 61 THR OG1 : rot 77:sc= 0.778 USER MOD Single : A 63 GLN : amide:sc= -0.236 X(o=-0.24,f=0) USER MOD Single : A 64 MET CE :methyl 164:sc= -0.923 (180deg=-1.39) USER MOD Single : A 65 GLN : amide:sc= -12.4! C(o=-12!,f=-19!) USER MOD Single : A 66 GLN : amide:sc= -1.83! C(o=-1.8!,f=-1.6!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 4:sc= 0.487 USER MOD Single : A 90 MET CE :methyl 157:sc= -14.7! (180deg=-17.4!) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= -0.761 K(o=-0.76,f=-2.5) USER MOD Single : A 110 ASN : amide:sc= -17.4! C(o=-17!,f=-23!) USER MOD Single : A 115 HIS : +bothHN:sc= -40.2! C(o=-40!,f=-43!) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ -144:sc= -6.48! (180deg=-6.68!) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 MET CE :methyl -171:sc= -22.4! (180deg=-22.6!) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot 66:sc= -5.21! USER MOD Single : A 140 GLN : amide:sc= -17.9! C(o=-18!,f=-29!) USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 HIS :FLIP no HE2:sc= -2.59! C(o=-14!,f=-2.6!) USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 GLN : amide:sc= -19.7! C(o=-20!,f=-32!) USER MOD Single : A 151 ASN :FLIP amide:sc=-0.00506 F(o=-1.7!,f=-0.0051) USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 54 N PRO A 5 10.958 -5.340 9.337 1.00 0.00 N ATOM 55 CA PRO A 5 10.450 -4.447 8.286 1.00 0.00 C ATOM 56 C PRO A 5 8.989 -4.102 8.567 1.00 0.00 C ATOM 57 O PRO A 5 8.127 -4.984 8.609 1.00 0.00 O ATOM 58 CB PRO A 5 10.614 -5.314 7.034 1.00 0.00 C ATOM 59 CG PRO A 5 10.498 -6.752 7.545 1.00 0.00 C ATOM 60 CD PRO A 5 11.178 -6.722 8.915 1.00 0.00 C ATOM 0 HA PRO A 5 10.960 -3.487 8.203 1.00 0.00 H new ATOM 0 HB2 PRO A 5 9.845 -5.092 6.294 1.00 0.00 H new ATOM 0 HB3 PRO A 5 11.577 -5.140 6.554 1.00 0.00 H new ATOM 0 HG2 PRO A 5 9.456 -7.063 7.625 1.00 0.00 H new ATOM 0 HG3 PRO A 5 10.990 -7.454 6.872 1.00 0.00 H new ATOM 0 HD2 PRO A 5 10.731 -7.435 9.607 1.00 0.00 H new ATOM 0 HD3 PRO A 5 12.239 -6.964 8.849 1.00 0.00 H new ATOM 68 N HIS A 6 8.754 -2.801 8.758 1.00 0.00 N ATOM 69 CA HIS A 6 7.425 -2.295 9.146 1.00 0.00 C ATOM 70 C HIS A 6 7.309 -0.821 8.772 1.00 0.00 C ATOM 71 O HIS A 6 7.737 0.056 9.528 1.00 0.00 O ATOM 72 CB HIS A 6 7.224 -2.508 10.651 1.00 0.00 C ATOM 73 CG HIS A 6 7.204 -3.980 10.985 1.00 0.00 C ATOM 74 ND1 HIS A 6 7.888 -4.973 10.272 1.00 0.00 N flip ATOM 75 CD2 HIS A 6 6.479 -4.522 12.037 1.00 0.00 C flip ATOM 76 CE1 HIS A 6 7.641 -6.211 10.830 1.00 0.00 C flip ATOM 77 NE2 HIS A 6 6.807 -5.843 11.852 1.00 0.00 N flip ATOM 0 H HIS A 6 9.463 -2.076 8.652 1.00 0.00 H new ATOM 0 HA HIS A 6 6.645 -2.839 8.614 1.00 0.00 H new ATOM 0 HB2 HIS A 6 8.025 -2.016 11.203 1.00 0.00 H new ATOM 0 HB3 HIS A 6 6.289 -2.046 10.967 1.00 0.00 H new ATOM 0 HD2 HIS A 6 5.849 -4.049 12.776 1.00 0.00 H new ATOM 0 HE1 HIS A 6 8.001 -7.188 10.543 1.00 0.00 H new ATOM 0 HE2 HIS A 6 6.428 -6.553 12.479 1.00 0.00 H new ATOM 85 N VAL A 7 6.677 -0.581 7.617 1.00 0.00 N ATOM 86 CA VAL A 7 6.205 0.772 7.278 1.00 0.00 C ATOM 87 C VAL A 7 5.204 1.138 8.365 1.00 0.00 C ATOM 88 O VAL A 7 3.989 0.995 8.193 1.00 0.00 O ATOM 89 CB VAL A 7 5.580 0.805 5.878 1.00 0.00 C ATOM 90 CG1 VAL A 7 5.045 2.210 5.597 1.00 0.00 C ATOM 91 CG2 VAL A 7 6.643 0.427 4.848 1.00 0.00 C ATOM 0 H VAL A 7 6.482 -1.290 6.911 1.00 0.00 H new ATOM 0 HA VAL A 7 7.022 1.493 7.244 1.00 0.00 H new ATOM 0 HB VAL A 7 4.756 0.094 5.818 1.00 0.00 H new ATOM 0 HG11 VAL A 7 4.600 2.238 4.602 1.00 0.00 H new ATOM 0 HG12 VAL A 7 4.290 2.467 6.340 1.00 0.00 H new ATOM 0 HG13 VAL A 7 5.864 2.928 5.648 1.00 0.00 H new ATOM 0 HG21 VAL A 7 6.206 0.448 3.850 1.00 0.00 H new ATOM 0 HG22 VAL A 7 7.468 1.138 4.898 1.00 0.00 H new ATOM 0 HG23 VAL A 7 7.015 -0.575 5.060 1.00 0.00 H new ATOM 101 N LEU A 8 5.771 1.540 9.504 1.00 0.00 N ATOM 102 CA LEU A 8 4.990 1.727 10.736 1.00 0.00 C ATOM 103 C LEU A 8 4.274 3.066 10.680 1.00 0.00 C ATOM 104 O LEU A 8 4.885 4.131 10.789 1.00 0.00 O ATOM 105 CB LEU A 8 5.917 1.603 11.942 1.00 0.00 C ATOM 106 CG LEU A 8 5.073 1.501 13.212 1.00 0.00 C ATOM 107 CD1 LEU A 8 5.917 0.924 14.345 1.00 0.00 C ATOM 108 CD2 LEU A 8 4.488 2.862 13.595 1.00 0.00 C ATOM 0 H LEU A 8 6.766 1.743 9.603 1.00 0.00 H new ATOM 0 HA LEU A 8 4.225 0.956 10.833 1.00 0.00 H new ATOM 0 HB2 LEU A 8 6.551 0.722 11.840 1.00 0.00 H new ATOM 0 HB3 LEU A 8 6.579 2.467 11.998 1.00 0.00 H new ATOM 0 HG LEU A 8 4.234 0.830 13.024 1.00 0.00 H new ATOM 0 HD11 LEU A 8 5.312 0.853 15.249 1.00 0.00 H new ATOM 0 HD12 LEU A 8 6.271 -0.068 14.066 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.771 1.575 14.530 1.00 0.00 H new ATOM 0 HD21 LEU A 8 3.892 2.760 14.502 1.00 0.00 H new ATOM 0 HD22 LEU A 8 5.298 3.570 13.771 1.00 0.00 H new ATOM 0 HD23 LEU A 8 3.856 3.227 12.785 1.00 0.00 H new ATOM 120 N LEU A 9 2.964 2.951 10.475 1.00 0.00 N ATOM 121 CA LEU A 9 2.086 4.116 10.230 1.00 0.00 C ATOM 122 C LEU A 9 1.259 4.486 11.456 1.00 0.00 C ATOM 123 O LEU A 9 1.220 3.783 12.470 1.00 0.00 O ATOM 124 CB LEU A 9 1.161 3.803 9.049 1.00 0.00 C ATOM 125 CG LEU A 9 1.847 4.226 7.749 1.00 0.00 C ATOM 126 CD1 LEU A 9 1.109 3.656 6.535 1.00 0.00 C ATOM 127 CD2 LEU A 9 1.891 5.755 7.667 1.00 0.00 C ATOM 0 H LEU A 9 2.473 2.057 10.472 1.00 0.00 H new ATOM 0 HA LEU A 9 2.719 4.974 10.002 1.00 0.00 H new ATOM 0 HB2 LEU A 9 0.931 2.738 9.023 1.00 0.00 H new ATOM 0 HB3 LEU A 9 0.214 4.331 9.163 1.00 0.00 H new ATOM 0 HG LEU A 9 2.863 3.832 7.745 1.00 0.00 H new ATOM 0 HD11 LEU A 9 1.614 3.970 5.622 1.00 0.00 H new ATOM 0 HD12 LEU A 9 1.103 2.567 6.591 1.00 0.00 H new ATOM 0 HD13 LEU A 9 0.083 4.024 6.527 1.00 0.00 H new ATOM 0 HD21 LEU A 9 2.380 6.056 6.740 1.00 0.00 H new ATOM 0 HD22 LEU A 9 0.875 6.150 7.686 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.449 6.149 8.516 1.00 0.00 H new ATOM 139 N THR A 10 0.605 5.632 11.286 1.00 0.00 N ATOM 140 CA THR A 10 -0.271 6.202 12.318 1.00 0.00 C ATOM 141 C THR A 10 -1.191 7.193 11.625 1.00 0.00 C ATOM 142 O THR A 10 -0.954 8.403 11.664 1.00 0.00 O ATOM 143 CB THR A 10 0.577 6.907 13.375 1.00 0.00 C ATOM 144 OG1 THR A 10 1.462 5.970 13.971 1.00 0.00 O ATOM 145 CG2 THR A 10 -0.321 7.503 14.456 1.00 0.00 C ATOM 0 H THR A 10 0.663 6.193 10.436 1.00 0.00 H new ATOM 0 HA THR A 10 -0.854 5.427 12.816 1.00 0.00 H new ATOM 0 HB THR A 10 1.145 7.706 12.899 1.00 0.00 H new ATOM 0 HG1 THR A 10 1.105 5.065 13.858 1.00 0.00 H new ATOM 0 HG21 THR A 10 0.294 8.003 15.205 1.00 0.00 H new ATOM 0 HG22 THR A 10 -1.003 8.224 14.006 1.00 0.00 H new ATOM 0 HG23 THR A 10 -0.896 6.708 14.931 1.00 0.00 H new ATOM 153 N THR A 11 -2.217 6.631 10.980 1.00 0.00 N ATOM 154 CA THR A 11 -3.235 7.436 10.277 1.00 0.00 C ATOM 155 C THR A 11 -4.197 8.111 11.247 1.00 0.00 C ATOM 156 O THR A 11 -4.265 7.782 12.436 1.00 0.00 O ATOM 157 CB THR A 11 -4.047 6.538 9.349 1.00 0.00 C ATOM 158 OG1 THR A 11 -4.536 5.415 10.070 1.00 0.00 O ATOM 159 CG2 THR A 11 -3.165 6.068 8.200 1.00 0.00 C ATOM 0 H THR A 11 -2.370 5.624 10.927 1.00 0.00 H new ATOM 0 HA THR A 11 -2.707 8.206 9.715 1.00 0.00 H new ATOM 0 HB THR A 11 -4.892 7.100 8.951 1.00 0.00 H new ATOM 0 HG1 THR A 11 -4.326 4.594 9.578 1.00 0.00 H new ATOM 0 HG21 THR A 11 -3.744 5.426 7.536 1.00 0.00 H new ATOM 0 HG22 THR A 11 -2.801 6.932 7.644 1.00 0.00 H new ATOM 0 HG23 THR A 11 -2.318 5.509 8.597 1.00 0.00 H new ATOM 167 N SER A 12 -4.947 9.050 10.672 1.00 0.00 N ATOM 168 CA SER A 12 -5.954 9.809 11.432 1.00 0.00 C ATOM 169 C SER A 12 -6.714 8.886 12.380 1.00 0.00 C ATOM 170 O SER A 12 -6.852 9.192 13.568 1.00 0.00 O ATOM 171 CB SER A 12 -6.914 10.486 10.456 1.00 0.00 C ATOM 172 OG SER A 12 -7.554 9.514 9.641 1.00 0.00 O ATOM 0 H SER A 12 -4.881 9.307 9.687 1.00 0.00 H new ATOM 0 HA SER A 12 -5.456 10.570 12.032 1.00 0.00 H new ATOM 0 HB2 SER A 12 -7.661 11.057 11.007 1.00 0.00 H new ATOM 0 HB3 SER A 12 -6.369 11.193 9.831 1.00 0.00 H new ATOM 0 HG SER A 12 -8.496 9.756 9.521 1.00 0.00 H new ATOM 178 N ALA A 13 -7.192 7.768 11.828 1.00 0.00 N ATOM 179 CA ALA A 13 -7.933 6.770 12.618 1.00 0.00 C ATOM 180 C ALA A 13 -7.113 6.336 13.821 1.00 0.00 C ATOM 181 O ALA A 13 -7.556 6.419 14.970 1.00 0.00 O ATOM 182 CB ALA A 13 -8.286 5.570 11.738 1.00 0.00 C ATOM 0 H ALA A 13 -7.082 7.528 10.843 1.00 0.00 H new ATOM 0 HA ALA A 13 -8.858 7.217 12.982 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -8.834 4.835 12.328 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -8.905 5.900 10.904 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -7.371 5.118 11.355 1.00 0.00 H new ATOM 188 N GLY A 14 -5.916 5.869 13.491 1.00 0.00 N ATOM 189 CA GLY A 14 -4.949 5.392 14.500 1.00 0.00 C ATOM 190 C GLY A 14 -3.729 4.712 13.880 1.00 0.00 C ATOM 191 O GLY A 14 -3.600 4.595 12.658 1.00 0.00 O ATOM 0 H GLY A 14 -5.580 5.806 12.530 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -4.619 6.235 15.107 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -5.447 4.692 15.171 1.00 0.00 H new ATOM 195 N ASN A 15 -2.847 4.275 14.781 1.00 0.00 N ATOM 196 CA ASN A 15 -1.605 3.579 14.391 1.00 0.00 C ATOM 197 C ASN A 15 -1.888 2.324 13.563 1.00 0.00 C ATOM 198 O ASN A 15 -2.983 1.755 13.610 1.00 0.00 O ATOM 199 CB ASN A 15 -0.838 3.198 15.660 1.00 0.00 C ATOM 200 CG ASN A 15 0.488 2.532 15.316 1.00 0.00 C ATOM 201 OD1 ASN A 15 1.239 3.148 14.421 1.00 0.00 O flip ATOM 202 ND2 ASN A 15 0.848 1.479 15.841 1.00 0.00 N flip ATOM 0 H ASN A 15 -2.964 4.388 15.788 1.00 0.00 H new ATOM 0 HA ASN A 15 -1.014 4.252 13.770 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -0.657 4.089 16.261 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -1.442 2.523 16.266 1.00 0.00 H new ATOM 0 HD21 ASN A 15 0.250 1.022 16.530 1.00 0.00 H new ATOM 0 HD22 ASN A 15 1.744 1.063 15.587 1.00 0.00 H new ATOM 209 N ILE A 16 -0.853 1.910 12.828 1.00 0.00 N ATOM 210 CA ILE A 16 -0.898 0.672 12.019 1.00 0.00 C ATOM 211 C ILE A 16 0.515 0.216 11.638 1.00 0.00 C ATOM 212 O ILE A 16 1.511 0.754 12.132 1.00 0.00 O ATOM 213 CB ILE A 16 -1.748 0.906 10.770 1.00 0.00 C ATOM 214 CG1 ILE A 16 -1.202 2.086 9.965 1.00 0.00 C ATOM 215 CG2 ILE A 16 -3.192 1.161 11.183 1.00 0.00 C ATOM 216 CD1 ILE A 16 -2.087 2.367 8.751 1.00 0.00 C ATOM 0 H ILE A 16 0.034 2.411 12.771 1.00 0.00 H new ATOM 0 HA ILE A 16 -1.352 -0.121 12.613 1.00 0.00 H new ATOM 0 HB ILE A 16 -1.709 0.020 10.137 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -1.152 2.972 10.598 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -0.185 1.870 9.638 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -3.801 1.328 10.294 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -3.573 0.296 11.726 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -3.237 2.041 11.824 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -1.681 3.210 8.192 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -2.115 1.486 8.110 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -3.097 2.605 9.084 1.00 0.00 H new ATOM 228 N GLU A 17 0.562 -0.816 10.787 1.00 0.00 N ATOM 229 CA GLU A 17 1.833 -1.501 10.474 1.00 0.00 C ATOM 230 C GLU A 17 1.751 -2.311 9.185 1.00 0.00 C ATOM 231 O GLU A 17 0.892 -3.188 9.061 1.00 0.00 O ATOM 232 CB GLU A 17 2.125 -2.477 11.612 1.00 0.00 C ATOM 233 CG GLU A 17 2.020 -1.786 12.974 1.00 0.00 C ATOM 234 CD GLU A 17 2.994 -0.618 13.103 1.00 0.00 C ATOM 235 OE1 GLU A 17 4.141 -0.833 13.554 1.00 0.00 O ATOM 236 OE2 GLU A 17 2.619 0.524 12.757 1.00 0.00 O ATOM 0 H GLU A 17 -0.253 -1.196 10.305 1.00 0.00 H new ATOM 0 HA GLU A 17 2.608 -0.744 10.355 1.00 0.00 H new ATOM 0 HB2 GLU A 17 1.424 -3.310 11.569 1.00 0.00 H new ATOM 0 HB3 GLU A 17 3.124 -2.895 11.489 1.00 0.00 H new ATOM 0 HG2 GLU A 17 1.002 -1.426 13.119 1.00 0.00 H new ATOM 0 HG3 GLU A 17 2.218 -2.511 13.764 1.00 0.00 H new ATOM 243 N LEU A 18 2.704 -2.047 8.280 1.00 0.00 N ATOM 244 CA LEU A 18 2.978 -2.945 7.134 1.00 0.00 C ATOM 245 C LEU A 18 4.353 -3.586 7.324 1.00 0.00 C ATOM 246 O LEU A 18 5.381 -2.905 7.258 1.00 0.00 O ATOM 247 CB LEU A 18 2.953 -2.190 5.799 1.00 0.00 C ATOM 248 CG LEU A 18 1.546 -1.708 5.439 1.00 0.00 C ATOM 249 CD1 LEU A 18 0.532 -2.829 5.678 1.00 0.00 C ATOM 250 CD2 LEU A 18 1.179 -0.467 6.253 1.00 0.00 C ATOM 0 H LEU A 18 3.301 -1.221 8.314 1.00 0.00 H new ATOM 0 HA LEU A 18 2.197 -3.705 7.103 1.00 0.00 H new ATOM 0 HB2 LEU A 18 3.626 -1.335 5.854 1.00 0.00 H new ATOM 0 HB3 LEU A 18 3.327 -2.840 5.008 1.00 0.00 H new ATOM 0 HG LEU A 18 1.527 -1.439 4.383 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -0.467 -2.477 5.419 1.00 0.00 H new ATOM 0 HD12 LEU A 18 0.786 -3.688 5.057 1.00 0.00 H new ATOM 0 HD13 LEU A 18 0.553 -3.121 6.728 1.00 0.00 H new ATOM 0 HD21 LEU A 18 0.175 -0.139 5.983 1.00 0.00 H new ATOM 0 HD22 LEU A 18 1.209 -0.707 7.316 1.00 0.00 H new ATOM 0 HD23 LEU A 18 1.891 0.331 6.041 1.00 0.00 H new ATOM 262 N GLU A 19 4.332 -4.908 7.516 1.00 0.00 N ATOM 263 CA GLU A 19 5.563 -5.720 7.489 1.00 0.00 C ATOM 264 C GLU A 19 5.946 -5.971 6.035 1.00 0.00 C ATOM 265 O GLU A 19 5.238 -6.685 5.319 1.00 0.00 O ATOM 266 CB GLU A 19 5.302 -7.046 8.196 1.00 0.00 C ATOM 267 CG GLU A 19 4.149 -7.791 7.513 1.00 0.00 C ATOM 268 CD GLU A 19 3.837 -9.137 8.173 1.00 0.00 C ATOM 269 OE1 GLU A 19 3.002 -9.175 9.104 1.00 0.00 O ATOM 270 OE2 GLU A 19 4.425 -10.163 7.764 1.00 0.00 O ATOM 0 H GLU A 19 3.481 -5.442 7.692 1.00 0.00 H new ATOM 0 HA GLU A 19 6.375 -5.200 7.997 1.00 0.00 H new ATOM 0 HB2 GLU A 19 6.203 -7.660 8.178 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.059 -6.867 9.243 1.00 0.00 H new ATOM 0 HG2 GLU A 19 3.256 -7.166 7.534 1.00 0.00 H new ATOM 0 HG3 GLU A 19 4.399 -7.955 6.465 1.00 0.00 H new ATOM 277 N LEU A 20 7.059 -5.348 5.632 1.00 0.00 N ATOM 278 CA LEU A 20 7.522 -5.371 4.226 1.00 0.00 C ATOM 279 C LEU A 20 8.769 -6.243 4.080 1.00 0.00 C ATOM 280 O LEU A 20 9.744 -6.096 4.822 1.00 0.00 O ATOM 281 CB LEU A 20 7.842 -3.944 3.761 1.00 0.00 C ATOM 282 CG LEU A 20 6.577 -3.093 3.592 1.00 0.00 C ATOM 283 CD1 LEU A 20 5.906 -2.812 4.939 1.00 0.00 C ATOM 284 CD2 LEU A 20 6.924 -1.766 2.911 1.00 0.00 C ATOM 0 H LEU A 20 7.664 -4.817 6.258 1.00 0.00 H new ATOM 0 HA LEU A 20 6.727 -5.790 3.610 1.00 0.00 H new ATOM 0 HB2 LEU A 20 8.504 -3.468 4.484 1.00 0.00 H new ATOM 0 HB3 LEU A 20 8.380 -3.984 2.814 1.00 0.00 H new ATOM 0 HG LEU A 20 5.880 -3.656 2.972 1.00 0.00 H new ATOM 0 HD11 LEU A 20 5.013 -2.207 4.782 1.00 0.00 H new ATOM 0 HD12 LEU A 20 5.627 -3.754 5.410 1.00 0.00 H new ATOM 0 HD13 LEU A 20 6.599 -2.274 5.586 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.019 -1.169 2.795 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.643 -1.221 3.522 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.357 -1.963 1.930 1.00 0.00 H new ATOM 296 N ASP A 21 8.704 -7.117 3.074 1.00 0.00 N ATOM 297 CA ASP A 21 9.871 -7.915 2.663 1.00 0.00 C ATOM 298 C ASP A 21 11.027 -6.997 2.296 1.00 0.00 C ATOM 299 O ASP A 21 11.478 -6.177 3.102 1.00 0.00 O ATOM 300 CB ASP A 21 9.488 -8.755 1.447 1.00 0.00 C ATOM 301 CG ASP A 21 8.374 -9.732 1.796 1.00 0.00 C ATOM 302 OD1 ASP A 21 7.934 -9.745 2.966 1.00 0.00 O ATOM 303 OD2 ASP A 21 7.931 -10.490 0.906 1.00 0.00 O ATOM 0 H ASP A 21 7.861 -7.293 2.528 1.00 0.00 H new ATOM 0 HA ASP A 21 10.178 -8.561 3.486 1.00 0.00 H new ATOM 0 HB2 ASP A 21 9.165 -8.103 0.636 1.00 0.00 H new ATOM 0 HB3 ASP A 21 10.359 -9.303 1.088 1.00 0.00 H new ATOM 308 N LYS A 22 11.480 -7.185 1.060 1.00 0.00 N ATOM 309 CA LYS A 22 12.616 -6.417 0.534 1.00 0.00 C ATOM 310 C LYS A 22 13.470 -7.318 -0.347 1.00 0.00 C ATOM 311 O LYS A 22 13.741 -6.990 -1.505 1.00 0.00 O ATOM 312 CB LYS A 22 13.446 -5.890 1.700 1.00 0.00 C ATOM 313 CG LYS A 22 13.974 -7.063 2.538 1.00 0.00 C ATOM 314 CD LYS A 22 14.782 -6.663 3.791 1.00 0.00 C ATOM 315 CE LYS A 22 16.168 -6.057 3.495 1.00 0.00 C ATOM 316 NZ LYS A 22 16.898 -5.748 4.737 1.00 0.00 N ATOM 0 H LYS A 22 11.084 -7.857 0.403 1.00 0.00 H new ATOM 0 HA LYS A 22 12.254 -5.578 -0.060 1.00 0.00 H new ATOM 0 HB2 LYS A 22 14.279 -5.295 1.325 1.00 0.00 H new ATOM 0 HB3 LYS A 22 12.839 -5.232 2.322 1.00 0.00 H new ATOM 0 HG2 LYS A 22 13.128 -7.675 2.851 1.00 0.00 H new ATOM 0 HG3 LYS A 22 14.603 -7.688 1.904 1.00 0.00 H new ATOM 0 HD2 LYS A 22 14.201 -5.943 4.367 1.00 0.00 H new ATOM 0 HD3 LYS A 22 14.912 -7.544 4.420 1.00 0.00 H new ATOM 0 HE2 LYS A 22 16.750 -6.755 2.893 1.00 0.00 H new ATOM 0 HE3 LYS A 22 16.051 -5.148 2.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 17.826 -5.342 4.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 16.353 -5.064 5.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 17.031 -6.620 5.288 1.00 0.00 H new ATOM 330 N GLN A 23 13.883 -8.443 0.241 1.00 0.00 N ATOM 331 CA GLN A 23 14.709 -9.429 -0.474 1.00 0.00 C ATOM 332 C GLN A 23 14.089 -9.763 -1.829 1.00 0.00 C ATOM 333 O GLN A 23 14.801 -9.832 -2.834 1.00 0.00 O ATOM 334 CB GLN A 23 14.848 -10.692 0.378 1.00 0.00 C ATOM 335 CG GLN A 23 13.480 -11.308 0.671 1.00 0.00 C ATOM 336 CD GLN A 23 13.609 -12.569 1.520 1.00 0.00 C ATOM 337 OE1 GLN A 23 13.003 -13.605 1.247 1.00 0.00 O ATOM 338 NE2 GLN A 23 14.404 -12.494 2.572 1.00 0.00 N ATOM 0 H GLN A 23 13.663 -8.697 1.204 1.00 0.00 H new ATOM 0 HA GLN A 23 15.698 -9.006 -0.649 1.00 0.00 H new ATOM 0 HB2 GLN A 23 15.474 -11.418 -0.141 1.00 0.00 H new ATOM 0 HB3 GLN A 23 15.350 -10.450 1.315 1.00 0.00 H new ATOM 0 HG2 GLN A 23 12.855 -10.581 1.189 1.00 0.00 H new ATOM 0 HG3 GLN A 23 12.979 -11.548 -0.267 1.00 0.00 H new ATOM 0 HE21 GLN A 23 14.896 -11.625 2.778 1.00 0.00 H new ATOM 0 HE22 GLN A 23 14.526 -13.305 3.178 1.00 0.00 H new ATOM 347 N LYS A 24 12.768 -9.968 -1.826 1.00 0.00 N ATOM 348 CA LYS A 24 12.037 -10.335 -3.053 1.00 0.00 C ATOM 349 C LYS A 24 11.985 -9.200 -4.077 1.00 0.00 C ATOM 350 O LYS A 24 11.652 -9.456 -5.238 1.00 0.00 O ATOM 351 CB LYS A 24 10.611 -10.724 -2.672 1.00 0.00 C ATOM 352 CG LYS A 24 9.828 -11.146 -3.922 1.00 0.00 C ATOM 353 CD LYS A 24 10.459 -12.323 -4.692 1.00 0.00 C ATOM 354 CE LYS A 24 11.788 -11.984 -5.396 1.00 0.00 C ATOM 355 NZ LYS A 24 12.318 -13.141 -6.139 1.00 0.00 N ATOM 0 H LYS A 24 12.182 -9.888 -0.995 1.00 0.00 H new ATOM 0 HA LYS A 24 12.570 -11.165 -3.518 1.00 0.00 H new ATOM 0 HB2 LYS A 24 10.629 -11.542 -1.951 1.00 0.00 H new ATOM 0 HB3 LYS A 24 10.113 -9.884 -2.188 1.00 0.00 H new ATOM 0 HG2 LYS A 24 8.815 -11.420 -3.628 1.00 0.00 H new ATOM 0 HG3 LYS A 24 9.745 -10.290 -4.592 1.00 0.00 H new ATOM 0 HD2 LYS A 24 10.629 -13.146 -3.998 1.00 0.00 H new ATOM 0 HD3 LYS A 24 9.747 -12.677 -5.437 1.00 0.00 H new ATOM 0 HE2 LYS A 24 11.635 -11.150 -6.081 1.00 0.00 H new ATOM 0 HE3 LYS A 24 12.520 -11.659 -4.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 13.212 -12.877 -6.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 12.487 -13.928 -5.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 11.630 -13.435 -6.861 1.00 0.00 H new ATOM 369 N ALA A 25 12.303 -7.971 -3.648 1.00 0.00 N ATOM 370 CA ALA A 25 12.290 -6.803 -4.549 1.00 0.00 C ATOM 371 C ALA A 25 13.131 -5.687 -3.931 1.00 0.00 C ATOM 372 O ALA A 25 12.605 -4.675 -3.459 1.00 0.00 O ATOM 373 CB ALA A 25 10.841 -6.370 -4.797 1.00 0.00 C ATOM 0 H ALA A 25 12.572 -7.757 -2.688 1.00 0.00 H new ATOM 0 HA ALA A 25 12.727 -7.053 -5.515 1.00 0.00 H new ATOM 0 HB1 ALA A 25 10.828 -5.507 -5.463 1.00 0.00 H new ATOM 0 HB2 ALA A 25 10.290 -7.191 -5.256 1.00 0.00 H new ATOM 0 HB3 ALA A 25 10.373 -6.104 -3.849 1.00 0.00 H new ATOM 379 N PRO A 26 14.448 -5.901 -3.957 1.00 0.00 N ATOM 380 CA PRO A 26 15.434 -4.970 -3.396 1.00 0.00 C ATOM 381 C PRO A 26 15.296 -3.573 -3.994 1.00 0.00 C ATOM 382 O PRO A 26 14.987 -2.613 -3.283 1.00 0.00 O ATOM 383 CB PRO A 26 16.757 -5.640 -3.786 1.00 0.00 C ATOM 384 CG PRO A 26 16.420 -7.128 -3.909 1.00 0.00 C ATOM 385 CD PRO A 26 15.003 -7.146 -4.482 1.00 0.00 C ATOM 0 HA PRO A 26 15.329 -4.808 -2.323 1.00 0.00 H new ATOM 0 HB2 PRO A 26 17.140 -5.242 -4.726 1.00 0.00 H new ATOM 0 HB3 PRO A 26 17.525 -5.469 -3.031 1.00 0.00 H new ATOM 0 HG2 PRO A 26 17.122 -7.642 -4.566 1.00 0.00 H new ATOM 0 HG3 PRO A 26 16.465 -7.628 -2.941 1.00 0.00 H new ATOM 0 HD2 PRO A 26 15.004 -7.165 -5.572 1.00 0.00 H new ATOM 0 HD3 PRO A 26 14.439 -8.017 -4.148 1.00 0.00 H new ATOM 393 N VAL A 27 15.553 -3.498 -5.301 1.00 0.00 N ATOM 394 CA VAL A 27 15.552 -2.214 -6.020 1.00 0.00 C ATOM 395 C VAL A 27 14.240 -1.481 -5.771 1.00 0.00 C ATOM 396 O VAL A 27 14.222 -0.426 -5.130 1.00 0.00 O ATOM 397 CB VAL A 27 15.746 -2.468 -7.517 1.00 0.00 C ATOM 398 CG1 VAL A 27 15.736 -1.133 -8.263 1.00 0.00 C ATOM 399 CG2 VAL A 27 17.071 -3.196 -7.747 1.00 0.00 C ATOM 0 H VAL A 27 15.764 -4.307 -5.886 1.00 0.00 H new ATOM 0 HA VAL A 27 16.370 -1.593 -5.657 1.00 0.00 H new ATOM 0 HB VAL A 27 14.934 -3.091 -7.893 1.00 0.00 H new ATOM 0 HG11 VAL A 27 15.874 -1.311 -9.329 1.00 0.00 H new ATOM 0 HG12 VAL A 27 14.782 -0.632 -8.099 1.00 0.00 H new ATOM 0 HG13 VAL A 27 16.545 -0.503 -7.893 1.00 0.00 H new ATOM 0 HG21 VAL A 27 17.207 -3.376 -8.813 1.00 0.00 H new ATOM 0 HG22 VAL A 27 17.892 -2.583 -7.375 1.00 0.00 H new ATOM 0 HG23 VAL A 27 17.060 -4.148 -7.217 1.00 0.00 H new ATOM 409 N SER A 28 13.163 -2.063 -6.302 1.00 0.00 N ATOM 410 CA SER A 28 11.822 -1.469 -6.181 1.00 0.00 C ATOM 411 C SER A 28 11.595 -0.991 -4.753 1.00 0.00 C ATOM 412 O SER A 28 11.389 0.202 -4.513 1.00 0.00 O ATOM 413 CB SER A 28 10.778 -2.521 -6.543 1.00 0.00 C ATOM 414 OG SER A 28 10.972 -2.952 -7.882 1.00 0.00 O ATOM 0 H SER A 28 13.188 -2.942 -6.819 1.00 0.00 H new ATOM 0 HA SER A 28 11.737 -0.618 -6.856 1.00 0.00 H new ATOM 0 HB2 SER A 28 10.854 -3.370 -5.864 1.00 0.00 H new ATOM 0 HB3 SER A 28 9.776 -2.107 -6.426 1.00 0.00 H new ATOM 0 HG SER A 28 10.318 -2.513 -8.465 1.00 0.00 H new ATOM 420 N VAL A 29 11.638 -1.956 -3.833 1.00 0.00 N ATOM 421 CA VAL A 29 11.438 -1.670 -2.403 1.00 0.00 C ATOM 422 C VAL A 29 12.322 -0.501 -1.978 1.00 0.00 C ATOM 423 O VAL A 29 11.833 0.472 -1.397 1.00 0.00 O ATOM 424 CB VAL A 29 11.768 -2.917 -1.580 1.00 0.00 C ATOM 425 CG1 VAL A 29 11.483 -2.634 -0.105 1.00 0.00 C ATOM 426 CG2 VAL A 29 10.922 -4.097 -2.063 1.00 0.00 C ATOM 0 H VAL A 29 11.808 -2.939 -4.046 1.00 0.00 H new ATOM 0 HA VAL A 29 10.397 -1.398 -2.230 1.00 0.00 H new ATOM 0 HB VAL A 29 12.821 -3.169 -1.703 1.00 0.00 H new ATOM 0 HG11 VAL A 29 11.716 -3.519 0.487 1.00 0.00 H new ATOM 0 HG12 VAL A 29 12.099 -1.800 0.231 1.00 0.00 H new ATOM 0 HG13 VAL A 29 10.430 -2.381 0.020 1.00 0.00 H new ATOM 0 HG21 VAL A 29 11.161 -4.982 -1.473 1.00 0.00 H new ATOM 0 HG22 VAL A 29 9.865 -3.859 -1.947 1.00 0.00 H new ATOM 0 HG23 VAL A 29 11.136 -4.292 -3.114 1.00 0.00 H new ATOM 436 N GLN A 30 13.616 -0.627 -2.284 1.00 0.00 N ATOM 437 CA GLN A 30 14.600 0.418 -1.951 1.00 0.00 C ATOM 438 C GLN A 30 14.016 1.796 -2.238 1.00 0.00 C ATOM 439 O GLN A 30 13.865 2.614 -1.327 1.00 0.00 O ATOM 440 CB GLN A 30 15.874 0.206 -2.770 1.00 0.00 C ATOM 441 CG GLN A 30 16.908 1.281 -2.435 1.00 0.00 C ATOM 442 CD GLN A 30 17.271 1.244 -0.952 1.00 0.00 C ATOM 443 OE1 GLN A 30 18.069 0.422 -0.503 1.00 0.00 O ATOM 444 NE2 GLN A 30 16.687 2.134 -0.167 1.00 0.00 N ATOM 0 H GLN A 30 14.010 -1.438 -2.760 1.00 0.00 H new ATOM 0 HA GLN A 30 14.843 0.355 -0.890 1.00 0.00 H new ATOM 0 HB2 GLN A 30 16.287 -0.781 -2.563 1.00 0.00 H new ATOM 0 HB3 GLN A 30 15.639 0.237 -3.834 1.00 0.00 H new ATOM 0 HG2 GLN A 30 17.804 1.130 -3.037 1.00 0.00 H new ATOM 0 HG3 GLN A 30 16.513 2.264 -2.693 1.00 0.00 H new ATOM 0 HE21 GLN A 30 16.028 2.807 -0.560 1.00 0.00 H new ATOM 0 HE22 GLN A 30 16.895 2.148 0.831 1.00 0.00 H new ATOM 453 N ASN A 31 13.691 2.015 -3.514 1.00 0.00 N ATOM 454 CA ASN A 31 13.059 3.274 -3.945 1.00 0.00 C ATOM 455 C ASN A 31 11.977 3.677 -2.946 1.00 0.00 C ATOM 456 O ASN A 31 11.972 4.805 -2.447 1.00 0.00 O ATOM 457 CB ASN A 31 12.456 3.086 -5.339 1.00 0.00 C ATOM 458 CG ASN A 31 13.538 2.704 -6.345 1.00 0.00 C ATOM 459 OD1 ASN A 31 13.900 1.434 -6.376 1.00 0.00 O flip ATOM 460 ND2 ASN A 31 14.056 3.536 -7.089 1.00 0.00 N flip ATOM 0 H ASN A 31 13.852 1.345 -4.266 1.00 0.00 H new ATOM 0 HA ASN A 31 13.807 4.066 -3.985 1.00 0.00 H new ATOM 0 HB2 ASN A 31 11.690 2.311 -5.308 1.00 0.00 H new ATOM 0 HB3 ASN A 31 11.965 4.006 -5.656 1.00 0.00 H new ATOM 0 HD21 ASN A 31 13.760 4.511 -7.047 1.00 0.00 H new ATOM 0 HD22 ASN A 31 14.781 3.250 -7.747 1.00 0.00 H new ATOM 467 N PHE A 32 11.086 2.722 -2.671 1.00 0.00 N ATOM 468 CA PHE A 32 10.024 2.912 -1.669 1.00 0.00 C ATOM 469 C PHE A 32 10.582 3.648 -0.455 1.00 0.00 C ATOM 470 O PHE A 32 10.095 4.721 -0.090 1.00 0.00 O ATOM 471 CB PHE A 32 9.485 1.540 -1.257 1.00 0.00 C ATOM 472 CG PHE A 32 8.340 1.678 -0.271 1.00 0.00 C ATOM 473 CD1 PHE A 32 7.144 2.152 -0.693 1.00 0.00 C ATOM 474 CD2 PHE A 32 8.500 1.314 1.025 1.00 0.00 C ATOM 475 CE1 PHE A 32 6.112 2.261 0.176 1.00 0.00 C ATOM 476 CE2 PHE A 32 7.469 1.428 1.894 1.00 0.00 C ATOM 477 CZ PHE A 32 6.276 1.901 1.469 1.00 0.00 C ATOM 0 H PHE A 32 11.075 1.809 -3.125 1.00 0.00 H new ATOM 0 HA PHE A 32 9.216 3.509 -2.092 1.00 0.00 H new ATOM 0 HB2 PHE A 32 9.146 0.999 -2.140 1.00 0.00 H new ATOM 0 HB3 PHE A 32 10.285 0.950 -0.810 1.00 0.00 H new ATOM 0 HD1 PHE A 32 7.013 2.444 -1.725 1.00 0.00 H new ATOM 0 HD2 PHE A 32 9.452 0.932 1.364 1.00 0.00 H new ATOM 0 HE1 PHE A 32 5.158 2.636 -0.163 1.00 0.00 H new ATOM 0 HE2 PHE A 32 7.599 1.141 2.927 1.00 0.00 H new ATOM 0 HZ PHE A 32 5.453 1.991 2.163 1.00 0.00 H new ATOM 487 N VAL A 33 11.613 3.041 0.135 1.00 0.00 N ATOM 488 CA VAL A 33 12.311 3.637 1.287 1.00 0.00 C ATOM 489 C VAL A 33 12.723 5.078 1.001 1.00 0.00 C ATOM 490 O VAL A 33 12.651 5.920 1.899 1.00 0.00 O ATOM 491 CB VAL A 33 13.541 2.793 1.623 1.00 0.00 C ATOM 492 CG1 VAL A 33 14.262 3.402 2.826 1.00 0.00 C ATOM 493 CG2 VAL A 33 13.112 1.357 1.931 1.00 0.00 C ATOM 0 H VAL A 33 11.986 2.139 -0.161 1.00 0.00 H new ATOM 0 HA VAL A 33 11.630 3.651 2.138 1.00 0.00 H new ATOM 0 HB VAL A 33 14.221 2.780 0.771 1.00 0.00 H new ATOM 0 HG11 VAL A 33 15.139 2.801 3.067 1.00 0.00 H new ATOM 0 HG12 VAL A 33 14.573 4.419 2.587 1.00 0.00 H new ATOM 0 HG13 VAL A 33 13.588 3.420 3.683 1.00 0.00 H new ATOM 0 HG21 VAL A 33 13.991 0.758 2.170 1.00 0.00 H new ATOM 0 HG22 VAL A 33 12.430 1.355 2.781 1.00 0.00 H new ATOM 0 HG23 VAL A 33 12.609 0.933 1.062 1.00 0.00 H new ATOM 503 N ASP A 34 13.156 5.341 -0.236 1.00 0.00 N ATOM 504 CA ASP A 34 13.550 6.704 -0.635 1.00 0.00 C ATOM 505 C ASP A 34 12.512 7.698 -0.130 1.00 0.00 C ATOM 506 O ASP A 34 12.821 8.640 0.604 1.00 0.00 O ATOM 507 CB ASP A 34 13.702 6.756 -2.157 1.00 0.00 C ATOM 508 CG ASP A 34 12.397 6.646 -2.940 1.00 0.00 C ATOM 509 OD1 ASP A 34 11.716 5.604 -2.828 1.00 0.00 O ATOM 510 OD2 ASP A 34 12.044 7.598 -3.671 1.00 0.00 O ATOM 0 H ASP A 34 13.243 4.641 -0.973 1.00 0.00 H new ATOM 0 HA ASP A 34 14.509 6.973 -0.192 1.00 0.00 H new ATOM 0 HB2 ASP A 34 14.192 7.692 -2.426 1.00 0.00 H new ATOM 0 HB3 ASP A 34 14.364 5.948 -2.469 1.00 0.00 H new ATOM 515 N TYR A 35 11.281 7.413 -0.539 1.00 0.00 N ATOM 516 CA TYR A 35 10.106 8.202 -0.128 1.00 0.00 C ATOM 517 C TYR A 35 9.836 7.960 1.354 1.00 0.00 C ATOM 518 O TYR A 35 9.751 8.903 2.145 1.00 0.00 O ATOM 519 CB TYR A 35 8.906 7.773 -0.975 1.00 0.00 C ATOM 520 CG TYR A 35 9.236 7.905 -2.452 1.00 0.00 C ATOM 521 CD1 TYR A 35 9.458 9.133 -2.971 1.00 0.00 C ATOM 522 CD2 TYR A 35 9.347 6.798 -3.221 1.00 0.00 C ATOM 523 CE1 TYR A 35 9.796 9.254 -4.269 1.00 0.00 C ATOM 524 CE2 TYR A 35 9.686 6.921 -4.518 1.00 0.00 C ATOM 525 CZ TYR A 35 9.912 8.147 -5.032 1.00 0.00 C ATOM 526 OH TYR A 35 10.274 8.269 -6.349 1.00 0.00 O ATOM 0 H TYR A 35 11.061 6.635 -1.161 1.00 0.00 H new ATOM 0 HA TYR A 35 10.285 9.266 -0.280 1.00 0.00 H new ATOM 0 HB2 TYR A 35 8.639 6.742 -0.745 1.00 0.00 H new ATOM 0 HB3 TYR A 35 8.040 8.389 -0.731 1.00 0.00 H new ATOM 0 HD1 TYR A 35 9.365 10.011 -2.349 1.00 0.00 H new ATOM 0 HD2 TYR A 35 9.165 5.821 -2.797 1.00 0.00 H new ATOM 0 HE1 TYR A 35 9.973 10.230 -4.696 1.00 0.00 H new ATOM 0 HE2 TYR A 35 9.776 6.044 -5.142 1.00 0.00 H new ATOM 0 HH TYR A 35 11.181 7.919 -6.473 1.00 0.00 H new ATOM 536 N VAL A 36 9.716 6.674 1.689 1.00 0.00 N ATOM 537 CA VAL A 36 9.511 6.241 3.082 1.00 0.00 C ATOM 538 C VAL A 36 10.347 7.073 4.045 1.00 0.00 C ATOM 539 O VAL A 36 9.837 7.582 5.047 1.00 0.00 O ATOM 540 CB VAL A 36 9.958 4.786 3.205 1.00 0.00 C ATOM 541 CG1 VAL A 36 9.755 4.307 4.643 1.00 0.00 C ATOM 542 CG2 VAL A 36 9.169 3.909 2.232 1.00 0.00 C ATOM 0 H VAL A 36 9.757 5.909 1.016 1.00 0.00 H new ATOM 0 HA VAL A 36 8.457 6.362 3.332 1.00 0.00 H new ATOM 0 HB VAL A 36 11.016 4.712 2.954 1.00 0.00 H new ATOM 0 HG11 VAL A 36 10.074 3.268 4.729 1.00 0.00 H new ATOM 0 HG12 VAL A 36 10.345 4.925 5.319 1.00 0.00 H new ATOM 0 HG13 VAL A 36 8.700 4.385 4.907 1.00 0.00 H new ATOM 0 HG21 VAL A 36 9.496 2.874 2.328 1.00 0.00 H new ATOM 0 HG22 VAL A 36 8.106 3.977 2.462 1.00 0.00 H new ATOM 0 HG23 VAL A 36 9.342 4.251 1.212 1.00 0.00 H new ATOM 552 N ASN A 37 11.635 7.177 3.712 1.00 0.00 N ATOM 553 CA ASN A 37 12.610 7.868 4.576 1.00 0.00 C ATOM 554 C ASN A 37 12.013 9.110 5.238 1.00 0.00 C ATOM 555 O ASN A 37 12.379 9.434 6.372 1.00 0.00 O ATOM 556 CB ASN A 37 13.822 8.268 3.732 1.00 0.00 C ATOM 557 CG ASN A 37 13.414 9.239 2.632 1.00 0.00 C ATOM 558 OD1 ASN A 37 12.255 9.636 2.522 1.00 0.00 O ATOM 559 ND2 ASN A 37 14.362 9.635 1.800 1.00 0.00 N ATOM 0 H ASN A 37 12.032 6.795 2.854 1.00 0.00 H new ATOM 0 HA ASN A 37 12.903 7.184 5.372 1.00 0.00 H new ATOM 0 HB2 ASN A 37 14.579 8.728 4.368 1.00 0.00 H new ATOM 0 HB3 ASN A 37 14.274 7.379 3.291 1.00 0.00 H new ATOM 0 HD21 ASN A 37 14.140 10.284 1.046 1.00 0.00 H new ATOM 0 HD22 ASN A 37 15.316 9.291 1.913 1.00 0.00 H new ATOM 566 N SER A 38 11.105 9.778 4.522 1.00 0.00 N ATOM 567 CA SER A 38 10.376 10.921 5.096 1.00 0.00 C ATOM 568 C SER A 38 10.068 11.985 4.051 1.00 0.00 C ATOM 569 O SER A 38 10.925 12.355 3.243 1.00 0.00 O ATOM 570 CB SER A 38 11.204 11.535 6.221 1.00 0.00 C ATOM 571 OG SER A 38 12.432 12.028 5.705 1.00 0.00 O ATOM 0 H SER A 38 10.857 9.555 3.558 1.00 0.00 H new ATOM 0 HA SER A 38 9.426 10.552 5.481 1.00 0.00 H new ATOM 0 HB2 SER A 38 10.647 12.344 6.694 1.00 0.00 H new ATOM 0 HB3 SER A 38 11.397 10.788 6.991 1.00 0.00 H new ATOM 0 HG SER A 38 13.142 11.372 5.868 1.00 0.00 H new ATOM 577 N GLY A 39 8.825 12.468 4.127 1.00 0.00 N ATOM 578 CA GLY A 39 8.327 13.545 3.251 1.00 0.00 C ATOM 579 C GLY A 39 6.985 13.139 2.659 1.00 0.00 C ATOM 580 O GLY A 39 5.977 13.827 2.840 1.00 0.00 O ATOM 0 H GLY A 39 8.133 12.128 4.794 1.00 0.00 H new ATOM 0 HA2 GLY A 39 8.221 14.470 3.818 1.00 0.00 H new ATOM 0 HA3 GLY A 39 9.044 13.740 2.454 1.00 0.00 H new ATOM 584 N PHE A 40 7.023 12.018 1.939 1.00 0.00 N ATOM 585 CA PHE A 40 5.843 11.509 1.219 1.00 0.00 C ATOM 586 C PHE A 40 4.732 11.158 2.205 1.00 0.00 C ATOM 587 O PHE A 40 3.731 11.873 2.304 1.00 0.00 O ATOM 588 CB PHE A 40 6.261 10.280 0.407 1.00 0.00 C ATOM 589 CG PHE A 40 5.098 9.736 -0.402 1.00 0.00 C ATOM 590 CD1 PHE A 40 4.262 8.818 0.140 1.00 0.00 C ATOM 591 CD2 PHE A 40 4.906 10.149 -1.678 1.00 0.00 C ATOM 592 CE1 PHE A 40 3.245 8.310 -0.593 1.00 0.00 C ATOM 593 CE2 PHE A 40 3.889 9.641 -2.411 1.00 0.00 C ATOM 594 CZ PHE A 40 3.061 8.719 -1.869 1.00 0.00 C ATOM 0 H PHE A 40 7.857 11.440 1.835 1.00 0.00 H new ATOM 0 HA PHE A 40 5.457 12.274 0.546 1.00 0.00 H new ATOM 0 HB2 PHE A 40 7.081 10.544 -0.261 1.00 0.00 H new ATOM 0 HB3 PHE A 40 6.634 9.507 1.079 1.00 0.00 H new ATOM 0 HD1 PHE A 40 4.408 8.491 1.159 1.00 0.00 H new ATOM 0 HD2 PHE A 40 5.567 10.886 -2.111 1.00 0.00 H new ATOM 0 HE1 PHE A 40 2.580 7.578 -0.159 1.00 0.00 H new ATOM 0 HE2 PHE A 40 3.738 9.971 -3.428 1.00 0.00 H new ATOM 0 HZ PHE A 40 2.252 8.309 -2.456 1.00 0.00 H new ATOM 604 N TYR A 41 4.931 10.036 2.900 1.00 0.00 N ATOM 605 CA TYR A 41 3.897 9.467 3.787 1.00 0.00 C ATOM 606 C TYR A 41 3.602 10.351 5.003 1.00 0.00 C ATOM 607 O TYR A 41 2.510 10.262 5.571 1.00 0.00 O ATOM 608 CB TYR A 41 4.365 8.084 4.250 1.00 0.00 C ATOM 609 CG TYR A 41 4.706 7.217 3.049 1.00 0.00 C ATOM 610 CD1 TYR A 41 3.711 6.634 2.343 1.00 0.00 C ATOM 611 CD2 TYR A 41 5.997 7.075 2.673 1.00 0.00 C ATOM 612 CE1 TYR A 41 4.011 5.904 1.252 1.00 0.00 C ATOM 613 CE2 TYR A 41 6.295 6.345 1.582 1.00 0.00 C ATOM 614 CZ TYR A 41 5.300 5.767 0.877 1.00 0.00 C ATOM 615 OH TYR A 41 5.603 5.037 -0.243 1.00 0.00 O ATOM 0 H TYR A 41 5.797 9.498 2.870 1.00 0.00 H new ATOM 0 HA TYR A 41 2.968 9.399 3.221 1.00 0.00 H new ATOM 0 HB2 TYR A 41 5.238 8.184 4.895 1.00 0.00 H new ATOM 0 HB3 TYR A 41 3.584 7.607 4.842 1.00 0.00 H new ATOM 0 HD1 TYR A 41 2.683 6.753 2.652 1.00 0.00 H new ATOM 0 HD2 TYR A 41 6.784 7.544 3.244 1.00 0.00 H new ATOM 0 HE1 TYR A 41 3.225 5.431 0.681 1.00 0.00 H new ATOM 0 HE2 TYR A 41 7.323 6.223 1.273 1.00 0.00 H new ATOM 0 HH TYR A 41 6.170 4.277 0.005 1.00 0.00 H new ATOM 625 N ASN A 42 4.582 11.170 5.396 1.00 0.00 N ATOM 626 CA ASN A 42 4.483 11.963 6.635 1.00 0.00 C ATOM 627 C ASN A 42 3.076 12.512 6.866 1.00 0.00 C ATOM 628 O ASN A 42 2.632 12.579 8.016 1.00 0.00 O ATOM 629 CB ASN A 42 5.491 13.112 6.575 1.00 0.00 C ATOM 630 CG ASN A 42 6.910 12.574 6.421 1.00 0.00 C ATOM 631 OD1 ASN A 42 7.386 12.312 5.317 1.00 0.00 O ATOM 632 ND2 ASN A 42 7.608 12.394 7.530 1.00 0.00 N ATOM 0 H ASN A 42 5.451 11.304 4.880 1.00 0.00 H new ATOM 0 HA ASN A 42 4.707 11.304 7.474 1.00 0.00 H new ATOM 0 HB2 ASN A 42 5.253 13.769 5.738 1.00 0.00 H new ATOM 0 HB3 ASN A 42 5.420 13.713 7.482 1.00 0.00 H new ATOM 0 HD21 ASN A 42 8.560 12.032 7.480 1.00 0.00 H new ATOM 0 HD22 ASN A 42 7.194 12.618 8.435 1.00 0.00 H new ATOM 639 N ASN A 43 2.402 12.899 5.778 1.00 0.00 N ATOM 640 CA ASN A 43 1.033 13.446 5.863 1.00 0.00 C ATOM 641 C ASN A 43 0.317 13.294 4.523 1.00 0.00 C ATOM 642 O ASN A 43 -0.347 14.222 4.051 1.00 0.00 O ATOM 643 CB ASN A 43 1.093 14.906 6.324 1.00 0.00 C ATOM 644 CG ASN A 43 -0.297 15.526 6.346 1.00 0.00 C ATOM 645 OD1 ASN A 43 -1.308 14.690 6.489 1.00 0.00 O flip ATOM 646 ND2 ASN A 43 -0.473 16.739 6.242 1.00 0.00 N flip ATOM 0 H ASN A 43 2.775 12.846 4.830 1.00 0.00 H new ATOM 0 HA ASN A 43 0.456 12.886 6.599 1.00 0.00 H new ATOM 0 HB2 ASN A 43 1.535 14.960 7.319 1.00 0.00 H new ATOM 0 HB3 ASN A 43 1.739 15.476 5.657 1.00 0.00 H new ATOM 0 HD21 ASN A 43 0.327 17.363 6.132 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -1.418 17.121 6.265 1.00 0.00 H new ATOM 653 N THR A 44 0.421 12.082 3.972 1.00 0.00 N ATOM 654 CA THR A 44 -0.466 11.651 2.874 1.00 0.00 C ATOM 655 C THR A 44 -1.806 11.227 3.477 1.00 0.00 C ATOM 656 O THR A 44 -2.364 11.943 4.315 1.00 0.00 O ATOM 657 CB THR A 44 0.196 10.496 2.123 1.00 0.00 C ATOM 658 OG1 THR A 44 0.517 9.450 3.030 1.00 0.00 O ATOM 659 CG2 THR A 44 1.477 10.984 1.452 1.00 0.00 C ATOM 0 H THR A 44 1.104 11.382 4.262 1.00 0.00 H new ATOM 0 HA THR A 44 -0.639 12.462 2.166 1.00 0.00 H new ATOM 0 HB THR A 44 -0.496 10.124 1.367 1.00 0.00 H new ATOM 0 HG1 THR A 44 0.939 8.712 2.542 1.00 0.00 H new ATOM 0 HG21 THR A 44 1.946 10.157 0.918 1.00 0.00 H new ATOM 0 HG22 THR A 44 1.238 11.782 0.749 1.00 0.00 H new ATOM 0 HG23 THR A 44 2.163 11.362 2.210 1.00 0.00 H new ATOM 667 N THR A 45 -2.303 10.067 3.038 1.00 0.00 N ATOM 668 CA THR A 45 -3.518 9.471 3.631 1.00 0.00 C ATOM 669 C THR A 45 -3.656 7.992 3.276 1.00 0.00 C ATOM 670 O THR A 45 -2.675 7.291 3.011 1.00 0.00 O ATOM 671 CB THR A 45 -4.750 10.218 3.126 1.00 0.00 C ATOM 672 OG1 THR A 45 -4.796 10.147 1.708 1.00 0.00 O ATOM 673 CG2 THR A 45 -4.715 11.682 3.557 1.00 0.00 C ATOM 0 H THR A 45 -1.892 9.521 2.281 1.00 0.00 H new ATOM 0 HA THR A 45 -3.434 9.556 4.714 1.00 0.00 H new ATOM 0 HB THR A 45 -5.637 9.751 3.554 1.00 0.00 H new ATOM 0 HG1 THR A 45 -5.587 10.625 1.382 1.00 0.00 H new ATOM 0 HG21 THR A 45 -5.603 12.192 3.185 1.00 0.00 H new ATOM 0 HG22 THR A 45 -4.692 11.740 4.645 1.00 0.00 H new ATOM 0 HG23 THR A 45 -3.824 12.160 3.149 1.00 0.00 H new ATOM 681 N PHE A 46 -4.923 7.568 3.273 1.00 0.00 N ATOM 682 CA PHE A 46 -5.319 6.213 2.841 1.00 0.00 C ATOM 683 C PHE A 46 -6.638 6.365 2.081 1.00 0.00 C ATOM 684 O PHE A 46 -7.684 5.857 2.495 1.00 0.00 O ATOM 685 CB PHE A 46 -5.459 5.284 4.054 1.00 0.00 C ATOM 686 CG PHE A 46 -4.104 4.900 4.611 1.00 0.00 C ATOM 687 CD1 PHE A 46 -2.981 5.166 3.902 1.00 0.00 C ATOM 688 CD2 PHE A 46 -4.014 4.252 5.797 1.00 0.00 C ATOM 689 CE1 PHE A 46 -1.773 4.795 4.383 1.00 0.00 C ATOM 690 CE2 PHE A 46 -2.806 3.877 6.274 1.00 0.00 C ATOM 691 CZ PHE A 46 -1.685 4.150 5.568 1.00 0.00 C ATOM 0 H PHE A 46 -5.707 8.150 3.569 1.00 0.00 H new ATOM 0 HA PHE A 46 -4.566 5.760 2.196 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -6.046 5.779 4.828 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -6.004 4.385 3.766 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -3.050 5.675 2.952 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -4.908 4.035 6.362 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -0.878 5.014 3.820 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -2.736 3.359 7.219 1.00 0.00 H new ATOM 0 HZ PHE A 46 -0.720 3.853 5.951 1.00 0.00 H new ATOM 701 N HIS A 47 -6.538 7.093 0.968 1.00 0.00 N ATOM 702 CA HIS A 47 -7.704 7.399 0.128 1.00 0.00 C ATOM 703 C HIS A 47 -8.464 6.124 -0.224 1.00 0.00 C ATOM 704 O HIS A 47 -9.571 5.904 0.273 1.00 0.00 O ATOM 705 CB HIS A 47 -7.194 8.086 -1.138 1.00 0.00 C ATOM 706 CG HIS A 47 -6.109 7.237 -1.753 1.00 0.00 C ATOM 707 ND1 HIS A 47 -5.190 6.513 -1.006 1.00 0.00 N ATOM 708 CD2 HIS A 47 -5.893 7.077 -3.127 1.00 0.00 C ATOM 709 CE1 HIS A 47 -4.476 5.960 -2.040 1.00 0.00 C ATOM 710 NE2 HIS A 47 -4.818 6.235 -3.339 1.00 0.00 N ATOM 0 H HIS A 47 -5.661 7.484 0.624 1.00 0.00 H new ATOM 0 HA HIS A 47 -8.394 8.051 0.663 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -8.011 8.225 -1.846 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -6.807 9.077 -0.899 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -6.479 7.542 -3.905 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.642 5.306 -1.830 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -4.399 5.911 -4.211 1.00 0.00 H new ATOM 718 N ARG A 48 -7.863 5.327 -1.113 1.00 0.00 N ATOM 719 CA ARG A 48 -8.528 4.134 -1.664 1.00 0.00 C ATOM 720 C ARG A 48 -8.640 3.036 -0.615 1.00 0.00 C ATOM 721 O ARG A 48 -7.658 2.680 0.044 1.00 0.00 O ATOM 722 CB ARG A 48 -7.729 3.642 -2.867 1.00 0.00 C ATOM 723 CG ARG A 48 -7.718 4.734 -3.948 1.00 0.00 C ATOM 724 CD ARG A 48 -7.040 4.343 -5.276 1.00 0.00 C ATOM 725 NE ARG A 48 -5.564 4.224 -5.158 1.00 0.00 N ATOM 726 CZ ARG A 48 -4.741 3.928 -6.182 1.00 0.00 C ATOM 727 NH1 ARG A 48 -5.153 3.703 -7.429 1.00 0.00 N ATOM 728 NH2 ARG A 48 -3.445 3.856 -5.936 1.00 0.00 N ATOM 0 H ARG A 48 -6.920 5.483 -1.468 1.00 0.00 H new ATOM 0 HA ARG A 48 -9.540 4.396 -1.972 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -6.709 3.400 -2.567 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -8.170 2.727 -3.262 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.747 5.025 -4.157 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -7.214 5.613 -3.547 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -7.450 3.394 -5.622 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -7.280 5.089 -6.034 1.00 0.00 H new ATOM 0 HE ARG A 48 -5.146 4.377 -4.240 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -6.147 3.750 -7.654 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -4.475 3.483 -8.158 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -3.095 4.023 -4.993 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -2.794 3.634 -6.690 1.00 0.00 H new ATOM 742 N VAL A 49 -9.863 2.514 -0.504 1.00 0.00 N ATOM 743 CA VAL A 49 -10.178 1.456 0.479 1.00 0.00 C ATOM 744 C VAL A 49 -11.450 0.707 0.083 1.00 0.00 C ATOM 745 O VAL A 49 -12.291 1.216 -0.665 1.00 0.00 O ATOM 746 CB VAL A 49 -10.343 2.088 1.862 1.00 0.00 C ATOM 747 CG1 VAL A 49 -11.503 3.085 1.837 1.00 0.00 C ATOM 748 CG2 VAL A 49 -10.596 0.996 2.901 1.00 0.00 C ATOM 0 H VAL A 49 -10.656 2.801 -1.078 1.00 0.00 H new ATOM 0 HA VAL A 49 -9.359 0.737 0.501 1.00 0.00 H new ATOM 0 HB VAL A 49 -9.431 2.620 2.131 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -11.618 3.534 2.824 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -11.296 3.866 1.105 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -12.422 2.567 1.564 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -10.713 1.450 3.885 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -11.504 0.451 2.642 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -9.752 0.307 2.918 1.00 0.00 H new ATOM 758 N ILE A 50 -11.546 -0.517 0.607 1.00 0.00 N ATOM 759 CA ILE A 50 -12.654 -1.432 0.274 1.00 0.00 C ATOM 760 C ILE A 50 -12.841 -2.438 1.406 1.00 0.00 C ATOM 761 O ILE A 50 -11.898 -3.111 1.831 1.00 0.00 O ATOM 762 CB ILE A 50 -12.334 -2.151 -1.037 1.00 0.00 C ATOM 763 CG1 ILE A 50 -13.484 -3.090 -1.406 1.00 0.00 C ATOM 764 CG2 ILE A 50 -11.034 -2.942 -0.890 1.00 0.00 C ATOM 765 CD1 ILE A 50 -13.186 -3.829 -2.712 1.00 0.00 C ATOM 0 H ILE A 50 -10.870 -0.904 1.266 1.00 0.00 H new ATOM 0 HA ILE A 50 -13.580 -0.869 0.152 1.00 0.00 H new ATOM 0 HB ILE A 50 -12.211 -1.414 -1.831 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -13.643 -3.810 -0.604 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -14.407 -2.519 -1.509 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -10.811 -3.452 -1.827 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -10.219 -2.261 -0.645 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -11.144 -3.678 -0.093 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -14.018 -4.491 -2.954 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -13.052 -3.106 -3.517 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -12.276 -4.418 -2.597 1.00 0.00 H new ATOM 777 N PRO A 51 -14.086 -2.510 1.878 1.00 0.00 N ATOM 778 CA PRO A 51 -14.501 -3.440 2.937 1.00 0.00 C ATOM 779 C PRO A 51 -13.847 -4.817 2.829 1.00 0.00 C ATOM 780 O PRO A 51 -13.436 -5.246 1.748 1.00 0.00 O ATOM 781 CB PRO A 51 -16.016 -3.484 2.722 1.00 0.00 C ATOM 782 CG PRO A 51 -16.360 -2.101 2.161 1.00 0.00 C ATOM 783 CD PRO A 51 -15.171 -1.748 1.265 1.00 0.00 C ATOM 0 HA PRO A 51 -14.202 -3.122 3.936 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -16.296 -4.276 2.027 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -16.545 -3.677 3.655 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -17.292 -2.122 1.595 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -16.488 -1.369 2.959 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -15.340 -2.042 0.229 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -14.966 -0.677 1.263 1.00 0.00 H new ATOM 791 N GLY A 52 -13.771 -5.479 3.986 1.00 0.00 N ATOM 792 CA GLY A 52 -13.163 -6.818 4.100 1.00 0.00 C ATOM 793 C GLY A 52 -12.704 -7.403 2.769 1.00 0.00 C ATOM 794 O GLY A 52 -13.256 -8.402 2.299 1.00 0.00 O ATOM 0 H GLY A 52 -14.125 -5.110 4.868 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -12.309 -6.762 4.775 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -13.885 -7.497 4.554 1.00 0.00 H new ATOM 798 N PHE A 53 -11.688 -6.753 2.196 1.00 0.00 N ATOM 799 CA PHE A 53 -11.123 -7.171 0.900 1.00 0.00 C ATOM 800 C PHE A 53 -9.731 -6.571 0.736 1.00 0.00 C ATOM 801 O PHE A 53 -8.768 -7.295 0.467 1.00 0.00 O ATOM 802 CB PHE A 53 -12.033 -6.704 -0.238 1.00 0.00 C ATOM 803 CG PHE A 53 -11.467 -7.147 -1.573 1.00 0.00 C ATOM 804 CD1 PHE A 53 -10.879 -8.361 -1.678 1.00 0.00 C ATOM 805 CD2 PHE A 53 -11.548 -6.341 -2.659 1.00 0.00 C ATOM 806 CE1 PHE A 53 -10.373 -8.769 -2.865 1.00 0.00 C ATOM 807 CE2 PHE A 53 -11.041 -6.749 -3.845 1.00 0.00 C ATOM 808 CZ PHE A 53 -10.453 -7.963 -3.948 1.00 0.00 C ATOM 0 H PHE A 53 -11.236 -5.935 2.605 1.00 0.00 H new ATOM 0 HA PHE A 53 -11.051 -8.258 0.869 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -13.034 -7.114 -0.105 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -12.127 -5.618 -0.216 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -10.813 -9.005 -0.814 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -12.018 -5.372 -2.578 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -9.905 -9.739 -2.947 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -11.106 -6.105 -4.710 1.00 0.00 H new ATOM 0 HZ PHE A 53 -10.048 -8.288 -4.895 1.00 0.00 H new ATOM 818 N MET A 54 -9.660 -5.247 0.897 1.00 0.00 N ATOM 819 CA MET A 54 -8.398 -4.505 0.693 1.00 0.00 C ATOM 820 C MET A 54 -8.485 -3.070 1.223 1.00 0.00 C ATOM 821 O MET A 54 -9.527 -2.617 1.705 1.00 0.00 O ATOM 822 CB MET A 54 -8.087 -4.466 -0.804 1.00 0.00 C ATOM 823 CG MET A 54 -6.826 -3.643 -1.066 1.00 0.00 C ATOM 824 SD MET A 54 -6.486 -3.571 -2.839 1.00 0.00 S ATOM 825 CE MET A 54 -7.993 -2.781 -3.438 1.00 0.00 C ATOM 0 H MET A 54 -10.452 -4.664 1.166 1.00 0.00 H new ATOM 0 HA MET A 54 -7.610 -5.018 1.244 1.00 0.00 H new ATOM 0 HB2 MET A 54 -7.952 -5.480 -1.180 1.00 0.00 H new ATOM 0 HB3 MET A 54 -8.929 -4.035 -1.346 1.00 0.00 H new ATOM 0 HG2 MET A 54 -6.952 -2.635 -0.671 1.00 0.00 H new ATOM 0 HG3 MET A 54 -5.978 -4.086 -0.543 1.00 0.00 H new ATOM 0 HE1 MET A 54 -7.750 -2.115 -4.266 1.00 0.00 H new ATOM 0 HE2 MET A 54 -8.693 -3.544 -3.780 1.00 0.00 H new ATOM 0 HE3 MET A 54 -8.448 -2.207 -2.631 1.00 0.00 H new ATOM 835 N ILE A 55 -7.346 -2.385 1.105 1.00 0.00 N ATOM 836 CA ILE A 55 -7.215 -0.993 1.571 1.00 0.00 C ATOM 837 C ILE A 55 -5.744 -0.599 1.481 1.00 0.00 C ATOM 838 O ILE A 55 -4.885 -1.165 2.165 1.00 0.00 O ATOM 839 CB ILE A 55 -7.820 -0.822 2.972 1.00 0.00 C ATOM 840 CG1 ILE A 55 -7.372 0.507 3.594 1.00 0.00 C ATOM 841 CG2 ILE A 55 -7.473 -1.993 3.897 1.00 0.00 C ATOM 842 CD1 ILE A 55 -5.985 0.399 4.230 1.00 0.00 C ATOM 0 H ILE A 55 -6.496 -2.768 0.691 1.00 0.00 H new ATOM 0 HA ILE A 55 -7.784 -0.314 0.936 1.00 0.00 H new ATOM 0 HB ILE A 55 -8.904 -0.811 2.857 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -7.361 1.281 2.827 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -8.095 0.817 4.349 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -7.922 -1.828 4.876 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -7.859 -2.919 3.472 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -6.390 -2.065 4.002 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -5.705 1.361 4.659 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -6.003 -0.357 5.015 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -5.257 0.115 3.470 1.00 0.00 H new ATOM 854 N GLN A 56 -5.493 0.349 0.573 1.00 0.00 N ATOM 855 CA GLN A 56 -4.122 0.678 0.119 1.00 0.00 C ATOM 856 C GLN A 56 -3.553 1.908 0.836 1.00 0.00 C ATOM 857 O GLN A 56 -4.157 2.435 1.775 1.00 0.00 O ATOM 858 CB GLN A 56 -4.201 0.977 -1.382 1.00 0.00 C ATOM 859 CG GLN A 56 -4.951 -0.117 -2.147 1.00 0.00 C ATOM 860 CD GLN A 56 -5.015 0.173 -3.648 1.00 0.00 C ATOM 861 OE1 GLN A 56 -4.764 -0.834 -4.468 1.00 0.00 O flip ATOM 862 NE2 GLN A 56 -5.295 1.291 -4.078 1.00 0.00 N flip ATOM 0 H GLN A 56 -6.221 0.910 0.131 1.00 0.00 H new ATOM 0 HA GLN A 56 -3.465 -0.163 0.342 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -4.700 1.934 -1.535 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -3.193 1.075 -1.785 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -4.459 -1.076 -1.984 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -5.963 -0.207 -1.752 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -5.485 2.054 -3.429 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -5.337 1.455 -5.084 1.00 0.00 H new ATOM 871 N GLY A 57 -2.401 2.367 0.328 1.00 0.00 N ATOM 872 CA GLY A 57 -1.807 3.646 0.766 1.00 0.00 C ATOM 873 C GLY A 57 -0.861 4.240 -0.277 1.00 0.00 C ATOM 874 O GLY A 57 -0.724 3.733 -1.396 1.00 0.00 O ATOM 0 H GLY A 57 -1.860 1.877 -0.384 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -2.604 4.359 0.977 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -1.263 3.490 1.698 1.00 0.00 H new ATOM 878 N GLY A 58 -0.253 5.356 0.135 1.00 0.00 N ATOM 879 CA GLY A 58 0.445 6.262 -0.795 1.00 0.00 C ATOM 880 C GLY A 58 -0.549 7.335 -1.218 1.00 0.00 C ATOM 881 O GLY A 58 -0.347 8.525 -0.961 1.00 0.00 O ATOM 0 H GLY A 58 -0.228 5.658 1.109 1.00 0.00 H new ATOM 0 HA2 GLY A 58 1.313 6.712 -0.313 1.00 0.00 H new ATOM 0 HA3 GLY A 58 0.810 5.714 -1.663 1.00 0.00 H new ATOM 885 N GLY A 59 -1.637 6.863 -1.826 1.00 0.00 N ATOM 886 CA GLY A 59 -2.812 7.709 -2.092 1.00 0.00 C ATOM 887 C GLY A 59 -2.469 9.112 -2.575 1.00 0.00 C ATOM 888 O GLY A 59 -1.503 9.734 -2.124 1.00 0.00 O ATOM 0 H GLY A 59 -1.734 5.899 -2.146 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -3.436 7.221 -2.840 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -3.406 7.785 -1.181 1.00 0.00 H new ATOM 892 N PHE A 60 -3.322 9.582 -3.485 1.00 0.00 N ATOM 893 CA PHE A 60 -3.237 10.963 -3.997 1.00 0.00 C ATOM 894 C PHE A 60 -3.069 11.958 -2.844 1.00 0.00 C ATOM 895 O PHE A 60 -3.525 11.716 -1.722 1.00 0.00 O ATOM 896 CB PHE A 60 -4.509 11.259 -4.795 1.00 0.00 C ATOM 897 CG PHE A 60 -4.705 10.220 -5.886 1.00 0.00 C ATOM 898 CD1 PHE A 60 -3.633 9.560 -6.386 1.00 0.00 C ATOM 899 CD2 PHE A 60 -5.946 9.927 -6.342 1.00 0.00 C ATOM 900 CE1 PHE A 60 -3.803 8.614 -7.337 1.00 0.00 C ATOM 901 CE2 PHE A 60 -6.114 8.984 -7.297 1.00 0.00 C ATOM 902 CZ PHE A 60 -5.042 8.327 -7.794 1.00 0.00 C ATOM 0 H PHE A 60 -4.082 9.033 -3.887 1.00 0.00 H new ATOM 0 HA PHE A 60 -2.366 11.067 -4.644 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -5.371 11.262 -4.128 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -4.445 12.253 -5.238 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -2.641 9.790 -6.025 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -6.804 10.448 -5.942 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -2.947 8.087 -7.732 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -7.104 8.756 -7.662 1.00 0.00 H new ATOM 0 HZ PHE A 60 -5.176 7.573 -8.556 1.00 0.00 H new ATOM 912 N THR A 61 -2.397 13.067 -3.158 1.00 0.00 N ATOM 913 CA THR A 61 -2.044 14.071 -2.142 1.00 0.00 C ATOM 914 C THR A 61 -3.300 14.606 -1.469 1.00 0.00 C ATOM 915 O THR A 61 -3.808 15.666 -1.844 1.00 0.00 O ATOM 916 CB THR A 61 -1.298 15.220 -2.819 1.00 0.00 C ATOM 917 OG1 THR A 61 -0.117 14.719 -3.429 1.00 0.00 O ATOM 918 CG2 THR A 61 -0.920 16.281 -1.788 1.00 0.00 C ATOM 0 H THR A 61 -2.086 13.296 -4.102 1.00 0.00 H new ATOM 0 HA THR A 61 -1.411 13.609 -1.384 1.00 0.00 H new ATOM 0 HB THR A 61 -1.945 15.669 -3.573 1.00 0.00 H new ATOM 0 HG1 THR A 61 -0.349 14.263 -4.265 1.00 0.00 H new ATOM 0 HG21 THR A 61 -0.389 17.095 -2.281 1.00 0.00 H new ATOM 0 HG22 THR A 61 -1.823 16.670 -1.318 1.00 0.00 H new ATOM 0 HG23 THR A 61 -0.278 15.837 -1.028 1.00 0.00 H new ATOM 926 N GLU A 62 -3.756 13.858 -0.462 1.00 0.00 N ATOM 927 CA GLU A 62 -4.892 14.291 0.367 1.00 0.00 C ATOM 928 C GLU A 62 -6.052 14.753 -0.506 1.00 0.00 C ATOM 929 O GLU A 62 -5.938 15.743 -1.234 1.00 0.00 O ATOM 930 CB GLU A 62 -4.469 15.438 1.285 1.00 0.00 C ATOM 931 CG GLU A 62 -3.480 14.983 2.365 1.00 0.00 C ATOM 932 CD GLU A 62 -2.136 14.516 1.802 1.00 0.00 C ATOM 933 OE1 GLU A 62 -1.237 15.363 1.601 1.00 0.00 O ATOM 934 OE2 GLU A 62 -1.971 13.300 1.559 1.00 0.00 O ATOM 0 H GLU A 62 -3.362 12.955 -0.199 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.214 13.440 0.968 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.014 16.229 0.689 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -5.352 15.865 1.760 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.308 15.805 3.059 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.927 14.171 2.938 1.00 0.00 H new ATOM 941 N GLN A 63 -7.159 14.020 -0.395 1.00 0.00 N ATOM 942 CA GLN A 63 -8.386 14.332 -1.149 1.00 0.00 C ATOM 943 C GLN A 63 -8.193 14.070 -2.641 1.00 0.00 C ATOM 944 O GLN A 63 -9.032 13.415 -3.266 1.00 0.00 O ATOM 945 CB GLN A 63 -8.863 15.767 -0.897 1.00 0.00 C ATOM 946 CG GLN A 63 -7.946 16.812 -1.536 1.00 0.00 C ATOM 947 CD GLN A 63 -8.470 18.226 -1.301 1.00 0.00 C ATOM 948 OE1 GLN A 63 -7.760 19.118 -0.838 1.00 0.00 O ATOM 949 NE2 GLN A 63 -9.731 18.446 -1.625 1.00 0.00 N ATOM 0 H GLN A 63 -7.238 13.203 0.210 1.00 0.00 H new ATOM 0 HA GLN A 63 -9.168 13.665 -0.786 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -9.872 15.885 -1.291 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -8.917 15.945 0.177 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -6.942 16.720 -1.122 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -7.867 16.624 -2.607 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -10.299 17.690 -2.007 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -10.137 19.372 -1.493 1.00 0.00 H new ATOM 958 N MET A 64 -7.090 14.590 -3.184 1.00 0.00 N ATOM 959 CA MET A 64 -6.749 14.386 -4.599 1.00 0.00 C ATOM 960 C MET A 64 -5.795 15.488 -5.035 1.00 0.00 C ATOM 961 O MET A 64 -6.177 16.608 -5.383 1.00 0.00 O ATOM 962 CB MET A 64 -7.993 14.345 -5.480 1.00 0.00 C ATOM 963 CG MET A 64 -8.911 13.209 -5.037 1.00 0.00 C ATOM 964 SD MET A 64 -7.989 11.663 -5.142 1.00 0.00 S ATOM 965 CE MET A 64 -9.229 10.462 -4.621 1.00 0.00 C ATOM 0 H MET A 64 -6.416 15.156 -2.668 1.00 0.00 H new ATOM 0 HA MET A 64 -6.262 13.418 -4.713 1.00 0.00 H new ATOM 0 HB2 MET A 64 -8.523 15.296 -5.420 1.00 0.00 H new ATOM 0 HB3 MET A 64 -7.706 14.206 -6.522 1.00 0.00 H new ATOM 0 HG2 MET A 64 -9.257 13.376 -4.017 1.00 0.00 H new ATOM 0 HG3 MET A 64 -9.796 13.167 -5.671 1.00 0.00 H new ATOM 0 HE1 MET A 64 -8.906 9.460 -4.903 1.00 0.00 H new ATOM 0 HE2 MET A 64 -9.353 10.513 -3.539 1.00 0.00 H new ATOM 0 HE3 MET A 64 -10.179 10.686 -5.106 1.00 0.00 H new ATOM 975 N GLN A 65 -4.540 15.069 -5.004 1.00 0.00 N ATOM 976 CA GLN A 65 -3.407 15.871 -5.493 1.00 0.00 C ATOM 977 C GLN A 65 -2.376 14.856 -5.970 1.00 0.00 C ATOM 978 O GLN A 65 -1.432 14.506 -5.256 1.00 0.00 O ATOM 979 CB GLN A 65 -2.870 16.780 -4.382 1.00 0.00 C ATOM 980 CG GLN A 65 -1.656 17.561 -4.885 1.00 0.00 C ATOM 981 CD GLN A 65 -1.103 18.492 -3.806 1.00 0.00 C ATOM 982 OE1 GLN A 65 -0.545 18.054 -2.801 1.00 0.00 O ATOM 983 NE2 GLN A 65 -1.249 19.793 -3.997 1.00 0.00 N ATOM 0 H GLN A 65 -4.267 14.157 -4.638 1.00 0.00 H new ATOM 0 HA GLN A 65 -3.687 16.544 -6.303 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -3.648 17.471 -4.058 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -2.594 16.182 -3.514 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -0.879 16.865 -5.199 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -1.935 18.144 -5.762 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -1.715 20.136 -4.837 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -0.896 20.453 -3.304 1.00 0.00 H new ATOM 992 N GLN A 66 -2.641 14.360 -7.180 1.00 0.00 N ATOM 993 CA GLN A 66 -1.951 13.172 -7.716 1.00 0.00 C ATOM 994 C GLN A 66 -0.549 12.921 -7.170 1.00 0.00 C ATOM 995 O GLN A 66 0.000 13.673 -6.361 1.00 0.00 O ATOM 996 CB GLN A 66 -1.877 13.227 -9.245 1.00 0.00 C ATOM 997 CG GLN A 66 -1.093 14.441 -9.751 1.00 0.00 C ATOM 998 CD GLN A 66 -1.837 15.750 -9.510 1.00 0.00 C ATOM 999 OE1 GLN A 66 -1.319 16.699 -8.922 1.00 0.00 O ATOM 1000 NE2 GLN A 66 -3.074 15.815 -9.969 1.00 0.00 N ATOM 0 H GLN A 66 -3.331 14.761 -7.815 1.00 0.00 H new ATOM 0 HA GLN A 66 -2.566 12.339 -7.375 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -1.408 12.316 -9.616 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -2.887 13.255 -9.654 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -0.124 14.479 -9.253 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -0.899 14.327 -10.817 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -3.481 15.015 -10.453 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -3.622 16.665 -9.839 1.00 0.00 H new ATOM 1009 N LYS A 67 -0.033 11.796 -7.656 1.00 0.00 N ATOM 1010 CA LYS A 67 1.255 11.260 -7.192 1.00 0.00 C ATOM 1011 C LYS A 67 2.345 12.324 -7.159 1.00 0.00 C ATOM 1012 O LYS A 67 2.118 13.473 -6.767 1.00 0.00 O ATOM 1013 CB LYS A 67 1.687 10.153 -8.149 1.00 0.00 C ATOM 1014 CG LYS A 67 0.512 9.219 -8.458 1.00 0.00 C ATOM 1015 CD LYS A 67 -0.654 9.964 -9.143 1.00 0.00 C ATOM 1016 CE LYS A 67 -1.839 9.070 -9.559 1.00 0.00 C ATOM 1017 NZ LYS A 67 -2.626 8.574 -8.412 1.00 0.00 N ATOM 0 H LYS A 67 -0.485 11.231 -8.375 1.00 0.00 H new ATOM 0 HA LYS A 67 1.120 10.888 -6.176 1.00 0.00 H new ATOM 0 HB2 LYS A 67 2.064 10.591 -9.074 1.00 0.00 H new ATOM 0 HB3 LYS A 67 2.506 9.583 -7.709 1.00 0.00 H new ATOM 0 HG2 LYS A 67 0.853 8.409 -9.102 1.00 0.00 H new ATOM 0 HG3 LYS A 67 0.158 8.764 -7.533 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -1.020 10.736 -8.467 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -0.272 10.471 -10.029 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -2.494 9.633 -10.224 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -1.462 8.220 -10.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -3.407 7.980 -8.758 1.00 0.00 H new ATOM 1031 N LYS A 68 3.530 11.878 -7.576 1.00 0.00 N ATOM 1032 CA LYS A 68 4.716 12.744 -7.624 1.00 0.00 C ATOM 1033 C LYS A 68 5.894 11.906 -8.104 1.00 0.00 C ATOM 1034 O LYS A 68 6.367 12.070 -9.232 1.00 0.00 O ATOM 1035 CB LYS A 68 4.994 13.313 -6.236 1.00 0.00 C ATOM 1036 CG LYS A 68 6.220 14.236 -6.289 1.00 0.00 C ATOM 1037 CD LYS A 68 6.554 14.962 -4.969 1.00 0.00 C ATOM 1038 CE LYS A 68 7.101 14.048 -3.855 1.00 0.00 C ATOM 1039 NZ LYS A 68 7.444 14.818 -2.646 1.00 0.00 N ATOM 0 H LYS A 68 3.698 10.921 -7.887 1.00 0.00 H new ATOM 0 HA LYS A 68 4.555 13.578 -8.307 1.00 0.00 H new ATOM 0 HB2 LYS A 68 4.126 13.867 -5.879 1.00 0.00 H new ATOM 0 HB3 LYS A 68 5.168 12.502 -5.529 1.00 0.00 H new ATOM 0 HG2 LYS A 68 7.086 13.646 -6.590 1.00 0.00 H new ATOM 0 HG3 LYS A 68 6.058 14.984 -7.065 1.00 0.00 H new ATOM 0 HD2 LYS A 68 7.287 15.742 -5.174 1.00 0.00 H new ATOM 0 HD3 LYS A 68 5.654 15.458 -4.605 1.00 0.00 H new ATOM 0 HE2 LYS A 68 6.358 13.290 -3.607 1.00 0.00 H new ATOM 0 HE3 LYS A 68 7.985 13.522 -4.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 7.809 14.174 -1.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 8.171 15.524 -2.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 6.595 15.300 -2.289 1.00 0.00 H new ATOM 1053 N PRO A 69 6.340 11.004 -7.227 1.00 0.00 N ATOM 1054 CA PRO A 69 7.380 10.012 -7.538 1.00 0.00 C ATOM 1055 C PRO A 69 6.922 9.068 -8.648 1.00 0.00 C ATOM 1056 O PRO A 69 5.809 8.535 -8.614 1.00 0.00 O ATOM 1057 CB PRO A 69 7.524 9.278 -6.201 1.00 0.00 C ATOM 1058 CG PRO A 69 6.161 9.430 -5.523 1.00 0.00 C ATOM 1059 CD PRO A 69 5.696 10.829 -5.926 1.00 0.00 C ATOM 0 HA PRO A 69 8.312 10.443 -7.903 1.00 0.00 H new ATOM 0 HB2 PRO A 69 7.776 8.228 -6.351 1.00 0.00 H new ATOM 0 HB3 PRO A 69 8.318 9.713 -5.594 1.00 0.00 H new ATOM 0 HG2 PRO A 69 5.461 8.665 -5.860 1.00 0.00 H new ATOM 0 HG3 PRO A 69 6.242 9.334 -4.440 1.00 0.00 H new ATOM 0 HD2 PRO A 69 4.610 10.893 -5.997 1.00 0.00 H new ATOM 0 HD3 PRO A 69 6.014 11.586 -5.209 1.00 0.00 H new ATOM 1067 N ASN A 70 7.826 8.876 -9.611 1.00 0.00 N ATOM 1068 CA ASN A 70 7.590 7.959 -10.740 1.00 0.00 C ATOM 1069 C ASN A 70 8.924 7.780 -11.464 1.00 0.00 C ATOM 1070 O ASN A 70 9.125 8.303 -12.564 1.00 0.00 O ATOM 1071 CB ASN A 70 6.506 8.523 -11.670 1.00 0.00 C ATOM 1072 CG ASN A 70 5.147 8.578 -10.983 1.00 0.00 C ATOM 1073 OD1 ASN A 70 4.908 7.912 -9.977 1.00 0.00 O ATOM 1074 ND2 ASN A 70 4.235 9.372 -11.519 1.00 0.00 N ATOM 0 H ASN A 70 8.733 9.343 -9.636 1.00 0.00 H new ATOM 0 HA ASN A 70 7.227 6.992 -10.393 1.00 0.00 H new ATOM 0 HB2 ASN A 70 6.790 9.524 -11.995 1.00 0.00 H new ATOM 0 HB3 ASN A 70 6.437 7.905 -12.565 1.00 0.00 H new ATOM 0 HD21 ASN A 70 3.309 9.442 -11.098 1.00 0.00 H new ATOM 0 HD22 ASN A 70 4.458 9.914 -12.354 1.00 0.00 H new ATOM 1081 N PRO A 71 9.829 7.045 -10.814 1.00 0.00 N ATOM 1082 CA PRO A 71 11.199 6.841 -11.295 1.00 0.00 C ATOM 1083 C PRO A 71 11.206 6.439 -12.772 1.00 0.00 C ATOM 1084 O PRO A 71 11.653 7.237 -13.598 1.00 0.00 O ATOM 1085 CB PRO A 71 11.747 5.834 -10.285 1.00 0.00 C ATOM 1086 CG PRO A 71 10.951 6.109 -9.005 1.00 0.00 C ATOM 1087 CD PRO A 71 9.549 6.479 -9.497 1.00 0.00 C ATOM 0 HA PRO A 71 11.841 7.721 -11.322 1.00 0.00 H new ATOM 0 HB2 PRO A 71 11.606 4.809 -10.629 1.00 0.00 H new ATOM 0 HB3 PRO A 71 12.816 5.972 -10.126 1.00 0.00 H new ATOM 0 HG2 PRO A 71 10.926 5.233 -8.357 1.00 0.00 H new ATOM 0 HG3 PRO A 71 11.396 6.919 -8.428 1.00 0.00 H new ATOM 0 HD2 PRO A 71 8.895 5.609 -9.557 1.00 0.00 H new ATOM 0 HD3 PRO A 71 9.062 7.199 -8.839 1.00 0.00 H new ATOM 1095 N PRO A 72 10.652 5.283 -13.175 1.00 0.00 N ATOM 1096 CA PRO A 72 10.057 4.311 -12.236 1.00 0.00 C ATOM 1097 C PRO A 72 11.125 3.328 -11.714 1.00 0.00 C ATOM 1098 O PRO A 72 12.262 3.735 -11.455 1.00 0.00 O ATOM 1099 CB PRO A 72 9.056 3.572 -13.143 1.00 0.00 C ATOM 1100 CG PRO A 72 8.758 4.537 -14.286 1.00 0.00 C ATOM 1101 CD PRO A 72 10.132 5.152 -14.544 1.00 0.00 C ATOM 0 HA PRO A 72 9.613 4.769 -11.352 1.00 0.00 H new ATOM 0 HB2 PRO A 72 9.478 2.639 -13.516 1.00 0.00 H new ATOM 0 HB3 PRO A 72 8.147 3.315 -12.598 1.00 0.00 H new ATOM 0 HG2 PRO A 72 8.369 4.022 -15.165 1.00 0.00 H new ATOM 0 HG3 PRO A 72 8.020 5.288 -14.005 1.00 0.00 H new ATOM 0 HD2 PRO A 72 10.760 4.510 -15.162 1.00 0.00 H new ATOM 0 HD3 PRO A 72 10.063 6.114 -15.051 1.00 0.00 H new ATOM 1109 N ILE A 73 10.750 2.049 -11.579 1.00 0.00 N ATOM 1110 CA ILE A 73 11.702 0.985 -11.194 1.00 0.00 C ATOM 1111 C ILE A 73 11.183 -0.391 -11.614 1.00 0.00 C ATOM 1112 O ILE A 73 9.974 -0.629 -11.694 1.00 0.00 O ATOM 1113 CB ILE A 73 11.982 1.003 -9.688 1.00 0.00 C ATOM 1114 CG1 ILE A 73 10.755 0.556 -8.887 1.00 0.00 C ATOM 1115 CG2 ILE A 73 12.432 2.396 -9.249 1.00 0.00 C ATOM 1116 CD1 ILE A 73 9.624 1.580 -8.957 1.00 0.00 C ATOM 0 H ILE A 73 9.796 1.721 -11.729 1.00 0.00 H new ATOM 0 HA ILE A 73 12.637 1.182 -11.718 1.00 0.00 H new ATOM 0 HB ILE A 73 12.785 0.294 -9.486 1.00 0.00 H new ATOM 0 HG12 ILE A 73 10.402 -0.402 -9.269 1.00 0.00 H new ATOM 0 HG13 ILE A 73 11.039 0.399 -7.846 1.00 0.00 H new ATOM 0 HG21 ILE A 73 12.627 2.394 -8.177 1.00 0.00 H new ATOM 0 HG22 ILE A 73 13.342 2.670 -9.783 1.00 0.00 H new ATOM 0 HG23 ILE A 73 11.648 3.119 -9.474 1.00 0.00 H new ATOM 0 HD11 ILE A 73 8.774 1.223 -8.376 1.00 0.00 H new ATOM 0 HD12 ILE A 73 9.968 2.531 -8.550 1.00 0.00 H new ATOM 0 HD13 ILE A 73 9.322 1.718 -9.995 1.00 0.00 H new ATOM 1128 N LYS A 74 12.147 -1.275 -11.875 1.00 0.00 N ATOM 1129 CA LYS A 74 11.854 -2.642 -12.342 1.00 0.00 C ATOM 1130 C LYS A 74 10.521 -3.178 -11.824 1.00 0.00 C ATOM 1131 O LYS A 74 10.109 -2.884 -10.698 1.00 0.00 O ATOM 1132 CB LYS A 74 12.981 -3.559 -11.876 1.00 0.00 C ATOM 1133 CG LYS A 74 14.335 -3.018 -12.346 1.00 0.00 C ATOM 1134 CD LYS A 74 14.400 -2.847 -13.875 1.00 0.00 C ATOM 1135 CE LYS A 74 15.755 -2.288 -14.347 1.00 0.00 C ATOM 1136 NZ LYS A 74 15.792 -2.127 -15.811 1.00 0.00 N ATOM 0 H LYS A 74 13.142 -1.074 -11.772 1.00 0.00 H new ATOM 0 HA LYS A 74 11.781 -2.614 -13.429 1.00 0.00 H new ATOM 0 HB2 LYS A 74 12.970 -3.636 -10.789 1.00 0.00 H new ATOM 0 HB3 LYS A 74 12.827 -4.564 -12.269 1.00 0.00 H new ATOM 0 HG2 LYS A 74 14.525 -2.057 -11.867 1.00 0.00 H new ATOM 0 HG3 LYS A 74 15.126 -3.696 -12.025 1.00 0.00 H new ATOM 0 HD2 LYS A 74 14.221 -3.810 -14.353 1.00 0.00 H new ATOM 0 HD3 LYS A 74 13.602 -2.178 -14.197 1.00 0.00 H new ATOM 0 HE2 LYS A 74 15.939 -1.326 -13.869 1.00 0.00 H new ATOM 0 HE3 LYS A 74 16.555 -2.958 -14.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 16.718 -1.749 -16.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 15.641 -3.050 -16.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 15.043 -1.468 -16.107 1.00 0.00 H new ATOM 1150 N ASN A 75 9.883 -3.978 -12.680 1.00 0.00 N ATOM 1151 CA ASN A 75 8.585 -4.598 -12.349 1.00 0.00 C ATOM 1152 C ASN A 75 8.549 -5.141 -10.915 1.00 0.00 C ATOM 1153 O ASN A 75 9.425 -4.841 -10.097 1.00 0.00 O ATOM 1154 CB ASN A 75 8.313 -5.718 -13.356 1.00 0.00 C ATOM 1155 CG ASN A 75 8.292 -5.169 -14.780 1.00 0.00 C ATOM 1156 OD1 ASN A 75 7.267 -4.709 -15.281 1.00 0.00 O ATOM 1157 ND2 ASN A 75 9.430 -5.202 -15.452 1.00 0.00 N ATOM 0 H ASN A 75 10.237 -4.215 -13.607 1.00 0.00 H new ATOM 0 HA ASN A 75 7.808 -3.836 -12.409 1.00 0.00 H new ATOM 0 HB2 ASN A 75 9.081 -6.487 -13.269 1.00 0.00 H new ATOM 0 HB3 ASN A 75 7.359 -6.193 -13.130 1.00 0.00 H new ATOM 0 HD21 ASN A 75 9.470 -4.842 -16.405 1.00 0.00 H new ATOM 0 HD22 ASN A 75 10.268 -5.588 -15.017 1.00 0.00 H new ATOM 1164 N GLU A 76 7.507 -5.929 -10.644 1.00 0.00 N ATOM 1165 CA GLU A 76 7.294 -6.488 -9.301 1.00 0.00 C ATOM 1166 C GLU A 76 5.849 -6.940 -9.142 1.00 0.00 C ATOM 1167 O GLU A 76 4.916 -6.135 -9.217 1.00 0.00 O ATOM 1168 CB GLU A 76 7.672 -5.436 -8.259 1.00 0.00 C ATOM 1169 CG GLU A 76 7.080 -4.061 -8.593 1.00 0.00 C ATOM 1170 CD GLU A 76 5.552 -4.046 -8.610 1.00 0.00 C ATOM 1171 OE1 GLU A 76 4.937 -3.845 -7.539 1.00 0.00 O ATOM 1172 OE2 GLU A 76 4.956 -4.232 -9.694 1.00 0.00 O ATOM 0 H GLU A 76 6.800 -6.195 -11.329 1.00 0.00 H new ATOM 0 HA GLU A 76 7.926 -7.364 -9.157 1.00 0.00 H new ATOM 0 HB2 GLU A 76 7.320 -5.754 -7.278 1.00 0.00 H new ATOM 0 HB3 GLU A 76 8.758 -5.359 -8.198 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.435 -3.334 -7.863 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.450 -3.741 -9.567 1.00 0.00 H new ATOM 1179 N ALA A 77 5.711 -8.247 -8.914 1.00 0.00 N ATOM 1180 CA ALA A 77 4.389 -8.872 -8.752 1.00 0.00 C ATOM 1181 C ALA A 77 4.566 -10.384 -8.654 1.00 0.00 C ATOM 1182 O ALA A 77 4.056 -11.012 -7.722 1.00 0.00 O ATOM 1183 CB ALA A 77 3.488 -8.520 -9.937 1.00 0.00 C ATOM 0 H ALA A 77 6.494 -8.896 -8.837 1.00 0.00 H new ATOM 0 HA ALA A 77 3.917 -8.499 -7.843 1.00 0.00 H new ATOM 0 HB1 ALA A 77 2.513 -8.989 -9.805 1.00 0.00 H new ATOM 0 HB2 ALA A 77 3.366 -7.438 -9.993 1.00 0.00 H new ATOM 0 HB3 ALA A 77 3.942 -8.882 -10.859 1.00 0.00 H new ATOM 1189 N ASP A 78 5.299 -10.935 -9.627 1.00 0.00 N ATOM 1190 CA ASP A 78 5.594 -12.379 -9.663 1.00 0.00 C ATOM 1191 C ASP A 78 6.566 -12.784 -8.558 1.00 0.00 C ATOM 1192 O ASP A 78 7.436 -13.629 -8.782 1.00 0.00 O ATOM 1193 CB ASP A 78 6.210 -12.706 -11.020 1.00 0.00 C ATOM 1194 CG ASP A 78 7.526 -11.967 -11.217 1.00 0.00 C ATOM 1195 OD1 ASP A 78 7.956 -11.252 -10.286 1.00 0.00 O ATOM 1196 OD2 ASP A 78 8.138 -12.096 -12.299 1.00 0.00 O ATOM 0 H ASP A 78 5.701 -10.407 -10.402 1.00 0.00 H new ATOM 0 HA ASP A 78 4.667 -12.930 -9.507 1.00 0.00 H new ATOM 0 HB2 ASP A 78 6.378 -13.780 -11.097 1.00 0.00 H new ATOM 0 HB3 ASP A 78 5.514 -12.434 -11.814 1.00 0.00 H new ATOM 1201 N ASN A 79 6.387 -12.183 -7.379 1.00 0.00 N ATOM 1202 CA ASN A 79 7.209 -12.515 -6.202 1.00 0.00 C ATOM 1203 C ASN A 79 7.451 -14.021 -6.111 1.00 0.00 C ATOM 1204 O ASN A 79 8.563 -14.451 -5.791 1.00 0.00 O ATOM 1205 CB ASN A 79 6.500 -12.024 -4.939 1.00 0.00 C ATOM 1206 CG ASN A 79 5.146 -12.708 -4.774 1.00 0.00 C ATOM 1207 OD1 ASN A 79 4.988 -13.660 -4.011 1.00 0.00 O ATOM 1208 ND2 ASN A 79 4.147 -12.232 -5.496 1.00 0.00 N ATOM 0 H ASN A 79 5.683 -11.465 -7.209 1.00 0.00 H new ATOM 0 HA ASN A 79 8.177 -12.023 -6.299 1.00 0.00 H new ATOM 0 HB2 ASN A 79 7.122 -12.225 -4.067 1.00 0.00 H new ATOM 0 HB3 ASN A 79 6.362 -10.944 -4.991 1.00 0.00 H new ATOM 0 HD21 ASN A 79 3.221 -12.655 -5.427 1.00 0.00 H new ATOM 0 HD22 ASN A 79 4.301 -11.442 -6.122 1.00 0.00 H new ATOM 1215 N GLY A 80 6.396 -14.791 -6.390 1.00 0.00 N ATOM 1216 CA GLY A 80 6.467 -16.257 -6.313 1.00 0.00 C ATOM 1217 C GLY A 80 6.732 -16.681 -4.877 1.00 0.00 C ATOM 1218 O GLY A 80 7.826 -17.147 -4.547 1.00 0.00 O ATOM 0 H GLY A 80 5.485 -14.428 -6.670 1.00 0.00 H new ATOM 0 HA2 GLY A 80 5.533 -16.695 -6.666 1.00 0.00 H new ATOM 0 HA3 GLY A 80 7.259 -16.627 -6.964 1.00 0.00 H new ATOM 1222 N LEU A 81 5.699 -16.500 -4.051 1.00 0.00 N ATOM 1223 CA LEU A 81 5.763 -16.859 -2.618 1.00 0.00 C ATOM 1224 C LEU A 81 4.361 -16.925 -2.005 1.00 0.00 C ATOM 1225 O LEU A 81 3.348 -16.695 -2.673 1.00 0.00 O ATOM 1226 CB LEU A 81 6.588 -15.817 -1.857 1.00 0.00 C ATOM 1227 CG LEU A 81 7.995 -15.668 -2.443 1.00 0.00 C ATOM 1228 CD1 LEU A 81 8.775 -14.588 -1.686 1.00 0.00 C ATOM 1229 CD2 LEU A 81 8.735 -17.006 -2.375 1.00 0.00 C ATOM 0 H LEU A 81 4.804 -16.107 -4.343 1.00 0.00 H new ATOM 0 HA LEU A 81 6.231 -17.840 -2.538 1.00 0.00 H new ATOM 0 HB2 LEU A 81 6.077 -14.855 -1.889 1.00 0.00 H new ATOM 0 HB3 LEU A 81 6.660 -16.105 -0.808 1.00 0.00 H new ATOM 0 HG LEU A 81 7.911 -15.366 -3.487 1.00 0.00 H new ATOM 0 HD11 LEU A 81 9.773 -14.493 -2.113 1.00 0.00 H new ATOM 0 HD12 LEU A 81 8.252 -13.635 -1.770 1.00 0.00 H new ATOM 0 HD13 LEU A 81 8.855 -14.866 -0.635 1.00 0.00 H new ATOM 0 HD21 LEU A 81 9.735 -16.891 -2.794 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.812 -17.327 -1.336 1.00 0.00 H new ATOM 0 HD23 LEU A 81 8.186 -17.755 -2.946 1.00 0.00 H new ATOM 1241 N ARG A 82 4.356 -17.236 -0.708 1.00 0.00 N ATOM 1242 CA ARG A 82 3.115 -17.247 0.087 1.00 0.00 C ATOM 1243 C ARG A 82 2.638 -15.820 0.345 1.00 0.00 C ATOM 1244 O ARG A 82 3.438 -14.926 0.637 1.00 0.00 O ATOM 1245 CB ARG A 82 3.392 -17.956 1.410 1.00 0.00 C ATOM 1246 CG ARG A 82 3.848 -19.394 1.142 1.00 0.00 C ATOM 1247 CD ARG A 82 2.825 -20.173 0.298 1.00 0.00 C ATOM 1248 NE ARG A 82 3.297 -21.553 0.028 1.00 0.00 N ATOM 1249 CZ ARG A 82 2.629 -22.455 -0.719 1.00 0.00 C ATOM 1250 NH1 ARG A 82 1.456 -22.215 -1.303 1.00 0.00 N ATOM 1251 NH2 ARG A 82 3.170 -23.648 -0.882 1.00 0.00 N ATOM 0 H ARG A 82 5.193 -17.484 -0.181 1.00 0.00 H new ATOM 0 HA ARG A 82 2.332 -17.773 -0.459 1.00 0.00 H new ATOM 0 HB2 ARG A 82 4.160 -17.419 1.967 1.00 0.00 H new ATOM 0 HB3 ARG A 82 2.493 -17.959 2.027 1.00 0.00 H new ATOM 0 HG2 ARG A 82 4.808 -19.380 0.626 1.00 0.00 H new ATOM 0 HG3 ARG A 82 4.003 -19.908 2.090 1.00 0.00 H new ATOM 0 HD2 ARG A 82 1.869 -20.208 0.820 1.00 0.00 H new ATOM 0 HD3 ARG A 82 2.655 -19.653 -0.644 1.00 0.00 H new ATOM 0 HE ARG A 82 4.187 -21.839 0.435 1.00 0.00 H new ATOM 0 HH11 ARG A 82 1.011 -21.303 -1.197 1.00 0.00 H new ATOM 0 HH12 ARG A 82 1.003 -22.943 -1.856 1.00 0.00 H new ATOM 0 HH21 ARG A 82 4.068 -23.864 -0.449 1.00 0.00 H new ATOM 0 HH22 ARG A 82 2.690 -24.353 -1.441 1.00 0.00 H new ATOM 1265 N ASN A 83 1.319 -15.648 0.230 1.00 0.00 N ATOM 1266 CA ASN A 83 0.679 -14.327 0.398 1.00 0.00 C ATOM 1267 C ASN A 83 -0.777 -14.507 0.822 1.00 0.00 C ATOM 1268 O ASN A 83 -1.519 -15.308 0.246 1.00 0.00 O ATOM 1269 CB ASN A 83 0.771 -13.548 -0.916 1.00 0.00 C ATOM 1270 CG ASN A 83 2.227 -13.309 -1.295 1.00 0.00 C ATOM 1271 OD1 ASN A 83 3.034 -12.950 -0.314 1.00 0.00 O flip ATOM 1272 ND2 ASN A 83 2.632 -13.438 -2.449 1.00 0.00 N flip ATOM 0 H ASN A 83 0.667 -16.404 0.021 1.00 0.00 H new ATOM 0 HA ASN A 83 1.194 -13.764 1.176 1.00 0.00 H new ATOM 0 HB2 ASN A 83 0.269 -14.102 -1.709 1.00 0.00 H new ATOM 0 HB3 ASN A 83 0.254 -12.594 -0.817 1.00 0.00 H new ATOM 0 HD21 ASN A 83 1.986 -13.717 -3.188 1.00 0.00 H new ATOM 0 HD22 ASN A 83 3.614 -13.266 -2.667 1.00 0.00 H new ATOM 1279 N THR A 84 -1.142 -13.737 1.849 1.00 0.00 N ATOM 1280 CA THR A 84 -2.452 -13.876 2.505 1.00 0.00 C ATOM 1281 C THR A 84 -2.738 -12.681 3.414 1.00 0.00 C ATOM 1282 O THR A 84 -1.825 -12.038 3.942 1.00 0.00 O ATOM 1283 CB THR A 84 -2.394 -15.150 3.346 1.00 0.00 C ATOM 1284 OG1 THR A 84 -2.404 -16.282 2.489 1.00 0.00 O ATOM 1285 CG2 THR A 84 -3.582 -15.221 4.298 1.00 0.00 C ATOM 0 H THR A 84 -0.550 -13.008 2.248 1.00 0.00 H new ATOM 0 HA THR A 84 -3.244 -13.921 1.757 1.00 0.00 H new ATOM 0 HB THR A 84 -1.477 -15.139 3.935 1.00 0.00 H new ATOM 0 HG1 THR A 84 -2.384 -15.986 1.555 1.00 0.00 H new ATOM 0 HG21 THR A 84 -3.522 -16.136 4.888 1.00 0.00 H new ATOM 0 HG22 THR A 84 -3.567 -14.358 4.964 1.00 0.00 H new ATOM 0 HG23 THR A 84 -4.509 -15.220 3.724 1.00 0.00 H new ATOM 1293 N ARG A 85 -4.039 -12.452 3.615 1.00 0.00 N ATOM 1294 CA ARG A 85 -4.513 -11.497 4.631 1.00 0.00 C ATOM 1295 C ARG A 85 -3.596 -11.497 5.833 1.00 0.00 C ATOM 1296 O ARG A 85 -3.501 -12.448 6.608 1.00 0.00 O ATOM 1297 CB ARG A 85 -5.929 -11.886 5.046 1.00 0.00 C ATOM 1298 CG ARG A 85 -6.420 -10.993 6.191 1.00 0.00 C ATOM 1299 CD ARG A 85 -7.821 -11.389 6.692 1.00 0.00 C ATOM 1300 NE ARG A 85 -8.249 -10.526 7.819 1.00 0.00 N ATOM 1301 CZ ARG A 85 -9.403 -10.677 8.499 1.00 0.00 C ATOM 1302 NH1 ARG A 85 -10.305 -11.621 8.234 1.00 0.00 N ATOM 1303 NH2 ARG A 85 -9.655 -9.840 9.488 1.00 0.00 N ATOM 0 H ARG A 85 -4.784 -12.912 3.091 1.00 0.00 H new ATOM 0 HA ARG A 85 -4.514 -10.491 4.211 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -6.602 -11.796 4.193 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -5.948 -12.930 5.358 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -5.713 -11.049 7.019 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -6.438 -9.956 5.856 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -8.539 -11.309 5.876 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -7.816 -12.432 7.010 1.00 0.00 H new ATOM 0 HE ARG A 85 -7.628 -9.767 8.099 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -10.141 -12.285 7.477 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -11.159 -11.680 8.788 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -8.985 -9.106 9.718 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -10.519 -9.927 10.022 1.00 0.00 H new ATOM 1317 N GLY A 86 -2.892 -10.389 5.964 1.00 0.00 N ATOM 1318 CA GLY A 86 -3.098 -9.267 5.039 1.00 0.00 C ATOM 1319 C GLY A 86 -1.763 -8.664 4.624 1.00 0.00 C ATOM 1320 O GLY A 86 -1.360 -7.613 5.128 1.00 0.00 O ATOM 0 H GLY A 86 -2.185 -10.233 6.682 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -3.638 -9.610 4.157 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -3.715 -8.505 5.515 1.00 0.00 H new ATOM 1324 N THR A 87 -1.120 -9.351 3.679 1.00 0.00 N ATOM 1325 CA THR A 87 0.109 -8.838 3.046 1.00 0.00 C ATOM 1326 C THR A 87 -0.150 -7.515 2.338 1.00 0.00 C ATOM 1327 O THR A 87 -1.159 -7.341 1.647 1.00 0.00 O ATOM 1328 CB THR A 87 0.610 -9.849 2.017 1.00 0.00 C ATOM 1329 OG1 THR A 87 -0.422 -10.128 1.082 1.00 0.00 O ATOM 1330 CG2 THR A 87 1.033 -11.141 2.708 1.00 0.00 C ATOM 0 H THR A 87 -1.423 -10.261 3.332 1.00 0.00 H new ATOM 0 HA THR A 87 0.853 -8.683 3.827 1.00 0.00 H new ATOM 0 HB THR A 87 1.471 -9.427 1.498 1.00 0.00 H new ATOM 0 HG1 THR A 87 -1.174 -9.518 1.234 1.00 0.00 H new ATOM 0 HG21 THR A 87 1.388 -11.853 1.963 1.00 0.00 H new ATOM 0 HG22 THR A 87 1.833 -10.929 3.417 1.00 0.00 H new ATOM 0 HG23 THR A 87 0.181 -11.566 3.238 1.00 0.00 H new ATOM 1338 N ILE A 88 0.830 -6.624 2.496 1.00 0.00 N ATOM 1339 CA ILE A 88 0.962 -5.451 1.603 1.00 0.00 C ATOM 1340 C ILE A 88 1.633 -5.905 0.300 1.00 0.00 C ATOM 1341 O ILE A 88 2.319 -6.930 0.237 1.00 0.00 O ATOM 1342 CB ILE A 88 1.697 -4.281 2.294 1.00 0.00 C ATOM 1343 CG1 ILE A 88 2.555 -3.484 1.313 1.00 0.00 C ATOM 1344 CG2 ILE A 88 2.614 -4.721 3.435 1.00 0.00 C ATOM 1345 CD1 ILE A 88 1.711 -2.518 0.483 1.00 0.00 C ATOM 0 H ILE A 88 1.542 -6.683 3.224 1.00 0.00 H new ATOM 0 HA ILE A 88 -0.024 -5.055 1.362 1.00 0.00 H new ATOM 0 HB ILE A 88 0.892 -3.666 2.697 1.00 0.00 H new ATOM 0 HG12 ILE A 88 3.313 -2.926 1.862 1.00 0.00 H new ATOM 0 HG13 ILE A 88 3.082 -4.170 0.650 1.00 0.00 H new ATOM 0 HG21 ILE A 88 3.096 -3.847 3.872 1.00 0.00 H new ATOM 0 HG22 ILE A 88 2.026 -5.231 4.198 1.00 0.00 H new ATOM 0 HG23 ILE A 88 3.375 -5.400 3.049 1.00 0.00 H new ATOM 0 HD11 ILE A 88 2.356 -1.969 -0.203 1.00 0.00 H new ATOM 0 HD12 ILE A 88 0.970 -3.079 -0.086 1.00 0.00 H new ATOM 0 HD13 ILE A 88 1.205 -1.816 1.145 1.00 0.00 H new ATOM 1357 N ALA A 89 1.395 -5.089 -0.727 1.00 0.00 N ATOM 1358 CA ALA A 89 1.940 -5.347 -2.076 1.00 0.00 C ATOM 1359 C ALA A 89 1.936 -4.068 -2.912 1.00 0.00 C ATOM 1360 O ALA A 89 0.925 -3.365 -3.005 1.00 0.00 O ATOM 1361 CB ALA A 89 1.118 -6.442 -2.759 1.00 0.00 C ATOM 0 H ALA A 89 0.830 -4.243 -0.659 1.00 0.00 H new ATOM 0 HA ALA A 89 2.973 -5.683 -1.984 1.00 0.00 H new ATOM 0 HB1 ALA A 89 1.520 -6.632 -3.754 1.00 0.00 H new ATOM 0 HB2 ALA A 89 1.167 -7.356 -2.167 1.00 0.00 H new ATOM 0 HB3 ALA A 89 0.080 -6.119 -2.843 1.00 0.00 H new ATOM 1367 N MET A 90 3.104 -3.804 -3.503 1.00 0.00 N ATOM 1368 CA MET A 90 3.314 -2.590 -4.313 1.00 0.00 C ATOM 1369 C MET A 90 2.352 -2.568 -5.500 1.00 0.00 C ATOM 1370 O MET A 90 2.352 -3.484 -6.328 1.00 0.00 O ATOM 1371 CB MET A 90 4.772 -2.524 -4.779 1.00 0.00 C ATOM 1372 CG MET A 90 5.153 -1.085 -5.122 1.00 0.00 C ATOM 1373 SD MET A 90 3.995 -0.414 -6.330 1.00 0.00 S ATOM 1374 CE MET A 90 4.508 1.315 -6.362 1.00 0.00 C ATOM 0 H MET A 90 3.921 -4.411 -3.439 1.00 0.00 H new ATOM 0 HA MET A 90 3.108 -1.711 -3.703 1.00 0.00 H new ATOM 0 HB2 MET A 90 5.429 -2.905 -3.997 1.00 0.00 H new ATOM 0 HB3 MET A 90 4.912 -3.162 -5.651 1.00 0.00 H new ATOM 0 HG2 MET A 90 5.146 -0.473 -4.220 1.00 0.00 H new ATOM 0 HG3 MET A 90 6.167 -1.053 -5.521 1.00 0.00 H new ATOM 0 HE1 MET A 90 4.202 1.768 -7.305 1.00 0.00 H new ATOM 0 HE2 MET A 90 4.040 1.849 -5.535 1.00 0.00 H new ATOM 0 HE3 MET A 90 5.592 1.375 -6.266 1.00 0.00 H new ATOM 1384 N ALA A 91 1.555 -1.499 -5.557 1.00 0.00 N ATOM 1385 CA ALA A 91 0.629 -1.286 -6.687 1.00 0.00 C ATOM 1386 C ALA A 91 1.345 -1.398 -8.039 1.00 0.00 C ATOM 1387 O ALA A 91 2.525 -1.753 -8.112 1.00 0.00 O ATOM 1388 CB ALA A 91 -0.010 0.098 -6.545 1.00 0.00 C ATOM 0 H ALA A 91 1.527 -0.770 -4.844 1.00 0.00 H new ATOM 0 HA ALA A 91 -0.136 -2.062 -6.661 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -0.697 0.268 -7.374 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -0.557 0.151 -5.604 1.00 0.00 H new ATOM 0 HB3 ALA A 91 0.768 0.861 -6.556 1.00 0.00 H new ATOM 1394 N ARG A 92 0.589 -1.081 -9.094 1.00 0.00 N ATOM 1395 CA ARG A 92 1.124 -1.098 -10.466 1.00 0.00 C ATOM 1396 C ARG A 92 0.029 -0.707 -11.450 1.00 0.00 C ATOM 1397 O ARG A 92 -0.874 -1.499 -11.734 1.00 0.00 O ATOM 1398 CB ARG A 92 1.647 -2.491 -10.803 1.00 0.00 C ATOM 1399 CG ARG A 92 2.822 -2.859 -9.882 1.00 0.00 C ATOM 1400 CD ARG A 92 3.448 -4.243 -10.149 1.00 0.00 C ATOM 1401 NE ARG A 92 4.206 -4.293 -11.426 1.00 0.00 N ATOM 1402 CZ ARG A 92 4.786 -5.402 -11.926 1.00 0.00 C ATOM 1403 NH1 ARG A 92 4.754 -6.593 -11.330 1.00 0.00 N ATOM 1404 NH2 ARG A 92 5.424 -5.302 -13.078 1.00 0.00 N ATOM 0 H ARG A 92 -0.392 -0.810 -9.029 1.00 0.00 H new ATOM 0 HA ARG A 92 1.944 -0.383 -10.538 1.00 0.00 H new ATOM 0 HB2 ARG A 92 0.847 -3.223 -10.693 1.00 0.00 H new ATOM 0 HB3 ARG A 92 1.968 -2.524 -11.844 1.00 0.00 H new ATOM 0 HG2 ARG A 92 3.597 -2.100 -9.985 1.00 0.00 H new ATOM 0 HG3 ARG A 92 2.479 -2.825 -8.848 1.00 0.00 H new ATOM 0 HD2 ARG A 92 4.114 -4.501 -9.326 1.00 0.00 H new ATOM 0 HD3 ARG A 92 2.660 -4.996 -10.169 1.00 0.00 H new ATOM 0 HE ARG A 92 4.293 -3.429 -11.961 1.00 0.00 H new ATOM 0 HH11 ARG A 92 4.269 -6.705 -10.440 1.00 0.00 H new ATOM 0 HH12 ARG A 92 5.215 -7.393 -11.764 1.00 0.00 H new ATOM 0 HH21 ARG A 92 5.467 -4.405 -13.561 1.00 0.00 H new ATOM 0 HH22 ARG A 92 5.874 -6.122 -13.485 1.00 0.00 H new ATOM 1418 N THR A 93 0.149 0.522 -11.954 1.00 0.00 N ATOM 1419 CA THR A 93 -0.822 1.063 -12.919 1.00 0.00 C ATOM 1420 C THR A 93 -0.992 0.101 -14.087 1.00 0.00 C ATOM 1421 O THR A 93 -1.894 -0.742 -14.077 1.00 0.00 O ATOM 1422 CB THR A 93 -0.315 2.408 -13.433 1.00 0.00 C ATOM 1423 OG1 THR A 93 -0.187 3.310 -12.343 1.00 0.00 O ATOM 1424 CG2 THR A 93 -1.299 2.984 -14.448 1.00 0.00 C ATOM 0 H THR A 93 0.905 1.163 -11.714 1.00 0.00 H new ATOM 0 HA THR A 93 -1.786 1.193 -12.428 1.00 0.00 H new ATOM 0 HB THR A 93 0.653 2.265 -13.913 1.00 0.00 H new ATOM 0 HG1 THR A 93 0.140 4.174 -12.670 1.00 0.00 H new ATOM 0 HG21 THR A 93 -0.929 3.944 -14.809 1.00 0.00 H new ATOM 0 HG22 THR A 93 -1.401 2.295 -15.287 1.00 0.00 H new ATOM 0 HG23 THR A 93 -2.270 3.125 -13.974 1.00 0.00 H new ATOM 1432 N ALA A 94 -0.112 0.269 -15.079 1.00 0.00 N ATOM 1433 CA ALA A 94 -0.154 -0.524 -16.324 1.00 0.00 C ATOM 1434 C ALA A 94 1.273 -0.897 -16.709 1.00 0.00 C ATOM 1435 O ALA A 94 1.667 -2.061 -16.590 1.00 0.00 O ATOM 1436 CB ALA A 94 -0.813 0.304 -17.431 1.00 0.00 C ATOM 0 H ALA A 94 0.646 0.951 -15.048 1.00 0.00 H new ATOM 0 HA ALA A 94 -0.737 -1.433 -16.180 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -0.845 -0.279 -18.351 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -1.828 0.568 -17.133 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.236 1.213 -17.598 1.00 0.00 H new ATOM 1442 N ASP A 95 2.023 0.111 -17.161 1.00 0.00 N ATOM 1443 CA ASP A 95 3.433 -0.086 -17.539 1.00 0.00 C ATOM 1444 C ASP A 95 4.161 -0.898 -16.474 1.00 0.00 C ATOM 1445 O ASP A 95 4.121 -0.562 -15.287 1.00 0.00 O ATOM 1446 CB ASP A 95 4.107 1.274 -17.696 1.00 0.00 C ATOM 1447 CG ASP A 95 3.446 2.081 -18.804 1.00 0.00 C ATOM 1448 OD1 ASP A 95 2.488 1.573 -19.425 1.00 0.00 O ATOM 1449 OD2 ASP A 95 3.879 3.226 -19.062 1.00 0.00 O ATOM 0 H ASP A 95 1.685 1.067 -17.275 1.00 0.00 H new ATOM 0 HA ASP A 95 3.475 -0.631 -18.482 1.00 0.00 H new ATOM 0 HB2 ASP A 95 4.050 1.824 -16.756 1.00 0.00 H new ATOM 0 HB3 ASP A 95 5.165 1.137 -17.921 1.00 0.00 H new ATOM 1454 N LYS A 96 4.829 -1.957 -16.939 1.00 0.00 N ATOM 1455 CA LYS A 96 5.593 -2.846 -16.048 1.00 0.00 C ATOM 1456 C LYS A 96 6.367 -2.034 -15.016 1.00 0.00 C ATOM 1457 O LYS A 96 5.788 -1.531 -14.049 1.00 0.00 O ATOM 1458 CB LYS A 96 6.566 -3.660 -16.896 1.00 0.00 C ATOM 1459 CG LYS A 96 5.792 -4.470 -17.946 1.00 0.00 C ATOM 1460 CD LYS A 96 6.652 -5.224 -18.986 1.00 0.00 C ATOM 1461 CE LYS A 96 7.377 -6.499 -18.502 1.00 0.00 C ATOM 1462 NZ LYS A 96 8.607 -6.227 -17.735 1.00 0.00 N ATOM 0 H LYS A 96 4.859 -2.222 -17.923 1.00 0.00 H new ATOM 0 HA LYS A 96 4.907 -3.507 -15.518 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.277 -2.996 -17.388 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.144 -4.331 -16.260 1.00 0.00 H new ATOM 0 HG2 LYS A 96 5.165 -5.195 -17.427 1.00 0.00 H new ATOM 0 HG3 LYS A 96 5.123 -3.793 -18.478 1.00 0.00 H new ATOM 0 HD2 LYS A 96 6.010 -5.496 -19.824 1.00 0.00 H new ATOM 0 HD3 LYS A 96 7.402 -4.533 -19.371 1.00 0.00 H new ATOM 0 HE2 LYS A 96 6.695 -7.081 -17.883 1.00 0.00 H new ATOM 0 HE3 LYS A 96 7.627 -7.114 -19.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 9.433 -6.556 -18.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 8.690 -5.205 -17.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 8.566 -6.728 -16.825 1.00 0.00 H new ATOM 1476 N ASP A 97 7.674 -1.920 -15.261 1.00 0.00 N ATOM 1477 CA ASP A 97 8.542 -1.080 -14.420 1.00 0.00 C ATOM 1478 C ASP A 97 7.950 0.321 -14.331 1.00 0.00 C ATOM 1479 O ASP A 97 7.881 1.033 -15.337 1.00 0.00 O ATOM 1480 CB ASP A 97 9.933 -1.014 -15.048 1.00 0.00 C ATOM 1481 CG ASP A 97 10.556 -2.400 -15.129 1.00 0.00 C ATOM 1482 OD1 ASP A 97 9.903 -3.376 -14.701 1.00 0.00 O ATOM 1483 OD2 ASP A 97 11.700 -2.523 -15.620 1.00 0.00 O ATOM 0 H ASP A 97 8.155 -2.392 -16.026 1.00 0.00 H new ATOM 0 HA ASP A 97 8.615 -1.505 -13.419 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.866 -0.582 -16.046 1.00 0.00 H new ATOM 0 HB3 ASP A 97 10.572 -0.357 -14.458 1.00 0.00 H new ATOM 1488 N SER A 98 7.532 0.684 -13.116 1.00 0.00 N ATOM 1489 CA SER A 98 6.877 1.983 -12.886 1.00 0.00 C ATOM 1490 C SER A 98 6.602 2.204 -11.402 1.00 0.00 C ATOM 1491 O SER A 98 6.843 3.301 -10.891 1.00 0.00 O ATOM 1492 CB SER A 98 5.567 2.015 -13.668 1.00 0.00 C ATOM 1493 OG SER A 98 4.931 3.272 -13.489 1.00 0.00 O ATOM 0 H SER A 98 7.632 0.107 -12.281 1.00 0.00 H new ATOM 0 HA SER A 98 7.538 2.780 -13.225 1.00 0.00 H new ATOM 0 HB2 SER A 98 5.760 1.842 -14.727 1.00 0.00 H new ATOM 0 HB3 SER A 98 4.911 1.213 -13.329 1.00 0.00 H new ATOM 0 HG SER A 98 4.091 3.289 -13.994 1.00 0.00 H new ATOM 1499 N ALA A 99 6.089 1.164 -10.737 1.00 0.00 N ATOM 1500 CA ALA A 99 5.731 1.253 -9.308 1.00 0.00 C ATOM 1501 C ALA A 99 6.710 2.165 -8.569 1.00 0.00 C ATOM 1502 O ALA A 99 7.789 1.736 -8.151 1.00 0.00 O ATOM 1503 CB ALA A 99 5.702 -0.152 -8.696 1.00 0.00 C ATOM 0 H ALA A 99 5.911 0.252 -11.158 1.00 0.00 H new ATOM 0 HA ALA A 99 4.737 1.690 -9.210 1.00 0.00 H new ATOM 0 HB1 ALA A 99 5.437 -0.084 -7.641 1.00 0.00 H new ATOM 0 HB2 ALA A 99 4.963 -0.761 -9.217 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.685 -0.612 -8.795 1.00 0.00 H new ATOM 1509 N THR A 100 6.298 3.430 -8.451 1.00 0.00 N ATOM 1510 CA THR A 100 7.156 4.484 -7.877 1.00 0.00 C ATOM 1511 C THR A 100 7.181 4.420 -6.352 1.00 0.00 C ATOM 1512 O THR A 100 8.227 4.678 -5.749 1.00 0.00 O ATOM 1513 CB THR A 100 6.625 5.846 -8.319 1.00 0.00 C ATOM 1514 OG1 THR A 100 5.306 6.024 -7.823 1.00 0.00 O ATOM 1515 CG2 THR A 100 6.607 5.941 -9.843 1.00 0.00 C ATOM 0 H THR A 100 5.376 3.755 -8.744 1.00 0.00 H new ATOM 0 HA THR A 100 8.175 4.333 -8.235 1.00 0.00 H new ATOM 0 HB THR A 100 7.279 6.623 -7.923 1.00 0.00 H new ATOM 0 HG1 THR A 100 4.881 6.775 -8.287 1.00 0.00 H new ATOM 0 HG21 THR A 100 6.226 6.917 -10.142 1.00 0.00 H new ATOM 0 HG22 THR A 100 7.619 5.813 -10.228 1.00 0.00 H new ATOM 0 HG23 THR A 100 5.963 5.161 -10.249 1.00 0.00 H new ATOM 1523 N SER A 101 6.031 4.090 -5.752 1.00 0.00 N ATOM 1524 CA SER A 101 5.908 4.045 -4.284 1.00 0.00 C ATOM 1525 C SER A 101 4.583 3.411 -3.875 1.00 0.00 C ATOM 1526 O SER A 101 4.562 2.526 -3.014 1.00 0.00 O ATOM 1527 CB SER A 101 6.008 5.465 -3.728 1.00 0.00 C ATOM 1528 OG SER A 101 4.978 6.278 -4.272 1.00 0.00 O ATOM 0 H SER A 101 5.176 3.851 -6.254 1.00 0.00 H new ATOM 0 HA SER A 101 6.715 3.436 -3.876 1.00 0.00 H new ATOM 0 HB2 SER A 101 5.929 5.444 -2.641 1.00 0.00 H new ATOM 0 HB3 SER A 101 6.982 5.890 -3.969 1.00 0.00 H new ATOM 0 HG SER A 101 5.050 7.185 -3.908 1.00 0.00 H new ATOM 1534 N GLN A 102 3.498 3.882 -4.494 1.00 0.00 N ATOM 1535 CA GLN A 102 2.145 3.390 -4.173 1.00 0.00 C ATOM 1536 C GLN A 102 2.134 1.891 -3.872 1.00 0.00 C ATOM 1537 O GLN A 102 2.952 1.128 -4.395 1.00 0.00 O ATOM 1538 CB GLN A 102 1.213 3.684 -5.349 1.00 0.00 C ATOM 1539 CG GLN A 102 1.688 2.947 -6.602 1.00 0.00 C ATOM 1540 CD GLN A 102 0.761 3.202 -7.787 1.00 0.00 C ATOM 1541 OE1 GLN A 102 0.381 2.294 -8.525 1.00 0.00 O ATOM 1542 NE2 GLN A 102 0.387 4.453 -7.987 1.00 0.00 N ATOM 0 H GLN A 102 3.523 4.600 -5.218 1.00 0.00 H new ATOM 0 HA GLN A 102 1.804 3.906 -3.276 1.00 0.00 H new ATOM 0 HB2 GLN A 102 0.197 3.377 -5.102 1.00 0.00 H new ATOM 0 HB3 GLN A 102 1.184 4.757 -5.539 1.00 0.00 H new ATOM 0 HG2 GLN A 102 2.698 3.269 -6.854 1.00 0.00 H new ATOM 0 HG3 GLN A 102 1.736 1.877 -6.400 1.00 0.00 H new ATOM 0 HE21 GLN A 102 0.715 5.189 -7.362 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -0.230 4.683 -8.766 1.00 0.00 H new ATOM 1551 N PHE A 103 1.170 1.504 -3.031 1.00 0.00 N ATOM 1552 CA PHE A 103 0.972 0.086 -2.664 1.00 0.00 C ATOM 1553 C PHE A 103 -0.463 -0.146 -2.184 1.00 0.00 C ATOM 1554 O PHE A 103 -1.336 0.710 -2.368 1.00 0.00 O ATOM 1555 CB PHE A 103 1.983 -0.304 -1.583 1.00 0.00 C ATOM 1556 CG PHE A 103 1.764 0.495 -0.310 1.00 0.00 C ATOM 1557 CD1 PHE A 103 0.692 0.230 0.473 1.00 0.00 C ATOM 1558 CD2 PHE A 103 2.648 1.452 0.062 1.00 0.00 C ATOM 1559 CE1 PHE A 103 0.505 0.912 1.625 1.00 0.00 C ATOM 1560 CE2 PHE A 103 2.461 2.135 1.215 1.00 0.00 C ATOM 1561 CZ PHE A 103 1.392 1.862 1.997 1.00 0.00 C ATOM 0 H PHE A 103 0.512 2.146 -2.589 1.00 0.00 H new ATOM 0 HA PHE A 103 1.134 -0.542 -3.540 1.00 0.00 H new ATOM 0 HB2 PHE A 103 1.895 -1.369 -1.367 1.00 0.00 H new ATOM 0 HB3 PHE A 103 2.995 -0.136 -1.951 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.016 -0.529 0.176 1.00 0.00 H new ATOM 0 HD2 PHE A 103 3.502 1.670 -0.562 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.352 0.698 2.247 1.00 0.00 H new ATOM 0 HE2 PHE A 103 3.166 2.898 1.511 1.00 0.00 H new ATOM 0 HZ PHE A 103 1.247 2.404 2.920 1.00 0.00 H new ATOM 1571 N PHE A 104 -0.684 -1.323 -1.588 1.00 0.00 N ATOM 1572 CA PHE A 104 -2.037 -1.716 -1.154 1.00 0.00 C ATOM 1573 C PHE A 104 -1.972 -2.780 -0.072 1.00 0.00 C ATOM 1574 O PHE A 104 -1.420 -3.868 -0.263 1.00 0.00 O ATOM 1575 CB PHE A 104 -2.852 -2.195 -2.356 1.00 0.00 C ATOM 1576 CG PHE A 104 -2.304 -3.479 -2.946 1.00 0.00 C ATOM 1577 CD1 PHE A 104 -2.589 -4.663 -2.353 1.00 0.00 C ATOM 1578 CD2 PHE A 104 -1.579 -3.455 -4.090 1.00 0.00 C ATOM 1579 CE1 PHE A 104 -2.167 -5.820 -2.912 1.00 0.00 C ATOM 1580 CE2 PHE A 104 -1.157 -4.613 -4.649 1.00 0.00 C ATOM 1581 CZ PHE A 104 -1.459 -5.795 -4.064 1.00 0.00 C ATOM 0 H PHE A 104 0.042 -2.013 -1.396 1.00 0.00 H new ATOM 0 HA PHE A 104 -2.535 -0.846 -0.726 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -3.887 -2.350 -2.052 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -2.857 -1.419 -3.121 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -3.154 -4.683 -1.433 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -1.338 -2.511 -4.556 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -2.395 -6.763 -2.439 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -0.580 -4.594 -5.561 1.00 0.00 H new ATOM 0 HZ PHE A 104 -1.134 -6.720 -4.518 1.00 0.00 H new ATOM 1591 N ILE A 105 -2.566 -2.401 1.060 1.00 0.00 N ATOM 1592 CA ILE A 105 -2.668 -3.284 2.236 1.00 0.00 C ATOM 1593 C ILE A 105 -3.962 -4.086 2.136 1.00 0.00 C ATOM 1594 O ILE A 105 -5.051 -3.552 2.369 1.00 0.00 O ATOM 1595 CB ILE A 105 -2.663 -2.421 3.501 1.00 0.00 C ATOM 1596 CG1 ILE A 105 -1.397 -1.563 3.549 1.00 0.00 C ATOM 1597 CG2 ILE A 105 -2.734 -3.329 4.729 1.00 0.00 C ATOM 1598 CD1 ILE A 105 -1.403 -0.654 4.778 1.00 0.00 C ATOM 0 H ILE A 105 -2.989 -1.482 1.193 1.00 0.00 H new ATOM 0 HA ILE A 105 -1.826 -3.975 2.276 1.00 0.00 H new ATOM 0 HB ILE A 105 -3.528 -1.757 3.492 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -0.517 -2.206 3.571 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -1.327 -0.959 2.645 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -2.731 -2.720 5.633 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -3.650 -3.919 4.693 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -1.872 -3.996 4.738 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.493 -0.054 4.791 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -2.271 0.004 4.740 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -1.449 -1.263 5.681 1.00 0.00 H new ATOM 1610 N ASN A 106 -3.812 -5.366 1.785 1.00 0.00 N ATOM 1611 CA ASN A 106 -4.967 -6.283 1.731 1.00 0.00 C ATOM 1612 C ASN A 106 -5.573 -6.460 3.124 1.00 0.00 C ATOM 1613 O ASN A 106 -4.880 -6.334 4.139 1.00 0.00 O ATOM 1614 CB ASN A 106 -4.524 -7.638 1.178 1.00 0.00 C ATOM 1615 CG ASN A 106 -3.556 -8.323 2.137 1.00 0.00 C ATOM 1616 OD1 ASN A 106 -2.351 -8.073 2.130 1.00 0.00 O ATOM 1617 ND2 ASN A 106 -4.073 -9.198 2.983 1.00 0.00 N ATOM 0 H ASN A 106 -2.919 -5.792 1.536 1.00 0.00 H new ATOM 0 HA ASN A 106 -5.725 -5.856 1.074 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -5.395 -8.273 1.018 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -4.046 -7.502 0.208 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -3.470 -9.682 3.648 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -5.075 -9.389 2.970 1.00 0.00 H new ATOM 1624 N VAL A 107 -6.873 -6.772 3.132 1.00 0.00 N ATOM 1625 CA VAL A 107 -7.607 -7.060 4.381 1.00 0.00 C ATOM 1626 C VAL A 107 -8.593 -8.202 4.128 1.00 0.00 C ATOM 1627 O VAL A 107 -9.762 -8.134 4.519 1.00 0.00 O ATOM 1628 CB VAL A 107 -8.305 -5.784 4.861 1.00 0.00 C ATOM 1629 CG1 VAL A 107 -7.265 -4.690 5.109 1.00 0.00 C ATOM 1630 CG2 VAL A 107 -9.328 -5.330 3.820 1.00 0.00 C ATOM 0 H VAL A 107 -7.444 -6.833 2.289 1.00 0.00 H new ATOM 0 HA VAL A 107 -6.925 -7.378 5.169 1.00 0.00 H new ATOM 0 HB VAL A 107 -8.829 -5.985 5.796 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -7.765 -3.783 5.450 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -6.560 -5.024 5.870 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -6.728 -4.482 4.183 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -9.821 -4.422 4.167 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -8.822 -5.130 2.876 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -10.071 -6.114 3.674 1.00 0.00 H new ATOM 1640 N ALA A 108 -8.069 -9.254 3.493 1.00 0.00 N ATOM 1641 CA ALA A 108 -8.853 -10.473 3.230 1.00 0.00 C ATOM 1642 C ALA A 108 -8.094 -11.405 2.288 1.00 0.00 C ATOM 1643 O ALA A 108 -7.464 -10.965 1.321 1.00 0.00 O ATOM 1644 CB ALA A 108 -10.215 -10.106 2.634 1.00 0.00 C ATOM 0 H ALA A 108 -7.109 -9.290 3.151 1.00 0.00 H new ATOM 0 HA ALA A 108 -9.013 -10.994 4.174 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -10.786 -11.015 2.444 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -10.761 -9.475 3.335 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -10.069 -9.567 1.698 1.00 0.00 H new ATOM 1650 N ASP A 109 -8.190 -12.698 2.603 1.00 0.00 N ATOM 1651 CA ASP A 109 -7.521 -13.748 1.812 1.00 0.00 C ATOM 1652 C ASP A 109 -7.403 -13.369 0.338 1.00 0.00 C ATOM 1653 O ASP A 109 -8.336 -12.820 -0.254 1.00 0.00 O ATOM 1654 CB ASP A 109 -8.316 -15.045 1.939 1.00 0.00 C ATOM 1655 CG ASP A 109 -8.380 -15.502 3.389 1.00 0.00 C ATOM 1656 OD1 ASP A 109 -7.803 -14.816 4.260 1.00 0.00 O ATOM 1657 OD2 ASP A 109 -9.006 -16.549 3.669 1.00 0.00 O ATOM 0 H ASP A 109 -8.723 -13.049 3.399 1.00 0.00 H new ATOM 0 HA ASP A 109 -6.511 -13.872 2.202 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -9.325 -14.897 1.555 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -7.854 -15.821 1.329 1.00 0.00 H new ATOM 1662 N ASN A 110 -6.230 -13.684 -0.218 1.00 0.00 N ATOM 1663 CA ASN A 110 -5.913 -13.360 -1.623 1.00 0.00 C ATOM 1664 C ASN A 110 -4.797 -14.260 -2.156 1.00 0.00 C ATOM 1665 O ASN A 110 -3.995 -14.821 -1.403 1.00 0.00 O ATOM 1666 CB ASN A 110 -5.497 -11.890 -1.727 1.00 0.00 C ATOM 1667 CG ASN A 110 -6.630 -10.975 -1.280 1.00 0.00 C ATOM 1668 OD1 ASN A 110 -7.662 -11.424 -0.785 1.00 0.00 O ATOM 1669 ND2 ASN A 110 -6.453 -9.676 -1.450 1.00 0.00 N ATOM 0 H ASN A 110 -5.479 -14.164 0.279 1.00 0.00 H new ATOM 0 HA ASN A 110 -6.803 -13.532 -2.229 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -4.615 -11.712 -1.111 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -5.220 -11.658 -2.755 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -7.182 -9.021 -1.168 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -5.587 -9.329 -1.863 1.00 0.00 H new ATOM 1676 N ALA A 111 -4.791 -14.363 -3.484 1.00 0.00 N ATOM 1677 CA ALA A 111 -3.837 -15.228 -4.196 1.00 0.00 C ATOM 1678 C ALA A 111 -4.238 -15.250 -5.664 1.00 0.00 C ATOM 1679 O ALA A 111 -3.442 -14.895 -6.539 1.00 0.00 O ATOM 1680 CB ALA A 111 -3.865 -16.640 -3.611 1.00 0.00 C ATOM 0 H ALA A 111 -5.435 -13.860 -4.094 1.00 0.00 H new ATOM 0 HA ALA A 111 -2.822 -14.846 -4.089 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -3.155 -17.270 -4.147 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -3.593 -16.602 -2.556 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -4.867 -17.056 -3.712 1.00 0.00 H new ATOM 1686 N PHE A 112 -5.494 -15.639 -5.895 1.00 0.00 N ATOM 1687 CA PHE A 112 -6.108 -15.514 -7.227 1.00 0.00 C ATOM 1688 C PHE A 112 -5.691 -14.196 -7.880 1.00 0.00 C ATOM 1689 O PHE A 112 -5.358 -14.167 -9.068 1.00 0.00 O ATOM 1690 CB PHE A 112 -7.629 -15.571 -7.073 1.00 0.00 C ATOM 1691 CG PHE A 112 -8.117 -14.487 -6.126 1.00 0.00 C ATOM 1692 CD1 PHE A 112 -8.037 -14.672 -4.786 1.00 0.00 C ATOM 1693 CD2 PHE A 112 -8.625 -13.330 -6.614 1.00 0.00 C ATOM 1694 CE1 PHE A 112 -8.469 -13.709 -3.940 1.00 0.00 C ATOM 1695 CE2 PHE A 112 -9.058 -12.367 -5.768 1.00 0.00 C ATOM 1696 CZ PHE A 112 -8.980 -12.557 -4.431 1.00 0.00 C ATOM 0 H PHE A 112 -6.106 -16.041 -5.185 1.00 0.00 H new ATOM 0 HA PHE A 112 -5.772 -16.331 -7.866 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -8.102 -15.449 -8.047 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -7.924 -16.550 -6.695 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -7.627 -15.591 -4.393 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -8.685 -13.176 -7.681 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -8.406 -13.860 -2.872 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -9.466 -11.447 -6.160 1.00 0.00 H new ATOM 0 HZ PHE A 112 -9.326 -11.789 -3.755 1.00 0.00 H new ATOM 1706 N LEU A 113 -5.700 -13.131 -7.072 1.00 0.00 N ATOM 1707 CA LEU A 113 -5.230 -11.811 -7.521 1.00 0.00 C ATOM 1708 C LEU A 113 -3.775 -11.910 -7.967 1.00 0.00 C ATOM 1709 O LEU A 113 -3.429 -11.475 -9.069 1.00 0.00 O ATOM 1710 CB LEU A 113 -5.332 -10.813 -6.365 1.00 0.00 C ATOM 1711 CG LEU A 113 -4.813 -9.441 -6.806 1.00 0.00 C ATOM 1712 CD1 LEU A 113 -5.682 -8.894 -7.942 1.00 0.00 C ATOM 1713 CD2 LEU A 113 -4.800 -8.464 -5.626 1.00 0.00 C ATOM 0 H LEU A 113 -6.026 -13.154 -6.106 1.00 0.00 H new ATOM 0 HA LEU A 113 -5.847 -11.475 -8.355 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -6.368 -10.730 -6.036 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -4.755 -11.172 -5.513 1.00 0.00 H new ATOM 0 HG LEU A 113 -3.790 -9.554 -7.166 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -5.306 -7.918 -8.250 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -5.648 -9.580 -8.789 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -6.711 -8.794 -7.597 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -4.428 -7.495 -5.960 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -5.812 -8.350 -5.237 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -4.151 -8.851 -4.841 1.00 0.00 H new ATOM 1725 N ASP A 114 -2.947 -12.467 -7.079 1.00 0.00 N ATOM 1726 CA ASP A 114 -1.497 -12.556 -7.324 1.00 0.00 C ATOM 1727 C ASP A 114 -1.188 -12.911 -8.775 1.00 0.00 C ATOM 1728 O ASP A 114 -1.833 -13.779 -9.371 1.00 0.00 O ATOM 1729 CB ASP A 114 -0.893 -13.609 -6.397 1.00 0.00 C ATOM 1730 CG ASP A 114 -1.446 -14.992 -6.708 1.00 0.00 C ATOM 1731 OD1 ASP A 114 -2.284 -15.109 -7.628 1.00 0.00 O ATOM 1732 OD2 ASP A 114 -1.047 -15.970 -6.038 1.00 0.00 O ATOM 0 H ASP A 114 -3.249 -12.862 -6.188 1.00 0.00 H new ATOM 0 HA ASP A 114 -1.059 -11.579 -7.122 1.00 0.00 H new ATOM 0 HB2 ASP A 114 0.192 -13.615 -6.505 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -1.109 -13.352 -5.360 1.00 0.00 H new ATOM 1737 N HIS A 115 -0.170 -12.228 -9.302 1.00 0.00 N ATOM 1738 CA HIS A 115 0.315 -12.482 -10.670 1.00 0.00 C ATOM 1739 C HIS A 115 0.244 -13.970 -11.003 1.00 0.00 C ATOM 1740 O HIS A 115 0.957 -14.790 -10.415 1.00 0.00 O ATOM 1741 CB HIS A 115 1.752 -11.968 -10.799 1.00 0.00 C ATOM 1742 CG HIS A 115 2.354 -12.400 -12.114 1.00 0.00 C ATOM 1743 ND1 HIS A 115 1.644 -12.515 -13.301 1.00 0.00 N ATOM 1744 CD2 HIS A 115 3.694 -12.772 -12.283 1.00 0.00 C ATOM 1745 CE1 HIS A 115 2.665 -12.962 -14.105 1.00 0.00 C ATOM 1746 NE2 HIS A 115 3.921 -13.144 -13.591 1.00 0.00 N ATOM 0 H HIS A 115 0.337 -11.495 -8.807 1.00 0.00 H new ATOM 0 HA HIS A 115 -0.322 -11.953 -11.379 1.00 0.00 H new ATOM 0 HB2 HIS A 115 1.763 -10.880 -10.728 1.00 0.00 H new ATOM 0 HB3 HIS A 115 2.355 -12.348 -9.974 1.00 0.00 H new ATOM 0 HD1 HIS A 115 0.664 -12.326 -13.512 1.00 0.00 H new ATOM 0 HD2 HIS A 115 4.440 -12.768 -11.502 1.00 0.00 H new ATOM 0 HE1 HIS A 115 2.476 -13.171 -15.148 1.00 0.00 H new ATOM 0 HE2 HIS A 115 4.777 -13.463 -14.045 1.00 0.00 H new ATOM 1754 N GLY A 116 -0.638 -14.277 -11.958 1.00 0.00 N ATOM 1755 CA GLY A 116 -0.851 -15.662 -12.410 1.00 0.00 C ATOM 1756 C GLY A 116 -1.850 -15.674 -13.559 1.00 0.00 C ATOM 1757 O GLY A 116 -1.478 -15.461 -14.716 1.00 0.00 O ATOM 0 H GLY A 116 -1.218 -13.587 -12.436 1.00 0.00 H new ATOM 0 HA2 GLY A 116 0.094 -16.100 -12.731 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -1.221 -16.272 -11.586 1.00 0.00 H new ATOM 1814 N PHE A 120 0.837 -10.691 -14.730 1.00 0.00 N ATOM 1815 CA PHE A 120 1.137 -9.821 -13.576 1.00 0.00 C ATOM 1816 C PHE A 120 -0.016 -8.860 -13.271 1.00 0.00 C ATOM 1817 O PHE A 120 -0.988 -8.761 -14.027 1.00 0.00 O ATOM 1818 CB PHE A 120 2.414 -9.031 -13.869 1.00 0.00 C ATOM 1819 CG PHE A 120 3.576 -9.976 -14.119 1.00 0.00 C ATOM 1820 CD1 PHE A 120 3.767 -10.504 -15.351 1.00 0.00 C ATOM 1821 CD2 PHE A 120 4.420 -10.301 -13.110 1.00 0.00 C ATOM 1822 CE1 PHE A 120 4.798 -11.350 -15.575 1.00 0.00 C ATOM 1823 CE2 PHE A 120 5.452 -11.147 -13.335 1.00 0.00 C ATOM 1824 CZ PHE A 120 5.641 -11.671 -14.567 1.00 0.00 C ATOM 0 HA PHE A 120 1.275 -10.450 -12.697 1.00 0.00 H new ATOM 0 HB2 PHE A 120 2.263 -8.393 -14.739 1.00 0.00 H new ATOM 0 HB3 PHE A 120 2.644 -8.375 -13.029 1.00 0.00 H new ATOM 0 HD1 PHE A 120 3.094 -10.249 -16.157 1.00 0.00 H new ATOM 0 HD2 PHE A 120 4.269 -9.884 -12.125 1.00 0.00 H new ATOM 0 HE1 PHE A 120 4.948 -11.769 -16.559 1.00 0.00 H new ATOM 0 HE2 PHE A 120 6.125 -11.404 -12.530 1.00 0.00 H new ATOM 0 HZ PHE A 120 6.465 -12.346 -14.746 1.00 0.00 H new ATOM 1834 N GLY A 121 0.135 -8.161 -12.143 1.00 0.00 N ATOM 1835 CA GLY A 121 -0.870 -7.181 -11.693 1.00 0.00 C ATOM 1836 C GLY A 121 -0.382 -6.458 -10.445 1.00 0.00 C ATOM 1837 O GLY A 121 0.547 -5.649 -10.510 1.00 0.00 O ATOM 0 H GLY A 121 0.940 -8.252 -11.523 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -1.065 -6.460 -12.486 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -1.813 -7.687 -11.483 1.00 0.00 H new ATOM 1841 N TYR A 122 -1.047 -6.767 -9.329 1.00 0.00 N ATOM 1842 CA TYR A 122 -0.755 -6.115 -8.039 1.00 0.00 C ATOM 1843 C TYR A 122 0.496 -6.729 -7.417 1.00 0.00 C ATOM 1844 O TYR A 122 0.519 -7.915 -7.072 1.00 0.00 O ATOM 1845 CB TYR A 122 -1.960 -6.284 -7.109 1.00 0.00 C ATOM 1846 CG TYR A 122 -3.202 -5.676 -7.737 1.00 0.00 C ATOM 1847 CD1 TYR A 122 -3.453 -4.358 -7.576 1.00 0.00 C ATOM 1848 CD2 TYR A 122 -4.036 -6.456 -8.460 1.00 0.00 C ATOM 1849 CE1 TYR A 122 -4.550 -3.816 -8.138 1.00 0.00 C ATOM 1850 CE2 TYR A 122 -5.133 -5.914 -9.021 1.00 0.00 C ATOM 1851 CZ TYR A 122 -5.383 -4.598 -8.856 1.00 0.00 C ATOM 1852 OH TYR A 122 -6.500 -4.047 -9.428 1.00 0.00 O ATOM 0 H TYR A 122 -1.791 -7.463 -9.287 1.00 0.00 H new ATOM 0 HA TYR A 122 -0.571 -5.052 -8.195 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -2.127 -7.342 -6.908 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -1.758 -5.806 -6.151 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -2.778 -3.743 -7.000 1.00 0.00 H new ATOM 0 HD2 TYR A 122 -3.824 -7.507 -8.587 1.00 0.00 H new ATOM 0 HE1 TYR A 122 -4.761 -2.764 -8.015 1.00 0.00 H new ATOM 0 HE2 TYR A 122 -5.808 -6.528 -9.599 1.00 0.00 H new ATOM 0 HH TYR A 122 -6.995 -4.740 -9.912 1.00 0.00 H new ATOM 1862 N ALA A 123 1.516 -5.881 -7.284 1.00 0.00 N ATOM 1863 CA ALA A 123 2.790 -6.295 -6.666 1.00 0.00 C ATOM 1864 C ALA A 123 2.554 -6.996 -5.322 1.00 0.00 C ATOM 1865 O ALA A 123 1.473 -7.535 -5.067 1.00 0.00 O ATOM 1866 CB ALA A 123 3.678 -5.059 -6.503 1.00 0.00 C ATOM 0 H ALA A 123 1.493 -4.909 -7.591 1.00 0.00 H new ATOM 0 HA ALA A 123 3.290 -7.017 -7.311 1.00 0.00 H new ATOM 0 HB1 ALA A 123 4.625 -5.349 -6.047 1.00 0.00 H new ATOM 0 HB2 ALA A 123 3.867 -4.615 -7.480 1.00 0.00 H new ATOM 0 HB3 ALA A 123 3.176 -4.332 -5.865 1.00 0.00 H new ATOM 1872 N VAL A 124 3.603 -7.001 -4.495 1.00 0.00 N ATOM 1873 CA VAL A 124 3.578 -7.682 -3.185 1.00 0.00 C ATOM 1874 C VAL A 124 4.947 -7.491 -2.534 1.00 0.00 C ATOM 1875 O VAL A 124 5.966 -7.909 -3.093 1.00 0.00 O ATOM 1876 CB VAL A 124 3.277 -9.182 -3.339 1.00 0.00 C ATOM 1877 CG1 VAL A 124 3.552 -9.909 -2.019 1.00 0.00 C ATOM 1878 CG2 VAL A 124 1.820 -9.411 -3.748 1.00 0.00 C ATOM 0 H VAL A 124 4.488 -6.540 -4.706 1.00 0.00 H new ATOM 0 HA VAL A 124 2.789 -7.254 -2.567 1.00 0.00 H new ATOM 0 HB VAL A 124 3.926 -9.577 -4.121 1.00 0.00 H new ATOM 0 HG11 VAL A 124 3.336 -10.971 -2.137 1.00 0.00 H new ATOM 0 HG12 VAL A 124 4.599 -9.780 -1.744 1.00 0.00 H new ATOM 0 HG13 VAL A 124 2.917 -9.494 -1.236 1.00 0.00 H new ATOM 0 HG21 VAL A 124 1.634 -10.480 -3.850 1.00 0.00 H new ATOM 0 HG22 VAL A 124 1.159 -8.999 -2.985 1.00 0.00 H new ATOM 0 HG23 VAL A 124 1.627 -8.917 -4.700 1.00 0.00 H new ATOM 1888 N PHE A 125 4.938 -6.879 -1.345 1.00 0.00 N ATOM 1889 CA PHE A 125 6.183 -6.665 -0.583 1.00 0.00 C ATOM 1890 C PHE A 125 5.883 -6.315 0.879 1.00 0.00 C ATOM 1891 O PHE A 125 6.693 -5.635 1.516 1.00 0.00 O ATOM 1892 CB PHE A 125 6.996 -5.549 -1.256 1.00 0.00 C ATOM 1893 CG PHE A 125 6.384 -4.193 -0.945 1.00 0.00 C ATOM 1894 CD1 PHE A 125 5.061 -3.992 -1.154 1.00 0.00 C ATOM 1895 CD2 PHE A 125 7.132 -3.214 -0.381 1.00 0.00 C ATOM 1896 CE1 PHE A 125 4.483 -2.830 -0.775 1.00 0.00 C ATOM 1897 CE2 PHE A 125 6.553 -2.050 -0.006 1.00 0.00 C ATOM 1898 CZ PHE A 125 5.225 -1.866 -0.186 1.00 0.00 C ATOM 0 H PHE A 125 4.096 -6.525 -0.890 1.00 0.00 H new ATOM 0 HA PHE A 125 6.764 -7.587 -0.582 1.00 0.00 H new ATOM 0 HB2 PHE A 125 8.028 -5.579 -0.906 1.00 0.00 H new ATOM 0 HB3 PHE A 125 7.020 -5.706 -2.334 1.00 0.00 H new ATOM 0 HD1 PHE A 125 4.467 -4.761 -1.624 1.00 0.00 H new ATOM 0 HD2 PHE A 125 8.191 -3.363 -0.231 1.00 0.00 H new ATOM 0 HE1 PHE A 125 3.428 -2.672 -0.943 1.00 0.00 H new ATOM 0 HE2 PHE A 125 7.151 -1.268 0.437 1.00 0.00 H new ATOM 0 HZ PHE A 125 4.758 -0.949 0.141 1.00 0.00 H new ATOM 1908 N GLY A 126 4.739 -6.787 1.397 1.00 0.00 N ATOM 1909 CA GLY A 126 4.325 -6.486 2.777 1.00 0.00 C ATOM 1910 C GLY A 126 3.471 -7.595 3.377 1.00 0.00 C ATOM 1911 O GLY A 126 3.293 -8.682 2.820 1.00 0.00 O ATOM 0 H GLY A 126 4.085 -7.377 0.883 1.00 0.00 H new ATOM 0 HA2 GLY A 126 5.210 -6.337 3.395 1.00 0.00 H new ATOM 0 HA3 GLY A 126 3.765 -5.551 2.791 1.00 0.00 H new ATOM 1915 N LYS A 127 2.985 -7.247 4.559 1.00 0.00 N ATOM 1916 CA LYS A 127 2.173 -8.164 5.370 1.00 0.00 C ATOM 1917 C LYS A 127 1.823 -7.481 6.682 1.00 0.00 C ATOM 1918 O LYS A 127 2.654 -7.415 7.592 1.00 0.00 O ATOM 1919 CB LYS A 127 2.979 -9.430 5.644 1.00 0.00 C ATOM 1920 CG LYS A 127 3.378 -10.097 4.320 1.00 0.00 C ATOM 1921 CD LYS A 127 4.189 -11.406 4.464 1.00 0.00 C ATOM 1922 CE LYS A 127 5.621 -11.281 5.028 1.00 0.00 C ATOM 1923 NZ LYS A 127 6.546 -10.568 4.126 1.00 0.00 N ATOM 0 H LYS A 127 3.136 -6.333 4.986 1.00 0.00 H new ATOM 0 HA LYS A 127 1.257 -8.427 4.841 1.00 0.00 H new ATOM 0 HB2 LYS A 127 3.871 -9.185 6.220 1.00 0.00 H new ATOM 0 HB3 LYS A 127 2.391 -10.122 6.246 1.00 0.00 H new ATOM 0 HG2 LYS A 127 2.473 -10.309 3.751 1.00 0.00 H new ATOM 0 HG3 LYS A 127 3.963 -9.387 3.735 1.00 0.00 H new ATOM 0 HD2 LYS A 127 3.628 -12.083 5.108 1.00 0.00 H new ATOM 0 HD3 LYS A 127 4.250 -11.877 3.483 1.00 0.00 H new ATOM 0 HE2 LYS A 127 5.583 -10.759 5.984 1.00 0.00 H new ATOM 0 HE3 LYS A 127 6.014 -12.278 5.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 7.492 -10.996 4.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 6.200 -10.638 3.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 6.599 -9.567 4.404 1.00 0.00 H new ATOM 1937 N VAL A 128 0.586 -6.987 6.749 1.00 0.00 N ATOM 1938 CA VAL A 128 0.098 -6.289 7.952 1.00 0.00 C ATOM 1939 C VAL A 128 0.592 -6.996 9.212 1.00 0.00 C ATOM 1940 O VAL A 128 0.242 -8.152 9.470 1.00 0.00 O ATOM 1941 CB VAL A 128 -1.432 -6.227 7.924 1.00 0.00 C ATOM 1942 CG1 VAL A 128 -1.930 -5.502 9.175 1.00 0.00 C ATOM 1943 CG2 VAL A 128 -1.893 -5.494 6.664 1.00 0.00 C ATOM 0 H VAL A 128 -0.096 -7.053 5.994 1.00 0.00 H new ATOM 0 HA VAL A 128 0.489 -5.272 7.963 1.00 0.00 H new ATOM 0 HB VAL A 128 -1.843 -7.236 7.911 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -3.019 -5.455 9.159 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -1.603 -6.042 10.063 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -1.524 -4.491 9.195 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -2.982 -5.451 6.646 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -1.490 -4.481 6.664 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -1.536 -6.026 5.782 1.00 0.00 H new ATOM 1953 N VAL A 129 1.412 -6.265 9.970 1.00 0.00 N ATOM 1954 CA VAL A 129 2.004 -6.803 11.207 1.00 0.00 C ATOM 1955 C VAL A 129 0.891 -7.229 12.157 1.00 0.00 C ATOM 1956 O VAL A 129 0.894 -8.359 12.655 1.00 0.00 O ATOM 1957 CB VAL A 129 2.876 -5.733 11.864 1.00 0.00 C ATOM 1958 CG1 VAL A 129 3.468 -6.287 13.161 1.00 0.00 C ATOM 1959 CG2 VAL A 129 3.992 -5.318 10.904 1.00 0.00 C ATOM 0 H VAL A 129 1.683 -5.305 9.755 1.00 0.00 H new ATOM 0 HA VAL A 129 2.623 -7.669 10.972 1.00 0.00 H new ATOM 0 HB VAL A 129 2.271 -4.857 12.096 1.00 0.00 H new ATOM 0 HG11 VAL A 129 4.090 -5.526 13.631 1.00 0.00 H new ATOM 0 HG12 VAL A 129 2.661 -6.566 13.839 1.00 0.00 H new ATOM 0 HG13 VAL A 129 4.075 -7.165 12.938 1.00 0.00 H new ATOM 0 HG21 VAL A 129 4.612 -4.555 11.375 1.00 0.00 H new ATOM 0 HG22 VAL A 129 4.605 -6.186 10.662 1.00 0.00 H new ATOM 0 HG23 VAL A 129 3.555 -4.917 9.990 1.00 0.00 H new ATOM 1969 N LYS A 130 -0.043 -6.304 12.383 1.00 0.00 N ATOM 1970 CA LYS A 130 -1.190 -6.570 13.259 1.00 0.00 C ATOM 1971 C LYS A 130 -1.813 -5.245 13.666 1.00 0.00 C ATOM 1972 O LYS A 130 -1.527 -4.724 14.748 1.00 0.00 O ATOM 1973 CB LYS A 130 -0.720 -7.333 14.494 1.00 0.00 C ATOM 1974 CG LYS A 130 0.292 -6.496 15.282 1.00 0.00 C ATOM 1975 CD LYS A 130 -0.286 -5.137 15.714 1.00 0.00 C ATOM 1976 CE LYS A 130 0.726 -4.288 16.504 1.00 0.00 C ATOM 1977 NZ LYS A 130 0.147 -2.993 16.906 1.00 0.00 N ATOM 0 H LYS A 130 -0.030 -5.369 11.976 1.00 0.00 H new ATOM 0 HA LYS A 130 -1.931 -7.173 12.735 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -1.574 -7.575 15.127 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -0.267 -8.278 14.195 1.00 0.00 H new ATOM 0 HG2 LYS A 130 0.610 -7.051 16.165 1.00 0.00 H new ATOM 0 HG3 LYS A 130 1.180 -6.333 14.671 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -0.606 -4.585 14.830 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -1.173 -5.301 16.326 1.00 0.00 H new ATOM 0 HE2 LYS A 130 1.048 -4.835 17.390 1.00 0.00 H new ATOM 0 HE3 LYS A 130 1.614 -4.118 15.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 0.855 -2.446 17.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -0.137 -2.462 16.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -0.686 -3.157 17.507 1.00 0.00 H new ATOM 1991 N GLY A 131 -2.661 -4.730 12.772 1.00 0.00 N ATOM 1992 CA GLY A 131 -3.359 -3.452 13.004 1.00 0.00 C ATOM 1993 C GLY A 131 -4.510 -3.222 12.025 1.00 0.00 C ATOM 1994 O GLY A 131 -4.923 -2.074 11.836 1.00 0.00 O ATOM 0 H GLY A 131 -2.884 -5.173 11.881 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -3.745 -3.434 14.023 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -2.646 -2.632 12.919 1.00 0.00 H new ATOM 1998 N MET A 132 -5.032 -4.308 11.442 1.00 0.00 N ATOM 1999 CA MET A 132 -6.257 -4.226 10.625 1.00 0.00 C ATOM 2000 C MET A 132 -7.400 -3.556 11.395 1.00 0.00 C ATOM 2001 O MET A 132 -8.322 -3.029 10.767 1.00 0.00 O ATOM 2002 CB MET A 132 -6.658 -5.624 10.149 1.00 0.00 C ATOM 2003 CG MET A 132 -5.699 -6.086 9.056 1.00 0.00 C ATOM 2004 SD MET A 132 -5.783 -4.906 7.694 1.00 0.00 S ATOM 2005 CE MET A 132 -4.687 -5.672 6.485 1.00 0.00 C ATOM 0 H MET A 132 -4.634 -5.244 11.517 1.00 0.00 H new ATOM 0 HA MET A 132 -6.050 -3.604 9.754 1.00 0.00 H new ATOM 0 HB2 MET A 132 -6.638 -6.324 10.985 1.00 0.00 H new ATOM 0 HB3 MET A 132 -7.680 -5.611 9.769 1.00 0.00 H new ATOM 0 HG2 MET A 132 -4.682 -6.147 9.444 1.00 0.00 H new ATOM 0 HG3 MET A 132 -5.969 -7.084 8.711 1.00 0.00 H new ATOM 0 HE1 MET A 132 -4.515 -4.981 5.660 1.00 0.00 H new ATOM 0 HE2 MET A 132 -3.736 -5.915 6.959 1.00 0.00 H new ATOM 0 HE3 MET A 132 -5.146 -6.584 6.104 1.00 0.00 H new ATOM 2015 N ASP A 133 -7.326 -3.567 12.731 1.00 0.00 N ATOM 2016 CA ASP A 133 -8.279 -2.811 13.559 1.00 0.00 C ATOM 2017 C ASP A 133 -8.392 -1.396 13.005 1.00 0.00 C ATOM 2018 O ASP A 133 -9.472 -0.968 12.589 1.00 0.00 O ATOM 2019 CB ASP A 133 -7.767 -2.773 14.996 1.00 0.00 C ATOM 2020 CG ASP A 133 -8.731 -2.001 15.885 1.00 0.00 C ATOM 2021 OD1 ASP A 133 -9.774 -1.538 15.376 1.00 0.00 O ATOM 2022 OD2 ASP A 133 -8.453 -1.852 17.095 1.00 0.00 O ATOM 0 H ASP A 133 -6.624 -4.085 13.260 1.00 0.00 H new ATOM 0 HA ASP A 133 -9.260 -3.286 13.542 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -7.649 -3.789 15.373 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -6.783 -2.306 15.025 1.00 0.00 H new ATOM 2027 N VAL A 134 -7.249 -0.706 13.004 1.00 0.00 N ATOM 2028 CA VAL A 134 -7.161 0.651 12.438 1.00 0.00 C ATOM 2029 C VAL A 134 -7.482 0.601 10.951 1.00 0.00 C ATOM 2030 O VAL A 134 -8.554 1.042 10.530 1.00 0.00 O ATOM 2031 CB VAL A 134 -5.758 1.215 12.669 1.00 0.00 C ATOM 2032 CG1 VAL A 134 -5.625 2.573 11.977 1.00 0.00 C ATOM 2033 CG2 VAL A 134 -5.505 1.355 14.171 1.00 0.00 C ATOM 0 H VAL A 134 -6.372 -1.059 13.386 1.00 0.00 H new ATOM 0 HA VAL A 134 -7.882 1.304 12.930 1.00 0.00 H new ATOM 0 HB VAL A 134 -5.018 0.535 12.247 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -4.624 2.970 12.145 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -5.794 2.454 10.907 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -6.363 3.264 12.386 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -4.505 1.757 14.336 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -6.243 2.031 14.603 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -5.586 0.377 14.646 1.00 0.00 H new ATOM 2043 N ALA A 135 -6.531 0.065 10.182 1.00 0.00 N ATOM 2044 CA ALA A 135 -6.685 -0.040 8.720 1.00 0.00 C ATOM 2045 C ALA A 135 -8.113 -0.436 8.364 1.00 0.00 C ATOM 2046 O ALA A 135 -8.764 0.225 7.551 1.00 0.00 O ATOM 2047 CB ALA A 135 -5.710 -1.086 8.184 1.00 0.00 C ATOM 0 H ALA A 135 -5.649 -0.302 10.540 1.00 0.00 H new ATOM 0 HA ALA A 135 -6.470 0.928 8.268 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -5.821 -1.167 7.103 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -4.689 -0.788 8.423 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -5.923 -2.051 8.643 1.00 0.00 H new ATOM 2053 N ASP A 136 -8.560 -1.524 8.993 1.00 0.00 N ATOM 2054 CA ASP A 136 -9.940 -2.002 8.836 1.00 0.00 C ATOM 2055 C ASP A 136 -10.882 -0.914 9.322 1.00 0.00 C ATOM 2056 O ASP A 136 -11.625 -0.331 8.527 1.00 0.00 O ATOM 2057 CB ASP A 136 -10.134 -3.264 9.673 1.00 0.00 C ATOM 2058 CG ASP A 136 -9.229 -4.383 9.176 1.00 0.00 C ATOM 2059 OD1 ASP A 136 -8.512 -4.172 8.174 1.00 0.00 O ATOM 2060 OD2 ASP A 136 -9.230 -5.477 9.780 1.00 0.00 O ATOM 0 H ASP A 136 -7.988 -2.093 9.617 1.00 0.00 H new ATOM 0 HA ASP A 136 -10.146 -2.233 7.791 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -9.915 -3.050 10.719 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -11.175 -3.583 9.624 1.00 0.00 H new ATOM 2065 N LYS A 137 -10.824 -0.660 10.632 1.00 0.00 N ATOM 2066 CA LYS A 137 -11.644 0.395 11.254 1.00 0.00 C ATOM 2067 C LYS A 137 -11.813 1.570 10.296 1.00 0.00 C ATOM 2068 O LYS A 137 -12.934 2.024 10.053 1.00 0.00 O ATOM 2069 CB LYS A 137 -10.971 0.863 12.540 1.00 0.00 C ATOM 2070 CG LYS A 137 -11.817 1.963 13.196 1.00 0.00 C ATOM 2071 CD LYS A 137 -11.241 2.541 14.509 1.00 0.00 C ATOM 2072 CE LYS A 137 -11.225 1.602 15.735 1.00 0.00 C ATOM 2073 NZ LYS A 137 -12.573 1.271 16.237 1.00 0.00 N ATOM 0 H LYS A 137 -10.223 -1.165 11.283 1.00 0.00 H new ATOM 0 HA LYS A 137 -12.631 -0.007 11.484 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -10.853 0.024 13.226 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -9.972 1.240 12.322 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -11.941 2.778 12.483 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -12.810 1.563 13.399 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -10.219 2.867 14.317 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -11.815 3.430 14.770 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -10.707 0.680 15.471 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -10.652 2.071 16.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -12.492 0.639 17.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -13.063 2.144 16.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -13.116 0.796 15.487 1.00 0.00 H new ATOM 2087 N ILE A 138 -10.679 2.007 9.744 1.00 0.00 N ATOM 2088 CA ILE A 138 -10.692 2.949 8.614 1.00 0.00 C ATOM 2089 C ILE A 138 -11.435 2.285 7.458 1.00 0.00 C ATOM 2090 O ILE A 138 -12.399 2.833 6.916 1.00 0.00 O ATOM 2091 CB ILE A 138 -9.256 3.261 8.189 1.00 0.00 C ATOM 2092 CG1 ILE A 138 -8.479 3.843 9.370 1.00 0.00 C ATOM 2093 CG2 ILE A 138 -9.270 4.260 7.032 1.00 0.00 C ATOM 2094 CD1 ILE A 138 -7.059 4.232 8.958 1.00 0.00 C ATOM 0 H ILE A 138 -9.748 1.730 10.054 1.00 0.00 H new ATOM 0 HA ILE A 138 -11.184 3.879 8.899 1.00 0.00 H new ATOM 0 HB ILE A 138 -8.769 2.342 7.864 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -9.001 4.718 9.757 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -8.439 3.113 10.178 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -8.246 4.481 6.730 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -9.813 3.833 6.189 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -9.761 5.179 7.351 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -6.530 4.643 9.818 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -6.531 3.350 8.595 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -7.102 4.981 8.167 1.00 0.00 H new ATOM 2106 N SER A 139 -10.933 1.099 7.106 1.00 0.00 N ATOM 2107 CA SER A 139 -11.437 0.334 5.952 1.00 0.00 C ATOM 2108 C SER A 139 -12.885 -0.138 6.078 1.00 0.00 C ATOM 2109 O SER A 139 -13.394 -0.785 5.159 1.00 0.00 O ATOM 2110 CB SER A 139 -10.506 -0.865 5.768 1.00 0.00 C ATOM 2111 OG SER A 139 -9.173 -0.410 5.600 1.00 0.00 O ATOM 0 H SER A 139 -10.171 0.640 7.606 1.00 0.00 H new ATOM 0 HA SER A 139 -11.441 0.999 5.088 1.00 0.00 H new ATOM 0 HB2 SER A 139 -10.570 -1.524 6.634 1.00 0.00 H new ATOM 0 HB3 SER A 139 -10.814 -1.448 4.900 1.00 0.00 H new ATOM 0 HG SER A 139 -8.866 0.017 6.427 1.00 0.00 H new ATOM 2117 N GLN A 140 -13.522 0.206 7.200 1.00 0.00 N ATOM 2118 CA GLN A 140 -14.965 -0.040 7.416 1.00 0.00 C ATOM 2119 C GLN A 140 -15.715 1.288 7.328 1.00 0.00 C ATOM 2120 O GLN A 140 -16.772 1.362 6.694 1.00 0.00 O ATOM 2121 CB GLN A 140 -15.200 -0.676 8.790 1.00 0.00 C ATOM 2122 CG GLN A 140 -14.835 -2.162 8.790 1.00 0.00 C ATOM 2123 CD GLN A 140 -13.339 -2.391 8.594 1.00 0.00 C ATOM 2124 OE1 GLN A 140 -12.549 -2.322 9.535 1.00 0.00 O ATOM 2125 NE2 GLN A 140 -12.923 -2.675 7.372 1.00 0.00 N ATOM 0 H GLN A 140 -13.061 0.662 7.987 1.00 0.00 H new ATOM 0 HA GLN A 140 -15.330 -0.725 6.651 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -14.606 -0.154 9.540 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -16.246 -0.557 9.073 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -15.149 -2.611 9.733 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -15.385 -2.669 7.997 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -13.593 -2.728 6.605 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -11.932 -2.841 7.196 1.00 0.00 H new ATOM 2134 N VAL A 141 -15.156 2.311 7.982 1.00 0.00 N ATOM 2135 CA VAL A 141 -15.768 3.651 7.993 1.00 0.00 C ATOM 2136 C VAL A 141 -16.335 3.994 6.617 1.00 0.00 C ATOM 2137 O VAL A 141 -15.643 3.894 5.600 1.00 0.00 O ATOM 2138 CB VAL A 141 -14.715 4.679 8.411 1.00 0.00 C ATOM 2139 CG1 VAL A 141 -14.197 4.345 9.810 1.00 0.00 C ATOM 2140 CG2 VAL A 141 -13.569 4.683 7.399 1.00 0.00 C ATOM 0 H VAL A 141 -14.286 2.242 8.509 1.00 0.00 H new ATOM 0 HA VAL A 141 -16.591 3.666 8.707 1.00 0.00 H new ATOM 0 HB VAL A 141 -15.163 5.673 8.433 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -13.447 5.079 10.105 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -15.025 4.366 10.519 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -13.750 3.351 9.805 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -12.821 5.416 7.700 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -13.113 3.694 7.362 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -13.955 4.942 6.413 1.00 0.00 H new ATOM 2150 N PRO A 142 -17.606 4.396 6.620 1.00 0.00 N ATOM 2151 CA PRO A 142 -18.313 4.849 5.414 1.00 0.00 C ATOM 2152 C PRO A 142 -17.434 5.663 4.464 1.00 0.00 C ATOM 2153 O PRO A 142 -16.262 5.929 4.749 1.00 0.00 O ATOM 2154 CB PRO A 142 -19.450 5.674 6.022 1.00 0.00 C ATOM 2155 CG PRO A 142 -19.721 5.008 7.374 1.00 0.00 C ATOM 2156 CD PRO A 142 -18.338 4.580 7.871 1.00 0.00 C ATOM 0 HA PRO A 142 -18.648 4.032 4.775 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -19.162 6.718 6.144 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -20.336 5.659 5.387 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -20.197 5.699 8.069 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -20.388 4.152 7.269 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -17.879 5.340 8.504 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -18.382 3.662 8.457 1.00 0.00 H new ATOM 2164 N THR A 143 -18.040 6.033 3.334 1.00 0.00 N ATOM 2165 CA THR A 143 -17.333 6.782 2.278 1.00 0.00 C ATOM 2166 C THR A 143 -18.276 7.486 1.330 1.00 0.00 C ATOM 2167 O THR A 143 -19.406 7.864 1.648 1.00 0.00 O ATOM 2168 CB THR A 143 -16.567 5.837 1.358 1.00 0.00 C ATOM 2169 OG1 THR A 143 -17.375 4.717 1.024 1.00 0.00 O ATOM 2170 CG2 THR A 143 -15.282 5.368 2.011 1.00 0.00 C ATOM 0 H THR A 143 -19.017 5.830 3.121 1.00 0.00 H new ATOM 0 HA THR A 143 -16.698 7.481 2.822 1.00 0.00 H new ATOM 0 HB THR A 143 -16.313 6.381 0.448 1.00 0.00 H new ATOM 0 HG1 THR A 143 -16.875 4.118 0.432 1.00 0.00 H new ATOM 0 HG21 THR A 143 -14.755 4.695 1.335 1.00 0.00 H new ATOM 0 HG22 THR A 143 -14.651 6.229 2.232 1.00 0.00 H new ATOM 0 HG23 THR A 143 -15.515 4.842 2.937 1.00 0.00 H new ATOM 2178 N HIS A 144 -17.715 7.599 0.130 1.00 0.00 N ATOM 2179 CA HIS A 144 -18.480 8.076 -1.034 1.00 0.00 C ATOM 2180 C HIS A 144 -17.607 8.155 -2.282 1.00 0.00 C ATOM 2181 O HIS A 144 -16.373 8.141 -2.207 1.00 0.00 O ATOM 2182 CB HIS A 144 -19.114 9.438 -0.737 1.00 0.00 C ATOM 2183 CG HIS A 144 -18.101 10.550 -0.559 1.00 0.00 C ATOM 2184 ND1 HIS A 144 -16.734 10.484 -0.873 1.00 0.00 N flip ATOM 2185 CD2 HIS A 144 -18.450 11.820 -0.117 1.00 0.00 C flip ATOM 2186 CE1 HIS A 144 -16.133 11.704 -0.640 1.00 0.00 C flip ATOM 2187 NE2 HIS A 144 -17.217 12.418 -0.208 1.00 0.00 N flip ATOM 0 H HIS A 144 -16.741 7.370 -0.069 1.00 0.00 H new ATOM 0 HA HIS A 144 -19.273 7.354 -1.228 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -19.790 9.700 -1.551 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -19.718 9.359 0.167 1.00 0.00 H new ATOM 0 HD1 HIS A 144 -16.255 9.654 -1.223 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -19.403 12.217 0.202 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -15.104 12.008 -0.763 1.00 0.00 H new ATOM 2195 N ASP A 145 -18.293 8.277 -3.421 1.00 0.00 N ATOM 2196 CA ASP A 145 -17.616 8.651 -4.676 1.00 0.00 C ATOM 2197 C ASP A 145 -16.798 9.925 -4.427 1.00 0.00 C ATOM 2198 O ASP A 145 -16.337 10.154 -3.303 1.00 0.00 O ATOM 2199 CB ASP A 145 -18.690 8.862 -5.744 1.00 0.00 C ATOM 2200 CG ASP A 145 -18.089 8.945 -7.141 1.00 0.00 C ATOM 2201 OD1 ASP A 145 -16.873 8.695 -7.286 1.00 0.00 O ATOM 2202 OD2 ASP A 145 -18.827 9.259 -8.101 1.00 0.00 O ATOM 0 H ASP A 145 -19.298 8.127 -3.506 1.00 0.00 H new ATOM 0 HA ASP A 145 -16.933 7.874 -5.019 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -19.408 8.042 -5.705 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -19.241 9.778 -5.530 1.00 0.00 H new ATOM 2207 N VAL A 146 -16.631 10.745 -5.467 1.00 0.00 N ATOM 2208 CA VAL A 146 -16.021 12.082 -5.302 1.00 0.00 C ATOM 2209 C VAL A 146 -16.389 12.943 -6.522 1.00 0.00 C ATOM 2210 O VAL A 146 -17.501 12.836 -7.050 1.00 0.00 O ATOM 2211 CB VAL A 146 -14.497 11.986 -5.092 1.00 0.00 C ATOM 2212 CG1 VAL A 146 -14.090 13.130 -4.164 1.00 0.00 C ATOM 2213 CG2 VAL A 146 -14.021 10.661 -4.496 1.00 0.00 C ATOM 0 H VAL A 146 -16.903 10.518 -6.424 1.00 0.00 H new ATOM 0 HA VAL A 146 -16.415 12.557 -4.404 1.00 0.00 H new ATOM 0 HB VAL A 146 -14.028 12.050 -6.074 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -13.014 13.094 -3.992 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -14.352 14.083 -4.624 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -14.613 13.030 -3.213 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -12.937 10.681 -4.383 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -14.485 10.513 -3.521 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -14.301 9.842 -5.159 1.00 0.00 H new ATOM 2223 N GLY A 147 -15.436 13.769 -6.964 1.00 0.00 N ATOM 2224 CA GLY A 147 -15.544 14.433 -8.272 1.00 0.00 C ATOM 2225 C GLY A 147 -15.450 13.363 -9.350 1.00 0.00 C ATOM 2226 O GLY A 147 -16.403 12.617 -9.589 1.00 0.00 O ATOM 0 H GLY A 147 -14.588 13.994 -6.443 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -16.489 14.971 -8.350 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -14.748 15.168 -8.394 1.00 0.00 H new ATOM 2230 N PRO A 148 -14.269 13.296 -9.965 1.00 0.00 N ATOM 2231 CA PRO A 148 -13.922 12.277 -10.965 1.00 0.00 C ATOM 2232 C PRO A 148 -13.599 10.956 -10.271 1.00 0.00 C ATOM 2233 O PRO A 148 -14.163 9.913 -10.611 1.00 0.00 O ATOM 2234 CB PRO A 148 -12.663 12.889 -11.584 1.00 0.00 C ATOM 2235 CG PRO A 148 -12.019 13.671 -10.436 1.00 0.00 C ATOM 2236 CD PRO A 148 -13.204 14.247 -9.658 1.00 0.00 C ATOM 0 HA PRO A 148 -14.709 12.052 -11.685 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -11.993 12.119 -11.966 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -12.909 13.542 -12.422 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -11.408 13.023 -9.807 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -11.367 14.461 -10.809 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -13.001 14.299 -8.588 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -13.453 15.256 -9.985 1.00 0.00 H new ATOM 2244 N TYR A 149 -12.663 11.037 -9.322 1.00 0.00 N ATOM 2245 CA TYR A 149 -12.115 9.842 -8.653 1.00 0.00 C ATOM 2246 C TYR A 149 -13.152 9.178 -7.750 1.00 0.00 C ATOM 2247 O TYR A 149 -13.666 9.792 -6.811 1.00 0.00 O ATOM 2248 CB TYR A 149 -10.895 10.259 -7.827 1.00 0.00 C ATOM 2249 CG TYR A 149 -9.846 10.901 -8.716 1.00 0.00 C ATOM 2250 CD1 TYR A 149 -9.240 10.153 -9.663 1.00 0.00 C ATOM 2251 CD2 TYR A 149 -9.534 12.207 -8.559 1.00 0.00 C ATOM 2252 CE1 TYR A 149 -8.311 10.714 -10.459 1.00 0.00 C ATOM 2253 CE2 TYR A 149 -8.605 12.768 -9.356 1.00 0.00 C ATOM 2254 CZ TYR A 149 -8.000 12.018 -10.301 1.00 0.00 C ATOM 2255 OH TYR A 149 -7.055 12.589 -11.113 1.00 0.00 O ATOM 0 H TYR A 149 -12.265 11.917 -8.995 1.00 0.00 H new ATOM 0 HA TYR A 149 -11.830 9.115 -9.413 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -11.198 10.959 -7.048 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -10.472 9.388 -7.326 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -9.499 9.111 -9.781 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -10.026 12.796 -7.800 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -7.818 10.125 -11.218 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -8.346 13.810 -9.240 1.00 0.00 H new ATOM 0 HH TYR A 149 -6.946 13.533 -10.874 1.00 0.00 H new ATOM 2265 N GLN A 150 -13.398 7.900 -8.048 1.00 0.00 N ATOM 2266 CA GLN A 150 -14.209 7.033 -7.167 1.00 0.00 C ATOM 2267 C GLN A 150 -13.419 6.624 -5.917 1.00 0.00 C ATOM 2268 O GLN A 150 -12.277 7.048 -5.714 1.00 0.00 O ATOM 2269 CB GLN A 150 -14.611 5.783 -7.955 1.00 0.00 C ATOM 2270 CG GLN A 150 -15.416 6.165 -9.201 1.00 0.00 C ATOM 2271 CD GLN A 150 -16.700 6.920 -8.859 1.00 0.00 C ATOM 2272 OE1 GLN A 150 -16.959 7.285 -7.712 1.00 0.00 O ATOM 2273 NE2 GLN A 150 -17.527 7.168 -9.860 1.00 0.00 N ATOM 0 H GLN A 150 -13.052 7.437 -8.888 1.00 0.00 H new ATOM 0 HA GLN A 150 -15.093 7.581 -6.841 1.00 0.00 H new ATOM 0 HB2 GLN A 150 -13.719 5.229 -8.248 1.00 0.00 H new ATOM 0 HB3 GLN A 150 -15.203 5.122 -7.322 1.00 0.00 H new ATOM 0 HG2 GLN A 150 -14.798 6.782 -9.854 1.00 0.00 H new ATOM 0 HG3 GLN A 150 -15.666 5.263 -9.759 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -17.294 6.857 -10.803 1.00 0.00 H new ATOM 0 HE22 GLN A 150 -18.398 7.670 -9.689 1.00 0.00 H new ATOM 2282 N ASN A 151 -14.060 5.782 -5.104 1.00 0.00 N ATOM 2283 CA ASN A 151 -13.408 5.223 -3.909 1.00 0.00 C ATOM 2284 C ASN A 151 -12.745 6.344 -3.112 1.00 0.00 C ATOM 2285 O ASN A 151 -11.554 6.624 -3.282 1.00 0.00 O ATOM 2286 CB ASN A 151 -12.402 4.150 -4.341 1.00 0.00 C ATOM 2287 CG ASN A 151 -13.106 3.019 -5.079 1.00 0.00 C ATOM 2288 OD1 ASN A 151 -14.390 2.861 -4.820 1.00 0.00 O flip ATOM 2289 ND2 ASN A 151 -12.512 2.286 -5.869 1.00 0.00 N flip ATOM 0 H ASN A 151 -15.021 5.472 -5.246 1.00 0.00 H new ATOM 0 HA ASN A 151 -14.145 4.752 -3.258 1.00 0.00 H new ATOM 0 HB2 ASN A 151 -11.643 4.594 -4.985 1.00 0.00 H new ATOM 0 HB3 ASN A 151 -11.886 3.755 -3.466 1.00 0.00 H new ATOM 0 HD21 ASN A 151 -11.519 2.431 -6.051 1.00 0.00 H new ATOM 0 HD22 ASN A 151 -13.013 1.534 -6.342 1.00 0.00 H new ATOM 2296 N VAL A 152 -13.549 6.953 -2.237 1.00 0.00 N ATOM 2297 CA VAL A 152 -13.062 8.011 -1.334 1.00 0.00 C ATOM 2298 C VAL A 152 -14.062 8.168 -0.197 1.00 0.00 C ATOM 2299 O VAL A 152 -15.150 8.725 -0.369 1.00 0.00 O ATOM 2300 CB VAL A 152 -12.886 9.326 -2.094 1.00 0.00 C ATOM 2301 CG1 VAL A 152 -12.447 10.420 -1.119 1.00 0.00 C ATOM 2302 CG2 VAL A 152 -11.839 9.147 -3.194 1.00 0.00 C ATOM 0 H VAL A 152 -14.540 6.735 -2.131 1.00 0.00 H new ATOM 0 HA VAL A 152 -12.088 7.737 -0.929 1.00 0.00 H new ATOM 0 HB VAL A 152 -13.832 9.615 -2.552 1.00 0.00 H new ATOM 0 HG11 VAL A 152 -12.321 11.359 -1.658 1.00 0.00 H new ATOM 0 HG12 VAL A 152 -13.206 10.545 -0.346 1.00 0.00 H new ATOM 0 HG13 VAL A 152 -11.501 10.137 -0.657 1.00 0.00 H new ATOM 0 HG21 VAL A 152 -11.715 10.085 -3.735 1.00 0.00 H new ATOM 0 HG22 VAL A 152 -10.888 8.857 -2.747 1.00 0.00 H new ATOM 0 HG23 VAL A 152 -12.167 8.371 -3.885 1.00 0.00 H new ATOM 2312 N PRO A 153 -13.655 7.654 0.961 1.00 0.00 N ATOM 2313 CA PRO A 153 -14.449 7.711 2.194 1.00 0.00 C ATOM 2314 C PRO A 153 -15.051 9.093 2.426 1.00 0.00 C ATOM 2315 O PRO A 153 -14.395 10.115 2.203 1.00 0.00 O ATOM 2316 CB PRO A 153 -13.402 7.334 3.248 1.00 0.00 C ATOM 2317 CG PRO A 153 -12.414 6.433 2.502 1.00 0.00 C ATOM 2318 CD PRO A 153 -12.340 7.034 1.096 1.00 0.00 C ATOM 0 HA PRO A 153 -15.321 7.057 2.194 1.00 0.00 H new ATOM 0 HB2 PRO A 153 -12.907 8.218 3.650 1.00 0.00 H new ATOM 0 HB3 PRO A 153 -13.857 6.813 4.090 1.00 0.00 H new ATOM 0 HG2 PRO A 153 -11.437 6.429 2.985 1.00 0.00 H new ATOM 0 HG3 PRO A 153 -12.760 5.400 2.475 1.00 0.00 H new ATOM 0 HD2 PRO A 153 -11.534 7.763 1.006 1.00 0.00 H new ATOM 0 HD3 PRO A 153 -12.168 6.272 0.335 1.00 0.00 H new ATOM 2326 N SER A 154 -16.302 9.082 2.893 1.00 0.00 N ATOM 2327 CA SER A 154 -16.994 10.323 3.287 1.00 0.00 C ATOM 2328 C SER A 154 -16.426 10.828 4.612 1.00 0.00 C ATOM 2329 O SER A 154 -17.176 11.212 5.513 1.00 0.00 O ATOM 2330 CB SER A 154 -18.483 10.024 3.442 1.00 0.00 C ATOM 2331 OG SER A 154 -18.680 9.033 4.441 1.00 0.00 O ATOM 0 H SER A 154 -16.858 8.235 3.009 1.00 0.00 H new ATOM 0 HA SER A 154 -16.848 11.090 2.526 1.00 0.00 H new ATOM 0 HB2 SER A 154 -19.019 10.934 3.711 1.00 0.00 H new ATOM 0 HB3 SER A 154 -18.894 9.681 2.492 1.00 0.00 H new ATOM 0 HG SER A 154 -19.638 8.849 4.535 1.00 0.00 H new ATOM 2337 N LYS A 155 -15.096 10.800 4.691 1.00 0.00 N ATOM 2338 CA LYS A 155 -14.371 11.121 5.928 1.00 0.00 C ATOM 2339 C LYS A 155 -12.886 11.018 5.622 1.00 0.00 C ATOM 2340 O LYS A 155 -12.218 10.069 6.039 1.00 0.00 O ATOM 2341 CB LYS A 155 -14.751 10.113 7.008 1.00 0.00 C ATOM 2342 CG LYS A 155 -13.795 10.216 8.204 1.00 0.00 C ATOM 2343 CD LYS A 155 -13.700 11.620 8.834 1.00 0.00 C ATOM 2344 CE LYS A 155 -14.949 12.050 9.629 1.00 0.00 C ATOM 2345 NZ LYS A 155 -14.759 13.369 10.257 1.00 0.00 N ATOM 0 H LYS A 155 -14.491 10.556 3.907 1.00 0.00 H new ATOM 0 HA LYS A 155 -14.619 12.122 6.282 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -15.774 10.293 7.337 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -14.721 9.104 6.598 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -14.116 9.510 8.970 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -12.800 9.908 7.884 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -12.835 11.649 9.497 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -13.520 12.348 8.043 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -15.812 12.083 8.964 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -15.167 11.308 10.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -15.617 13.629 10.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -13.950 13.329 10.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -14.576 14.081 9.521 1.00 0.00 H new ATOM 2359 N PRO A 156 -12.403 12.007 4.871 1.00 0.00 N ATOM 2360 CA PRO A 156 -11.015 12.069 4.400 1.00 0.00 C ATOM 2361 C PRO A 156 -10.012 11.764 5.508 1.00 0.00 C ATOM 2362 O PRO A 156 -9.796 12.577 6.412 1.00 0.00 O ATOM 2363 CB PRO A 156 -10.935 13.506 3.873 1.00 0.00 C ATOM 2364 CG PRO A 156 -12.360 13.823 3.414 1.00 0.00 C ATOM 2365 CD PRO A 156 -13.254 13.111 4.432 1.00 0.00 C ATOM 0 HA PRO A 156 -10.762 11.324 3.646 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -10.605 14.196 4.649 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -10.225 13.589 3.050 1.00 0.00 H new ATOM 0 HG2 PRO A 156 -12.545 14.897 3.405 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -12.542 13.460 2.403 1.00 0.00 H new ATOM 0 HD2 PRO A 156 -13.531 13.765 5.259 1.00 0.00 H new ATOM 0 HD3 PRO A 156 -14.181 12.756 3.982 1.00 0.00 H new ATOM 2373 N VAL A 157 -9.405 10.582 5.387 1.00 0.00 N ATOM 2374 CA VAL A 157 -8.329 10.162 6.307 1.00 0.00 C ATOM 2375 C VAL A 157 -7.072 11.005 6.082 1.00 0.00 C ATOM 2376 O VAL A 157 -6.840 11.530 4.989 1.00 0.00 O ATOM 2377 CB VAL A 157 -8.010 8.684 6.065 1.00 0.00 C ATOM 2378 CG1 VAL A 157 -6.876 8.245 6.993 1.00 0.00 C ATOM 2379 CG2 VAL A 157 -9.257 7.836 6.321 1.00 0.00 C ATOM 0 H VAL A 157 -9.634 9.897 4.667 1.00 0.00 H new ATOM 0 HA VAL A 157 -8.662 10.306 7.335 1.00 0.00 H new ATOM 0 HB VAL A 157 -7.697 8.547 5.030 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -6.650 7.193 6.819 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -5.988 8.845 6.792 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -7.180 8.384 8.030 1.00 0.00 H new ATOM 0 HG21 VAL A 157 -9.024 6.785 6.147 1.00 0.00 H new ATOM 0 HG22 VAL A 157 -9.583 7.970 7.353 1.00 0.00 H new ATOM 0 HG23 VAL A 157 -10.054 8.148 5.646 1.00 0.00 H new ATOM 2389 N VAL A 158 -6.274 11.096 7.150 1.00 0.00 N ATOM 2390 CA VAL A 158 -4.991 11.826 7.124 1.00 0.00 C ATOM 2391 C VAL A 158 -3.965 11.055 7.945 1.00 0.00 C ATOM 2392 O VAL A 158 -4.122 10.857 9.153 1.00 0.00 O ATOM 2393 CB VAL A 158 -5.178 13.240 7.680 1.00 0.00 C ATOM 2394 CG1 VAL A 158 -3.818 13.932 7.781 1.00 0.00 C ATOM 2395 CG2 VAL A 158 -6.107 14.028 6.756 1.00 0.00 C ATOM 0 H VAL A 158 -6.491 10.672 8.052 1.00 0.00 H new ATOM 0 HA VAL A 158 -4.636 11.912 6.097 1.00 0.00 H new ATOM 0 HB VAL A 158 -5.623 13.191 8.674 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -3.951 14.939 8.177 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -3.169 13.363 8.447 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -3.364 13.988 6.792 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -6.242 15.036 7.149 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -5.668 14.083 5.760 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -7.074 13.528 6.699 1.00 0.00 H new ATOM 2405 N ILE A 159 -2.919 10.639 7.232 1.00 0.00 N ATOM 2406 CA ILE A 159 -1.829 9.850 7.831 1.00 0.00 C ATOM 2407 C ILE A 159 -1.012 10.694 8.800 1.00 0.00 C ATOM 2408 O ILE A 159 -0.654 11.842 8.524 1.00 0.00 O ATOM 2409 CB ILE A 159 -0.948 9.297 6.714 1.00 0.00 C ATOM 2410 CG1 ILE A 159 -1.788 8.307 5.908 1.00 0.00 C ATOM 2411 CG2 ILE A 159 0.279 8.601 7.304 1.00 0.00 C ATOM 2412 CD1 ILE A 159 -0.939 7.611 4.850 1.00 0.00 C ATOM 0 H ILE A 159 -2.798 10.832 6.238 1.00 0.00 H new ATOM 0 HA ILE A 159 -2.253 9.024 8.401 1.00 0.00 H new ATOM 0 HB ILE A 159 -0.595 10.103 6.071 1.00 0.00 H new ATOM 0 HG12 ILE A 159 -2.224 7.565 6.577 1.00 0.00 H new ATOM 0 HG13 ILE A 159 -2.616 8.831 5.430 1.00 0.00 H new ATOM 0 HG21 ILE A 159 0.899 8.211 6.497 1.00 0.00 H new ATOM 0 HG22 ILE A 159 0.855 9.316 7.892 1.00 0.00 H new ATOM 0 HG23 ILE A 159 -0.042 7.779 7.945 1.00 0.00 H new ATOM 0 HD11 ILE A 159 -1.558 6.911 4.289 1.00 0.00 H new ATOM 0 HD12 ILE A 159 -0.524 8.355 4.169 1.00 0.00 H new ATOM 0 HD13 ILE A 159 -0.127 7.069 5.334 1.00 0.00 H new ATOM 2424 N LEU A 160 -0.747 10.057 9.939 1.00 0.00 N ATOM 2425 CA LEU A 160 0.034 10.674 11.028 1.00 0.00 C ATOM 2426 C LEU A 160 1.523 10.470 10.772 1.00 0.00 C ATOM 2427 O LEU A 160 2.302 11.424 10.847 1.00 0.00 O ATOM 2428 CB LEU A 160 -0.380 10.037 12.355 1.00 0.00 C ATOM 2429 CG LEU A 160 -1.866 10.303 12.617 1.00 0.00 C ATOM 2430 CD1 LEU A 160 -2.297 9.694 13.954 1.00 0.00 C ATOM 2431 CD2 LEU A 160 -2.132 11.811 12.613 1.00 0.00 C ATOM 0 H LEU A 160 -1.061 9.107 10.140 1.00 0.00 H new ATOM 0 HA LEU A 160 -0.161 11.746 11.070 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -0.193 8.964 12.328 1.00 0.00 H new ATOM 0 HB3 LEU A 160 0.221 10.445 13.168 1.00 0.00 H new ATOM 0 HG LEU A 160 -2.449 9.835 11.824 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -3.355 9.894 14.121 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -2.130 8.617 13.934 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -1.713 10.137 14.761 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -3.190 11.994 12.800 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -1.538 12.287 13.393 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -1.857 12.226 11.643 1.00 0.00 H new ATOM 2443 N SER A 161 1.887 9.218 10.474 1.00 0.00 N ATOM 2444 CA SER A 161 3.299 8.862 10.227 1.00 0.00 C ATOM 2445 C SER A 161 3.451 7.441 9.680 1.00 0.00 C ATOM 2446 O SER A 161 2.552 6.605 9.809 1.00 0.00 O ATOM 2447 CB SER A 161 4.060 8.997 11.544 1.00 0.00 C ATOM 2448 OG SER A 161 5.440 8.730 11.338 1.00 0.00 O ATOM 0 H SER A 161 1.235 8.437 10.397 1.00 0.00 H new ATOM 0 HA SER A 161 3.702 9.536 9.471 1.00 0.00 H new ATOM 0 HB2 SER A 161 3.932 10.002 11.946 1.00 0.00 H new ATOM 0 HB3 SER A 161 3.653 8.305 12.281 1.00 0.00 H new ATOM 0 HG SER A 161 5.686 8.969 10.420 1.00 0.00 H new ATOM 2454 N ALA A 162 4.622 7.213 9.075 1.00 0.00 N ATOM 2455 CA ALA A 162 4.985 5.903 8.496 1.00 0.00 C ATOM 2456 C ALA A 162 6.436 5.599 8.856 1.00 0.00 C ATOM 2457 O ALA A 162 7.308 5.435 7.997 1.00 0.00 O ATOM 2458 CB ALA A 162 4.778 5.941 6.984 1.00 0.00 C ATOM 0 H ALA A 162 5.346 7.924 8.970 1.00 0.00 H new ATOM 0 HA ALA A 162 4.352 5.112 8.899 1.00 0.00 H new ATOM 0 HB1 ALA A 162 5.046 4.975 6.556 1.00 0.00 H new ATOM 0 HB2 ALA A 162 3.732 6.158 6.765 1.00 0.00 H new ATOM 0 HB3 ALA A 162 5.408 6.717 6.550 1.00 0.00 H new ATOM 2464 N LYS A 163 6.630 5.525 10.167 1.00 0.00 N ATOM 2465 CA LYS A 163 7.925 5.150 10.753 1.00 0.00 C ATOM 2466 C LYS A 163 8.196 3.677 10.485 1.00 0.00 C ATOM 2467 O LYS A 163 7.776 2.816 11.263 1.00 0.00 O ATOM 2468 CB LYS A 163 7.864 5.379 12.261 1.00 0.00 C ATOM 2469 CG LYS A 163 7.586 6.852 12.577 1.00 0.00 C ATOM 2470 CD LYS A 163 8.662 7.794 11.998 1.00 0.00 C ATOM 2471 CE LYS A 163 8.469 9.285 12.341 1.00 0.00 C ATOM 2472 NZ LYS A 163 7.318 9.902 11.653 1.00 0.00 N ATOM 0 H LYS A 163 5.904 5.721 10.856 1.00 0.00 H new ATOM 0 HA LYS A 163 8.719 5.752 10.311 1.00 0.00 H new ATOM 0 HB2 LYS A 163 7.083 4.755 12.697 1.00 0.00 H new ATOM 0 HB3 LYS A 163 8.806 5.076 12.718 1.00 0.00 H new ATOM 0 HG2 LYS A 163 6.611 7.129 12.175 1.00 0.00 H new ATOM 0 HG3 LYS A 163 7.535 6.985 13.658 1.00 0.00 H new ATOM 0 HD2 LYS A 163 9.638 7.475 12.363 1.00 0.00 H new ATOM 0 HD3 LYS A 163 8.676 7.684 10.914 1.00 0.00 H new ATOM 0 HE2 LYS A 163 8.337 9.388 13.418 1.00 0.00 H new ATOM 0 HE3 LYS A 163 9.375 9.831 12.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 7.099 10.817 12.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 7.551 10.049 10.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 6.492 9.275 11.728 1.00 0.00 H new ATOM 2486 N VAL A 164 8.906 3.418 9.385 1.00 0.00 N ATOM 2487 CA VAL A 164 9.331 2.052 9.041 1.00 0.00 C ATOM 2488 C VAL A 164 10.431 1.583 9.989 1.00 0.00 C ATOM 2489 O VAL A 164 11.407 2.296 10.243 1.00 0.00 O ATOM 2490 CB VAL A 164 9.833 2.048 7.601 1.00 0.00 C ATOM 2491 CG1 VAL A 164 8.690 2.430 6.661 1.00 0.00 C ATOM 2492 CG2 VAL A 164 11.010 3.014 7.451 1.00 0.00 C ATOM 0 H VAL A 164 9.200 4.131 8.717 1.00 0.00 H new ATOM 0 HA VAL A 164 8.489 1.368 9.140 1.00 0.00 H new ATOM 0 HB VAL A 164 10.181 1.049 7.340 1.00 0.00 H new ATOM 0 HG11 VAL A 164 9.049 2.427 5.632 1.00 0.00 H new ATOM 0 HG12 VAL A 164 7.878 1.710 6.764 1.00 0.00 H new ATOM 0 HG13 VAL A 164 8.327 3.426 6.916 1.00 0.00 H new ATOM 0 HG21 VAL A 164 11.360 3.003 6.419 1.00 0.00 H new ATOM 0 HG22 VAL A 164 10.689 4.022 7.715 1.00 0.00 H new ATOM 0 HG23 VAL A 164 11.820 2.706 8.112 1.00 0.00 H new ATOM 2502 N LEU A 165 10.227 0.365 10.490 1.00 0.00 N ATOM 2503 CA LEU A 165 11.180 -0.274 11.418 1.00 0.00 C ATOM 2504 C LEU A 165 12.366 -0.821 10.628 1.00 0.00 C ATOM 2505 O LEU A 165 12.206 -1.650 9.727 1.00 0.00 O ATOM 2506 CB LEU A 165 10.485 -1.398 12.196 1.00 0.00 C ATOM 2507 CG LEU A 165 9.459 -0.850 13.196 1.00 0.00 C ATOM 2508 CD1 LEU A 165 10.122 0.192 14.100 1.00 0.00 C ATOM 2509 CD2 LEU A 165 8.249 -0.239 12.482 1.00 0.00 C ATOM 0 H LEU A 165 9.410 -0.206 10.272 1.00 0.00 H new ATOM 0 HA LEU A 165 11.541 0.464 12.134 1.00 0.00 H new ATOM 0 HB2 LEU A 165 9.988 -2.070 11.497 1.00 0.00 H new ATOM 0 HB3 LEU A 165 11.232 -1.987 12.728 1.00 0.00 H new ATOM 0 HG LEU A 165 9.100 -1.681 13.803 1.00 0.00 H new ATOM 0 HD11 LEU A 165 9.389 0.578 14.808 1.00 0.00 H new ATOM 0 HD12 LEU A 165 10.945 -0.270 14.645 1.00 0.00 H new ATOM 0 HD13 LEU A 165 10.505 1.011 13.491 1.00 0.00 H new ATOM 0 HD21 LEU A 165 7.543 0.139 13.221 1.00 0.00 H new ATOM 0 HD22 LEU A 165 8.579 0.580 11.843 1.00 0.00 H new ATOM 0 HD23 LEU A 165 7.763 -1.001 11.873 1.00 0.00 H new ATOM 2521 N PRO A 166 13.553 -0.338 10.998 1.00 0.00 N ATOM 2522 CA PRO A 166 14.829 -0.797 10.433 1.00 0.00 C ATOM 2523 C PRO A 166 15.046 -2.270 10.777 1.00 0.00 C ATOM 2524 O PRO A 166 14.954 -3.118 9.863 1.00 0.00 O ATOM 2525 CB PRO A 166 15.831 0.127 11.136 1.00 0.00 C ATOM 2526 CG PRO A 166 15.161 0.480 12.466 1.00 0.00 C ATOM 2527 CD PRO A 166 13.674 0.587 12.123 1.00 0.00 C ATOM 2528 OXT PRO A 166 15.308 -2.587 11.959 1.00 0.00 O ATOM 0 HA PRO A 166 14.903 -0.747 9.347 1.00 0.00 H new ATOM 0 HB2 PRO A 166 16.787 -0.372 11.294 1.00 0.00 H new ATOM 0 HB3 PRO A 166 16.031 1.020 10.543 1.00 0.00 H new ATOM 0 HG2 PRO A 166 15.341 -0.288 13.218 1.00 0.00 H new ATOM 0 HG3 PRO A 166 15.545 1.417 12.868 1.00 0.00 H new ATOM 0 HD2 PRO A 166 13.040 0.295 12.961 1.00 0.00 H new ATOM 0 HD3 PRO A 166 13.391 1.603 11.848 1.00 0.00 H new