USER MOD reduce.3.24.130724 H: found=0, std=0, add=1193, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1192 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 MET CE :methyl -110:sc= -3.82 (180deg=-1.08) USER MOD Set 1.2: A 125 GLN : amide:sc= -3.7 K(o=-7.5,f=-8.8!) USER MOD Set 2.1: A 114 LYS NZ :NH3+ 166:sc= 0.314 (180deg=0) USER MOD Set 2.2: A 119 SER OG : rot 180:sc= 0.297 USER MOD Set 3.1: A 70 THR OG1 : rot 59:sc= 1.37 USER MOD Set 3.2: A 109 THR OG1 : rot 177:sc= 0.506 USER MOD Set 4.1: A 88 ASN : amide:sc= -2.35 K(o=-5.6,f=-12!) USER MOD Set 4.2: A 108 SER OG : rot 67:sc= -3.24 USER MOD Set 5.1: A 35 THR OG1 : rot 126:sc= 0.763 USER MOD Set 5.2: A 37 ASN : amide:sc= 0 K(o=-8.2,f=-8.9) USER MOD Set 5.3: A 41 HIS : no HE2:sc= -8.93! C(o=-8.2!,f=-13!) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -1.56 X(o=-1.6,f=-1.7) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 138:sc= 0.13 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 40:sc= -2.62 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 139:sc= -2.52! USER MOD Single : A 36 ASN : amide:sc= -1.99 K(o=-2,f=-5.2!) USER MOD Single : A 40 HIS : no HD1:sc= -0.0891 K(o=-0.089,f=-1.2!) USER MOD Single : A 43 MET CE :methyl 156:sc= -9.97! (180deg=-10.7!) USER MOD Single : A 47 SER OG : rot 180:sc= 0.437 USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot -94:sc= 0.884 USER MOD Single : A 57 GLN : amide:sc= -1.05 X(o=-1,f=-1.1) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot -140:sc= -0.25 USER MOD Single : A 62 MET CE :methyl 143:sc= -6.64 (180deg=-13.6!) USER MOD Single : A 65 THR OG1 : rot 60:sc= 1.1 USER MOD Single : A 67 LYS NZ :NH3+ -170:sc=-0.00421 (180deg=-0.139) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 85:sc= 1.3 USER MOD Single : A 86 HIS :FLIP no HE2:sc= -3.83! F(o=-4.8,f=-3.8!) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0.0649 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 MET CE :methyl -127:sc= -6.89! (180deg=-11.5!) USER MOD Single : A 111 SER OG : rot 50:sc= 1.4 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.037 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -2.89 X(o=-2.9,f=-3.4) USER MOD Single : A 124 SER OG : rot -35:sc= 0.0256 USER MOD Single : A 126 LYS NZ :NH3+ 151:sc= 0.548 (180deg=0.0399) USER MOD Single : A 128 GLN : amide:sc= -0.164 X(o=-0.16,f=-0.065) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 ASN :FLIP amide:sc= -0.392 F(o=-1.2,f=-0.39) USER MOD Single : A 147 SER OG : rot 180:sc= -0.621 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 8.712 -37.813 -37.928 1.00 0.00 N ATOM 2 CA GLY A 2 9.569 -37.500 -36.752 1.00 0.00 C ATOM 3 C GLY A 2 8.934 -36.481 -35.826 1.00 0.00 C ATOM 4 O GLY A 2 8.189 -36.840 -34.914 1.00 0.00 O ATOM 0 HA2 GLY A 2 9.767 -38.417 -36.197 1.00 0.00 H new ATOM 0 HA3 GLY A 2 10.531 -37.122 -37.098 1.00 0.00 H new ATOM 10 N SER A 3 9.230 -35.207 -36.060 1.00 0.00 N ATOM 11 CA SER A 3 8.683 -34.132 -35.239 1.00 0.00 C ATOM 12 C SER A 3 7.412 -33.566 -35.861 1.00 0.00 C ATOM 13 O SER A 3 7.355 -33.320 -37.067 1.00 0.00 O ATOM 14 CB SER A 3 9.718 -33.020 -35.061 1.00 0.00 C ATOM 15 OG SER A 3 9.503 -32.308 -33.854 1.00 0.00 O ATOM 0 H SER A 3 9.845 -34.893 -36.811 1.00 0.00 H new ATOM 0 HA SER A 3 8.434 -34.546 -34.262 1.00 0.00 H new ATOM 0 HB2 SER A 3 10.720 -33.449 -35.060 1.00 0.00 H new ATOM 0 HB3 SER A 3 9.667 -32.333 -35.906 1.00 0.00 H new ATOM 0 HG SER A 3 10.179 -31.604 -33.764 1.00 0.00 H new ATOM 21 N HIS A 4 6.393 -33.361 -35.033 1.00 0.00 N ATOM 22 CA HIS A 4 5.122 -32.824 -35.502 1.00 0.00 C ATOM 23 C HIS A 4 5.148 -31.297 -35.515 1.00 0.00 C ATOM 24 O HIS A 4 5.301 -30.660 -34.472 1.00 0.00 O ATOM 25 CB HIS A 4 3.976 -33.320 -34.618 1.00 0.00 C ATOM 26 CG HIS A 4 2.778 -33.777 -35.390 1.00 0.00 C ATOM 27 ND1 HIS A 4 1.806 -32.915 -35.852 1.00 0.00 N ATOM 28 CD2 HIS A 4 2.398 -35.016 -35.785 1.00 0.00 C ATOM 29 CE1 HIS A 4 0.880 -33.604 -36.496 1.00 0.00 C ATOM 30 NE2 HIS A 4 1.216 -34.881 -36.469 1.00 0.00 N ATOM 0 H HIS A 4 6.423 -33.559 -34.033 1.00 0.00 H new ATOM 0 HA HIS A 4 4.962 -33.175 -36.521 1.00 0.00 H new ATOM 0 HB2 HIS A 4 4.335 -34.143 -34.000 1.00 0.00 H new ATOM 0 HB3 HIS A 4 3.678 -32.519 -33.941 1.00 0.00 H new ATOM 0 HD2 HIS A 4 2.927 -35.939 -35.597 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -0.002 -33.193 -36.965 1.00 0.00 H new ATOM 0 HE2 HIS A 4 0.683 -35.643 -36.888 1.00 0.00 H new ATOM 38 N MET A 5 4.997 -30.718 -36.702 1.00 0.00 N ATOM 39 CA MET A 5 5.004 -29.267 -36.849 1.00 0.00 C ATOM 40 C MET A 5 3.584 -28.709 -36.803 1.00 0.00 C ATOM 41 O MET A 5 2.706 -29.156 -37.541 1.00 0.00 O ATOM 42 CB MET A 5 5.677 -28.870 -38.164 1.00 0.00 C ATOM 43 CG MET A 5 7.181 -29.091 -38.169 1.00 0.00 C ATOM 44 SD MET A 5 8.070 -27.798 -39.058 1.00 0.00 S ATOM 45 CE MET A 5 8.536 -28.673 -40.551 1.00 0.00 C ATOM 0 H MET A 5 4.869 -31.230 -37.575 1.00 0.00 H new ATOM 0 HA MET A 5 5.569 -28.845 -36.018 1.00 0.00 H new ATOM 0 HB2 MET A 5 5.231 -29.442 -38.978 1.00 0.00 H new ATOM 0 HB3 MET A 5 5.472 -27.818 -38.364 1.00 0.00 H new ATOM 0 HG2 MET A 5 7.541 -29.134 -37.141 1.00 0.00 H new ATOM 0 HG3 MET A 5 7.401 -30.057 -38.624 1.00 0.00 H new ATOM 0 HE1 MET A 5 9.095 -28.004 -41.205 1.00 0.00 H new ATOM 0 HE2 MET A 5 9.158 -29.530 -40.292 1.00 0.00 H new ATOM 0 HE3 MET A 5 7.639 -29.018 -41.066 1.00 0.00 H new ATOM 55 N ARG A 6 3.368 -27.730 -35.931 1.00 0.00 N ATOM 56 CA ARG A 6 2.056 -27.110 -35.788 1.00 0.00 C ATOM 57 C ARG A 6 1.890 -25.954 -36.771 1.00 0.00 C ATOM 58 O ARG A 6 2.549 -24.922 -36.645 1.00 0.00 O ATOM 59 CB ARG A 6 1.857 -26.611 -34.355 1.00 0.00 C ATOM 60 CG ARG A 6 0.498 -26.966 -33.770 1.00 0.00 C ATOM 61 CD ARG A 6 0.609 -28.039 -32.696 1.00 0.00 C ATOM 62 NE ARG A 6 0.042 -27.599 -31.423 1.00 0.00 N ATOM 63 CZ ARG A 6 -1.256 -27.650 -31.131 1.00 0.00 C ATOM 64 NH1 ARG A 6 -2.127 -28.116 -32.018 1.00 0.00 N ATOM 65 NH2 ARG A 6 -1.685 -27.232 -29.948 1.00 0.00 N ATOM 0 H ARG A 6 4.084 -27.349 -35.313 1.00 0.00 H new ATOM 0 HA ARG A 6 1.300 -27.863 -36.010 1.00 0.00 H new ATOM 0 HB2 ARG A 6 2.637 -27.032 -33.721 1.00 0.00 H new ATOM 0 HB3 ARG A 6 1.980 -25.528 -34.336 1.00 0.00 H new ATOM 0 HG2 ARG A 6 0.040 -26.073 -33.346 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -0.161 -27.314 -34.566 1.00 0.00 H new ATOM 0 HD2 ARG A 6 0.095 -28.941 -33.030 1.00 0.00 H new ATOM 0 HD3 ARG A 6 1.657 -28.303 -32.554 1.00 0.00 H new ATOM 0 HE ARG A 6 0.679 -27.231 -30.716 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -1.803 -28.438 -32.930 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -3.120 -28.152 -31.787 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -1.021 -26.872 -29.263 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -2.679 -27.271 -29.723 1.00 0.00 H new ATOM 79 N VAL A 7 1.006 -26.136 -37.746 1.00 0.00 N ATOM 80 CA VAL A 7 0.753 -25.108 -38.749 1.00 0.00 C ATOM 81 C VAL A 7 -0.152 -24.012 -38.196 1.00 0.00 C ATOM 82 O VAL A 7 0.095 -22.825 -38.405 1.00 0.00 O ATOM 83 CB VAL A 7 0.106 -25.700 -40.014 1.00 0.00 C ATOM 84 CG1 VAL A 7 0.075 -24.669 -41.131 1.00 0.00 C ATOM 85 CG2 VAL A 7 0.843 -26.955 -40.456 1.00 0.00 C ATOM 0 H VAL A 7 0.453 -26.985 -37.863 1.00 0.00 H new ATOM 0 HA VAL A 7 1.721 -24.681 -39.012 1.00 0.00 H new ATOM 0 HB VAL A 7 -0.922 -25.976 -39.778 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -0.386 -25.106 -42.017 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -0.504 -23.803 -40.811 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.093 -24.358 -41.367 1.00 0.00 H new ATOM 0 HG21 VAL A 7 0.370 -27.358 -41.352 1.00 0.00 H new ATOM 0 HG22 VAL A 7 1.882 -26.709 -40.674 1.00 0.00 H new ATOM 0 HG23 VAL A 7 0.805 -27.699 -39.660 1.00 0.00 H new ATOM 95 N THR A 8 -1.200 -24.421 -37.489 1.00 0.00 N ATOM 96 CA THR A 8 -2.143 -23.475 -36.905 1.00 0.00 C ATOM 97 C THR A 8 -1.513 -22.733 -35.729 1.00 0.00 C ATOM 98 O THR A 8 -0.993 -23.351 -34.800 1.00 0.00 O ATOM 99 CB THR A 8 -3.408 -24.201 -36.448 1.00 0.00 C ATOM 100 OG1 THR A 8 -4.235 -23.337 -35.687 1.00 0.00 O ATOM 101 CG2 THR A 8 -3.124 -25.424 -35.602 1.00 0.00 C ATOM 0 H THR A 8 -1.418 -25.401 -37.307 1.00 0.00 H new ATOM 0 HA THR A 8 -2.408 -22.745 -37.670 1.00 0.00 H new ATOM 0 HB THR A 8 -3.905 -24.519 -37.364 1.00 0.00 H new ATOM 0 HG1 THR A 8 -5.040 -23.819 -35.405 1.00 0.00 H new ATOM 0 HG21 THR A 8 -4.065 -25.892 -35.311 1.00 0.00 H new ATOM 0 HG22 THR A 8 -2.528 -26.133 -36.176 1.00 0.00 H new ATOM 0 HG23 THR A 8 -2.574 -25.129 -34.708 1.00 0.00 H new ATOM 109 N GLN A 9 -1.565 -21.407 -35.776 1.00 0.00 N ATOM 110 CA GLN A 9 -1.001 -20.581 -34.714 1.00 0.00 C ATOM 111 C GLN A 9 -2.055 -19.636 -34.145 1.00 0.00 C ATOM 112 O GLN A 9 -2.774 -18.971 -34.889 1.00 0.00 O ATOM 113 CB GLN A 9 0.190 -19.778 -35.241 1.00 0.00 C ATOM 114 CG GLN A 9 -0.149 -18.893 -36.430 1.00 0.00 C ATOM 115 CD GLN A 9 -0.643 -17.520 -36.013 1.00 0.00 C ATOM 116 OE1 GLN A 9 -0.039 -16.861 -35.168 1.00 0.00 O ATOM 117 NE2 GLN A 9 -1.748 -17.086 -36.605 1.00 0.00 N ATOM 0 H GLN A 9 -1.992 -20.880 -36.538 1.00 0.00 H new ATOM 0 HA GLN A 9 -0.660 -21.240 -33.916 1.00 0.00 H new ATOM 0 HB2 GLN A 9 0.582 -19.156 -34.436 1.00 0.00 H new ATOM 0 HB3 GLN A 9 0.984 -20.468 -35.527 1.00 0.00 H new ATOM 0 HG2 GLN A 9 0.734 -18.782 -37.059 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -0.912 -19.381 -37.036 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -2.216 -17.667 -37.301 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -2.130 -16.171 -36.365 1.00 0.00 H new ATOM 126 N GLU A 10 -2.139 -19.585 -32.819 1.00 0.00 N ATOM 127 CA GLU A 10 -3.107 -18.722 -32.149 1.00 0.00 C ATOM 128 C GLU A 10 -2.506 -18.106 -30.889 1.00 0.00 C ATOM 129 O GLU A 10 -1.295 -18.162 -30.675 1.00 0.00 O ATOM 130 CB GLU A 10 -4.368 -19.515 -31.797 1.00 0.00 C ATOM 131 CG GLU A 10 -5.659 -18.807 -32.175 1.00 0.00 C ATOM 132 CD GLU A 10 -6.892 -19.564 -31.725 1.00 0.00 C ATOM 133 OE1 GLU A 10 -7.230 -19.488 -30.526 1.00 0.00 O ATOM 134 OE2 GLU A 10 -7.521 -20.233 -32.572 1.00 0.00 O ATOM 0 H GLU A 10 -1.550 -20.129 -32.188 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.374 -17.915 -32.831 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.332 -20.481 -32.301 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -4.374 -19.715 -30.726 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -5.666 -17.811 -31.731 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -5.693 -18.674 -33.256 1.00 0.00 H new ATOM 141 N GLU A 11 -3.361 -17.519 -30.057 1.00 0.00 N ATOM 142 CA GLU A 11 -2.917 -16.894 -28.818 1.00 0.00 C ATOM 143 C GLU A 11 -3.795 -17.327 -27.649 1.00 0.00 C ATOM 144 O GLU A 11 -5.009 -17.471 -27.793 1.00 0.00 O ATOM 145 CB GLU A 11 -2.943 -15.370 -28.952 1.00 0.00 C ATOM 146 CG GLU A 11 -1.878 -14.668 -28.124 1.00 0.00 C ATOM 147 CD GLU A 11 -1.280 -13.470 -28.836 1.00 0.00 C ATOM 148 OE1 GLU A 11 -1.993 -12.457 -28.991 1.00 0.00 O ATOM 149 OE2 GLU A 11 -0.101 -13.547 -29.242 1.00 0.00 O ATOM 0 H GLU A 11 -4.366 -17.464 -30.220 1.00 0.00 H new ATOM 0 HA GLU A 11 -1.894 -17.217 -28.623 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -2.810 -15.103 -30.001 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -3.925 -15.004 -28.652 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -2.313 -14.344 -27.179 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -1.085 -15.376 -27.884 1.00 0.00 H new ATOM 156 N ILE A 12 -3.174 -17.538 -26.494 1.00 0.00 N ATOM 157 CA ILE A 12 -3.901 -17.957 -25.303 1.00 0.00 C ATOM 158 C ILE A 12 -4.479 -16.759 -24.560 1.00 0.00 C ATOM 159 O ILE A 12 -3.740 -15.948 -24.000 1.00 0.00 O ATOM 160 CB ILE A 12 -3.001 -18.758 -24.342 1.00 0.00 C ATOM 161 CG1 ILE A 12 -2.231 -19.841 -25.104 1.00 0.00 C ATOM 162 CG2 ILE A 12 -3.833 -19.376 -23.231 1.00 0.00 C ATOM 163 CD1 ILE A 12 -0.823 -20.052 -24.593 1.00 0.00 C ATOM 0 H ILE A 12 -2.169 -17.426 -26.358 1.00 0.00 H new ATOM 0 HA ILE A 12 -4.715 -18.598 -25.643 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.279 -18.076 -23.894 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -2.779 -20.781 -25.036 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.190 -19.572 -26.159 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -3.184 -19.939 -22.560 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -4.337 -18.587 -22.672 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -4.576 -20.046 -23.663 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -0.337 -20.833 -25.178 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -0.259 -19.124 -24.686 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -0.857 -20.352 -23.546 1.00 0.00 H new ATOM 175 N LYS A 13 -5.803 -16.652 -24.556 1.00 0.00 N ATOM 176 CA LYS A 13 -6.482 -15.553 -23.880 1.00 0.00 C ATOM 177 C LYS A 13 -7.913 -15.936 -23.520 1.00 0.00 C ATOM 178 O LYS A 13 -8.854 -15.622 -24.250 1.00 0.00 O ATOM 179 CB LYS A 13 -6.484 -14.305 -24.766 1.00 0.00 C ATOM 180 CG LYS A 13 -5.150 -13.578 -24.797 1.00 0.00 C ATOM 181 CD LYS A 13 -5.334 -12.085 -25.026 1.00 0.00 C ATOM 182 CE LYS A 13 -5.115 -11.294 -23.746 1.00 0.00 C ATOM 183 NZ LYS A 13 -4.574 -9.932 -24.020 1.00 0.00 N ATOM 0 H LYS A 13 -6.429 -17.315 -25.014 1.00 0.00 H new ATOM 0 HA LYS A 13 -5.940 -15.337 -22.959 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -6.756 -14.592 -25.782 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -7.254 -13.619 -24.412 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -4.624 -13.741 -23.856 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -4.526 -13.994 -25.588 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -4.635 -11.744 -25.790 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -6.338 -11.895 -25.405 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -6.058 -11.208 -23.206 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -4.425 -11.835 -23.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -4.439 -9.425 -23.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -3.662 -10.013 -24.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -5.244 -9.406 -24.617 1.00 0.00 H new ATOM 197 N LYS A 14 -8.072 -16.618 -22.391 1.00 0.00 N ATOM 198 CA LYS A 14 -9.389 -17.046 -21.936 1.00 0.00 C ATOM 199 C LYS A 14 -9.422 -17.190 -20.416 1.00 0.00 C ATOM 200 O LYS A 14 -9.931 -18.177 -19.886 1.00 0.00 O ATOM 201 CB LYS A 14 -9.774 -18.372 -22.595 1.00 0.00 C ATOM 202 CG LYS A 14 -8.699 -19.442 -22.480 1.00 0.00 C ATOM 203 CD LYS A 14 -8.015 -19.695 -23.816 1.00 0.00 C ATOM 204 CE LYS A 14 -8.503 -20.983 -24.460 1.00 0.00 C ATOM 205 NZ LYS A 14 -8.770 -20.812 -25.915 1.00 0.00 N ATOM 0 H LYS A 14 -7.305 -16.886 -21.774 1.00 0.00 H new ATOM 0 HA LYS A 14 -10.111 -16.282 -22.225 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -10.693 -18.741 -22.140 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -9.989 -18.196 -23.649 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -7.957 -19.135 -21.743 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -9.144 -20.368 -22.117 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -8.205 -18.857 -24.487 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -6.936 -19.747 -23.669 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -7.757 -21.765 -24.318 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -9.413 -21.316 -23.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -9.101 -21.713 -26.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.500 -20.084 -26.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -7.896 -20.519 -26.396 1.00 0.00 H new ATOM 219 N GLU A 15 -8.875 -16.197 -19.721 1.00 0.00 N ATOM 220 CA GLU A 15 -8.844 -16.214 -18.264 1.00 0.00 C ATOM 221 C GLU A 15 -10.223 -15.903 -17.686 1.00 0.00 C ATOM 222 O GLU A 15 -11.109 -15.425 -18.396 1.00 0.00 O ATOM 223 CB GLU A 15 -7.818 -15.203 -17.743 1.00 0.00 C ATOM 224 CG GLU A 15 -6.494 -15.833 -17.344 1.00 0.00 C ATOM 225 CD GLU A 15 -5.584 -16.083 -18.530 1.00 0.00 C ATOM 226 OE1 GLU A 15 -5.933 -16.933 -19.377 1.00 0.00 O ATOM 227 OE2 GLU A 15 -4.524 -15.429 -18.613 1.00 0.00 O ATOM 0 H GLU A 15 -8.448 -15.372 -20.143 1.00 0.00 H new ATOM 0 HA GLU A 15 -8.553 -17.214 -17.943 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -7.637 -14.452 -18.512 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -8.238 -14.682 -16.882 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -5.986 -15.182 -16.633 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -6.685 -16.776 -16.832 1.00 0.00 H new ATOM 234 N PRO A 16 -10.423 -16.170 -16.386 1.00 0.00 N ATOM 235 CA PRO A 16 -11.703 -15.917 -15.713 1.00 0.00 C ATOM 236 C PRO A 16 -11.981 -14.427 -15.540 1.00 0.00 C ATOM 237 O PRO A 16 -11.111 -13.591 -15.785 1.00 0.00 O ATOM 238 CB PRO A 16 -11.528 -16.592 -14.351 1.00 0.00 C ATOM 239 CG PRO A 16 -10.059 -16.589 -14.113 1.00 0.00 C ATOM 240 CD PRO A 16 -9.420 -16.741 -15.466 1.00 0.00 C ATOM 0 HA PRO A 16 -12.548 -16.299 -16.286 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -12.057 -16.048 -13.569 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -11.926 -17.607 -14.358 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -9.743 -15.662 -13.634 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -9.769 -17.405 -13.451 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -8.472 -16.207 -15.524 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -9.212 -17.786 -15.697 1.00 0.00 H new ATOM 248 N GLU A 17 -13.197 -14.105 -15.114 1.00 0.00 N ATOM 249 CA GLU A 17 -13.590 -12.715 -14.906 1.00 0.00 C ATOM 250 C GLU A 17 -13.477 -12.333 -13.433 1.00 0.00 C ATOM 251 O GLU A 17 -14.213 -11.474 -12.946 1.00 0.00 O ATOM 252 CB GLU A 17 -15.021 -12.489 -15.394 1.00 0.00 C ATOM 253 CG GLU A 17 -15.115 -12.175 -16.880 1.00 0.00 C ATOM 254 CD GLU A 17 -14.901 -10.705 -17.179 1.00 0.00 C ATOM 255 OE1 GLU A 17 -15.742 -9.885 -16.756 1.00 0.00 O ATOM 256 OE2 GLU A 17 -13.892 -10.374 -17.838 1.00 0.00 O ATOM 0 H GLU A 17 -13.927 -14.786 -14.906 1.00 0.00 H new ATOM 0 HA GLU A 17 -12.914 -12.082 -15.481 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -15.614 -13.379 -15.181 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -15.463 -11.669 -14.829 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -14.373 -12.764 -17.420 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -16.094 -12.479 -17.251 1.00 0.00 H new ATOM 263 N LYS A 18 -12.549 -12.976 -12.730 1.00 0.00 N ATOM 264 CA LYS A 18 -12.338 -12.703 -11.313 1.00 0.00 C ATOM 265 C LYS A 18 -11.116 -11.811 -11.108 1.00 0.00 C ATOM 266 O LYS A 18 -10.219 -11.775 -11.949 1.00 0.00 O ATOM 267 CB LYS A 18 -12.161 -14.015 -10.544 1.00 0.00 C ATOM 268 CG LYS A 18 -10.956 -14.824 -10.991 1.00 0.00 C ATOM 269 CD LYS A 18 -10.500 -15.795 -9.910 1.00 0.00 C ATOM 270 CE LYS A 18 -9.055 -15.542 -9.506 1.00 0.00 C ATOM 271 NZ LYS A 18 -8.628 -16.426 -8.386 1.00 0.00 N ATOM 0 H LYS A 18 -11.932 -13.689 -13.119 1.00 0.00 H new ATOM 0 HA LYS A 18 -13.215 -12.180 -10.932 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -12.065 -13.793 -9.481 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -13.059 -14.621 -10.664 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -11.204 -15.377 -11.897 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -10.138 -14.150 -11.244 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -11.145 -15.698 -9.037 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -10.604 -16.818 -10.271 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -8.404 -15.705 -10.365 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -8.938 -14.499 -9.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -7.667 -16.779 -8.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -8.636 -15.887 -7.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -9.283 -17.230 -8.309 1.00 0.00 H new ATOM 285 N PRO A 19 -11.064 -11.078 -9.983 1.00 0.00 N ATOM 286 CA PRO A 19 -9.944 -10.186 -9.673 1.00 0.00 C ATOM 287 C PRO A 19 -8.599 -10.902 -9.748 1.00 0.00 C ATOM 288 O PRO A 19 -8.527 -12.065 -10.141 1.00 0.00 O ATOM 289 CB PRO A 19 -10.227 -9.718 -8.235 1.00 0.00 C ATOM 290 CG PRO A 19 -11.296 -10.626 -7.723 1.00 0.00 C ATOM 291 CD PRO A 19 -12.083 -11.059 -8.925 1.00 0.00 C ATOM 0 HA PRO A 19 -9.873 -9.366 -10.387 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -9.330 -9.781 -7.618 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -10.554 -8.678 -8.218 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -10.865 -11.485 -7.209 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -11.934 -10.111 -7.004 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -12.537 -12.040 -8.781 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -12.891 -10.364 -9.153 1.00 0.00 H new ATOM 299 N ILE A 20 -7.536 -10.198 -9.371 1.00 0.00 N ATOM 300 CA ILE A 20 -6.194 -10.768 -9.399 1.00 0.00 C ATOM 301 C ILE A 20 -6.070 -11.934 -8.425 1.00 0.00 C ATOM 302 O ILE A 20 -6.704 -11.944 -7.369 1.00 0.00 O ATOM 303 CB ILE A 20 -5.127 -9.712 -9.055 1.00 0.00 C ATOM 304 CG1 ILE A 20 -5.382 -8.418 -9.835 1.00 0.00 C ATOM 305 CG2 ILE A 20 -3.735 -10.251 -9.351 1.00 0.00 C ATOM 306 CD1 ILE A 20 -5.570 -7.206 -8.948 1.00 0.00 C ATOM 0 H ILE A 20 -7.578 -9.233 -9.043 1.00 0.00 H new ATOM 0 HA ILE A 20 -6.026 -11.127 -10.414 1.00 0.00 H new ATOM 0 HB ILE A 20 -5.191 -9.488 -7.990 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -4.545 -8.239 -10.509 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -6.269 -8.546 -10.455 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -2.991 -9.494 -9.103 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -3.556 -11.145 -8.753 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -3.659 -10.501 -10.409 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -5.746 -6.326 -9.567 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -6.425 -7.365 -8.291 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -4.674 -7.053 -8.346 1.00 0.00 H new ATOM 318 N ASP A 21 -5.252 -12.916 -8.786 1.00 0.00 N ATOM 319 CA ASP A 21 -5.044 -14.089 -7.943 1.00 0.00 C ATOM 320 C ASP A 21 -4.133 -13.757 -6.764 1.00 0.00 C ATOM 321 O ASP A 21 -2.926 -13.579 -6.929 1.00 0.00 O ATOM 322 CB ASP A 21 -4.443 -15.232 -8.763 1.00 0.00 C ATOM 323 CG ASP A 21 -5.429 -15.808 -9.760 1.00 0.00 C ATOM 324 OD1 ASP A 21 -5.874 -15.060 -10.655 1.00 0.00 O ATOM 325 OD2 ASP A 21 -5.757 -17.009 -9.644 1.00 0.00 O ATOM 0 H ASP A 21 -4.721 -12.924 -9.657 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.012 -14.402 -7.553 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -3.562 -14.871 -9.294 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -4.108 -16.021 -8.090 1.00 0.00 H new ATOM 330 N ARG A 22 -4.722 -13.678 -5.573 1.00 0.00 N ATOM 331 CA ARG A 22 -3.975 -13.366 -4.356 1.00 0.00 C ATOM 332 C ARG A 22 -2.674 -14.166 -4.268 1.00 0.00 C ATOM 333 O ARG A 22 -1.707 -13.730 -3.642 1.00 0.00 O ATOM 334 CB ARG A 22 -4.841 -13.647 -3.125 1.00 0.00 C ATOM 335 CG ARG A 22 -5.200 -12.397 -2.337 1.00 0.00 C ATOM 336 CD ARG A 22 -6.701 -12.151 -2.331 1.00 0.00 C ATOM 337 NE ARG A 22 -7.344 -12.716 -1.147 1.00 0.00 N ATOM 338 CZ ARG A 22 -8.633 -12.555 -0.856 1.00 0.00 C ATOM 339 NH1 ARG A 22 -9.420 -11.848 -1.661 1.00 0.00 N ATOM 340 NH2 ARG A 22 -9.139 -13.102 0.239 1.00 0.00 N ATOM 0 H ARG A 22 -5.720 -13.827 -5.424 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.715 -12.308 -4.389 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -5.758 -14.143 -3.442 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -4.313 -14.341 -2.470 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -4.843 -12.497 -1.312 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -4.691 -11.535 -2.769 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -6.893 -11.079 -2.371 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -7.143 -12.587 -3.227 1.00 0.00 H new ATOM 0 HE ARG A 22 -6.772 -13.266 -0.506 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -9.037 -11.426 -2.507 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -10.407 -11.728 -1.433 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -8.541 -13.647 0.860 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -10.127 -12.978 0.461 1.00 0.00 H new ATOM 354 N GLU A 23 -2.657 -15.343 -4.889 1.00 0.00 N ATOM 355 CA GLU A 23 -1.478 -16.205 -4.868 1.00 0.00 C ATOM 356 C GLU A 23 -0.681 -16.106 -6.168 1.00 0.00 C ATOM 357 O GLU A 23 0.544 -15.989 -6.145 1.00 0.00 O ATOM 358 CB GLU A 23 -1.892 -17.658 -4.625 1.00 0.00 C ATOM 359 CG GLU A 23 -2.449 -17.906 -3.232 1.00 0.00 C ATOM 360 CD GLU A 23 -1.732 -19.030 -2.508 1.00 0.00 C ATOM 361 OE1 GLU A 23 -0.598 -18.804 -2.038 1.00 0.00 O ATOM 362 OE2 GLU A 23 -2.308 -20.135 -2.411 1.00 0.00 O ATOM 0 H GLU A 23 -3.446 -15.722 -5.413 1.00 0.00 H new ATOM 0 HA GLU A 23 -0.837 -15.866 -4.054 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -2.642 -17.942 -5.363 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -1.029 -18.305 -4.783 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -2.369 -16.991 -2.645 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -3.510 -18.145 -3.306 1.00 0.00 H new ATOM 369 N LYS A 24 -1.379 -16.160 -7.298 1.00 0.00 N ATOM 370 CA LYS A 24 -0.728 -16.087 -8.605 1.00 0.00 C ATOM 371 C LYS A 24 -0.668 -14.650 -9.119 1.00 0.00 C ATOM 372 O LYS A 24 -0.676 -14.412 -10.327 1.00 0.00 O ATOM 373 CB LYS A 24 -1.464 -16.969 -9.614 1.00 0.00 C ATOM 374 CG LYS A 24 -1.024 -18.424 -9.584 1.00 0.00 C ATOM 375 CD LYS A 24 -1.626 -19.164 -8.400 1.00 0.00 C ATOM 376 CE LYS A 24 -3.016 -19.689 -8.720 1.00 0.00 C ATOM 377 NZ LYS A 24 -3.945 -19.536 -7.567 1.00 0.00 N ATOM 0 H LYS A 24 -2.394 -16.254 -7.337 1.00 0.00 H new ATOM 0 HA LYS A 24 0.294 -16.449 -8.487 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -2.535 -16.918 -9.416 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -1.306 -16.571 -10.616 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -1.322 -18.914 -10.511 1.00 0.00 H new ATOM 0 HG3 LYS A 24 0.064 -18.475 -9.532 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -0.978 -19.994 -8.121 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -1.677 -18.496 -7.540 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -3.416 -19.156 -9.582 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -2.952 -20.741 -8.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -4.882 -19.906 -7.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -3.576 -20.066 -6.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -4.026 -18.530 -7.318 1.00 0.00 H new ATOM 391 N THR A 25 -0.610 -13.696 -8.196 1.00 0.00 N ATOM 392 CA THR A 25 -0.550 -12.283 -8.555 1.00 0.00 C ATOM 393 C THR A 25 0.867 -11.867 -8.939 1.00 0.00 C ATOM 394 O THR A 25 1.841 -12.522 -8.571 1.00 0.00 O ATOM 395 CB THR A 25 -1.032 -11.425 -7.388 1.00 0.00 C ATOM 396 OG1 THR A 25 -0.869 -10.048 -7.681 1.00 0.00 O ATOM 397 CG2 THR A 25 -0.294 -11.710 -6.096 1.00 0.00 C ATOM 0 H THR A 25 -0.603 -13.876 -7.192 1.00 0.00 H new ATOM 0 HA THR A 25 -1.200 -12.131 -9.417 1.00 0.00 H new ATOM 0 HB THR A 25 -2.083 -11.679 -7.252 1.00 0.00 H new ATOM 0 HG1 THR A 25 -1.106 -9.883 -8.617 1.00 0.00 H new ATOM 0 HG21 THR A 25 -0.683 -11.068 -5.306 1.00 0.00 H new ATOM 0 HG22 THR A 25 -0.436 -12.754 -5.818 1.00 0.00 H new ATOM 0 HG23 THR A 25 0.769 -11.513 -6.233 1.00 0.00 H new ATOM 405 N SER A 26 0.969 -10.762 -9.676 1.00 0.00 N ATOM 406 CA SER A 26 2.263 -10.241 -10.103 1.00 0.00 C ATOM 407 C SER A 26 2.628 -8.988 -9.309 1.00 0.00 C ATOM 408 O SER A 26 1.748 -8.273 -8.824 1.00 0.00 O ATOM 409 CB SER A 26 2.240 -9.927 -11.602 1.00 0.00 C ATOM 410 OG SER A 26 3.013 -10.864 -12.331 1.00 0.00 O ATOM 0 H SER A 26 0.170 -10.211 -9.989 1.00 0.00 H new ATOM 0 HA SER A 26 3.019 -11.003 -9.913 1.00 0.00 H new ATOM 0 HB2 SER A 26 1.212 -9.939 -11.964 1.00 0.00 H new ATOM 0 HB3 SER A 26 2.626 -8.922 -11.772 1.00 0.00 H new ATOM 0 HG SER A 26 2.981 -10.643 -13.285 1.00 0.00 H new ATOM 416 N PRO A 27 3.933 -8.702 -9.162 1.00 0.00 N ATOM 417 CA PRO A 27 4.405 -7.530 -8.419 1.00 0.00 C ATOM 418 C PRO A 27 4.236 -6.232 -9.205 1.00 0.00 C ATOM 419 O PRO A 27 4.287 -6.228 -10.434 1.00 0.00 O ATOM 420 CB PRO A 27 5.887 -7.832 -8.202 1.00 0.00 C ATOM 421 CG PRO A 27 6.269 -8.685 -9.361 1.00 0.00 C ATOM 422 CD PRO A 27 5.050 -9.501 -9.703 1.00 0.00 C ATOM 0 HA PRO A 27 3.843 -7.376 -7.498 1.00 0.00 H new ATOM 0 HB2 PRO A 27 6.478 -6.917 -8.171 1.00 0.00 H new ATOM 0 HB3 PRO A 27 6.052 -8.350 -7.257 1.00 0.00 H new ATOM 0 HG2 PRO A 27 6.578 -8.074 -10.209 1.00 0.00 H new ATOM 0 HG3 PRO A 27 7.111 -9.330 -9.109 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.954 -9.647 -10.779 1.00 0.00 H new ATOM 0 HD3 PRO A 27 5.091 -10.491 -9.250 1.00 0.00 H new ATOM 430 N LEU A 28 4.037 -5.131 -8.484 1.00 0.00 N ATOM 431 CA LEU A 28 3.864 -3.825 -9.114 1.00 0.00 C ATOM 432 C LEU A 28 4.544 -2.731 -8.295 1.00 0.00 C ATOM 433 O LEU A 28 4.707 -2.862 -7.083 1.00 0.00 O ATOM 434 CB LEU A 28 2.373 -3.504 -9.279 1.00 0.00 C ATOM 435 CG LEU A 28 1.676 -2.965 -8.025 1.00 0.00 C ATOM 436 CD1 LEU A 28 1.826 -1.453 -7.933 1.00 0.00 C ATOM 437 CD2 LEU A 28 0.206 -3.357 -8.025 1.00 0.00 C ATOM 0 H LEU A 28 3.992 -5.117 -7.465 1.00 0.00 H new ATOM 0 HA LEU A 28 4.331 -3.861 -10.098 1.00 0.00 H new ATOM 0 HB2 LEU A 28 2.262 -2.772 -10.079 1.00 0.00 H new ATOM 0 HB3 LEU A 28 1.857 -4.409 -9.601 1.00 0.00 H new ATOM 0 HG LEU A 28 2.153 -3.408 -7.151 1.00 0.00 H new ATOM 0 HD11 LEU A 28 1.324 -1.091 -7.036 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.884 -1.195 -7.886 1.00 0.00 H new ATOM 0 HD13 LEU A 28 1.378 -0.989 -8.811 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.275 -2.967 -7.128 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.281 -2.942 -8.907 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.119 -4.443 -8.040 1.00 0.00 H new ATOM 449 N LEU A 29 4.932 -1.651 -8.964 1.00 0.00 N ATOM 450 CA LEU A 29 5.586 -0.535 -8.293 1.00 0.00 C ATOM 451 C LEU A 29 4.551 0.386 -7.653 1.00 0.00 C ATOM 452 O LEU A 29 3.735 0.994 -8.344 1.00 0.00 O ATOM 453 CB LEU A 29 6.454 0.250 -9.284 1.00 0.00 C ATOM 454 CG LEU A 29 6.927 1.628 -8.805 1.00 0.00 C ATOM 455 CD1 LEU A 29 7.257 1.607 -7.319 1.00 0.00 C ATOM 456 CD2 LEU A 29 8.134 2.083 -9.612 1.00 0.00 C ATOM 0 H LEU A 29 4.805 -1.525 -9.968 1.00 0.00 H new ATOM 0 HA LEU A 29 6.227 -0.935 -7.507 1.00 0.00 H new ATOM 0 HB2 LEU A 29 7.331 -0.351 -9.527 1.00 0.00 H new ATOM 0 HB3 LEU A 29 5.891 0.380 -10.208 1.00 0.00 H new ATOM 0 HG LEU A 29 6.115 2.338 -8.959 1.00 0.00 H new ATOM 0 HD11 LEU A 29 7.590 2.597 -7.006 1.00 0.00 H new ATOM 0 HD12 LEU A 29 6.369 1.327 -6.753 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.049 0.882 -7.132 1.00 0.00 H new ATOM 0 HD21 LEU A 29 8.458 3.063 -9.261 1.00 0.00 H new ATOM 0 HD22 LEU A 29 8.946 1.366 -9.488 1.00 0.00 H new ATOM 0 HD23 LEU A 29 7.864 2.147 -10.666 1.00 0.00 H new ATOM 468 N LEU A 30 4.592 0.479 -6.329 1.00 0.00 N ATOM 469 CA LEU A 30 3.657 1.321 -5.592 1.00 0.00 C ATOM 470 C LEU A 30 4.405 2.292 -4.680 1.00 0.00 C ATOM 471 O LEU A 30 5.281 1.888 -3.911 1.00 0.00 O ATOM 472 CB LEU A 30 2.691 0.443 -4.782 1.00 0.00 C ATOM 473 CG LEU A 30 2.141 1.064 -3.494 1.00 0.00 C ATOM 474 CD1 LEU A 30 1.290 2.282 -3.804 1.00 0.00 C ATOM 475 CD2 LEU A 30 1.335 0.037 -2.713 1.00 0.00 C ATOM 0 H LEU A 30 5.263 -0.018 -5.744 1.00 0.00 H new ATOM 0 HA LEU A 30 3.080 1.911 -6.304 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.850 0.177 -5.422 1.00 0.00 H new ATOM 0 HB3 LEU A 30 3.202 -0.485 -4.525 1.00 0.00 H new ATOM 0 HG LEU A 30 2.984 1.384 -2.882 1.00 0.00 H new ATOM 0 HD11 LEU A 30 0.910 2.706 -2.875 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.895 3.026 -4.322 1.00 0.00 H new ATOM 0 HD13 LEU A 30 0.453 1.989 -4.438 1.00 0.00 H new ATOM 0 HD21 LEU A 30 0.951 0.493 -1.801 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.502 -0.312 -3.323 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.974 -0.807 -2.455 1.00 0.00 H new ATOM 487 N ARG A 31 4.049 3.571 -4.771 1.00 0.00 N ATOM 488 CA ARG A 31 4.673 4.605 -3.954 1.00 0.00 C ATOM 489 C ARG A 31 4.022 4.659 -2.577 1.00 0.00 C ATOM 490 O ARG A 31 2.796 4.689 -2.460 1.00 0.00 O ATOM 491 CB ARG A 31 4.559 5.968 -4.644 1.00 0.00 C ATOM 492 CG ARG A 31 5.882 6.494 -5.175 1.00 0.00 C ATOM 493 CD ARG A 31 5.787 7.963 -5.557 1.00 0.00 C ATOM 494 NE ARG A 31 6.075 8.182 -6.973 1.00 0.00 N ATOM 495 CZ ARG A 31 5.957 9.360 -7.580 1.00 0.00 C ATOM 496 NH1 ARG A 31 5.557 10.428 -6.900 1.00 0.00 N ATOM 497 NH2 ARG A 31 6.241 9.473 -8.871 1.00 0.00 N ATOM 0 H ARG A 31 3.329 3.916 -5.405 1.00 0.00 H new ATOM 0 HA ARG A 31 5.728 4.360 -3.832 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.851 5.890 -5.469 1.00 0.00 H new ATOM 0 HB3 ARG A 31 4.148 6.690 -3.938 1.00 0.00 H new ATOM 0 HG2 ARG A 31 6.656 6.363 -4.419 1.00 0.00 H new ATOM 0 HG3 ARG A 31 6.184 5.910 -6.044 1.00 0.00 H new ATOM 0 HD2 ARG A 31 4.787 8.332 -5.329 1.00 0.00 H new ATOM 0 HD3 ARG A 31 6.486 8.541 -4.952 1.00 0.00 H new ATOM 0 HE ARG A 31 6.385 7.385 -7.529 1.00 0.00 H new ATOM 0 HH11 ARG A 31 5.338 10.348 -5.907 1.00 0.00 H new ATOM 0 HH12 ARG A 31 5.468 11.329 -7.371 1.00 0.00 H new ATOM 0 HH21 ARG A 31 6.550 8.657 -9.399 1.00 0.00 H new ATOM 0 HH22 ARG A 31 6.150 10.376 -9.336 1.00 0.00 H new ATOM 511 N VAL A 32 4.846 4.666 -1.535 1.00 0.00 N ATOM 512 CA VAL A 32 4.340 4.706 -0.168 1.00 0.00 C ATOM 513 C VAL A 32 5.039 5.780 0.660 1.00 0.00 C ATOM 514 O VAL A 32 6.264 5.867 0.677 1.00 0.00 O ATOM 515 CB VAL A 32 4.501 3.343 0.538 1.00 0.00 C ATOM 516 CG1 VAL A 32 3.257 2.493 0.332 1.00 0.00 C ATOM 517 CG2 VAL A 32 5.742 2.616 0.040 1.00 0.00 C ATOM 0 H VAL A 32 5.863 4.645 -1.610 1.00 0.00 H new ATOM 0 HA VAL A 32 3.279 4.947 -0.241 1.00 0.00 H new ATOM 0 HB VAL A 32 4.625 3.521 1.606 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.384 1.534 0.835 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.391 3.009 0.747 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.103 2.326 -0.734 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.833 1.658 0.553 1.00 0.00 H new ATOM 0 HG22 VAL A 32 5.658 2.446 -1.033 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.625 3.222 0.244 1.00 0.00 H new ATOM 527 N PHE A 33 4.244 6.584 1.360 1.00 0.00 N ATOM 528 CA PHE A 33 4.776 7.645 2.207 1.00 0.00 C ATOM 529 C PHE A 33 4.806 7.184 3.658 1.00 0.00 C ATOM 530 O PHE A 33 3.779 6.807 4.218 1.00 0.00 O ATOM 531 CB PHE A 33 3.929 8.910 2.067 1.00 0.00 C ATOM 532 CG PHE A 33 3.798 9.390 0.647 1.00 0.00 C ATOM 533 CD1 PHE A 33 3.135 8.625 -0.299 1.00 0.00 C ATOM 534 CD2 PHE A 33 4.343 10.604 0.261 1.00 0.00 C ATOM 535 CE1 PHE A 33 3.018 9.062 -1.605 1.00 0.00 C ATOM 536 CE2 PHE A 33 4.228 11.045 -1.044 1.00 0.00 C ATOM 537 CZ PHE A 33 3.565 10.274 -1.978 1.00 0.00 C ATOM 0 H PHE A 33 3.226 6.520 1.357 1.00 0.00 H new ATOM 0 HA PHE A 33 5.793 7.875 1.890 1.00 0.00 H new ATOM 0 HB2 PHE A 33 2.935 8.719 2.471 1.00 0.00 H new ATOM 0 HB3 PHE A 33 4.371 9.702 2.671 1.00 0.00 H new ATOM 0 HD1 PHE A 33 2.705 7.677 -0.013 1.00 0.00 H new ATOM 0 HD2 PHE A 33 4.863 11.212 0.987 1.00 0.00 H new ATOM 0 HE1 PHE A 33 2.499 8.456 -2.333 1.00 0.00 H new ATOM 0 HE2 PHE A 33 4.657 11.993 -1.333 1.00 0.00 H new ATOM 0 HZ PHE A 33 3.474 10.618 -2.998 1.00 0.00 H new ATOM 547 N THR A 34 5.990 7.191 4.260 1.00 0.00 N ATOM 548 CA THR A 34 6.140 6.742 5.640 1.00 0.00 C ATOM 549 C THR A 34 6.472 7.889 6.588 1.00 0.00 C ATOM 550 O THR A 34 7.432 8.631 6.378 1.00 0.00 O ATOM 551 CB THR A 34 7.226 5.672 5.722 1.00 0.00 C ATOM 552 OG1 THR A 34 8.218 5.890 4.735 1.00 0.00 O ATOM 553 CG2 THR A 34 6.695 4.266 5.537 1.00 0.00 C ATOM 0 H THR A 34 6.855 7.501 3.818 1.00 0.00 H new ATOM 0 HA THR A 34 5.183 6.326 5.953 1.00 0.00 H new ATOM 0 HB THR A 34 7.642 5.757 6.726 1.00 0.00 H new ATOM 0 HG1 THR A 34 9.104 5.721 5.118 1.00 0.00 H new ATOM 0 HG21 THR A 34 7.518 3.554 5.607 1.00 0.00 H new ATOM 0 HG22 THR A 34 5.961 4.049 6.313 1.00 0.00 H new ATOM 0 HG23 THR A 34 6.224 4.181 4.558 1.00 0.00 H new ATOM 561 N THR A 35 5.679 8.003 7.643 1.00 0.00 N ATOM 562 CA THR A 35 5.878 9.029 8.661 1.00 0.00 C ATOM 563 C THR A 35 5.946 8.373 10.049 1.00 0.00 C ATOM 564 O THR A 35 5.471 7.255 10.213 1.00 0.00 O ATOM 565 CB THR A 35 4.746 10.057 8.619 1.00 0.00 C ATOM 566 OG1 THR A 35 4.756 10.860 9.789 1.00 0.00 O ATOM 567 CG2 THR A 35 3.374 9.432 8.504 1.00 0.00 C ATOM 0 H THR A 35 4.882 7.391 7.819 1.00 0.00 H new ATOM 0 HA THR A 35 6.817 9.546 8.460 1.00 0.00 H new ATOM 0 HB THR A 35 4.930 10.655 7.726 1.00 0.00 H new ATOM 0 HG1 THR A 35 4.781 11.806 9.536 1.00 0.00 H new ATOM 0 HG21 THR A 35 2.618 10.217 8.479 1.00 0.00 H new ATOM 0 HG22 THR A 35 3.317 8.844 7.588 1.00 0.00 H new ATOM 0 HG23 THR A 35 3.196 8.784 9.362 1.00 0.00 H new ATOM 575 N ASN A 36 6.539 9.061 11.022 1.00 0.00 N ATOM 576 CA ASN A 36 6.655 8.508 12.369 1.00 0.00 C ATOM 577 C ASN A 36 5.789 9.276 13.355 1.00 0.00 C ATOM 578 O ASN A 36 6.117 9.364 14.539 1.00 0.00 O ATOM 579 CB ASN A 36 8.112 8.528 12.814 1.00 0.00 C ATOM 580 CG ASN A 36 8.436 7.417 13.790 1.00 0.00 C ATOM 581 OD1 ASN A 36 9.040 6.410 13.427 1.00 0.00 O ATOM 582 ND2 ASN A 36 8.032 7.596 15.045 1.00 0.00 N ATOM 0 H ASN A 36 6.942 9.991 10.906 1.00 0.00 H new ATOM 0 HA ASN A 36 6.302 7.477 12.348 1.00 0.00 H new ATOM 0 HB2 ASN A 36 8.757 8.438 11.940 1.00 0.00 H new ATOM 0 HB3 ASN A 36 8.334 9.490 13.277 1.00 0.00 H new ATOM 0 HD21 ASN A 36 8.221 6.882 15.748 1.00 0.00 H new ATOM 0 HD22 ASN A 36 7.533 8.447 15.304 1.00 0.00 H new ATOM 589 N ASN A 37 4.689 9.833 12.865 1.00 0.00 N ATOM 590 CA ASN A 37 3.778 10.600 13.714 1.00 0.00 C ATOM 591 C ASN A 37 2.360 10.007 13.684 1.00 0.00 C ATOM 592 O ASN A 37 1.502 10.413 14.464 1.00 0.00 O ATOM 593 CB ASN A 37 3.732 12.056 13.254 1.00 0.00 C ATOM 594 CG ASN A 37 5.058 12.764 13.435 1.00 0.00 C ATOM 595 OD1 ASN A 37 5.802 12.488 14.376 1.00 0.00 O ATOM 596 ND2 ASN A 37 5.362 13.686 12.528 1.00 0.00 N ATOM 0 H ASN A 37 4.404 9.770 11.888 1.00 0.00 H new ATOM 0 HA ASN A 37 4.152 10.551 14.737 1.00 0.00 H new ATOM 0 HB2 ASN A 37 3.445 12.093 12.203 1.00 0.00 H new ATOM 0 HB3 ASN A 37 2.961 12.586 13.814 1.00 0.00 H new ATOM 0 HD21 ASN A 37 6.242 14.197 12.596 1.00 0.00 H new ATOM 0 HD22 ASN A 37 4.715 13.883 11.764 1.00 0.00 H new ATOM 603 N GLY A 38 2.140 9.064 12.783 1.00 0.00 N ATOM 604 CA GLY A 38 0.828 8.443 12.667 1.00 0.00 C ATOM 605 C GLY A 38 -0.230 9.432 12.214 1.00 0.00 C ATOM 606 O GLY A 38 -1.298 9.530 12.817 1.00 0.00 O ATOM 0 H GLY A 38 2.841 8.714 12.129 1.00 0.00 H new ATOM 0 HA2 GLY A 38 0.879 7.617 11.958 1.00 0.00 H new ATOM 0 HA3 GLY A 38 0.541 8.020 13.630 1.00 0.00 H new ATOM 610 N ARG A 39 0.073 10.171 11.149 1.00 0.00 N ATOM 611 CA ARG A 39 -0.861 11.160 10.616 1.00 0.00 C ATOM 612 C ARG A 39 -0.736 11.274 9.098 1.00 0.00 C ATOM 613 O ARG A 39 0.318 10.993 8.527 1.00 0.00 O ATOM 614 CB ARG A 39 -0.612 12.521 11.265 1.00 0.00 C ATOM 615 CG ARG A 39 -1.108 12.611 12.700 1.00 0.00 C ATOM 616 CD ARG A 39 -2.626 12.582 12.775 1.00 0.00 C ATOM 617 NE ARG A 39 -3.182 13.890 13.119 1.00 0.00 N ATOM 618 CZ ARG A 39 -4.301 14.064 13.821 1.00 0.00 C ATOM 619 NH1 ARG A 39 -5.000 13.019 14.249 1.00 0.00 N ATOM 620 NH2 ARG A 39 -4.726 15.290 14.093 1.00 0.00 N ATOM 0 H ARG A 39 0.954 10.104 10.640 1.00 0.00 H new ATOM 0 HA ARG A 39 -1.873 10.830 10.850 1.00 0.00 H new ATOM 0 HB2 ARG A 39 0.457 12.734 11.245 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -1.102 13.293 10.671 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -0.700 11.782 13.278 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -0.739 13.530 13.155 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -3.030 12.257 11.816 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -2.938 11.848 13.518 1.00 0.00 H new ATOM 0 HE ARG A 39 -2.682 14.721 12.802 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -4.681 12.073 14.041 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -5.855 13.163 14.786 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -4.197 16.098 13.765 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -5.582 15.425 14.630 1.00 0.00 H new ATOM 634 N HIS A 40 -1.825 11.683 8.452 1.00 0.00 N ATOM 635 CA HIS A 40 -1.850 11.832 6.998 1.00 0.00 C ATOM 636 C HIS A 40 -1.447 13.239 6.558 1.00 0.00 C ATOM 637 O HIS A 40 -1.669 13.617 5.407 1.00 0.00 O ATOM 638 CB HIS A 40 -3.238 11.497 6.445 1.00 0.00 C ATOM 639 CG HIS A 40 -4.364 12.074 7.244 1.00 0.00 C ATOM 640 ND1 HIS A 40 -4.870 11.473 8.377 1.00 0.00 N ATOM 641 CD2 HIS A 40 -5.084 13.208 7.069 1.00 0.00 C ATOM 642 CE1 HIS A 40 -5.853 12.210 8.864 1.00 0.00 C ATOM 643 NE2 HIS A 40 -6.002 13.268 8.089 1.00 0.00 N ATOM 0 H HIS A 40 -2.704 11.918 8.913 1.00 0.00 H new ATOM 0 HA HIS A 40 -1.119 11.131 6.594 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -3.308 11.862 5.420 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -3.351 10.414 6.406 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -4.959 13.930 6.276 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -6.435 11.985 9.746 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -6.688 14.010 8.226 1.00 0.00 H new ATOM 651 N HIS A 41 -0.868 14.020 7.473 1.00 0.00 N ATOM 652 CA HIS A 41 -0.450 15.395 7.161 1.00 0.00 C ATOM 653 C HIS A 41 0.262 15.499 5.804 1.00 0.00 C ATOM 654 O HIS A 41 0.332 16.580 5.235 1.00 0.00 O ATOM 655 CB HIS A 41 0.447 15.977 8.263 1.00 0.00 C ATOM 656 CG HIS A 41 1.215 14.962 9.056 1.00 0.00 C ATOM 657 ND1 HIS A 41 1.556 13.715 8.574 1.00 0.00 N ATOM 658 CD2 HIS A 41 1.714 15.025 10.313 1.00 0.00 C ATOM 659 CE1 HIS A 41 2.231 13.058 9.500 1.00 0.00 C ATOM 660 NE2 HIS A 41 2.341 13.832 10.563 1.00 0.00 N ATOM 0 H HIS A 41 -0.677 13.729 8.432 1.00 0.00 H new ATOM 0 HA HIS A 41 -1.367 15.981 7.105 1.00 0.00 H new ATOM 0 HB2 HIS A 41 1.154 16.670 7.807 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -0.173 16.557 8.947 1.00 0.00 H new ATOM 0 HD1 HIS A 41 1.323 13.357 7.648 1.00 0.00 H new ATOM 0 HD2 HIS A 41 1.633 15.860 10.993 1.00 0.00 H new ATOM 0 HE1 HIS A 41 2.626 12.057 9.403 1.00 0.00 H new ATOM 668 N ARG A 42 0.776 14.370 5.303 1.00 0.00 N ATOM 669 CA ARG A 42 1.482 14.294 4.011 1.00 0.00 C ATOM 670 C ARG A 42 1.610 15.645 3.295 1.00 0.00 C ATOM 671 O ARG A 42 2.697 16.216 3.233 1.00 0.00 O ATOM 672 CB ARG A 42 0.760 13.295 3.098 1.00 0.00 C ATOM 673 CG ARG A 42 1.540 12.914 1.848 1.00 0.00 C ATOM 674 CD ARG A 42 1.151 13.775 0.657 1.00 0.00 C ATOM 675 NE ARG A 42 2.270 13.973 -0.263 1.00 0.00 N ATOM 676 CZ ARG A 42 2.311 13.505 -1.510 1.00 0.00 C ATOM 677 NH1 ARG A 42 1.298 12.802 -2.004 1.00 0.00 N ATOM 678 NH2 ARG A 42 3.373 13.739 -2.268 1.00 0.00 N ATOM 0 H ARG A 42 0.715 13.473 5.785 1.00 0.00 H new ATOM 0 HA ARG A 42 2.498 13.965 4.229 1.00 0.00 H new ATOM 0 HB2 ARG A 42 0.544 12.391 3.667 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -0.198 13.720 2.799 1.00 0.00 H new ATOM 0 HG2 ARG A 42 2.608 13.019 2.039 1.00 0.00 H new ATOM 0 HG3 ARG A 42 1.360 11.865 1.613 1.00 0.00 H new ATOM 0 HD2 ARG A 42 0.323 13.306 0.125 1.00 0.00 H new ATOM 0 HD3 ARG A 42 0.796 14.743 1.010 1.00 0.00 H new ATOM 0 HE ARG A 42 3.073 14.505 0.072 1.00 0.00 H new ATOM 0 HH11 ARG A 42 0.478 12.615 -1.427 1.00 0.00 H new ATOM 0 HH12 ARG A 42 1.341 12.449 -2.960 1.00 0.00 H new ATOM 0 HH21 ARG A 42 4.156 14.276 -1.896 1.00 0.00 H new ATOM 0 HH22 ARG A 42 3.407 13.382 -3.223 1.00 0.00 H new ATOM 692 N MET A 43 0.501 16.136 2.743 1.00 0.00 N ATOM 693 CA MET A 43 0.484 17.410 2.016 1.00 0.00 C ATOM 694 C MET A 43 1.402 18.444 2.667 1.00 0.00 C ATOM 695 O MET A 43 2.031 19.252 1.980 1.00 0.00 O ATOM 696 CB MET A 43 -0.945 17.956 1.927 1.00 0.00 C ATOM 697 CG MET A 43 -1.629 18.117 3.277 1.00 0.00 C ATOM 698 SD MET A 43 -3.134 17.132 3.425 1.00 0.00 S ATOM 699 CE MET A 43 -2.451 15.481 3.570 1.00 0.00 C ATOM 0 H MET A 43 -0.405 15.669 2.785 1.00 0.00 H new ATOM 0 HA MET A 43 0.857 17.218 1.010 1.00 0.00 H new ATOM 0 HB2 MET A 43 -0.923 18.923 1.424 1.00 0.00 H new ATOM 0 HB3 MET A 43 -1.541 17.287 1.306 1.00 0.00 H new ATOM 0 HG2 MET A 43 -0.934 17.831 4.067 1.00 0.00 H new ATOM 0 HG3 MET A 43 -1.872 19.168 3.432 1.00 0.00 H new ATOM 0 HE1 MET A 43 -3.166 14.835 4.079 1.00 0.00 H new ATOM 0 HE2 MET A 43 -2.246 15.084 2.576 1.00 0.00 H new ATOM 0 HE3 MET A 43 -1.525 15.519 4.144 1.00 0.00 H new ATOM 709 N ASP A 44 1.487 18.402 3.992 1.00 0.00 N ATOM 710 CA ASP A 44 2.338 19.317 4.736 1.00 0.00 C ATOM 711 C ASP A 44 3.690 18.669 5.017 1.00 0.00 C ATOM 712 O ASP A 44 4.726 19.334 5.000 1.00 0.00 O ATOM 713 CB ASP A 44 1.664 19.724 6.049 1.00 0.00 C ATOM 714 CG ASP A 44 1.591 21.229 6.220 1.00 0.00 C ATOM 715 OD1 ASP A 44 2.654 21.859 6.400 1.00 0.00 O ATOM 716 OD2 ASP A 44 0.469 21.777 6.175 1.00 0.00 O ATOM 0 H ASP A 44 0.973 17.740 4.573 1.00 0.00 H new ATOM 0 HA ASP A 44 2.496 20.212 4.134 1.00 0.00 H new ATOM 0 HB2 ASP A 44 0.657 19.308 6.081 1.00 0.00 H new ATOM 0 HB3 ASP A 44 2.214 19.292 6.885 1.00 0.00 H new ATOM 721 N GLU A 45 3.670 17.362 5.266 1.00 0.00 N ATOM 722 CA GLU A 45 4.892 16.615 5.538 1.00 0.00 C ATOM 723 C GLU A 45 5.847 16.699 4.355 1.00 0.00 C ATOM 724 O GLU A 45 7.007 17.082 4.500 1.00 0.00 O ATOM 725 CB GLU A 45 4.569 15.150 5.832 1.00 0.00 C ATOM 726 CG GLU A 45 3.762 14.945 7.100 1.00 0.00 C ATOM 727 CD GLU A 45 4.598 14.394 8.240 1.00 0.00 C ATOM 728 OE1 GLU A 45 4.868 13.175 8.244 1.00 0.00 O ATOM 729 OE2 GLU A 45 4.981 15.182 9.129 1.00 0.00 O ATOM 0 H GLU A 45 2.820 16.799 5.285 1.00 0.00 H new ATOM 0 HA GLU A 45 5.370 17.058 6.412 1.00 0.00 H new ATOM 0 HB2 GLU A 45 4.017 14.733 4.990 1.00 0.00 H new ATOM 0 HB3 GLU A 45 5.501 14.591 5.911 1.00 0.00 H new ATOM 0 HG2 GLU A 45 3.321 15.895 7.403 1.00 0.00 H new ATOM 0 HG3 GLU A 45 2.938 14.262 6.895 1.00 0.00 H new ATOM 736 N PHE A 46 5.342 16.339 3.179 1.00 0.00 N ATOM 737 CA PHE A 46 6.128 16.369 1.955 1.00 0.00 C ATOM 738 C PHE A 46 5.304 16.964 0.818 1.00 0.00 C ATOM 739 O PHE A 46 4.074 16.964 0.868 1.00 0.00 O ATOM 740 CB PHE A 46 6.610 14.960 1.572 1.00 0.00 C ATOM 741 CG PHE A 46 6.173 13.872 2.520 1.00 0.00 C ATOM 742 CD1 PHE A 46 4.827 13.622 2.742 1.00 0.00 C ATOM 743 CD2 PHE A 46 7.113 13.097 3.181 1.00 0.00 C ATOM 744 CE1 PHE A 46 4.429 12.617 3.606 1.00 0.00 C ATOM 745 CE2 PHE A 46 6.718 12.094 4.046 1.00 0.00 C ATOM 746 CZ PHE A 46 5.375 11.853 4.259 1.00 0.00 C ATOM 0 H PHE A 46 4.382 16.020 3.050 1.00 0.00 H new ATOM 0 HA PHE A 46 7.004 16.993 2.130 1.00 0.00 H new ATOM 0 HB2 PHE A 46 6.244 14.723 0.573 1.00 0.00 H new ATOM 0 HB3 PHE A 46 7.699 14.964 1.520 1.00 0.00 H new ATOM 0 HD1 PHE A 46 4.082 14.218 2.235 1.00 0.00 H new ATOM 0 HD2 PHE A 46 8.165 13.279 3.018 1.00 0.00 H new ATOM 0 HE1 PHE A 46 3.378 12.430 3.769 1.00 0.00 H new ATOM 0 HE2 PHE A 46 7.460 11.498 4.556 1.00 0.00 H new ATOM 0 HZ PHE A 46 5.066 11.069 4.934 1.00 0.00 H new ATOM 756 N SER A 47 5.984 17.474 -0.201 1.00 0.00 N ATOM 757 CA SER A 47 5.301 18.075 -1.341 1.00 0.00 C ATOM 758 C SER A 47 5.703 17.406 -2.652 1.00 0.00 C ATOM 759 O SER A 47 5.023 16.494 -3.125 1.00 0.00 O ATOM 760 CB SER A 47 5.589 19.579 -1.401 1.00 0.00 C ATOM 761 OG SER A 47 6.981 19.834 -1.334 1.00 0.00 O ATOM 0 H SER A 47 7.002 17.484 -0.262 1.00 0.00 H new ATOM 0 HA SER A 47 4.230 17.923 -1.205 1.00 0.00 H new ATOM 0 HB2 SER A 47 5.184 19.994 -2.324 1.00 0.00 H new ATOM 0 HB3 SER A 47 5.084 20.083 -0.577 1.00 0.00 H new ATOM 0 HG SER A 47 7.139 20.800 -1.376 1.00 0.00 H new ATOM 767 N ARG A 48 6.806 17.859 -3.240 1.00 0.00 N ATOM 768 CA ARG A 48 7.285 17.299 -4.498 1.00 0.00 C ATOM 769 C ARG A 48 8.294 16.186 -4.248 1.00 0.00 C ATOM 770 O ARG A 48 9.233 16.003 -5.024 1.00 0.00 O ATOM 771 CB ARG A 48 7.920 18.395 -5.355 1.00 0.00 C ATOM 772 CG ARG A 48 7.795 18.149 -6.850 1.00 0.00 C ATOM 773 CD ARG A 48 8.930 18.805 -7.623 1.00 0.00 C ATOM 774 NE ARG A 48 8.801 20.261 -7.654 1.00 0.00 N ATOM 775 CZ ARG A 48 9.431 21.088 -6.819 1.00 0.00 C ATOM 776 NH1 ARG A 48 10.239 20.613 -5.879 1.00 0.00 N ATOM 777 NH2 ARG A 48 9.252 22.397 -6.927 1.00 0.00 N ATOM 0 H ARG A 48 7.384 18.611 -2.866 1.00 0.00 H new ATOM 0 HA ARG A 48 6.432 16.878 -5.029 1.00 0.00 H new ATOM 0 HB2 ARG A 48 7.454 19.350 -5.112 1.00 0.00 H new ATOM 0 HB3 ARG A 48 8.975 18.481 -5.097 1.00 0.00 H new ATOM 0 HG2 ARG A 48 7.794 17.076 -7.044 1.00 0.00 H new ATOM 0 HG3 ARG A 48 6.840 18.538 -7.205 1.00 0.00 H new ATOM 0 HD2 ARG A 48 9.883 18.535 -7.167 1.00 0.00 H new ATOM 0 HD3 ARG A 48 8.944 18.420 -8.643 1.00 0.00 H new ATOM 0 HE ARG A 48 8.189 20.671 -8.360 1.00 0.00 H new ATOM 0 HH11 ARG A 48 10.383 19.607 -5.791 1.00 0.00 H new ATOM 0 HH12 ARG A 48 10.716 21.254 -5.245 1.00 0.00 H new ATOM 0 HH21 ARG A 48 8.634 22.769 -7.648 1.00 0.00 H new ATOM 0 HH22 ARG A 48 9.733 23.032 -6.290 1.00 0.00 H new ATOM 791 N GLY A 49 8.101 15.445 -3.162 1.00 0.00 N ATOM 792 CA GLY A 49 9.011 14.365 -2.833 1.00 0.00 C ATOM 793 C GLY A 49 10.447 14.838 -2.757 1.00 0.00 C ATOM 794 O GLY A 49 11.346 14.204 -3.310 1.00 0.00 O ATOM 0 H GLY A 49 7.331 15.573 -2.505 1.00 0.00 H new ATOM 0 HA2 GLY A 49 8.723 13.926 -1.878 1.00 0.00 H new ATOM 0 HA3 GLY A 49 8.927 13.579 -3.583 1.00 0.00 H new ATOM 798 N ASN A 50 10.661 15.961 -2.080 1.00 0.00 N ATOM 799 CA ASN A 50 12.002 16.528 -1.944 1.00 0.00 C ATOM 800 C ASN A 50 12.785 15.860 -0.815 1.00 0.00 C ATOM 801 O ASN A 50 13.439 16.534 -0.018 1.00 0.00 O ATOM 802 CB ASN A 50 11.914 18.038 -1.706 1.00 0.00 C ATOM 803 CG ASN A 50 12.773 18.825 -2.675 1.00 0.00 C ATOM 804 OD1 ASN A 50 13.999 18.708 -2.674 1.00 0.00 O ATOM 805 ND2 ASN A 50 12.132 19.636 -3.511 1.00 0.00 N ATOM 0 H ASN A 50 9.927 16.497 -1.617 1.00 0.00 H new ATOM 0 HA ASN A 50 12.538 16.341 -2.874 1.00 0.00 H new ATOM 0 HB2 ASN A 50 10.877 18.358 -1.801 1.00 0.00 H new ATOM 0 HB3 ASN A 50 12.224 18.261 -0.685 1.00 0.00 H new ATOM 0 HD21 ASN A 50 12.658 20.192 -4.186 1.00 0.00 H new ATOM 0 HD22 ASN A 50 11.115 19.702 -3.478 1.00 0.00 H new ATOM 812 N VAL A 51 12.724 14.534 -0.757 1.00 0.00 N ATOM 813 CA VAL A 51 13.435 13.781 0.265 1.00 0.00 C ATOM 814 C VAL A 51 13.269 12.276 0.045 1.00 0.00 C ATOM 815 O VAL A 51 12.147 11.776 -0.020 1.00 0.00 O ATOM 816 CB VAL A 51 12.948 14.158 1.676 1.00 0.00 C ATOM 817 CG1 VAL A 51 11.499 13.742 1.880 1.00 0.00 C ATOM 818 CG2 VAL A 51 13.845 13.533 2.731 1.00 0.00 C ATOM 0 H VAL A 51 12.188 13.959 -1.408 1.00 0.00 H new ATOM 0 HA VAL A 51 14.491 14.037 0.184 1.00 0.00 H new ATOM 0 HB VAL A 51 13.001 15.242 1.779 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.179 14.019 2.884 1.00 0.00 H new ATOM 0 HG12 VAL A 51 10.869 14.245 1.146 1.00 0.00 H new ATOM 0 HG13 VAL A 51 11.409 12.663 1.756 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.487 13.809 3.723 1.00 0.00 H new ATOM 0 HG22 VAL A 51 13.827 12.448 2.628 1.00 0.00 H new ATOM 0 HG23 VAL A 51 14.866 13.893 2.600 1.00 0.00 H new ATOM 828 N PRO A 52 14.382 11.530 -0.081 1.00 0.00 N ATOM 829 CA PRO A 52 14.338 10.078 -0.301 1.00 0.00 C ATOM 830 C PRO A 52 13.683 9.318 0.852 1.00 0.00 C ATOM 831 O PRO A 52 13.351 8.141 0.716 1.00 0.00 O ATOM 832 CB PRO A 52 15.815 9.684 -0.428 1.00 0.00 C ATOM 833 CG PRO A 52 16.570 10.791 0.222 1.00 0.00 C ATOM 834 CD PRO A 52 15.766 12.035 -0.025 1.00 0.00 C ATOM 0 HA PRO A 52 13.737 9.829 -1.176 1.00 0.00 H new ATOM 0 HB2 PRO A 52 16.012 8.731 0.063 1.00 0.00 H new ATOM 0 HB3 PRO A 52 16.104 9.570 -1.473 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.690 10.608 1.290 1.00 0.00 H new ATOM 0 HG3 PRO A 52 17.571 10.882 -0.200 1.00 0.00 H new ATOM 0 HD2 PRO A 52 15.897 12.765 0.773 1.00 0.00 H new ATOM 0 HD3 PRO A 52 16.055 12.524 -0.955 1.00 0.00 H new ATOM 842 N SER A 53 13.504 9.989 1.985 1.00 0.00 N ATOM 843 CA SER A 53 12.893 9.360 3.152 1.00 0.00 C ATOM 844 C SER A 53 11.382 9.593 3.191 1.00 0.00 C ATOM 845 O SER A 53 10.744 9.386 4.225 1.00 0.00 O ATOM 846 CB SER A 53 13.533 9.893 4.435 1.00 0.00 C ATOM 847 OG SER A 53 13.044 11.185 4.751 1.00 0.00 O ATOM 0 H SER A 53 13.772 10.964 2.121 1.00 0.00 H new ATOM 0 HA SER A 53 13.067 8.287 3.077 1.00 0.00 H new ATOM 0 HB2 SER A 53 13.325 9.211 5.259 1.00 0.00 H new ATOM 0 HB3 SER A 53 14.616 9.930 4.317 1.00 0.00 H new ATOM 0 HG SER A 53 13.467 11.502 5.576 1.00 0.00 H new ATOM 853 N SER A 54 10.813 10.022 2.069 1.00 0.00 N ATOM 854 CA SER A 54 9.373 10.276 1.996 1.00 0.00 C ATOM 855 C SER A 54 8.642 9.113 1.335 1.00 0.00 C ATOM 856 O SER A 54 7.978 8.322 2.005 1.00 0.00 O ATOM 857 CB SER A 54 9.094 11.567 1.227 1.00 0.00 C ATOM 858 OG SER A 54 9.710 11.547 -0.050 1.00 0.00 O ATOM 0 H SER A 54 11.320 10.201 1.202 1.00 0.00 H new ATOM 0 HA SER A 54 9.003 10.381 3.016 1.00 0.00 H new ATOM 0 HB2 SER A 54 8.018 11.700 1.113 1.00 0.00 H new ATOM 0 HB3 SER A 54 9.462 12.420 1.798 1.00 0.00 H new ATOM 0 HG SER A 54 10.587 11.981 0.003 1.00 0.00 H new ATOM 864 N GLU A 55 8.760 9.020 0.015 1.00 0.00 N ATOM 865 CA GLU A 55 8.099 7.959 -0.737 1.00 0.00 C ATOM 866 C GLU A 55 9.031 6.771 -0.953 1.00 0.00 C ATOM 867 O GLU A 55 10.209 6.939 -1.270 1.00 0.00 O ATOM 868 CB GLU A 55 7.615 8.489 -2.090 1.00 0.00 C ATOM 869 CG GLU A 55 7.004 9.879 -2.021 1.00 0.00 C ATOM 870 CD GLU A 55 7.744 10.886 -2.881 1.00 0.00 C ATOM 871 OE1 GLU A 55 8.870 11.275 -2.504 1.00 0.00 O ATOM 872 OE2 GLU A 55 7.198 11.283 -3.931 1.00 0.00 O ATOM 0 H GLU A 55 9.306 9.665 -0.556 1.00 0.00 H new ATOM 0 HA GLU A 55 7.242 7.622 -0.154 1.00 0.00 H new ATOM 0 HB2 GLU A 55 8.455 8.505 -2.785 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.877 7.798 -2.498 1.00 0.00 H new ATOM 0 HG2 GLU A 55 5.963 9.830 -2.340 1.00 0.00 H new ATOM 0 HG3 GLU A 55 7.005 10.221 -0.986 1.00 0.00 H new ATOM 879 N LEU A 56 8.490 5.567 -0.790 1.00 0.00 N ATOM 880 CA LEU A 56 9.265 4.346 -0.976 1.00 0.00 C ATOM 881 C LEU A 56 8.619 3.462 -2.038 1.00 0.00 C ATOM 882 O LEU A 56 7.412 3.535 -2.269 1.00 0.00 O ATOM 883 CB LEU A 56 9.407 3.555 0.338 1.00 0.00 C ATOM 884 CG LEU A 56 8.773 4.186 1.587 1.00 0.00 C ATOM 885 CD1 LEU A 56 7.807 3.216 2.256 1.00 0.00 C ATOM 886 CD2 LEU A 56 9.853 4.615 2.570 1.00 0.00 C ATOM 0 H LEU A 56 7.516 5.412 -0.529 1.00 0.00 H new ATOM 0 HA LEU A 56 10.261 4.641 -1.304 1.00 0.00 H new ATOM 0 HB2 LEU A 56 8.966 2.569 0.192 1.00 0.00 H new ATOM 0 HB3 LEU A 56 10.469 3.404 0.533 1.00 0.00 H new ATOM 0 HG LEU A 56 8.211 5.066 1.274 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.371 3.686 3.138 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.014 2.952 1.556 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.344 2.315 2.553 1.00 0.00 H new ATOM 0 HD21 LEU A 56 9.388 5.060 3.450 1.00 0.00 H new ATOM 0 HD22 LEU A 56 10.438 3.746 2.870 1.00 0.00 H new ATOM 0 HD23 LEU A 56 10.507 5.347 2.096 1.00 0.00 H new ATOM 898 N GLN A 57 9.426 2.635 -2.668 1.00 0.00 N ATOM 899 CA GLN A 57 8.930 1.731 -3.716 1.00 0.00 C ATOM 900 C GLN A 57 8.807 0.309 -3.183 1.00 0.00 C ATOM 901 O GLN A 57 9.709 -0.196 -2.513 1.00 0.00 O ATOM 902 CB GLN A 57 9.859 1.752 -4.930 1.00 0.00 C ATOM 903 CG GLN A 57 9.920 3.108 -5.618 1.00 0.00 C ATOM 904 CD GLN A 57 10.686 4.139 -4.809 1.00 0.00 C ATOM 905 OE1 GLN A 57 11.856 3.943 -4.483 1.00 0.00 O ATOM 906 NE2 GLN A 57 10.025 5.244 -4.483 1.00 0.00 N ATOM 0 H GLN A 57 10.426 2.560 -2.483 1.00 0.00 H new ATOM 0 HA GLN A 57 7.944 2.079 -4.023 1.00 0.00 H new ATOM 0 HB2 GLN A 57 10.863 1.466 -4.616 1.00 0.00 H new ATOM 0 HB3 GLN A 57 9.525 1.003 -5.648 1.00 0.00 H new ATOM 0 HG2 GLN A 57 10.391 2.995 -6.595 1.00 0.00 H new ATOM 0 HG3 GLN A 57 8.906 3.469 -5.793 1.00 0.00 H new ATOM 0 HE21 GLN A 57 9.055 5.363 -4.775 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.487 5.973 -3.940 1.00 0.00 H new ATOM 915 N ILE A 58 7.672 -0.331 -3.457 1.00 0.00 N ATOM 916 CA ILE A 58 7.435 -1.695 -2.998 1.00 0.00 C ATOM 917 C ILE A 58 6.767 -2.525 -4.086 1.00 0.00 C ATOM 918 O ILE A 58 5.788 -2.096 -4.697 1.00 0.00 O ATOM 919 CB ILE A 58 6.550 -1.739 -1.724 1.00 0.00 C ATOM 920 CG1 ILE A 58 5.847 -0.398 -1.482 1.00 0.00 C ATOM 921 CG2 ILE A 58 7.393 -2.131 -0.520 1.00 0.00 C ATOM 922 CD1 ILE A 58 4.454 -0.539 -0.908 1.00 0.00 C ATOM 0 H ILE A 58 6.904 0.073 -3.994 1.00 0.00 H new ATOM 0 HA ILE A 58 8.413 -2.113 -2.758 1.00 0.00 H new ATOM 0 HB ILE A 58 5.775 -2.490 -1.873 1.00 0.00 H new ATOM 0 HG12 ILE A 58 6.452 0.202 -0.802 1.00 0.00 H new ATOM 0 HG13 ILE A 58 5.789 0.148 -2.424 1.00 0.00 H new ATOM 0 HG21 ILE A 58 6.765 -2.160 0.370 1.00 0.00 H new ATOM 0 HG22 ILE A 58 7.831 -3.115 -0.687 1.00 0.00 H new ATOM 0 HG23 ILE A 58 8.189 -1.399 -0.379 1.00 0.00 H new ATOM 0 HD11 ILE A 58 4.018 0.450 -0.763 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.833 -1.112 -1.597 1.00 0.00 H new ATOM 0 HD13 ILE A 58 4.506 -1.056 0.050 1.00 0.00 H new ATOM 934 N TYR A 59 7.299 -3.722 -4.318 1.00 0.00 N ATOM 935 CA TYR A 59 6.752 -4.616 -5.331 1.00 0.00 C ATOM 936 C TYR A 59 5.629 -5.459 -4.739 1.00 0.00 C ATOM 937 O TYR A 59 5.840 -6.608 -4.352 1.00 0.00 O ATOM 938 CB TYR A 59 7.851 -5.519 -5.891 1.00 0.00 C ATOM 939 CG TYR A 59 8.667 -4.868 -6.986 1.00 0.00 C ATOM 940 CD1 TYR A 59 9.258 -3.627 -6.793 1.00 0.00 C ATOM 941 CD2 TYR A 59 8.845 -5.497 -8.213 1.00 0.00 C ATOM 942 CE1 TYR A 59 10.003 -3.028 -7.790 1.00 0.00 C ATOM 943 CE2 TYR A 59 9.590 -4.905 -9.216 1.00 0.00 C ATOM 944 CZ TYR A 59 10.166 -3.671 -8.999 1.00 0.00 C ATOM 945 OH TYR A 59 10.909 -3.079 -9.995 1.00 0.00 O ATOM 0 H TYR A 59 8.107 -4.094 -3.819 1.00 0.00 H new ATOM 0 HA TYR A 59 6.347 -4.014 -6.144 1.00 0.00 H new ATOM 0 HB2 TYR A 59 8.516 -5.814 -5.080 1.00 0.00 H new ATOM 0 HB3 TYR A 59 7.398 -6.431 -6.280 1.00 0.00 H new ATOM 0 HD1 TYR A 59 9.133 -3.121 -5.847 1.00 0.00 H new ATOM 0 HD2 TYR A 59 8.394 -6.463 -8.385 1.00 0.00 H new ATOM 0 HE1 TYR A 59 10.455 -2.061 -7.624 1.00 0.00 H new ATOM 0 HE2 TYR A 59 9.720 -5.406 -10.164 1.00 0.00 H new ATOM 0 HH TYR A 59 10.926 -3.663 -10.781 1.00 0.00 H new ATOM 955 N THR A 60 4.439 -4.875 -4.667 1.00 0.00 N ATOM 956 CA THR A 60 3.279 -5.562 -4.116 1.00 0.00 C ATOM 957 C THR A 60 2.196 -5.736 -5.168 1.00 0.00 C ATOM 958 O THR A 60 2.387 -5.385 -6.335 1.00 0.00 O ATOM 959 CB THR A 60 2.720 -4.793 -2.920 1.00 0.00 C ATOM 960 OG1 THR A 60 1.671 -5.521 -2.303 1.00 0.00 O ATOM 961 CG2 THR A 60 2.177 -3.427 -3.284 1.00 0.00 C ATOM 0 H THR A 60 4.252 -3.924 -4.985 1.00 0.00 H new ATOM 0 HA THR A 60 3.602 -6.549 -3.786 1.00 0.00 H new ATOM 0 HB THR A 60 3.564 -4.661 -2.243 1.00 0.00 H new ATOM 0 HG1 THR A 60 0.956 -4.905 -2.039 1.00 0.00 H new ATOM 0 HG21 THR A 60 1.796 -2.936 -2.388 1.00 0.00 H new ATOM 0 HG22 THR A 60 2.974 -2.823 -3.718 1.00 0.00 H new ATOM 0 HG23 THR A 60 1.370 -3.537 -4.008 1.00 0.00 H new ATOM 969 N TRP A 61 1.049 -6.287 -4.764 1.00 0.00 N ATOM 970 CA TRP A 61 -0.047 -6.498 -5.689 1.00 0.00 C ATOM 971 C TRP A 61 -1.366 -5.971 -5.129 1.00 0.00 C ATOM 972 O TRP A 61 -1.831 -6.396 -4.074 1.00 0.00 O ATOM 973 CB TRP A 61 -0.192 -7.979 -6.042 1.00 0.00 C ATOM 974 CG TRP A 61 -0.251 -8.887 -4.852 1.00 0.00 C ATOM 975 CD1 TRP A 61 -1.363 -9.495 -4.340 1.00 0.00 C ATOM 976 CD2 TRP A 61 0.846 -9.305 -4.038 1.00 0.00 C ATOM 977 NE1 TRP A 61 -1.021 -10.268 -3.258 1.00 0.00 N ATOM 978 CE2 TRP A 61 0.331 -10.165 -3.051 1.00 0.00 C ATOM 979 CE3 TRP A 61 2.217 -9.033 -4.049 1.00 0.00 C ATOM 980 CZ2 TRP A 61 1.144 -10.756 -2.085 1.00 0.00 C ATOM 981 CZ3 TRP A 61 3.020 -9.618 -3.090 1.00 0.00 C ATOM 982 CH2 TRP A 61 2.482 -10.473 -2.119 1.00 0.00 C ATOM 0 H TRP A 61 0.864 -6.590 -3.808 1.00 0.00 H new ATOM 0 HA TRP A 61 0.190 -5.939 -6.594 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -1.097 -8.114 -6.634 1.00 0.00 H new ATOM 0 HB3 TRP A 61 0.647 -8.276 -6.671 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -2.364 -9.384 -4.730 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -1.666 -10.827 -2.700 1.00 0.00 H new ATOM 0 HE3 TRP A 61 2.641 -8.377 -4.795 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 0.732 -11.415 -1.335 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 4.080 -9.413 -3.088 1.00 0.00 H new ATOM 0 HH2 TRP A 61 3.136 -10.917 -1.383 1.00 0.00 H new ATOM 993 N MET A 62 -1.957 -5.023 -5.865 1.00 0.00 N ATOM 994 CA MET A 62 -3.225 -4.388 -5.490 1.00 0.00 C ATOM 995 C MET A 62 -4.154 -5.325 -4.714 1.00 0.00 C ATOM 996 O MET A 62 -4.881 -4.887 -3.821 1.00 0.00 O ATOM 997 CB MET A 62 -3.944 -3.889 -6.747 1.00 0.00 C ATOM 998 CG MET A 62 -3.351 -2.614 -7.330 1.00 0.00 C ATOM 999 SD MET A 62 -3.747 -1.153 -6.351 1.00 0.00 S ATOM 1000 CE MET A 62 -2.135 -0.384 -6.227 1.00 0.00 C ATOM 0 H MET A 62 -1.568 -4.674 -6.741 1.00 0.00 H new ATOM 0 HA MET A 62 -2.980 -3.555 -4.831 1.00 0.00 H new ATOM 0 HB2 MET A 62 -3.915 -4.672 -7.505 1.00 0.00 H new ATOM 0 HB3 MET A 62 -4.993 -3.714 -6.509 1.00 0.00 H new ATOM 0 HG2 MET A 62 -2.268 -2.719 -7.397 1.00 0.00 H new ATOM 0 HG3 MET A 62 -3.721 -2.477 -8.346 1.00 0.00 H new ATOM 0 HE1 MET A 62 -2.244 0.699 -6.278 1.00 0.00 H new ATOM 0 HE2 MET A 62 -1.673 -0.658 -5.279 1.00 0.00 H new ATOM 0 HE3 MET A 62 -1.505 -0.724 -7.049 1.00 0.00 H new ATOM 1010 N ASP A 63 -4.132 -6.610 -5.056 1.00 0.00 N ATOM 1011 CA ASP A 63 -4.978 -7.598 -4.384 1.00 0.00 C ATOM 1012 C ASP A 63 -4.288 -8.181 -3.145 1.00 0.00 C ATOM 1013 O ASP A 63 -4.529 -9.330 -2.777 1.00 0.00 O ATOM 1014 CB ASP A 63 -5.343 -8.725 -5.350 1.00 0.00 C ATOM 1015 CG ASP A 63 -6.785 -9.166 -5.204 1.00 0.00 C ATOM 1016 OD1 ASP A 63 -7.109 -9.808 -4.181 1.00 0.00 O ATOM 1017 OD2 ASP A 63 -7.593 -8.871 -6.109 1.00 0.00 O ATOM 0 H ASP A 63 -3.540 -6.993 -5.793 1.00 0.00 H new ATOM 0 HA ASP A 63 -5.885 -7.089 -4.059 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -5.169 -8.393 -6.374 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -4.686 -9.577 -5.175 1.00 0.00 H new ATOM 1022 N ALA A 64 -3.430 -7.386 -2.510 1.00 0.00 N ATOM 1023 CA ALA A 64 -2.710 -7.829 -1.320 1.00 0.00 C ATOM 1024 C ALA A 64 -3.458 -7.454 -0.047 1.00 0.00 C ATOM 1025 O ALA A 64 -4.067 -6.388 0.034 1.00 0.00 O ATOM 1026 CB ALA A 64 -1.312 -7.228 -1.295 1.00 0.00 C ATOM 0 H ALA A 64 -3.217 -6.432 -2.800 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.634 -8.916 -1.362 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -0.786 -7.567 -0.402 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.763 -7.546 -2.182 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.384 -6.140 -1.283 1.00 0.00 H new ATOM 1032 N THR A 65 -3.397 -8.331 0.950 1.00 0.00 N ATOM 1033 CA THR A 65 -4.062 -8.076 2.218 1.00 0.00 C ATOM 1034 C THR A 65 -3.243 -7.083 3.043 1.00 0.00 C ATOM 1035 O THR A 65 -2.026 -6.999 2.881 1.00 0.00 O ATOM 1036 CB THR A 65 -4.261 -9.377 3.005 1.00 0.00 C ATOM 1037 OG1 THR A 65 -3.446 -10.411 2.480 1.00 0.00 O ATOM 1038 CG2 THR A 65 -5.693 -9.866 2.987 1.00 0.00 C ATOM 0 H THR A 65 -2.897 -9.219 0.903 1.00 0.00 H new ATOM 0 HA THR A 65 -5.044 -7.650 2.012 1.00 0.00 H new ATOM 0 HB THR A 65 -3.984 -9.143 4.033 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.504 -10.147 2.540 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.769 -10.790 3.561 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.341 -9.110 3.429 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.001 -10.052 1.958 1.00 0.00 H new ATOM 1046 N LEU A 66 -3.917 -6.336 3.930 1.00 0.00 N ATOM 1047 CA LEU A 66 -3.243 -5.361 4.777 1.00 0.00 C ATOM 1048 C LEU A 66 -1.947 -5.916 5.353 1.00 0.00 C ATOM 1049 O LEU A 66 -1.003 -5.166 5.604 1.00 0.00 O ATOM 1050 CB LEU A 66 -4.185 -4.923 5.902 1.00 0.00 C ATOM 1051 CG LEU A 66 -4.970 -3.623 5.656 1.00 0.00 C ATOM 1052 CD1 LEU A 66 -4.210 -2.424 6.200 1.00 0.00 C ATOM 1053 CD2 LEU A 66 -5.263 -3.435 4.173 1.00 0.00 C ATOM 0 H LEU A 66 -4.925 -6.394 4.074 1.00 0.00 H new ATOM 0 HA LEU A 66 -2.981 -4.499 4.164 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.899 -5.726 6.085 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.599 -4.804 6.814 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.920 -3.701 6.185 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.783 -1.516 6.015 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.058 -2.546 7.273 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -3.243 -2.350 5.703 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -5.819 -2.509 4.026 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.325 -3.387 3.620 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.855 -4.275 3.810 1.00 0.00 H new ATOM 1065 N LYS A 67 -1.906 -7.225 5.569 1.00 0.00 N ATOM 1066 CA LYS A 67 -0.719 -7.869 6.122 1.00 0.00 C ATOM 1067 C LYS A 67 0.454 -7.710 5.178 1.00 0.00 C ATOM 1068 O LYS A 67 1.541 -7.252 5.562 1.00 0.00 O ATOM 1069 CB LYS A 67 -0.981 -9.354 6.400 1.00 0.00 C ATOM 1070 CG LYS A 67 -1.856 -10.046 5.362 1.00 0.00 C ATOM 1071 CD LYS A 67 -1.260 -11.375 4.925 1.00 0.00 C ATOM 1072 CE LYS A 67 -1.733 -12.516 5.811 1.00 0.00 C ATOM 1073 NZ LYS A 67 -1.066 -12.501 7.142 1.00 0.00 N ATOM 0 H LYS A 67 -2.678 -7.861 5.371 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.478 -7.383 7.067 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -0.025 -9.874 6.456 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -1.454 -9.450 7.377 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -2.851 -10.211 5.776 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -1.975 -9.397 4.494 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -1.538 -11.577 3.891 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -0.172 -11.315 4.957 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -2.812 -12.447 5.946 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -1.533 -13.466 5.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -1.285 -13.382 7.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -0.037 -12.421 7.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.410 -11.689 7.694 1.00 0.00 H new ATOM 1087 N GLU A 68 0.279 -8.092 3.900 1.00 0.00 N ATOM 1088 CA GLU A 68 1.331 -7.981 2.922 1.00 0.00 C ATOM 1089 C GLU A 68 1.912 -6.579 2.882 1.00 0.00 C ATOM 1090 O GLU A 68 3.125 -6.401 2.780 1.00 0.00 O ATOM 1091 CB GLU A 68 0.794 -8.349 1.525 1.00 0.00 C ATOM 1092 CG GLU A 68 0.991 -9.812 1.165 1.00 0.00 C ATOM 1093 CD GLU A 68 0.176 -10.744 2.040 1.00 0.00 C ATOM 1094 OE1 GLU A 68 -1.062 -10.776 1.879 1.00 0.00 O ATOM 1095 OE2 GLU A 68 0.776 -11.439 2.886 1.00 0.00 O ATOM 0 H GLU A 68 -0.592 -8.480 3.537 1.00 0.00 H new ATOM 0 HA GLU A 68 2.123 -8.672 3.211 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -0.269 -8.112 1.479 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.291 -7.729 0.779 1.00 0.00 H new ATOM 0 HG2 GLU A 68 0.715 -9.966 0.122 1.00 0.00 H new ATOM 0 HG3 GLU A 68 2.047 -10.065 1.256 1.00 0.00 H new ATOM 1102 N LEU A 69 1.039 -5.587 2.969 1.00 0.00 N ATOM 1103 CA LEU A 69 1.475 -4.192 2.980 1.00 0.00 C ATOM 1104 C LEU A 69 2.257 -3.882 4.253 1.00 0.00 C ATOM 1105 O LEU A 69 3.168 -3.052 4.248 1.00 0.00 O ATOM 1106 CB LEU A 69 0.276 -3.244 2.848 1.00 0.00 C ATOM 1107 CG LEU A 69 -0.646 -3.497 1.643 1.00 0.00 C ATOM 1108 CD1 LEU A 69 0.141 -3.994 0.438 1.00 0.00 C ATOM 1109 CD2 LEU A 69 -1.741 -4.486 2.012 1.00 0.00 C ATOM 0 H LEU A 69 0.029 -5.717 3.033 1.00 0.00 H new ATOM 0 HA LEU A 69 2.131 -4.038 2.123 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.320 -3.313 3.758 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.650 -2.222 2.788 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.109 -2.549 1.369 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.540 -4.163 -0.396 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.883 -3.248 0.155 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.643 -4.928 0.691 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.385 -4.655 1.149 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -1.290 -5.430 2.318 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.333 -4.083 2.834 1.00 0.00 H new ATOM 1121 N THR A 70 1.908 -4.569 5.339 1.00 0.00 N ATOM 1122 CA THR A 70 2.589 -4.384 6.620 1.00 0.00 C ATOM 1123 C THR A 70 4.080 -4.624 6.463 1.00 0.00 C ATOM 1124 O THR A 70 4.897 -3.919 7.054 1.00 0.00 O ATOM 1125 CB THR A 70 2.009 -5.334 7.670 1.00 0.00 C ATOM 1126 OG1 THR A 70 0.605 -5.177 7.767 1.00 0.00 O ATOM 1127 CG2 THR A 70 2.589 -5.127 9.052 1.00 0.00 C ATOM 0 H THR A 70 1.157 -5.259 5.358 1.00 0.00 H new ATOM 0 HA THR A 70 2.433 -3.358 6.952 1.00 0.00 H new ATOM 0 HB THR A 70 2.273 -6.335 7.329 1.00 0.00 H new ATOM 0 HG1 THR A 70 0.195 -5.358 6.896 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.134 -5.833 9.747 1.00 0.00 H new ATOM 0 HG22 THR A 70 3.666 -5.290 9.023 1.00 0.00 H new ATOM 0 HG23 THR A 70 2.385 -4.109 9.383 1.00 0.00 H new ATOM 1135 N SER A 71 4.433 -5.619 5.654 1.00 0.00 N ATOM 1136 CA SER A 71 5.831 -5.944 5.412 1.00 0.00 C ATOM 1137 C SER A 71 6.493 -4.883 4.539 1.00 0.00 C ATOM 1138 O SER A 71 7.596 -4.422 4.825 1.00 0.00 O ATOM 1139 CB SER A 71 5.951 -7.316 4.745 1.00 0.00 C ATOM 1140 OG SER A 71 5.883 -8.356 5.704 1.00 0.00 O ATOM 0 H SER A 71 3.769 -6.212 5.156 1.00 0.00 H new ATOM 0 HA SER A 71 6.343 -5.970 6.374 1.00 0.00 H new ATOM 0 HB2 SER A 71 5.153 -7.439 4.013 1.00 0.00 H new ATOM 0 HB3 SER A 71 6.894 -7.379 4.202 1.00 0.00 H new ATOM 0 HG SER A 71 5.960 -9.223 5.253 1.00 0.00 H new ATOM 1146 N LEU A 72 5.802 -4.503 3.470 1.00 0.00 N ATOM 1147 CA LEU A 72 6.293 -3.500 2.528 1.00 0.00 C ATOM 1148 C LEU A 72 6.919 -2.292 3.230 1.00 0.00 C ATOM 1149 O LEU A 72 7.987 -1.825 2.837 1.00 0.00 O ATOM 1150 CB LEU A 72 5.141 -3.037 1.634 1.00 0.00 C ATOM 1151 CG LEU A 72 4.441 -4.149 0.850 1.00 0.00 C ATOM 1152 CD1 LEU A 72 3.315 -3.577 0.005 1.00 0.00 C ATOM 1153 CD2 LEU A 72 5.434 -4.900 -0.025 1.00 0.00 C ATOM 0 H LEU A 72 4.885 -4.881 3.231 1.00 0.00 H new ATOM 0 HA LEU A 72 7.076 -3.966 1.930 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.402 -2.530 2.254 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.523 -2.301 0.927 1.00 0.00 H new ATOM 0 HG LEU A 72 4.015 -4.853 1.565 1.00 0.00 H new ATOM 0 HD11 LEU A 72 2.828 -4.382 -0.546 1.00 0.00 H new ATOM 0 HD12 LEU A 72 2.587 -3.088 0.652 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.721 -2.850 -0.698 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.914 -5.686 -0.573 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.893 -4.208 -0.731 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.207 -5.345 0.601 1.00 0.00 H new ATOM 1165 N VAL A 73 6.239 -1.775 4.250 1.00 0.00 N ATOM 1166 CA VAL A 73 6.724 -0.601 4.980 1.00 0.00 C ATOM 1167 C VAL A 73 7.805 -0.946 6.008 1.00 0.00 C ATOM 1168 O VAL A 73 8.838 -0.282 6.068 1.00 0.00 O ATOM 1169 CB VAL A 73 5.565 0.128 5.690 1.00 0.00 C ATOM 1170 CG1 VAL A 73 6.080 1.305 6.510 1.00 0.00 C ATOM 1171 CG2 VAL A 73 4.534 0.594 4.674 1.00 0.00 C ATOM 0 H VAL A 73 5.353 -2.147 4.591 1.00 0.00 H new ATOM 0 HA VAL A 73 7.169 0.054 4.231 1.00 0.00 H new ATOM 0 HB VAL A 73 5.088 -0.574 6.374 1.00 0.00 H new ATOM 0 HG11 VAL A 73 5.242 1.801 7.000 1.00 0.00 H new ATOM 0 HG12 VAL A 73 6.780 0.945 7.264 1.00 0.00 H new ATOM 0 HG13 VAL A 73 6.587 2.012 5.853 1.00 0.00 H new ATOM 0 HG21 VAL A 73 3.722 1.107 5.189 1.00 0.00 H new ATOM 0 HG22 VAL A 73 5.004 1.277 3.966 1.00 0.00 H new ATOM 0 HG23 VAL A 73 4.137 -0.268 4.137 1.00 0.00 H new ATOM 1181 N LYS A 74 7.563 -1.956 6.834 1.00 0.00 N ATOM 1182 CA LYS A 74 8.534 -2.329 7.863 1.00 0.00 C ATOM 1183 C LYS A 74 9.839 -2.794 7.252 1.00 0.00 C ATOM 1184 O LYS A 74 10.912 -2.655 7.853 1.00 0.00 O ATOM 1185 CB LYS A 74 7.969 -3.405 8.792 1.00 0.00 C ATOM 1186 CG LYS A 74 7.269 -4.545 8.073 1.00 0.00 C ATOM 1187 CD LYS A 74 8.087 -5.825 8.115 1.00 0.00 C ATOM 1188 CE LYS A 74 8.349 -6.282 9.542 1.00 0.00 C ATOM 1189 NZ LYS A 74 8.995 -7.623 9.585 1.00 0.00 N ATOM 0 H LYS A 74 6.717 -2.526 6.816 1.00 0.00 H new ATOM 0 HA LYS A 74 8.736 -1.436 8.454 1.00 0.00 H new ATOM 0 HB2 LYS A 74 8.782 -3.814 9.392 1.00 0.00 H new ATOM 0 HB3 LYS A 74 7.266 -2.940 9.483 1.00 0.00 H new ATOM 0 HG2 LYS A 74 6.296 -4.720 8.531 1.00 0.00 H new ATOM 0 HG3 LYS A 74 7.087 -4.264 7.036 1.00 0.00 H new ATOM 0 HD2 LYS A 74 7.561 -6.611 7.573 1.00 0.00 H new ATOM 0 HD3 LYS A 74 9.037 -5.666 7.604 1.00 0.00 H new ATOM 0 HE2 LYS A 74 8.987 -5.555 10.045 1.00 0.00 H new ATOM 0 HE3 LYS A 74 7.408 -6.314 10.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 9.157 -7.899 10.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 8.375 -8.322 9.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 9.905 -7.586 9.083 1.00 0.00 H new ATOM 1203 N GLU A 75 9.794 -3.376 6.040 1.00 0.00 N ATOM 1204 CA GLU A 75 10.993 -3.850 5.382 1.00 0.00 C ATOM 1205 C GLU A 75 11.736 -2.707 4.699 1.00 0.00 C ATOM 1206 O GLU A 75 12.966 -2.677 4.679 1.00 0.00 O ATOM 1207 CB GLU A 75 10.637 -4.926 4.334 1.00 0.00 C ATOM 1208 CG GLU A 75 11.052 -6.331 4.739 1.00 0.00 C ATOM 1209 CD GLU A 75 11.352 -7.216 3.544 1.00 0.00 C ATOM 1210 OE1 GLU A 75 10.406 -7.836 3.013 1.00 0.00 O ATOM 1211 OE2 GLU A 75 12.531 -7.287 3.137 1.00 0.00 O ATOM 0 H GLU A 75 8.935 -3.522 5.509 1.00 0.00 H new ATOM 0 HA GLU A 75 11.642 -4.281 6.145 1.00 0.00 H new ATOM 0 HB2 GLU A 75 9.561 -4.910 4.160 1.00 0.00 H new ATOM 0 HB3 GLU A 75 11.116 -4.673 3.388 1.00 0.00 H new ATOM 0 HG2 GLU A 75 11.934 -6.276 5.377 1.00 0.00 H new ATOM 0 HG3 GLU A 75 10.258 -6.784 5.332 1.00 0.00 H new ATOM 1218 N VAL A 76 10.979 -1.764 4.151 1.00 0.00 N ATOM 1219 CA VAL A 76 11.562 -0.607 3.480 1.00 0.00 C ATOM 1220 C VAL A 76 12.062 0.408 4.504 1.00 0.00 C ATOM 1221 O VAL A 76 13.045 1.112 4.272 1.00 0.00 O ATOM 1222 CB VAL A 76 10.544 0.081 2.549 1.00 0.00 C ATOM 1223 CG1 VAL A 76 9.312 0.508 3.327 1.00 0.00 C ATOM 1224 CG2 VAL A 76 11.162 1.277 1.849 1.00 0.00 C ATOM 0 H VAL A 76 9.959 -1.777 4.158 1.00 0.00 H new ATOM 0 HA VAL A 76 12.396 -0.970 2.880 1.00 0.00 H new ATOM 0 HB VAL A 76 10.247 -0.642 1.789 1.00 0.00 H new ATOM 0 HG11 VAL A 76 8.605 0.992 2.653 1.00 0.00 H new ATOM 0 HG12 VAL A 76 8.844 -0.368 3.776 1.00 0.00 H new ATOM 0 HG13 VAL A 76 9.601 1.207 4.112 1.00 0.00 H new ATOM 0 HG21 VAL A 76 10.420 1.742 1.199 1.00 0.00 H new ATOM 0 HG22 VAL A 76 11.497 2.000 2.592 1.00 0.00 H new ATOM 0 HG23 VAL A 76 12.013 0.949 1.252 1.00 0.00 H new ATOM 1234 N TYR A 77 11.369 0.481 5.635 1.00 0.00 N ATOM 1235 CA TYR A 77 11.727 1.409 6.699 1.00 0.00 C ATOM 1236 C TYR A 77 12.268 0.657 7.915 1.00 0.00 C ATOM 1237 O TYR A 77 11.572 -0.174 8.499 1.00 0.00 O ATOM 1238 CB TYR A 77 10.507 2.244 7.091 1.00 0.00 C ATOM 1239 CG TYR A 77 10.805 3.717 7.246 1.00 0.00 C ATOM 1240 CD1 TYR A 77 11.798 4.161 8.110 1.00 0.00 C ATOM 1241 CD2 TYR A 77 10.091 4.664 6.524 1.00 0.00 C ATOM 1242 CE1 TYR A 77 12.071 5.507 8.252 1.00 0.00 C ATOM 1243 CE2 TYR A 77 10.358 6.014 6.660 1.00 0.00 C ATOM 1244 CZ TYR A 77 11.348 6.430 7.524 1.00 0.00 C ATOM 1245 OH TYR A 77 11.617 7.772 7.662 1.00 0.00 O ATOM 0 H TYR A 77 10.552 -0.095 5.838 1.00 0.00 H new ATOM 0 HA TYR A 77 12.511 2.072 6.334 1.00 0.00 H new ATOM 0 HB2 TYR A 77 9.732 2.116 6.335 1.00 0.00 H new ATOM 0 HB3 TYR A 77 10.103 1.863 8.029 1.00 0.00 H new ATOM 0 HD1 TYR A 77 12.366 3.441 8.680 1.00 0.00 H new ATOM 0 HD2 TYR A 77 9.315 4.341 5.846 1.00 0.00 H new ATOM 0 HE1 TYR A 77 12.846 5.836 8.929 1.00 0.00 H new ATOM 0 HE2 TYR A 77 9.794 6.739 6.092 1.00 0.00 H new ATOM 0 HH TYR A 77 11.020 8.287 7.079 1.00 0.00 H new ATOM 1255 N PRO A 78 13.524 0.933 8.311 1.00 0.00 N ATOM 1256 CA PRO A 78 14.153 0.271 9.459 1.00 0.00 C ATOM 1257 C PRO A 78 13.456 0.590 10.779 1.00 0.00 C ATOM 1258 O PRO A 78 13.287 -0.284 11.629 1.00 0.00 O ATOM 1259 CB PRO A 78 15.585 0.828 9.469 1.00 0.00 C ATOM 1260 CG PRO A 78 15.785 1.439 8.125 1.00 0.00 C ATOM 1261 CD PRO A 78 14.432 1.900 7.673 1.00 0.00 C ATOM 0 HA PRO A 78 14.104 -0.814 9.365 1.00 0.00 H new ATOM 0 HB2 PRO A 78 15.713 1.568 10.259 1.00 0.00 H new ATOM 0 HB3 PRO A 78 16.312 0.037 9.652 1.00 0.00 H new ATOM 0 HG2 PRO A 78 16.484 2.274 8.176 1.00 0.00 H new ATOM 0 HG3 PRO A 78 16.204 0.715 7.426 1.00 0.00 H new ATOM 0 HD2 PRO A 78 14.225 2.921 7.994 1.00 0.00 H new ATOM 0 HD3 PRO A 78 14.342 1.883 6.587 1.00 0.00 H new ATOM 1269 N GLU A 79 13.060 1.846 10.946 1.00 0.00 N ATOM 1270 CA GLU A 79 12.389 2.282 12.169 1.00 0.00 C ATOM 1271 C GLU A 79 11.000 1.660 12.304 1.00 0.00 C ATOM 1272 O GLU A 79 10.383 1.731 13.367 1.00 0.00 O ATOM 1273 CB GLU A 79 12.279 3.808 12.196 1.00 0.00 C ATOM 1274 CG GLU A 79 12.127 4.381 13.597 1.00 0.00 C ATOM 1275 CD GLU A 79 13.442 4.436 14.349 1.00 0.00 C ATOM 1276 OE1 GLU A 79 14.349 5.174 13.907 1.00 0.00 O ATOM 1277 OE2 GLU A 79 13.565 3.743 15.381 1.00 0.00 O ATOM 0 H GLU A 79 13.191 2.582 10.252 1.00 0.00 H new ATOM 0 HA GLU A 79 12.991 1.945 13.013 1.00 0.00 H new ATOM 0 HB2 GLU A 79 13.167 4.237 11.731 1.00 0.00 H new ATOM 0 HB3 GLU A 79 11.424 4.113 11.592 1.00 0.00 H new ATOM 0 HG2 GLU A 79 11.708 5.385 13.532 1.00 0.00 H new ATOM 0 HG3 GLU A 79 11.416 3.775 14.159 1.00 0.00 H new ATOM 1284 N ALA A 80 10.504 1.056 11.227 1.00 0.00 N ATOM 1285 CA ALA A 80 9.185 0.433 11.244 1.00 0.00 C ATOM 1286 C ALA A 80 9.267 -1.037 11.647 1.00 0.00 C ATOM 1287 O ALA A 80 8.365 -1.562 12.300 1.00 0.00 O ATOM 1288 CB ALA A 80 8.522 0.571 9.882 1.00 0.00 C ATOM 0 H ALA A 80 10.994 0.985 10.335 1.00 0.00 H new ATOM 0 HA ALA A 80 8.580 0.949 11.989 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.538 0.102 9.907 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.415 1.627 9.635 1.00 0.00 H new ATOM 0 HB3 ALA A 80 9.137 0.083 9.127 1.00 0.00 H new ATOM 1294 N ARG A 81 10.350 -1.696 11.250 1.00 0.00 N ATOM 1295 CA ARG A 81 10.548 -3.108 11.565 1.00 0.00 C ATOM 1296 C ARG A 81 10.562 -3.353 13.075 1.00 0.00 C ATOM 1297 O ARG A 81 10.395 -4.486 13.525 1.00 0.00 O ATOM 1298 CB ARG A 81 11.855 -3.609 10.944 1.00 0.00 C ATOM 1299 CG ARG A 81 11.659 -4.733 9.939 1.00 0.00 C ATOM 1300 CD ARG A 81 12.949 -5.052 9.202 1.00 0.00 C ATOM 1301 NE ARG A 81 12.838 -6.273 8.407 1.00 0.00 N ATOM 1302 CZ ARG A 81 12.930 -7.500 8.915 1.00 0.00 C ATOM 1303 NH1 ARG A 81 13.134 -7.673 10.215 1.00 0.00 N ATOM 1304 NH2 ARG A 81 12.818 -8.555 8.120 1.00 0.00 N ATOM 0 H ARG A 81 11.105 -1.275 10.709 1.00 0.00 H new ATOM 0 HA ARG A 81 9.709 -3.661 11.143 1.00 0.00 H new ATOM 0 HB2 ARG A 81 12.356 -2.776 10.452 1.00 0.00 H new ATOM 0 HB3 ARG A 81 12.516 -3.954 11.739 1.00 0.00 H new ATOM 0 HG2 ARG A 81 11.303 -5.625 10.454 1.00 0.00 H new ATOM 0 HG3 ARG A 81 10.889 -4.451 9.221 1.00 0.00 H new ATOM 0 HD2 ARG A 81 13.210 -4.218 8.551 1.00 0.00 H new ATOM 0 HD3 ARG A 81 13.760 -5.161 9.922 1.00 0.00 H new ATOM 0 HE ARG A 81 12.681 -6.180 7.404 1.00 0.00 H new ATOM 0 HH11 ARG A 81 13.221 -6.864 10.830 1.00 0.00 H new ATOM 0 HH12 ARG A 81 13.204 -8.615 10.599 1.00 0.00 H new ATOM 0 HH21 ARG A 81 12.662 -8.426 7.120 1.00 0.00 H new ATOM 0 HH22 ARG A 81 12.888 -9.496 8.508 1.00 0.00 H new ATOM 1318 N LYS A 82 10.768 -2.292 13.852 1.00 0.00 N ATOM 1319 CA LYS A 82 10.806 -2.411 15.305 1.00 0.00 C ATOM 1320 C LYS A 82 9.500 -2.986 15.841 1.00 0.00 C ATOM 1321 O LYS A 82 8.418 -2.662 15.349 1.00 0.00 O ATOM 1322 CB LYS A 82 11.080 -1.046 15.942 1.00 0.00 C ATOM 1323 CG LYS A 82 12.231 -1.061 16.935 1.00 0.00 C ATOM 1324 CD LYS A 82 13.546 -0.674 16.273 1.00 0.00 C ATOM 1325 CE LYS A 82 14.626 -1.714 16.524 1.00 0.00 C ATOM 1326 NZ LYS A 82 15.170 -1.628 17.908 1.00 0.00 N ATOM 0 H LYS A 82 10.910 -1.345 13.501 1.00 0.00 H new ATOM 0 HA LYS A 82 11.613 -3.095 15.567 1.00 0.00 H new ATOM 0 HB2 LYS A 82 11.299 -0.324 15.155 1.00 0.00 H new ATOM 0 HB3 LYS A 82 10.178 -0.702 16.448 1.00 0.00 H new ATOM 0 HG2 LYS A 82 12.017 -0.371 17.752 1.00 0.00 H new ATOM 0 HG3 LYS A 82 12.322 -2.055 17.373 1.00 0.00 H new ATOM 0 HD2 LYS A 82 13.394 -0.558 15.200 1.00 0.00 H new ATOM 0 HD3 LYS A 82 13.875 0.293 16.654 1.00 0.00 H new ATOM 0 HE2 LYS A 82 14.217 -2.710 16.356 1.00 0.00 H new ATOM 0 HE3 LYS A 82 15.435 -1.577 15.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 15.903 -2.354 18.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 15.584 -0.686 18.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 14.403 -1.784 18.593 1.00 0.00 H new ATOM 1340 N LYS A 83 9.606 -3.841 16.852 1.00 0.00 N ATOM 1341 CA LYS A 83 8.433 -4.461 17.456 1.00 0.00 C ATOM 1342 C LYS A 83 7.610 -3.428 18.218 1.00 0.00 C ATOM 1343 O LYS A 83 8.160 -2.550 18.883 1.00 0.00 O ATOM 1344 CB LYS A 83 8.853 -5.595 18.393 1.00 0.00 C ATOM 1345 CG LYS A 83 8.564 -6.980 17.839 1.00 0.00 C ATOM 1346 CD LYS A 83 9.758 -7.538 17.084 1.00 0.00 C ATOM 1347 CE LYS A 83 9.853 -9.048 17.227 1.00 0.00 C ATOM 1348 NZ LYS A 83 10.779 -9.445 18.324 1.00 0.00 N ATOM 0 H LYS A 83 10.493 -4.121 17.271 1.00 0.00 H new ATOM 0 HA LYS A 83 7.816 -4.874 16.658 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.920 -5.510 18.597 1.00 0.00 H new ATOM 0 HB3 LYS A 83 8.336 -5.479 19.345 1.00 0.00 H new ATOM 0 HG2 LYS A 83 8.302 -7.652 18.656 1.00 0.00 H new ATOM 0 HG3 LYS A 83 7.701 -6.934 17.175 1.00 0.00 H new ATOM 0 HD2 LYS A 83 9.677 -7.276 16.029 1.00 0.00 H new ATOM 0 HD3 LYS A 83 10.673 -7.078 17.457 1.00 0.00 H new ATOM 0 HE2 LYS A 83 8.862 -9.457 17.423 1.00 0.00 H new ATOM 0 HE3 LYS A 83 10.197 -9.481 16.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 10.816 -10.482 18.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 11.731 -9.076 18.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 10.438 -9.054 19.225 1.00 0.00 H new ATOM 1362 N GLY A 84 6.292 -3.538 18.118 1.00 0.00 N ATOM 1363 CA GLY A 84 5.417 -2.604 18.800 1.00 0.00 C ATOM 1364 C GLY A 84 5.047 -1.408 17.945 1.00 0.00 C ATOM 1365 O GLY A 84 4.472 -0.440 18.443 1.00 0.00 O ATOM 0 H GLY A 84 5.813 -4.257 17.577 1.00 0.00 H new ATOM 0 HA2 GLY A 84 4.507 -3.122 19.104 1.00 0.00 H new ATOM 0 HA3 GLY A 84 5.905 -2.256 19.711 1.00 0.00 H new ATOM 1369 N THR A 85 5.443 -1.435 16.672 1.00 0.00 N ATOM 1370 CA THR A 85 5.163 -0.330 15.763 1.00 0.00 C ATOM 1371 C THR A 85 3.841 -0.529 15.040 1.00 0.00 C ATOM 1372 O THR A 85 3.687 -1.465 14.254 1.00 0.00 O ATOM 1373 CB THR A 85 6.300 -0.185 14.747 1.00 0.00 C ATOM 1374 OG1 THR A 85 7.558 -0.132 15.397 1.00 0.00 O ATOM 1375 CG2 THR A 85 6.177 1.058 13.888 1.00 0.00 C ATOM 0 H THR A 85 5.957 -2.209 16.251 1.00 0.00 H new ATOM 0 HA THR A 85 5.089 0.582 16.355 1.00 0.00 H new ATOM 0 HB THR A 85 6.226 -1.064 14.107 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.876 -1.043 15.569 1.00 0.00 H new ATOM 0 HG21 THR A 85 7.013 1.102 13.190 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.240 1.024 13.331 1.00 0.00 H new ATOM 0 HG23 THR A 85 6.189 1.943 14.524 1.00 0.00 H new ATOM 1383 N HIS A 86 2.890 0.361 15.303 1.00 0.00 N ATOM 1384 CA HIS A 86 1.576 0.292 14.670 1.00 0.00 C ATOM 1385 C HIS A 86 1.451 1.352 13.581 1.00 0.00 C ATOM 1386 O HIS A 86 1.496 2.550 13.861 1.00 0.00 O ATOM 1387 CB HIS A 86 0.456 0.471 15.702 1.00 0.00 C ATOM 1388 CG HIS A 86 0.809 1.367 16.851 1.00 0.00 C ATOM 1389 ND1 HIS A 86 1.632 1.172 17.908 1.00 0.00 N flip ATOM 1390 CD2 HIS A 86 0.284 2.633 17.007 1.00 0.00 C flip ATOM 1391 CE1 HIS A 86 1.588 2.310 18.674 1.00 0.00 C flip ATOM 1392 NE2 HIS A 86 0.769 3.177 18.109 1.00 0.00 N flip ATOM 0 H HIS A 86 3.004 1.140 15.951 1.00 0.00 H new ATOM 0 HA HIS A 86 1.475 -0.695 14.219 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -0.423 0.874 15.200 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.179 -0.508 16.093 1.00 0.00 H new ATOM 0 HD1 HIS A 86 2.182 0.335 18.100 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -0.415 3.106 16.333 1.00 0.00 H new ATOM 0 HE1 HIS A 86 2.135 2.470 19.591 1.00 0.00 H new ATOM 1400 N PHE A 87 1.299 0.906 12.338 1.00 0.00 N ATOM 1401 CA PHE A 87 1.174 1.822 11.209 1.00 0.00 C ATOM 1402 C PHE A 87 -0.240 1.794 10.640 1.00 0.00 C ATOM 1403 O PHE A 87 -0.940 0.787 10.739 1.00 0.00 O ATOM 1404 CB PHE A 87 2.190 1.483 10.106 1.00 0.00 C ATOM 1405 CG PHE A 87 2.954 0.212 10.344 1.00 0.00 C ATOM 1406 CD1 PHE A 87 3.795 0.088 11.439 1.00 0.00 C ATOM 1407 CD2 PHE A 87 2.831 -0.856 9.472 1.00 0.00 C ATOM 1408 CE1 PHE A 87 4.496 -1.081 11.661 1.00 0.00 C ATOM 1409 CE2 PHE A 87 3.529 -2.028 9.690 1.00 0.00 C ATOM 1410 CZ PHE A 87 4.362 -2.140 10.787 1.00 0.00 C ATOM 0 H PHE A 87 1.259 -0.082 12.087 1.00 0.00 H new ATOM 0 HA PHE A 87 1.384 2.827 11.576 1.00 0.00 H new ATOM 0 HB2 PHE A 87 1.664 1.405 9.154 1.00 0.00 H new ATOM 0 HB3 PHE A 87 2.897 2.307 10.013 1.00 0.00 H new ATOM 0 HD1 PHE A 87 3.903 0.914 12.126 1.00 0.00 H new ATOM 0 HD2 PHE A 87 2.183 -0.772 8.612 1.00 0.00 H new ATOM 0 HE1 PHE A 87 5.148 -1.166 12.518 1.00 0.00 H new ATOM 0 HE2 PHE A 87 3.424 -2.856 9.004 1.00 0.00 H new ATOM 0 HZ PHE A 87 4.908 -3.056 10.960 1.00 0.00 H new ATOM 1420 N ASN A 88 -0.654 2.911 10.047 1.00 0.00 N ATOM 1421 CA ASN A 88 -1.986 3.017 9.463 1.00 0.00 C ATOM 1422 C ASN A 88 -1.911 3.309 7.970 1.00 0.00 C ATOM 1423 O ASN A 88 -1.165 4.184 7.533 1.00 0.00 O ATOM 1424 CB ASN A 88 -2.788 4.110 10.170 1.00 0.00 C ATOM 1425 CG ASN A 88 -2.828 3.919 11.674 1.00 0.00 C ATOM 1426 OD1 ASN A 88 -1.847 3.493 12.284 1.00 0.00 O ATOM 1427 ND2 ASN A 88 -3.967 4.235 12.281 1.00 0.00 N ATOM 0 H ASN A 88 -0.086 3.754 9.959 1.00 0.00 H new ATOM 0 HA ASN A 88 -2.489 2.059 9.598 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -2.351 5.082 9.942 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -3.806 4.119 9.781 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.053 4.128 13.292 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -4.755 4.585 11.736 1.00 0.00 H new ATOM 1434 N PHE A 89 -2.699 2.572 7.192 1.00 0.00 N ATOM 1435 CA PHE A 89 -2.733 2.755 5.752 1.00 0.00 C ATOM 1436 C PHE A 89 -3.840 3.730 5.363 1.00 0.00 C ATOM 1437 O PHE A 89 -5.005 3.540 5.722 1.00 0.00 O ATOM 1438 CB PHE A 89 -2.941 1.408 5.046 1.00 0.00 C ATOM 1439 CG PHE A 89 -1.981 0.343 5.502 1.00 0.00 C ATOM 1440 CD1 PHE A 89 -2.160 -0.288 6.720 1.00 0.00 C ATOM 1441 CD2 PHE A 89 -0.902 -0.023 4.715 1.00 0.00 C ATOM 1442 CE1 PHE A 89 -1.287 -1.262 7.149 1.00 0.00 C ATOM 1443 CE2 PHE A 89 -0.020 -1.001 5.137 1.00 0.00 C ATOM 1444 CZ PHE A 89 -0.213 -1.622 6.357 1.00 0.00 C ATOM 0 H PHE A 89 -3.322 1.843 7.539 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.776 3.171 5.436 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -3.961 1.067 5.222 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.833 1.549 3.971 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -2.997 -0.012 7.344 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.748 0.460 3.762 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.441 -1.744 8.103 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.818 -1.279 4.515 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.473 -2.386 6.690 1.00 0.00 H new ATOM 1454 N ALA A 90 -3.470 4.756 4.598 1.00 0.00 N ATOM 1455 CA ALA A 90 -4.419 5.758 4.143 1.00 0.00 C ATOM 1456 C ALA A 90 -4.047 6.271 2.760 1.00 0.00 C ATOM 1457 O ALA A 90 -2.928 6.067 2.291 1.00 0.00 O ATOM 1458 CB ALA A 90 -4.470 6.916 5.135 1.00 0.00 C ATOM 0 H ALA A 90 -2.513 4.911 4.281 1.00 0.00 H new ATOM 0 HA ALA A 90 -5.404 5.295 4.081 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.184 7.663 4.786 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -4.781 6.545 6.112 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -3.482 7.369 5.217 1.00 0.00 H new ATOM 1464 N ILE A 91 -4.994 6.936 2.104 1.00 0.00 N ATOM 1465 CA ILE A 91 -4.760 7.476 0.769 1.00 0.00 C ATOM 1466 C ILE A 91 -4.656 8.997 0.810 1.00 0.00 C ATOM 1467 O ILE A 91 -5.564 9.680 1.290 1.00 0.00 O ATOM 1468 CB ILE A 91 -5.880 7.075 -0.206 1.00 0.00 C ATOM 1469 CG1 ILE A 91 -6.142 5.570 -0.128 1.00 0.00 C ATOM 1470 CG2 ILE A 91 -5.516 7.485 -1.626 1.00 0.00 C ATOM 1471 CD1 ILE A 91 -7.377 5.211 0.667 1.00 0.00 C ATOM 0 H ILE A 91 -5.928 7.113 2.474 1.00 0.00 H new ATOM 0 HA ILE A 91 -3.819 7.055 0.416 1.00 0.00 H new ATOM 0 HB ILE A 91 -6.794 7.596 0.079 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -6.243 5.174 -1.139 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -5.277 5.082 0.320 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.318 7.195 -2.305 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -5.377 8.565 -1.669 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -4.592 6.989 -1.922 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -7.500 4.128 0.679 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -7.271 5.576 1.689 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -8.252 5.670 0.207 1.00 0.00 H new ATOM 1483 N VAL A 92 -3.537 9.517 0.308 1.00 0.00 N ATOM 1484 CA VAL A 92 -3.296 10.956 0.284 1.00 0.00 C ATOM 1485 C VAL A 92 -2.760 11.400 -1.077 1.00 0.00 C ATOM 1486 O VAL A 92 -2.293 10.581 -1.864 1.00 0.00 O ATOM 1487 CB VAL A 92 -2.301 11.375 1.386 1.00 0.00 C ATOM 1488 CG1 VAL A 92 -0.902 10.865 1.079 1.00 0.00 C ATOM 1489 CG2 VAL A 92 -2.300 12.884 1.562 1.00 0.00 C ATOM 0 H VAL A 92 -2.781 8.959 -0.089 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.253 11.445 0.468 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.624 10.923 2.324 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.220 11.174 1.871 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -0.917 9.777 1.017 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.565 11.278 0.128 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.592 13.159 2.344 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.009 13.359 0.625 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -3.299 13.218 1.843 1.00 0.00 H new ATOM 1499 N PHE A 93 -2.833 12.700 -1.348 1.00 0.00 N ATOM 1500 CA PHE A 93 -2.356 13.243 -2.619 1.00 0.00 C ATOM 1501 C PHE A 93 -1.751 14.632 -2.426 1.00 0.00 C ATOM 1502 O PHE A 93 -2.158 15.380 -1.538 1.00 0.00 O ATOM 1503 CB PHE A 93 -3.502 13.306 -3.636 1.00 0.00 C ATOM 1504 CG PHE A 93 -4.856 13.440 -3.001 1.00 0.00 C ATOM 1505 CD1 PHE A 93 -5.071 14.372 -2.003 1.00 0.00 C ATOM 1506 CD2 PHE A 93 -5.907 12.626 -3.392 1.00 0.00 C ATOM 1507 CE1 PHE A 93 -6.306 14.496 -1.405 1.00 0.00 C ATOM 1508 CE2 PHE A 93 -7.149 12.745 -2.797 1.00 0.00 C ATOM 1509 CZ PHE A 93 -7.349 13.683 -1.802 1.00 0.00 C ATOM 0 H PHE A 93 -3.216 13.396 -0.708 1.00 0.00 H new ATOM 0 HA PHE A 93 -1.580 12.579 -3.000 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.338 14.150 -4.306 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -3.484 12.405 -4.249 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -4.260 15.012 -1.688 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -5.754 11.892 -4.169 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -6.458 15.229 -0.626 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -7.962 12.106 -3.109 1.00 0.00 H new ATOM 0 HZ PHE A 93 -8.319 13.780 -1.336 1.00 0.00 H new ATOM 1519 N THR A 94 -0.775 14.969 -3.262 1.00 0.00 N ATOM 1520 CA THR A 94 -0.115 16.268 -3.182 1.00 0.00 C ATOM 1521 C THR A 94 -1.112 17.402 -3.409 1.00 0.00 C ATOM 1522 O THR A 94 -1.907 17.361 -4.348 1.00 0.00 O ATOM 1523 CB THR A 94 1.012 16.355 -4.212 1.00 0.00 C ATOM 1524 OG1 THR A 94 1.522 15.067 -4.506 1.00 0.00 O ATOM 1525 CG2 THR A 94 2.171 17.216 -3.759 1.00 0.00 C ATOM 0 H THR A 94 -0.423 14.362 -4.002 1.00 0.00 H new ATOM 0 HA THR A 94 0.305 16.371 -2.182 1.00 0.00 H new ATOM 0 HB THR A 94 0.564 16.813 -5.094 1.00 0.00 H new ATOM 0 HG1 THR A 94 2.241 15.143 -5.168 1.00 0.00 H new ATOM 0 HG21 THR A 94 2.935 17.235 -4.536 1.00 0.00 H new ATOM 0 HG22 THR A 94 1.819 18.230 -3.571 1.00 0.00 H new ATOM 0 HG23 THR A 94 2.595 16.804 -2.843 1.00 0.00 H new ATOM 1533 N ASP A 95 -1.060 18.411 -2.547 1.00 0.00 N ATOM 1534 CA ASP A 95 -1.959 19.557 -2.656 1.00 0.00 C ATOM 1535 C ASP A 95 -1.214 20.777 -3.186 1.00 0.00 C ATOM 1536 O ASP A 95 0.015 20.782 -3.259 1.00 0.00 O ATOM 1537 CB ASP A 95 -2.579 19.877 -1.295 1.00 0.00 C ATOM 1538 CG ASP A 95 -3.846 19.082 -1.036 1.00 0.00 C ATOM 1539 OD1 ASP A 95 -3.740 17.865 -0.776 1.00 0.00 O ATOM 1540 OD2 ASP A 95 -4.942 19.677 -1.096 1.00 0.00 O ATOM 0 H ASP A 95 -0.406 18.460 -1.766 1.00 0.00 H new ATOM 0 HA ASP A 95 -2.753 19.301 -3.357 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -1.854 19.666 -0.509 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -2.804 20.942 -1.243 1.00 0.00 H new ATOM 1545 N VAL A 96 -1.962 21.812 -3.561 1.00 0.00 N ATOM 1546 CA VAL A 96 -1.362 23.034 -4.086 1.00 0.00 C ATOM 1547 C VAL A 96 -2.072 24.281 -3.558 1.00 0.00 C ATOM 1548 O VAL A 96 -1.628 24.886 -2.581 1.00 0.00 O ATOM 1549 CB VAL A 96 -1.363 23.056 -5.631 1.00 0.00 C ATOM 1550 CG1 VAL A 96 -0.052 22.512 -6.174 1.00 0.00 C ATOM 1551 CG2 VAL A 96 -2.543 22.271 -6.190 1.00 0.00 C ATOM 0 H VAL A 96 -2.981 21.828 -3.511 1.00 0.00 H new ATOM 0 HA VAL A 96 -0.329 23.043 -3.738 1.00 0.00 H new ATOM 0 HB VAL A 96 -1.467 24.092 -5.953 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -0.072 22.536 -7.264 1.00 0.00 H new ATOM 0 HG12 VAL A 96 0.774 23.125 -5.813 1.00 0.00 H new ATOM 0 HG13 VAL A 96 0.084 21.485 -5.836 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -2.518 22.304 -7.279 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -2.482 21.235 -5.856 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.474 22.712 -5.835 1.00 0.00 H new ATOM 1561 N LYS A 97 -3.168 24.668 -4.206 1.00 0.00 N ATOM 1562 CA LYS A 97 -3.922 25.847 -3.794 1.00 0.00 C ATOM 1563 C LYS A 97 -5.304 25.471 -3.266 1.00 0.00 C ATOM 1564 O LYS A 97 -5.779 26.043 -2.286 1.00 0.00 O ATOM 1565 CB LYS A 97 -4.057 26.829 -4.961 1.00 0.00 C ATOM 1566 CG LYS A 97 -4.451 26.172 -6.275 1.00 0.00 C ATOM 1567 CD LYS A 97 -3.312 26.202 -7.282 1.00 0.00 C ATOM 1568 CE LYS A 97 -3.588 25.287 -8.465 1.00 0.00 C ATOM 1569 NZ LYS A 97 -3.841 26.057 -9.714 1.00 0.00 N ATOM 0 H LYS A 97 -3.552 24.183 -5.017 1.00 0.00 H new ATOM 0 HA LYS A 97 -3.370 26.325 -2.985 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -4.802 27.583 -4.705 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -3.109 27.350 -5.096 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -4.747 25.139 -6.091 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -5.319 26.683 -6.692 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -3.166 27.222 -7.637 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -2.386 25.898 -6.794 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -2.738 24.621 -8.615 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -4.451 24.659 -8.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -4.025 25.398 -10.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -4.667 26.674 -9.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -3.008 26.638 -9.939 1.00 0.00 H new ATOM 1583 N ARG A 98 -5.947 24.508 -3.922 1.00 0.00 N ATOM 1584 CA ARG A 98 -7.277 24.065 -3.516 1.00 0.00 C ATOM 1585 C ARG A 98 -7.773 22.936 -4.418 1.00 0.00 C ATOM 1586 O ARG A 98 -8.724 23.111 -5.181 1.00 0.00 O ATOM 1587 CB ARG A 98 -8.261 25.236 -3.554 1.00 0.00 C ATOM 1588 CG ARG A 98 -8.238 26.005 -4.866 1.00 0.00 C ATOM 1589 CD ARG A 98 -9.484 26.859 -5.032 1.00 0.00 C ATOM 1590 NE ARG A 98 -9.619 27.371 -6.396 1.00 0.00 N ATOM 1591 CZ ARG A 98 -8.953 28.425 -6.861 1.00 0.00 C ATOM 1592 NH1 ARG A 98 -8.105 29.082 -6.079 1.00 0.00 N ATOM 1593 NH2 ARG A 98 -9.135 28.826 -8.111 1.00 0.00 N ATOM 0 H ARG A 98 -5.569 24.021 -4.735 1.00 0.00 H new ATOM 0 HA ARG A 98 -7.212 23.688 -2.495 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -9.269 24.859 -3.380 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -8.031 25.920 -2.737 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -7.353 26.640 -4.901 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -8.162 25.305 -5.698 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -10.365 26.269 -4.777 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -9.447 27.695 -4.333 1.00 0.00 H new ATOM 0 HE ARG A 98 -10.261 26.892 -7.027 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -7.961 28.780 -5.116 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -7.598 29.889 -6.442 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -9.786 28.327 -8.717 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -8.624 29.634 -8.467 1.00 0.00 H new ATOM 1607 N PRO A 99 -7.128 21.760 -4.347 1.00 0.00 N ATOM 1608 CA PRO A 99 -7.502 20.604 -5.162 1.00 0.00 C ATOM 1609 C PRO A 99 -8.712 19.854 -4.607 1.00 0.00 C ATOM 1610 O PRO A 99 -9.290 19.008 -5.290 1.00 0.00 O ATOM 1611 CB PRO A 99 -6.255 19.726 -5.094 1.00 0.00 C ATOM 1612 CG PRO A 99 -5.662 20.023 -3.759 1.00 0.00 C ATOM 1613 CD PRO A 99 -5.976 21.468 -3.470 1.00 0.00 C ATOM 0 HA PRO A 99 -7.795 20.893 -6.171 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -6.507 18.670 -5.190 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -5.559 19.962 -5.899 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -6.084 19.373 -2.993 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -4.585 19.852 -3.765 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -6.224 21.621 -2.420 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -5.128 22.115 -3.695 1.00 0.00 H new ATOM 1621 N GLY A 100 -9.087 20.160 -3.368 1.00 0.00 N ATOM 1622 CA GLY A 100 -10.222 19.491 -2.756 1.00 0.00 C ATOM 1623 C GLY A 100 -9.796 18.338 -1.872 1.00 0.00 C ATOM 1624 O GLY A 100 -10.457 17.300 -1.833 1.00 0.00 O ATOM 0 H GLY A 100 -8.628 20.855 -2.780 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.790 20.209 -2.165 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.888 19.122 -3.536 1.00 0.00 H new ATOM 1628 N TYR A 101 -8.676 18.519 -1.172 1.00 0.00 N ATOM 1629 CA TYR A 101 -8.124 17.495 -0.283 1.00 0.00 C ATOM 1630 C TYR A 101 -9.214 16.669 0.400 1.00 0.00 C ATOM 1631 O TYR A 101 -10.251 17.195 0.805 1.00 0.00 O ATOM 1632 CB TYR A 101 -7.224 18.141 0.772 1.00 0.00 C ATOM 1633 CG TYR A 101 -7.928 19.175 1.624 1.00 0.00 C ATOM 1634 CD1 TYR A 101 -8.149 20.461 1.146 1.00 0.00 C ATOM 1635 CD2 TYR A 101 -8.369 18.865 2.904 1.00 0.00 C ATOM 1636 CE1 TYR A 101 -8.788 21.408 1.922 1.00 0.00 C ATOM 1637 CE2 TYR A 101 -9.011 19.807 3.685 1.00 0.00 C ATOM 1638 CZ TYR A 101 -9.217 21.077 3.189 1.00 0.00 C ATOM 1639 OH TYR A 101 -9.856 22.018 3.964 1.00 0.00 O ATOM 0 H TYR A 101 -8.126 19.378 -1.205 1.00 0.00 H new ATOM 0 HA TYR A 101 -7.538 16.816 -0.902 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -6.822 17.362 1.420 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -6.375 18.610 0.274 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -7.816 20.724 0.153 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -8.208 17.871 3.295 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -8.951 22.404 1.537 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -9.349 19.550 4.678 1.00 0.00 H new ATOM 0 HH TYR A 101 -10.094 21.623 4.829 1.00 0.00 H new ATOM 1649 N ARG A 102 -8.959 15.371 0.521 1.00 0.00 N ATOM 1650 CA ARG A 102 -9.893 14.447 1.149 1.00 0.00 C ATOM 1651 C ARG A 102 -9.196 13.122 1.452 1.00 0.00 C ATOM 1652 O ARG A 102 -9.641 12.057 1.025 1.00 0.00 O ATOM 1653 CB ARG A 102 -11.108 14.219 0.242 1.00 0.00 C ATOM 1654 CG ARG A 102 -12.359 14.943 0.712 1.00 0.00 C ATOM 1655 CD ARG A 102 -13.041 14.196 1.846 1.00 0.00 C ATOM 1656 NE ARG A 102 -14.280 14.846 2.266 1.00 0.00 N ATOM 1657 CZ ARG A 102 -14.322 15.959 2.997 1.00 0.00 C ATOM 1658 NH1 ARG A 102 -13.198 16.544 3.391 1.00 0.00 N ATOM 1659 NH2 ARG A 102 -15.491 16.485 3.335 1.00 0.00 N ATOM 0 H ARG A 102 -8.101 14.932 0.187 1.00 0.00 H new ATOM 0 HA ARG A 102 -10.240 14.881 2.087 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -10.865 14.549 -0.768 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.315 13.150 0.187 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -12.097 15.948 1.043 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -13.052 15.053 -0.122 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -13.257 13.176 1.529 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -12.361 14.129 2.696 1.00 0.00 H new ATOM 0 HE ARG A 102 -15.164 14.423 1.983 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -12.297 16.142 3.134 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -13.235 17.396 3.951 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -16.357 16.038 3.035 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -15.524 17.337 3.895 1.00 0.00 H new ATOM 1673 N VAL A 103 -8.094 13.204 2.190 1.00 0.00 N ATOM 1674 CA VAL A 103 -7.320 12.020 2.556 1.00 0.00 C ATOM 1675 C VAL A 103 -7.961 11.295 3.735 1.00 0.00 C ATOM 1676 O VAL A 103 -8.537 11.924 4.623 1.00 0.00 O ATOM 1677 CB VAL A 103 -5.855 12.388 2.907 1.00 0.00 C ATOM 1678 CG1 VAL A 103 -5.802 13.673 3.719 1.00 0.00 C ATOM 1679 CG2 VAL A 103 -5.162 11.254 3.654 1.00 0.00 C ATOM 0 H VAL A 103 -7.715 14.080 2.548 1.00 0.00 H new ATOM 0 HA VAL A 103 -7.314 11.358 1.690 1.00 0.00 H new ATOM 0 HB VAL A 103 -5.320 12.548 1.971 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -4.765 13.912 3.954 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.240 14.487 3.141 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -6.363 13.542 4.644 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.137 11.544 3.885 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.698 11.047 4.580 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.155 10.359 3.031 1.00 0.00 H new ATOM 1689 N LYS A 104 -7.859 9.970 3.734 1.00 0.00 N ATOM 1690 CA LYS A 104 -8.436 9.167 4.808 1.00 0.00 C ATOM 1691 C LYS A 104 -7.775 7.794 4.896 1.00 0.00 C ATOM 1692 O LYS A 104 -7.158 7.327 3.937 1.00 0.00 O ATOM 1693 CB LYS A 104 -9.943 9.007 4.598 1.00 0.00 C ATOM 1694 CG LYS A 104 -10.768 9.347 5.830 1.00 0.00 C ATOM 1695 CD LYS A 104 -10.868 10.851 6.035 1.00 0.00 C ATOM 1696 CE LYS A 104 -11.821 11.198 7.168 1.00 0.00 C ATOM 1697 NZ LYS A 104 -11.097 11.669 8.380 1.00 0.00 N ATOM 0 H LYS A 104 -7.386 9.432 3.008 1.00 0.00 H new ATOM 0 HA LYS A 104 -8.255 9.690 5.747 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.257 9.647 3.773 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -10.153 7.979 4.302 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -11.768 8.925 5.728 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -10.317 8.888 6.710 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -9.880 11.256 6.253 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -11.210 11.323 5.114 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -12.513 11.972 6.836 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -12.419 10.322 7.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -11.783 11.895 9.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -10.455 10.922 8.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -10.546 12.520 8.147 1.00 0.00 H new ATOM 1711 N GLU A 105 -7.911 7.155 6.052 1.00 0.00 N ATOM 1712 CA GLU A 105 -7.335 5.833 6.279 1.00 0.00 C ATOM 1713 C GLU A 105 -8.387 4.746 6.077 1.00 0.00 C ATOM 1714 O GLU A 105 -9.560 4.936 6.400 1.00 0.00 O ATOM 1715 CB GLU A 105 -6.736 5.755 7.688 1.00 0.00 C ATOM 1716 CG GLU A 105 -6.244 4.370 8.083 1.00 0.00 C ATOM 1717 CD GLU A 105 -6.441 4.084 9.559 1.00 0.00 C ATOM 1718 OE1 GLU A 105 -5.845 4.802 10.388 1.00 0.00 O ATOM 1719 OE2 GLU A 105 -7.192 3.139 9.884 1.00 0.00 O ATOM 0 H GLU A 105 -8.418 7.533 6.852 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.538 5.669 5.553 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.904 6.456 7.756 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.487 6.080 8.408 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -6.773 3.619 7.497 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -5.186 4.280 7.837 1.00 0.00 H new ATOM 1726 N ILE A 106 -7.959 3.609 5.537 1.00 0.00 N ATOM 1727 CA ILE A 106 -8.864 2.493 5.282 1.00 0.00 C ATOM 1728 C ILE A 106 -8.571 1.305 6.201 1.00 0.00 C ATOM 1729 O ILE A 106 -9.419 0.436 6.388 1.00 0.00 O ATOM 1730 CB ILE A 106 -8.790 2.021 3.817 1.00 0.00 C ATOM 1731 CG1 ILE A 106 -7.343 2.014 3.320 1.00 0.00 C ATOM 1732 CG2 ILE A 106 -9.656 2.909 2.933 1.00 0.00 C ATOM 1733 CD1 ILE A 106 -6.455 1.029 4.052 1.00 0.00 C ATOM 0 H ILE A 106 -6.991 3.436 5.267 1.00 0.00 H new ATOM 0 HA ILE A 106 -9.868 2.864 5.487 1.00 0.00 H new ATOM 0 HB ILE A 106 -9.170 1.001 3.765 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -7.334 1.777 2.256 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.926 3.015 3.427 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -9.595 2.565 1.901 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.691 2.860 3.271 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -9.303 3.938 2.994 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.444 1.079 3.647 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -6.433 1.278 5.113 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -6.848 0.020 3.924 1.00 0.00 H new ATOM 1745 N GLY A 107 -7.371 1.276 6.765 1.00 0.00 N ATOM 1746 CA GLY A 107 -7.001 0.184 7.654 1.00 0.00 C ATOM 1747 C GLY A 107 -5.583 0.319 8.154 1.00 0.00 C ATOM 1748 O GLY A 107 -4.716 0.816 7.440 1.00 0.00 O ATOM 0 H GLY A 107 -6.649 1.983 6.626 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.684 0.160 8.503 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.112 -0.765 7.129 1.00 0.00 H new ATOM 1752 N SER A 108 -5.334 -0.114 9.396 1.00 0.00 N ATOM 1753 CA SER A 108 -4.011 -0.024 9.987 1.00 0.00 C ATOM 1754 C SER A 108 -3.555 -1.377 10.534 1.00 0.00 C ATOM 1755 O SER A 108 -4.347 -2.130 11.097 1.00 0.00 O ATOM 1756 CB SER A 108 -4.025 1.003 11.120 1.00 0.00 C ATOM 1757 OG SER A 108 -4.747 2.165 10.742 1.00 0.00 O ATOM 0 H SER A 108 -6.039 -0.530 10.005 1.00 0.00 H new ATOM 0 HA SER A 108 -3.312 0.285 9.210 1.00 0.00 H new ATOM 0 HB2 SER A 108 -4.476 0.563 12.009 1.00 0.00 H new ATOM 0 HB3 SER A 108 -3.003 1.275 11.382 1.00 0.00 H new ATOM 0 HG SER A 108 -5.694 1.940 10.629 1.00 0.00 H new ATOM 1763 N THR A 109 -2.268 -1.671 10.370 1.00 0.00 N ATOM 1764 CA THR A 109 -1.705 -2.927 10.851 1.00 0.00 C ATOM 1765 C THR A 109 -0.609 -2.664 11.876 1.00 0.00 C ATOM 1766 O THR A 109 -0.433 -1.535 12.335 1.00 0.00 O ATOM 1767 CB THR A 109 -1.148 -3.752 9.689 1.00 0.00 C ATOM 1768 OG1 THR A 109 -0.022 -3.117 9.105 1.00 0.00 O ATOM 1769 CG2 THR A 109 -2.160 -3.996 8.593 1.00 0.00 C ATOM 0 H THR A 109 -1.597 -1.057 9.908 1.00 0.00 H new ATOM 0 HA THR A 109 -2.504 -3.494 11.328 1.00 0.00 H new ATOM 0 HB THR A 109 -0.870 -4.710 10.127 1.00 0.00 H new ATOM 0 HG1 THR A 109 0.346 -3.688 8.398 1.00 0.00 H new ATOM 0 HG21 THR A 109 -1.702 -4.586 7.800 1.00 0.00 H new ATOM 0 HG22 THR A 109 -3.014 -4.537 9.000 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.495 -3.041 8.188 1.00 0.00 H new ATOM 1777 N MET A 110 0.124 -3.711 12.236 1.00 0.00 N ATOM 1778 CA MET A 110 1.200 -3.589 13.209 1.00 0.00 C ATOM 1779 C MET A 110 2.434 -4.369 12.767 1.00 0.00 C ATOM 1780 O MET A 110 2.350 -5.258 11.919 1.00 0.00 O ATOM 1781 CB MET A 110 0.728 -4.089 14.572 1.00 0.00 C ATOM 1782 CG MET A 110 0.049 -3.020 15.413 1.00 0.00 C ATOM 1783 SD MET A 110 0.745 -2.899 17.071 1.00 0.00 S ATOM 1784 CE MET A 110 2.491 -2.801 16.691 1.00 0.00 C ATOM 0 H MET A 110 -0.008 -4.653 11.868 1.00 0.00 H new ATOM 0 HA MET A 110 1.473 -2.536 13.284 1.00 0.00 H new ATOM 0 HB2 MET A 110 0.035 -4.918 14.425 1.00 0.00 H new ATOM 0 HB3 MET A 110 1.584 -4.482 15.121 1.00 0.00 H new ATOM 0 HG2 MET A 110 0.141 -2.056 14.913 1.00 0.00 H new ATOM 0 HG3 MET A 110 -1.016 -3.241 15.485 1.00 0.00 H new ATOM 0 HE1 MET A 110 3.029 -3.563 17.254 1.00 0.00 H new ATOM 0 HE2 MET A 110 2.641 -2.965 15.624 1.00 0.00 H new ATOM 0 HE3 MET A 110 2.868 -1.815 16.963 1.00 0.00 H new ATOM 1794 N SER A 111 3.582 -4.027 13.347 1.00 0.00 N ATOM 1795 CA SER A 111 4.837 -4.689 13.015 1.00 0.00 C ATOM 1796 C SER A 111 4.893 -6.096 13.601 1.00 0.00 C ATOM 1797 O SER A 111 5.303 -6.286 14.747 1.00 0.00 O ATOM 1798 CB SER A 111 6.020 -3.867 13.529 1.00 0.00 C ATOM 1799 OG SER A 111 6.019 -3.800 14.945 1.00 0.00 O ATOM 0 H SER A 111 3.667 -3.293 14.051 1.00 0.00 H new ATOM 0 HA SER A 111 4.895 -4.768 11.929 1.00 0.00 H new ATOM 0 HB2 SER A 111 6.953 -4.312 13.184 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.974 -2.860 13.114 1.00 0.00 H new ATOM 0 HG SER A 111 5.918 -4.702 15.315 1.00 0.00 H new ATOM 1805 N GLY A 112 4.487 -7.082 12.807 1.00 0.00 N ATOM 1806 CA GLY A 112 4.507 -8.459 13.264 1.00 0.00 C ATOM 1807 C GLY A 112 3.286 -8.831 14.085 1.00 0.00 C ATOM 1808 O GLY A 112 3.329 -9.773 14.877 1.00 0.00 O ATOM 0 H GLY A 112 4.145 -6.952 11.855 1.00 0.00 H new ATOM 0 HA2 GLY A 112 4.573 -9.121 12.401 1.00 0.00 H new ATOM 0 HA3 GLY A 112 5.404 -8.624 13.862 1.00 0.00 H new ATOM 1812 N ARG A 113 2.194 -8.097 13.896 1.00 0.00 N ATOM 1813 CA ARG A 113 0.962 -8.366 14.627 1.00 0.00 C ATOM 1814 C ARG A 113 -0.235 -8.401 13.680 1.00 0.00 C ATOM 1815 O ARG A 113 -0.289 -7.655 12.702 1.00 0.00 O ATOM 1816 CB ARG A 113 0.745 -7.312 15.712 1.00 0.00 C ATOM 1817 CG ARG A 113 1.583 -7.547 16.961 1.00 0.00 C ATOM 1818 CD ARG A 113 0.777 -7.321 18.231 1.00 0.00 C ATOM 1819 NE ARG A 113 0.835 -8.474 19.126 1.00 0.00 N ATOM 1820 CZ ARG A 113 0.115 -9.580 18.956 1.00 0.00 C ATOM 1821 NH1 ARG A 113 -0.721 -9.687 17.931 1.00 0.00 N ATOM 1822 NH2 ARG A 113 0.232 -10.585 19.815 1.00 0.00 N ATOM 0 H ARG A 113 2.138 -7.314 13.245 1.00 0.00 H new ATOM 0 HA ARG A 113 1.055 -9.344 15.100 1.00 0.00 H new ATOM 0 HB2 ARG A 113 0.981 -6.329 15.305 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -0.309 -7.298 15.988 1.00 0.00 H new ATOM 0 HG2 ARG A 113 1.971 -8.566 16.953 1.00 0.00 H new ATOM 0 HG3 ARG A 113 2.444 -6.878 16.953 1.00 0.00 H new ATOM 0 HD2 ARG A 113 1.156 -6.440 18.749 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -0.261 -7.116 17.970 1.00 0.00 H new ATOM 0 HE ARG A 113 1.464 -8.429 19.928 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -0.815 -8.918 17.267 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -1.270 -10.538 17.807 1.00 0.00 H new ATOM 0 HH21 ARG A 113 0.873 -10.509 20.605 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -0.319 -11.433 19.686 1.00 0.00 H new ATOM 1836 N LYS A 114 -1.188 -9.281 13.972 1.00 0.00 N ATOM 1837 CA LYS A 114 -2.378 -9.423 13.143 1.00 0.00 C ATOM 1838 C LYS A 114 -3.488 -8.479 13.598 1.00 0.00 C ATOM 1839 O LYS A 114 -4.186 -8.751 14.577 1.00 0.00 O ATOM 1840 CB LYS A 114 -2.878 -10.869 13.179 1.00 0.00 C ATOM 1841 CG LYS A 114 -4.101 -11.115 12.309 1.00 0.00 C ATOM 1842 CD LYS A 114 -3.710 -11.541 10.905 1.00 0.00 C ATOM 1843 CE LYS A 114 -4.852 -11.335 9.922 1.00 0.00 C ATOM 1844 NZ LYS A 114 -5.934 -12.340 10.109 1.00 0.00 N ATOM 0 H LYS A 114 -1.158 -9.906 14.777 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.106 -9.160 12.121 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.074 -11.530 12.856 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.116 -11.136 14.209 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -4.723 -11.886 12.764 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -4.703 -10.207 12.260 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -2.841 -10.970 10.579 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -3.418 -12.591 10.910 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -5.262 -10.333 10.047 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -4.470 -11.398 8.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -6.785 -12.033 9.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -5.621 -13.260 9.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -6.153 -12.430 11.122 1.00 0.00 H new ATOM 1858 N GLY A 115 -3.651 -7.375 12.878 1.00 0.00 N ATOM 1859 CA GLY A 115 -4.684 -6.411 13.215 1.00 0.00 C ATOM 1860 C GLY A 115 -6.060 -6.874 12.794 1.00 0.00 C ATOM 1861 O GLY A 115 -6.257 -8.045 12.456 1.00 0.00 O ATOM 0 H GLY A 115 -3.086 -7.129 12.065 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -4.676 -6.234 14.291 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -4.460 -5.459 12.734 1.00 0.00 H new ATOM 1865 N THR A 116 -7.024 -5.950 12.748 1.00 0.00 N ATOM 1866 CA THR A 116 -8.376 -6.282 12.333 1.00 0.00 C ATOM 1867 C THR A 116 -8.528 -6.146 10.815 1.00 0.00 C ATOM 1868 O THR A 116 -9.245 -6.921 10.179 1.00 0.00 O ATOM 1869 CB THR A 116 -9.385 -5.362 13.031 1.00 0.00 C ATOM 1870 OG1 THR A 116 -8.933 -4.020 13.020 1.00 0.00 O ATOM 1871 CG2 THR A 116 -9.644 -5.747 14.470 1.00 0.00 C ATOM 0 H THR A 116 -6.887 -4.970 12.994 1.00 0.00 H new ATOM 0 HA THR A 116 -8.572 -7.316 12.615 1.00 0.00 H new ATOM 0 HB THR A 116 -10.312 -5.469 12.468 1.00 0.00 H new ATOM 0 HG1 THR A 116 -9.592 -3.449 13.468 1.00 0.00 H new ATOM 0 HG21 THR A 116 -10.366 -5.057 14.907 1.00 0.00 H new ATOM 0 HG22 THR A 116 -10.041 -6.761 14.509 1.00 0.00 H new ATOM 0 HG23 THR A 116 -8.712 -5.700 15.033 1.00 0.00 H new ATOM 1879 N ASP A 117 -7.849 -5.154 10.248 1.00 0.00 N ATOM 1880 CA ASP A 117 -7.903 -4.908 8.809 1.00 0.00 C ATOM 1881 C ASP A 117 -6.881 -5.764 8.064 1.00 0.00 C ATOM 1882 O ASP A 117 -6.909 -5.842 6.838 1.00 0.00 O ATOM 1883 CB ASP A 117 -7.653 -3.429 8.517 1.00 0.00 C ATOM 1884 CG ASP A 117 -8.699 -2.528 9.146 1.00 0.00 C ATOM 1885 OD1 ASP A 117 -9.797 -2.401 8.566 1.00 0.00 O ATOM 1886 OD2 ASP A 117 -8.419 -1.952 10.217 1.00 0.00 O ATOM 0 H ASP A 117 -7.253 -4.506 10.763 1.00 0.00 H new ATOM 0 HA ASP A 117 -8.898 -5.181 8.459 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.667 -3.150 8.889 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -7.643 -3.271 7.438 1.00 0.00 H new ATOM 1891 N ASP A 118 -5.980 -6.396 8.809 1.00 0.00 N ATOM 1892 CA ASP A 118 -4.945 -7.244 8.217 1.00 0.00 C ATOM 1893 C ASP A 118 -5.529 -8.222 7.197 1.00 0.00 C ATOM 1894 O ASP A 118 -4.847 -8.632 6.258 1.00 0.00 O ATOM 1895 CB ASP A 118 -4.209 -8.016 9.316 1.00 0.00 C ATOM 1896 CG ASP A 118 -2.824 -7.460 9.585 1.00 0.00 C ATOM 1897 OD1 ASP A 118 -2.719 -6.454 10.318 1.00 0.00 O ATOM 1898 OD2 ASP A 118 -1.844 -8.032 9.064 1.00 0.00 O ATOM 0 H ASP A 118 -5.944 -6.338 9.827 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.244 -6.594 7.693 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.795 -7.983 10.234 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -4.127 -9.064 9.028 1.00 0.00 H new ATOM 1903 N SER A 119 -6.800 -8.600 7.386 1.00 0.00 N ATOM 1904 CA SER A 119 -7.456 -9.533 6.489 1.00 0.00 C ATOM 1905 C SER A 119 -8.035 -8.826 5.262 1.00 0.00 C ATOM 1906 O SER A 119 -8.413 -9.474 4.287 1.00 0.00 O ATOM 1907 CB SER A 119 -8.568 -10.279 7.230 1.00 0.00 C ATOM 1908 OG SER A 119 -8.075 -10.888 8.410 1.00 0.00 O ATOM 0 H SER A 119 -7.385 -8.269 8.153 1.00 0.00 H new ATOM 0 HA SER A 119 -6.705 -10.243 6.144 1.00 0.00 H new ATOM 0 HB2 SER A 119 -9.370 -9.585 7.483 1.00 0.00 H new ATOM 0 HB3 SER A 119 -8.998 -11.039 6.577 1.00 0.00 H new ATOM 0 HG SER A 119 -8.805 -11.357 8.866 1.00 0.00 H new ATOM 1914 N MET A 120 -8.103 -7.499 5.315 1.00 0.00 N ATOM 1915 CA MET A 120 -8.623 -6.716 4.201 1.00 0.00 C ATOM 1916 C MET A 120 -7.557 -6.534 3.124 1.00 0.00 C ATOM 1917 O MET A 120 -6.372 -6.723 3.382 1.00 0.00 O ATOM 1918 CB MET A 120 -9.107 -5.353 4.697 1.00 0.00 C ATOM 1919 CG MET A 120 -10.505 -4.993 4.219 1.00 0.00 C ATOM 1920 SD MET A 120 -11.264 -3.695 5.213 1.00 0.00 S ATOM 1921 CE MET A 120 -9.960 -2.466 5.214 1.00 0.00 C ATOM 0 H MET A 120 -7.804 -6.945 6.117 1.00 0.00 H new ATOM 0 HA MET A 120 -9.464 -7.255 3.765 1.00 0.00 H new ATOM 0 HB2 MET A 120 -9.092 -5.346 5.787 1.00 0.00 H new ATOM 0 HB3 MET A 120 -8.409 -4.585 4.363 1.00 0.00 H new ATOM 0 HG2 MET A 120 -10.457 -4.669 3.179 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.135 -5.882 4.247 1.00 0.00 H new ATOM 0 HE1 MET A 120 -9.523 -2.400 6.210 1.00 0.00 H new ATOM 0 HE2 MET A 120 -9.189 -2.753 4.498 1.00 0.00 H new ATOM 0 HE3 MET A 120 -10.373 -1.497 4.934 1.00 0.00 H new ATOM 1931 N THR A 121 -7.983 -6.169 1.909 1.00 0.00 N ATOM 1932 CA THR A 121 -7.056 -5.955 0.815 1.00 0.00 C ATOM 1933 C THR A 121 -7.037 -4.493 0.388 1.00 0.00 C ATOM 1934 O THR A 121 -7.968 -3.739 0.670 1.00 0.00 O ATOM 1935 CB THR A 121 -7.432 -6.845 -0.370 1.00 0.00 C ATOM 1936 OG1 THR A 121 -8.839 -6.966 -0.478 1.00 0.00 O ATOM 1937 CG2 THR A 121 -6.857 -8.243 -0.273 1.00 0.00 C ATOM 0 H THR A 121 -8.963 -6.018 1.669 1.00 0.00 H new ATOM 0 HA THR A 121 -6.056 -6.219 1.160 1.00 0.00 H new ATOM 0 HB THR A 121 -7.009 -6.355 -1.247 1.00 0.00 H new ATOM 0 HG1 THR A 121 -9.060 -7.538 -1.243 1.00 0.00 H new ATOM 0 HG21 THR A 121 -7.161 -8.823 -1.144 1.00 0.00 H new ATOM 0 HG22 THR A 121 -5.769 -8.187 -0.236 1.00 0.00 H new ATOM 0 HG23 THR A 121 -7.226 -8.726 0.631 1.00 0.00 H new ATOM 1945 N LEU A 122 -5.964 -4.090 -0.294 1.00 0.00 N ATOM 1946 CA LEU A 122 -5.823 -2.715 -0.756 1.00 0.00 C ATOM 1947 C LEU A 122 -6.864 -2.383 -1.821 1.00 0.00 C ATOM 1948 O LEU A 122 -7.546 -1.362 -1.739 1.00 0.00 O ATOM 1949 CB LEU A 122 -4.413 -2.492 -1.313 1.00 0.00 C ATOM 1950 CG LEU A 122 -3.545 -1.511 -0.521 1.00 0.00 C ATOM 1951 CD1 LEU A 122 -2.148 -1.429 -1.119 1.00 0.00 C ATOM 1952 CD2 LEU A 122 -4.194 -0.137 -0.485 1.00 0.00 C ATOM 0 H LEU A 122 -5.182 -4.698 -0.537 1.00 0.00 H new ATOM 0 HA LEU A 122 -5.984 -2.052 0.094 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -3.900 -3.453 -1.355 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.498 -2.131 -2.338 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.457 -1.877 0.502 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.546 -0.727 -0.542 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.682 -2.414 -1.092 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.214 -1.087 -2.152 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.564 0.548 0.082 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -4.312 0.236 -1.502 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.172 -0.209 -0.009 1.00 0.00 H new ATOM 1964 N GLN A 123 -6.976 -3.250 -2.824 1.00 0.00 N ATOM 1965 CA GLN A 123 -7.931 -3.050 -3.911 1.00 0.00 C ATOM 1966 C GLN A 123 -9.334 -2.769 -3.377 1.00 0.00 C ATOM 1967 O GLN A 123 -10.093 -2.007 -3.976 1.00 0.00 O ATOM 1968 CB GLN A 123 -7.959 -4.278 -4.823 1.00 0.00 C ATOM 1969 CG GLN A 123 -8.313 -5.566 -4.099 1.00 0.00 C ATOM 1970 CD GLN A 123 -8.837 -6.637 -5.037 1.00 0.00 C ATOM 1971 OE1 GLN A 123 -8.852 -6.458 -6.254 1.00 0.00 O ATOM 1972 NE2 GLN A 123 -9.268 -7.759 -4.472 1.00 0.00 N ATOM 0 H GLN A 123 -6.417 -4.099 -2.907 1.00 0.00 H new ATOM 0 HA GLN A 123 -7.605 -2.181 -4.483 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -8.681 -4.110 -5.622 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -6.983 -4.392 -5.294 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -7.431 -5.942 -3.581 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -9.064 -5.356 -3.338 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -9.237 -7.864 -3.458 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -9.630 -8.516 -5.052 1.00 0.00 H new ATOM 1981 N SER A 124 -9.670 -3.388 -2.252 1.00 0.00 N ATOM 1982 CA SER A 124 -10.983 -3.202 -1.644 1.00 0.00 C ATOM 1983 C SER A 124 -11.158 -1.776 -1.128 1.00 0.00 C ATOM 1984 O SER A 124 -12.280 -1.326 -0.895 1.00 0.00 O ATOM 1985 CB SER A 124 -11.185 -4.199 -0.501 1.00 0.00 C ATOM 1986 OG SER A 124 -12.524 -4.180 -0.037 1.00 0.00 O ATOM 0 H SER A 124 -9.054 -4.022 -1.743 1.00 0.00 H new ATOM 0 HA SER A 124 -11.735 -3.380 -2.413 1.00 0.00 H new ATOM 0 HB2 SER A 124 -10.929 -5.203 -0.840 1.00 0.00 H new ATOM 0 HB3 SER A 124 -10.509 -3.958 0.320 1.00 0.00 H new ATOM 0 HG SER A 124 -12.875 -3.267 -0.089 1.00 0.00 H new ATOM 1992 N GLN A 125 -10.048 -1.068 -0.951 1.00 0.00 N ATOM 1993 CA GLN A 125 -10.091 0.306 -0.464 1.00 0.00 C ATOM 1994 C GLN A 125 -10.125 1.301 -1.623 1.00 0.00 C ATOM 1995 O GLN A 125 -9.847 2.487 -1.442 1.00 0.00 O ATOM 1996 CB GLN A 125 -8.881 0.586 0.432 1.00 0.00 C ATOM 1997 CG GLN A 125 -8.616 -0.507 1.456 1.00 0.00 C ATOM 1998 CD GLN A 125 -9.872 -0.942 2.188 1.00 0.00 C ATOM 1999 OE1 GLN A 125 -10.692 -0.116 2.585 1.00 0.00 O ATOM 2000 NE2 GLN A 125 -10.027 -2.249 2.368 1.00 0.00 N ATOM 0 H GLN A 125 -9.109 -1.422 -1.137 1.00 0.00 H new ATOM 0 HA GLN A 125 -11.005 0.430 0.117 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -7.997 0.708 -0.194 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -9.036 1.531 0.953 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -8.176 -1.369 0.955 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -7.884 -0.151 2.180 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -9.321 -2.899 2.022 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -10.852 -2.603 2.852 1.00 0.00 H new ATOM 2009 N LYS A 126 -10.471 0.810 -2.813 1.00 0.00 N ATOM 2010 CA LYS A 126 -10.551 1.646 -4.008 1.00 0.00 C ATOM 2011 C LYS A 126 -9.167 2.000 -4.551 1.00 0.00 C ATOM 2012 O LYS A 126 -9.050 2.669 -5.577 1.00 0.00 O ATOM 2013 CB LYS A 126 -11.335 2.930 -3.721 1.00 0.00 C ATOM 2014 CG LYS A 126 -12.640 2.691 -2.976 1.00 0.00 C ATOM 2015 CD LYS A 126 -12.976 3.850 -2.053 1.00 0.00 C ATOM 2016 CE LYS A 126 -12.391 3.646 -0.664 1.00 0.00 C ATOM 2017 NZ LYS A 126 -11.309 4.625 -0.366 1.00 0.00 N ATOM 0 H LYS A 126 -10.702 -0.170 -2.974 1.00 0.00 H new ATOM 0 HA LYS A 126 -11.075 1.065 -4.767 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -10.710 3.605 -3.136 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -11.551 3.433 -4.664 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -13.449 2.550 -3.693 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -12.565 1.772 -2.395 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -12.592 4.777 -2.478 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -14.058 3.957 -1.981 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -13.182 3.742 0.080 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -11.997 2.633 -0.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -11.274 4.802 0.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -10.396 4.240 -0.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -11.501 5.517 -0.865 1.00 0.00 H new ATOM 2031 N PHE A 127 -8.110 1.546 -3.871 1.00 0.00 N ATOM 2032 CA PHE A 127 -6.750 1.829 -4.309 1.00 0.00 C ATOM 2033 C PHE A 127 -6.470 1.198 -5.669 1.00 0.00 C ATOM 2034 O PHE A 127 -7.016 0.145 -6.001 1.00 0.00 O ATOM 2035 CB PHE A 127 -5.751 1.305 -3.277 1.00 0.00 C ATOM 2036 CG PHE A 127 -4.382 1.911 -3.408 1.00 0.00 C ATOM 2037 CD1 PHE A 127 -4.179 3.255 -3.146 1.00 0.00 C ATOM 2038 CD2 PHE A 127 -3.303 1.135 -3.800 1.00 0.00 C ATOM 2039 CE1 PHE A 127 -2.924 3.816 -3.272 1.00 0.00 C ATOM 2040 CE2 PHE A 127 -2.046 1.691 -3.926 1.00 0.00 C ATOM 2041 CZ PHE A 127 -1.856 3.032 -3.663 1.00 0.00 C ATOM 0 H PHE A 127 -8.174 0.985 -3.021 1.00 0.00 H new ATOM 0 HA PHE A 127 -6.640 2.909 -4.404 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -6.135 1.506 -2.277 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -5.672 0.222 -3.376 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -5.011 3.871 -2.840 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -3.447 0.085 -4.009 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -2.777 4.866 -3.065 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -1.212 1.077 -4.230 1.00 0.00 H new ATOM 0 HZ PHE A 127 -0.873 3.468 -3.763 1.00 0.00 H new ATOM 2051 N GLN A 128 -5.616 1.849 -6.452 1.00 0.00 N ATOM 2052 CA GLN A 128 -5.262 1.354 -7.776 1.00 0.00 C ATOM 2053 C GLN A 128 -3.780 1.575 -8.060 1.00 0.00 C ATOM 2054 O GLN A 128 -3.116 2.355 -7.377 1.00 0.00 O ATOM 2055 CB GLN A 128 -6.108 2.048 -8.847 1.00 0.00 C ATOM 2056 CG GLN A 128 -7.598 1.782 -8.710 1.00 0.00 C ATOM 2057 CD GLN A 128 -7.978 0.371 -9.114 1.00 0.00 C ATOM 2058 OE1 GLN A 128 -7.748 -0.046 -10.250 1.00 0.00 O ATOM 2059 NE2 GLN A 128 -8.565 -0.374 -8.184 1.00 0.00 N ATOM 0 H GLN A 128 -5.156 2.721 -6.192 1.00 0.00 H new ATOM 0 HA GLN A 128 -5.463 0.283 -7.802 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -5.933 3.123 -8.797 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -5.777 1.717 -9.831 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -7.901 1.954 -7.677 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -8.148 2.493 -9.326 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -8.737 0.011 -7.255 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -8.844 -1.331 -8.399 1.00 0.00 H new ATOM 2068 N ILE A 129 -3.265 0.882 -9.071 1.00 0.00 N ATOM 2069 CA ILE A 129 -1.859 1.002 -9.445 1.00 0.00 C ATOM 2070 C ILE A 129 -1.497 2.451 -9.758 1.00 0.00 C ATOM 2071 O ILE A 129 -2.171 3.114 -10.545 1.00 0.00 O ATOM 2072 CB ILE A 129 -1.521 0.122 -10.666 1.00 0.00 C ATOM 2073 CG1 ILE A 129 -1.980 -1.319 -10.429 1.00 0.00 C ATOM 2074 CG2 ILE A 129 -0.028 0.169 -10.958 1.00 0.00 C ATOM 2075 CD1 ILE A 129 -1.631 -2.259 -11.562 1.00 0.00 C ATOM 0 H ILE A 129 -3.800 0.231 -9.646 1.00 0.00 H new ATOM 0 HA ILE A 129 -1.275 0.660 -8.591 1.00 0.00 H new ATOM 0 HB ILE A 129 -2.052 0.513 -11.534 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -1.528 -1.689 -9.509 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -3.060 -1.328 -10.280 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.194 -0.457 -11.822 1.00 0.00 H new ATOM 0 HG22 ILE A 129 0.269 1.196 -11.168 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.524 -0.198 -10.093 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -1.987 -3.262 -11.325 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -2.105 -1.913 -12.481 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -0.550 -2.280 -11.697 1.00 0.00 H new ATOM 2087 N GLY A 130 -0.426 2.935 -9.134 1.00 0.00 N ATOM 2088 CA GLY A 130 0.009 4.301 -9.359 1.00 0.00 C ATOM 2089 C GLY A 130 -0.520 5.263 -8.313 1.00 0.00 C ATOM 2090 O GLY A 130 -0.047 6.396 -8.208 1.00 0.00 O ATOM 0 H GLY A 130 0.147 2.405 -8.477 1.00 0.00 H new ATOM 0 HA2 GLY A 130 1.098 4.335 -9.361 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -0.322 4.626 -10.346 1.00 0.00 H new ATOM 2094 N ASP A 131 -1.504 4.819 -7.536 1.00 0.00 N ATOM 2095 CA ASP A 131 -2.091 5.653 -6.495 1.00 0.00 C ATOM 2096 C ASP A 131 -1.100 5.893 -5.358 1.00 0.00 C ATOM 2097 O ASP A 131 -0.202 5.084 -5.123 1.00 0.00 O ATOM 2098 CB ASP A 131 -3.369 5.008 -5.957 1.00 0.00 C ATOM 2099 CG ASP A 131 -4.543 5.172 -6.901 1.00 0.00 C ATOM 2100 OD1 ASP A 131 -4.471 4.652 -8.034 1.00 0.00 O ATOM 2101 OD2 ASP A 131 -5.536 5.820 -6.508 1.00 0.00 O ATOM 0 H ASP A 131 -1.911 3.886 -7.609 1.00 0.00 H new ATOM 0 HA ASP A 131 -2.340 6.618 -6.936 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -3.191 3.947 -5.784 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -3.618 5.451 -4.993 1.00 0.00 H new ATOM 2106 N TYR A 132 -1.274 7.008 -4.663 1.00 0.00 N ATOM 2107 CA TYR A 132 -0.393 7.369 -3.552 1.00 0.00 C ATOM 2108 C TYR A 132 -0.937 6.852 -2.220 1.00 0.00 C ATOM 2109 O TYR A 132 -1.926 7.368 -1.696 1.00 0.00 O ATOM 2110 CB TYR A 132 -0.203 8.883 -3.484 1.00 0.00 C ATOM 2111 CG TYR A 132 -0.213 9.563 -4.837 1.00 0.00 C ATOM 2112 CD1 TYR A 132 0.710 9.218 -5.817 1.00 0.00 C ATOM 2113 CD2 TYR A 132 -1.144 10.551 -5.131 1.00 0.00 C ATOM 2114 CE1 TYR A 132 0.705 9.840 -7.050 1.00 0.00 C ATOM 2115 CE2 TYR A 132 -1.156 11.175 -6.363 1.00 0.00 C ATOM 2116 CZ TYR A 132 -0.230 10.817 -7.319 1.00 0.00 C ATOM 2117 OH TYR A 132 -0.239 11.437 -8.547 1.00 0.00 O ATOM 0 H TYR A 132 -2.017 7.682 -4.846 1.00 0.00 H new ATOM 0 HA TYR A 132 0.573 6.898 -3.733 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -0.993 9.311 -2.867 1.00 0.00 H new ATOM 0 HB3 TYR A 132 0.743 9.099 -2.987 1.00 0.00 H new ATOM 0 HD1 TYR A 132 1.443 8.452 -5.611 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -1.870 10.836 -4.384 1.00 0.00 H new ATOM 0 HE1 TYR A 132 1.430 9.562 -7.800 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -1.888 11.940 -6.576 1.00 0.00 H new ATOM 0 HH TYR A 132 -0.961 12.099 -8.574 1.00 0.00 H new ATOM 2127 N LEU A 133 -0.276 5.829 -1.682 1.00 0.00 N ATOM 2128 CA LEU A 133 -0.677 5.237 -0.411 1.00 0.00 C ATOM 2129 C LEU A 133 0.235 5.729 0.712 1.00 0.00 C ATOM 2130 O LEU A 133 1.443 5.509 0.668 1.00 0.00 O ATOM 2131 CB LEU A 133 -0.610 3.711 -0.502 1.00 0.00 C ATOM 2132 CG LEU A 133 -1.587 2.947 0.394 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -1.140 3.007 1.845 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -2.998 3.495 0.244 1.00 0.00 C ATOM 0 H LEU A 133 0.541 5.393 -2.109 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.701 5.538 -0.192 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -0.791 3.419 -1.537 1.00 0.00 H new ATOM 0 HB3 LEU A 133 0.403 3.395 -0.254 1.00 0.00 H new ATOM 0 HG LEU A 133 -1.593 1.903 0.080 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -1.847 2.458 2.467 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.151 2.560 1.940 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -1.101 4.046 2.171 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -3.676 2.937 0.890 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -3.012 4.548 0.527 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.319 3.394 -0.793 1.00 0.00 H new ATOM 2146 N ASP A 134 -0.332 6.401 1.722 1.00 0.00 N ATOM 2147 CA ASP A 134 0.467 6.909 2.826 1.00 0.00 C ATOM 2148 C ASP A 134 0.311 6.040 4.067 1.00 0.00 C ATOM 2149 O ASP A 134 -0.806 5.799 4.535 1.00 0.00 O ATOM 2150 CB ASP A 134 0.053 8.343 3.149 1.00 0.00 C ATOM 2151 CG ASP A 134 1.063 9.052 4.031 1.00 0.00 C ATOM 2152 OD1 ASP A 134 1.505 8.451 5.033 1.00 0.00 O ATOM 2153 OD2 ASP A 134 1.411 10.214 3.724 1.00 0.00 O ATOM 0 H ASP A 134 -1.330 6.600 1.791 1.00 0.00 H new ATOM 0 HA ASP A 134 1.514 6.887 2.523 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -0.069 8.901 2.221 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -0.917 8.335 3.646 1.00 0.00 H new ATOM 2158 N ILE A 135 1.435 5.583 4.605 1.00 0.00 N ATOM 2159 CA ILE A 135 1.427 4.750 5.802 1.00 0.00 C ATOM 2160 C ILE A 135 1.930 5.524 7.017 1.00 0.00 C ATOM 2161 O ILE A 135 3.105 5.890 7.093 1.00 0.00 O ATOM 2162 CB ILE A 135 2.287 3.479 5.608 1.00 0.00 C ATOM 2163 CG1 ILE A 135 1.620 2.538 4.600 1.00 0.00 C ATOM 2164 CG2 ILE A 135 2.509 2.766 6.937 1.00 0.00 C ATOM 2165 CD1 ILE A 135 2.380 2.411 3.300 1.00 0.00 C ATOM 0 H ILE A 135 2.364 5.775 4.231 1.00 0.00 H new ATOM 0 HA ILE A 135 0.393 4.452 5.976 1.00 0.00 H new ATOM 0 HB ILE A 135 3.260 3.778 5.218 1.00 0.00 H new ATOM 0 HG12 ILE A 135 1.517 1.550 5.050 1.00 0.00 H new ATOM 0 HG13 ILE A 135 0.613 2.899 4.389 1.00 0.00 H new ATOM 0 HG21 ILE A 135 3.116 1.875 6.775 1.00 0.00 H new ATOM 0 HG22 ILE A 135 3.023 3.435 7.627 1.00 0.00 H new ATOM 0 HG23 ILE A 135 1.547 2.477 7.360 1.00 0.00 H new ATOM 0 HD11 ILE A 135 1.850 1.730 2.634 1.00 0.00 H new ATOM 0 HD12 ILE A 135 2.460 3.390 2.828 1.00 0.00 H new ATOM 0 HD13 ILE A 135 3.378 2.021 3.499 1.00 0.00 H new ATOM 2177 N ALA A 136 1.032 5.759 7.964 1.00 0.00 N ATOM 2178 CA ALA A 136 1.372 6.475 9.183 1.00 0.00 C ATOM 2179 C ALA A 136 1.942 5.515 10.219 1.00 0.00 C ATOM 2180 O ALA A 136 1.199 4.786 10.875 1.00 0.00 O ATOM 2181 CB ALA A 136 0.144 7.186 9.730 1.00 0.00 C ATOM 0 H ALA A 136 0.058 5.462 7.909 1.00 0.00 H new ATOM 0 HA ALA A 136 2.132 7.222 8.953 1.00 0.00 H new ATOM 0 HB1 ALA A 136 0.409 7.719 10.643 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -0.226 7.895 8.990 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -0.633 6.454 9.950 1.00 0.00 H new ATOM 2187 N ILE A 137 3.266 5.505 10.355 1.00 0.00 N ATOM 2188 CA ILE A 137 3.936 4.617 11.302 1.00 0.00 C ATOM 2189 C ILE A 137 3.960 5.207 12.701 1.00 0.00 C ATOM 2190 O ILE A 137 4.370 6.351 12.913 1.00 0.00 O ATOM 2191 CB ILE A 137 5.379 4.312 10.857 1.00 0.00 C ATOM 2192 CG1 ILE A 137 5.405 3.825 9.405 1.00 0.00 C ATOM 2193 CG2 ILE A 137 6.011 3.276 11.775 1.00 0.00 C ATOM 2194 CD1 ILE A 137 6.622 4.294 8.635 1.00 0.00 C ATOM 0 H ILE A 137 3.897 6.103 9.821 1.00 0.00 H new ATOM 0 HA ILE A 137 3.363 3.690 11.320 1.00 0.00 H new ATOM 0 HB ILE A 137 5.959 5.233 10.921 1.00 0.00 H new ATOM 0 HG12 ILE A 137 5.375 2.735 9.394 1.00 0.00 H new ATOM 0 HG13 ILE A 137 4.506 4.173 8.897 1.00 0.00 H new ATOM 0 HG21 ILE A 137 7.030 3.072 11.446 1.00 0.00 H new ATOM 0 HG22 ILE A 137 6.028 3.657 12.796 1.00 0.00 H new ATOM 0 HG23 ILE A 137 5.428 2.356 11.741 1.00 0.00 H new ATOM 0 HD11 ILE A 137 6.576 3.913 7.615 1.00 0.00 H new ATOM 0 HD12 ILE A 137 6.642 5.384 8.615 1.00 0.00 H new ATOM 0 HD13 ILE A 137 7.525 3.923 9.120 1.00 0.00 H new ATOM 2206 N THR A 138 3.520 4.410 13.666 1.00 0.00 N ATOM 2207 CA THR A 138 3.479 4.839 15.060 1.00 0.00 C ATOM 2208 C THR A 138 4.257 3.869 15.962 1.00 0.00 C ATOM 2209 O THR A 138 3.666 3.041 16.654 1.00 0.00 O ATOM 2210 CB THR A 138 2.033 4.943 15.544 1.00 0.00 C ATOM 2211 OG1 THR A 138 1.245 5.635 14.591 1.00 0.00 O ATOM 2212 CG2 THR A 138 1.892 5.662 16.868 1.00 0.00 C ATOM 0 H THR A 138 3.185 3.459 13.509 1.00 0.00 H new ATOM 0 HA THR A 138 3.950 5.820 15.119 1.00 0.00 H new ATOM 0 HB THR A 138 1.693 3.916 15.675 1.00 0.00 H new ATOM 0 HG1 THR A 138 0.321 5.694 14.911 1.00 0.00 H new ATOM 0 HG21 THR A 138 0.840 5.700 17.151 1.00 0.00 H new ATOM 0 HG22 THR A 138 2.455 5.128 17.634 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.279 6.677 16.774 1.00 0.00 H new ATOM 2220 N PRO A 139 5.599 3.963 15.962 1.00 0.00 N ATOM 2221 CA PRO A 139 6.455 3.094 16.774 1.00 0.00 C ATOM 2222 C PRO A 139 6.206 3.268 18.269 1.00 0.00 C ATOM 2223 O PRO A 139 5.414 4.117 18.683 1.00 0.00 O ATOM 2224 CB PRO A 139 7.880 3.535 16.416 1.00 0.00 C ATOM 2225 CG PRO A 139 7.747 4.286 15.135 1.00 0.00 C ATOM 2226 CD PRO A 139 6.387 4.920 15.165 1.00 0.00 C ATOM 0 HA PRO A 139 6.263 2.041 16.570 1.00 0.00 H new ATOM 0 HB2 PRO A 139 8.306 4.163 17.198 1.00 0.00 H new ATOM 0 HB3 PRO A 139 8.541 2.676 16.302 1.00 0.00 H new ATOM 0 HG2 PRO A 139 8.527 5.041 15.043 1.00 0.00 H new ATOM 0 HG3 PRO A 139 7.847 3.618 14.279 1.00 0.00 H new ATOM 0 HD2 PRO A 139 6.411 5.907 15.626 1.00 0.00 H new ATOM 0 HD3 PRO A 139 5.977 5.046 14.163 1.00 0.00 H new ATOM 2234 N PRO A 140 6.883 2.461 19.106 1.00 0.00 N ATOM 2235 CA PRO A 140 6.732 2.525 20.561 1.00 0.00 C ATOM 2236 C PRO A 140 7.464 3.716 21.173 1.00 0.00 C ATOM 2237 O PRO A 140 8.574 3.578 21.687 1.00 0.00 O ATOM 2238 CB PRO A 140 7.356 1.214 21.033 1.00 0.00 C ATOM 2239 CG PRO A 140 8.385 0.899 20.003 1.00 0.00 C ATOM 2240 CD PRO A 140 7.844 1.419 18.697 1.00 0.00 C ATOM 0 HA PRO A 140 5.691 2.653 20.859 1.00 0.00 H new ATOM 0 HB2 PRO A 140 7.803 1.320 22.021 1.00 0.00 H new ATOM 0 HB3 PRO A 140 6.610 0.422 21.104 1.00 0.00 H new ATOM 0 HG2 PRO A 140 9.337 1.372 20.246 1.00 0.00 H new ATOM 0 HG3 PRO A 140 8.567 -0.174 19.950 1.00 0.00 H new ATOM 0 HD2 PRO A 140 8.636 1.829 18.070 1.00 0.00 H new ATOM 0 HD3 PRO A 140 7.359 0.630 18.122 1.00 0.00 H new ATOM 2248 N ASN A 141 6.834 4.883 21.112 1.00 0.00 N ATOM 2249 CA ASN A 141 7.423 6.101 21.662 1.00 0.00 C ATOM 2250 C ASN A 141 6.393 6.895 22.452 1.00 0.00 C ATOM 2251 O ASN A 141 6.693 7.450 23.510 1.00 0.00 O ATOM 2252 CB ASN A 141 8.000 6.969 20.543 1.00 0.00 C ATOM 2253 CG ASN A 141 8.953 6.205 19.648 1.00 0.00 C ATOM 2254 OD1 ASN A 141 8.690 6.231 18.347 1.00 0.00 O flip ATOM 2255 ND2 ASN A 141 9.915 5.598 20.120 1.00 0.00 N flip ATOM 0 H ASN A 141 5.916 5.013 20.688 1.00 0.00 H new ATOM 0 HA ASN A 141 8.228 5.809 22.337 1.00 0.00 H new ATOM 0 HB2 ASN A 141 7.184 7.370 19.941 1.00 0.00 H new ATOM 0 HB3 ASN A 141 8.521 7.820 20.980 1.00 0.00 H new ATOM 0 HD21 ASN A 141 10.079 5.605 21.127 1.00 0.00 H new ATOM 0 HD22 ASN A 141 10.548 5.088 19.504 1.00 0.00 H new ATOM 2262 N ARG A 142 5.178 6.948 21.929 1.00 0.00 N ATOM 2263 CA ARG A 142 4.091 7.675 22.574 1.00 0.00 C ATOM 2264 C ARG A 142 3.019 6.723 23.103 1.00 0.00 C ATOM 2265 O ARG A 142 2.147 7.127 23.873 1.00 0.00 O ATOM 2266 CB ARG A 142 3.468 8.669 21.593 1.00 0.00 C ATOM 2267 CG ARG A 142 2.678 9.778 22.269 1.00 0.00 C ATOM 2268 CD ARG A 142 1.178 9.582 22.105 1.00 0.00 C ATOM 2269 NE ARG A 142 0.615 10.493 21.109 1.00 0.00 N ATOM 2270 CZ ARG A 142 -0.543 11.137 21.254 1.00 0.00 C ATOM 2271 NH1 ARG A 142 -1.280 10.969 22.346 1.00 0.00 N ATOM 2272 NH2 ARG A 142 -0.968 11.951 20.298 1.00 0.00 N ATOM 0 H ARG A 142 4.917 6.494 21.054 1.00 0.00 H new ATOM 0 HA ARG A 142 4.509 8.217 23.422 1.00 0.00 H new ATOM 0 HB2 ARG A 142 4.258 9.114 20.989 1.00 0.00 H new ATOM 0 HB3 ARG A 142 2.811 8.130 20.911 1.00 0.00 H new ATOM 0 HG2 ARG A 142 2.927 9.808 23.330 1.00 0.00 H new ATOM 0 HG3 ARG A 142 2.967 10.740 21.847 1.00 0.00 H new ATOM 0 HD2 ARG A 142 0.976 8.552 21.810 1.00 0.00 H new ATOM 0 HD3 ARG A 142 0.684 9.742 23.063 1.00 0.00 H new ATOM 0 HE ARG A 142 1.142 10.645 20.249 1.00 0.00 H new ATOM 0 HH11 ARG A 142 -0.962 10.342 23.085 1.00 0.00 H new ATOM 0 HH12 ARG A 142 -2.164 11.467 22.446 1.00 0.00 H new ATOM 0 HH21 ARG A 142 -0.409 12.083 19.455 1.00 0.00 H new ATOM 0 HH22 ARG A 142 -1.854 12.445 20.406 1.00 0.00 H new ATOM 2286 N ALA A 143 3.089 5.460 22.691 1.00 0.00 N ATOM 2287 CA ALA A 143 2.122 4.460 23.130 1.00 0.00 C ATOM 2288 C ALA A 143 2.719 3.552 24.203 1.00 0.00 C ATOM 2289 O ALA A 143 3.377 2.559 23.890 1.00 0.00 O ATOM 2290 CB ALA A 143 1.646 3.634 21.943 1.00 0.00 C ATOM 0 H ALA A 143 3.804 5.106 22.055 1.00 0.00 H new ATOM 0 HA ALA A 143 1.269 4.980 23.565 1.00 0.00 H new ATOM 0 HB1 ALA A 143 0.925 2.891 22.283 1.00 0.00 H new ATOM 0 HB2 ALA A 143 1.175 4.289 21.210 1.00 0.00 H new ATOM 0 HB3 ALA A 143 2.497 3.130 21.485 1.00 0.00 H new ATOM 2296 N PRO A 144 2.517 3.890 25.488 1.00 0.00 N ATOM 2297 CA PRO A 144 3.056 3.104 26.598 1.00 0.00 C ATOM 2298 C PRO A 144 2.562 1.649 26.638 1.00 0.00 C ATOM 2299 O PRO A 144 3.309 0.762 27.050 1.00 0.00 O ATOM 2300 CB PRO A 144 2.613 3.857 27.860 1.00 0.00 C ATOM 2301 CG PRO A 144 1.593 4.859 27.425 1.00 0.00 C ATOM 2302 CD PRO A 144 1.777 5.079 25.948 1.00 0.00 C ATOM 0 HA PRO A 144 4.138 3.014 26.499 1.00 0.00 H new ATOM 0 HB2 PRO A 144 2.192 3.169 28.593 1.00 0.00 H new ATOM 0 HB3 PRO A 144 3.462 4.349 28.335 1.00 0.00 H new ATOM 0 HG2 PRO A 144 0.586 4.498 27.636 1.00 0.00 H new ATOM 0 HG3 PRO A 144 1.717 5.794 27.970 1.00 0.00 H new ATOM 0 HD2 PRO A 144 0.818 5.172 25.438 1.00 0.00 H new ATOM 0 HD3 PRO A 144 2.334 5.995 25.749 1.00 0.00 H new ATOM 2310 N PRO A 145 1.304 1.361 26.231 1.00 0.00 N ATOM 2311 CA PRO A 145 0.777 -0.009 26.264 1.00 0.00 C ATOM 2312 C PRO A 145 1.544 -0.965 25.346 1.00 0.00 C ATOM 2313 O PRO A 145 2.051 -1.989 25.806 1.00 0.00 O ATOM 2314 CB PRO A 145 -0.682 0.126 25.812 1.00 0.00 C ATOM 2315 CG PRO A 145 -0.998 1.582 25.887 1.00 0.00 C ATOM 2316 CD PRO A 145 0.303 2.320 25.734 1.00 0.00 C ATOM 0 HA PRO A 145 0.877 -0.440 27.260 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -0.814 -0.251 24.798 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -1.346 -0.452 26.455 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -1.698 1.866 25.101 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -1.471 1.826 26.838 1.00 0.00 H new ATOM 0 HD2 PRO A 145 0.490 2.593 24.695 1.00 0.00 H new ATOM 0 HD3 PRO A 145 0.311 3.244 26.312 1.00 0.00 H new ATOM 2324 N PRO A 146 1.649 -0.657 24.037 1.00 0.00 N ATOM 2325 CA PRO A 146 2.368 -1.515 23.090 1.00 0.00 C ATOM 2326 C PRO A 146 3.750 -1.911 23.599 1.00 0.00 C ATOM 2327 O PRO A 146 4.194 -3.043 23.404 1.00 0.00 O ATOM 2328 CB PRO A 146 2.492 -0.640 21.843 1.00 0.00 C ATOM 2329 CG PRO A 146 1.329 0.284 21.914 1.00 0.00 C ATOM 2330 CD PRO A 146 1.087 0.540 23.378 1.00 0.00 C ATOM 0 HA PRO A 146 1.847 -2.457 22.918 1.00 0.00 H new ATOM 0 HB2 PRO A 146 3.434 -0.091 21.836 1.00 0.00 H new ATOM 0 HB3 PRO A 146 2.466 -1.240 20.934 1.00 0.00 H new ATOM 0 HG2 PRO A 146 1.537 1.214 21.385 1.00 0.00 H new ATOM 0 HG3 PRO A 146 0.450 -0.159 21.445 1.00 0.00 H new ATOM 0 HD2 PRO A 146 1.582 1.452 23.713 1.00 0.00 H new ATOM 0 HD3 PRO A 146 0.025 0.656 23.595 1.00 0.00 H new ATOM 2338 N SER A 147 4.426 -0.972 24.252 1.00 0.00 N ATOM 2339 CA SER A 147 5.758 -1.222 24.789 1.00 0.00 C ATOM 2340 C SER A 147 5.678 -1.953 26.126 1.00 0.00 C ATOM 2341 O SER A 147 4.766 -1.717 26.920 1.00 0.00 O ATOM 2342 CB SER A 147 6.517 0.095 24.960 1.00 0.00 C ATOM 2343 OG SER A 147 6.372 0.920 23.817 1.00 0.00 O ATOM 0 H SER A 147 4.073 -0.030 24.422 1.00 0.00 H new ATOM 0 HA SER A 147 6.295 -1.854 24.081 1.00 0.00 H new ATOM 0 HB2 SER A 147 6.147 0.620 25.840 1.00 0.00 H new ATOM 0 HB3 SER A 147 7.574 -0.110 25.132 1.00 0.00 H new ATOM 0 HG SER A 147 6.865 1.756 23.952 1.00 0.00 H new ATOM 2349 N GLY A 148 6.637 -2.840 26.367 1.00 0.00 N ATOM 2350 CA GLY A 148 6.656 -3.592 27.609 1.00 0.00 C ATOM 2351 C GLY A 148 7.526 -2.942 28.667 1.00 0.00 C ATOM 2352 O GLY A 148 8.737 -3.159 28.702 1.00 0.00 O ATOM 0 H GLY A 148 7.401 -3.052 25.726 1.00 0.00 H new ATOM 0 HA2 GLY A 148 5.638 -3.687 27.988 1.00 0.00 H new ATOM 0 HA3 GLY A 148 7.019 -4.601 27.414 1.00 0.00 H new ATOM 2356 N ARG A 149 6.907 -2.143 29.530 1.00 0.00 N ATOM 2357 CA ARG A 149 7.634 -1.460 30.594 1.00 0.00 C ATOM 2358 C ARG A 149 7.729 -2.337 31.838 1.00 0.00 C ATOM 2359 O ARG A 149 6.693 -2.908 32.239 1.00 0.00 O ATOM 2360 CB ARG A 149 6.949 -0.137 30.940 1.00 0.00 C ATOM 2361 CG ARG A 149 6.975 0.877 29.806 1.00 0.00 C ATOM 2362 CD ARG A 149 7.258 2.282 30.316 1.00 0.00 C ATOM 2363 NE ARG A 149 6.049 3.101 30.359 1.00 0.00 N ATOM 2364 CZ ARG A 149 6.047 4.406 30.624 1.00 0.00 C ATOM 2365 NH1 ARG A 149 7.186 5.042 30.871 1.00 0.00 N ATOM 2366 NH2 ARG A 149 4.904 5.077 30.642 1.00 0.00 N ATOM 2367 OXT ARG A 149 8.839 -2.446 32.401 1.00 0.00 O ATOM 0 H ARG A 149 5.905 -1.953 29.514 1.00 0.00 H new ATOM 0 HA ARG A 149 8.644 -1.256 30.237 1.00 0.00 H new ATOM 0 HB2 ARG A 149 5.913 -0.335 31.216 1.00 0.00 H new ATOM 0 HB3 ARG A 149 7.434 0.296 31.815 1.00 0.00 H new ATOM 0 HG2 ARG A 149 7.737 0.593 29.080 1.00 0.00 H new ATOM 0 HG3 ARG A 149 6.018 0.865 29.284 1.00 0.00 H new ATOM 0 HD2 ARG A 149 7.693 2.225 31.314 1.00 0.00 H new ATOM 0 HD3 ARG A 149 7.997 2.760 29.673 1.00 0.00 H new ATOM 0 HE ARG A 149 5.154 2.647 30.175 1.00 0.00 H new ATOM 0 HH11 ARG A 149 8.069 4.531 30.858 1.00 0.00 H new ATOM 0 HH12 ARG A 149 7.178 6.042 31.073 1.00 0.00 H new ATOM 0 HH21 ARG A 149 4.026 4.594 30.453 1.00 0.00 H new ATOM 0 HH22 ARG A 149 4.903 6.077 30.845 1.00 0.00 H new TER 2381 ARG A 149