#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jpn n SER 2 N 0.00 0.59 0.27 1.61 7.64 -1.26 -4.85 113.62 117.62 2jpn n SER 2 Ca 0.00 -1.57 0.15 0.00 1.01 0.00 0.00 58.87 58.46 2jpn n SER 2 Cb 0.00 -0.07 0.72 0.00 -1.01 0.00 0.00 64.21 63.85 2jpn n SER 2 CO 0.00 0.00 0.00 -0.74 -3.01 0.00 0.00 175.04 171.29 2jpn h HIS 3 N 0.00 0.00 -3.64 1.43 -0.00 -2.09 -3.46 115.15 107.39 2jpn h HIS 3 Ca 0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 60.37 60.01 2jpn h HIS 3 Cb 0.98 0.00 -0.14 0.00 -0.00 0.00 0.00 27.41 28.25 2jpn h HIS 3 CO 0.02 0.08 -0.62 -1.64 -0.00 0.00 0.00 177.93 175.78 2jpn s MET 4 N -3.88 1.42 0.21 5.26 1.00 -1.26 -5.09 119.30 116.96 2jpn s MET 4 Ca -0.01 -1.77 -0.05 0.00 0.00 0.00 0.00 55.69 53.87 2jpn s MET 4 Cb 0.11 -0.35 0.18 0.00 0.00 0.00 0.00 34.83 34.77 2jpn s MET 4 CO 0.56 -0.26 1.64 -0.07 0.00 0.00 0.00 175.02 176.89 2jpn h LEU 5 N 2.37 0.84 0.00 -0.03 4.07 -1.88 -3.47 115.31 117.21 2jpn h LEU 5 Ca -0.38 -0.28 0.00 0.00 0.08 0.00 0.00 57.88 57.30 2jpn h LEU 5 Cb 1.24 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 42.76 2jpn h LEU 5 CO 0.62 0.99 0.00 0.18 -1.08 0.00 0.00 178.44 179.15 2jpn n LEU 6 N -4.14 0.00 0.00 1.67 7.99 -1.26 -4.29 117.00 116.98 2jpn n LEU 6 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.01 2jpn n LEU 6 Cb 0.40 -0.17 0.00 0.00 -0.11 0.00 0.00 43.42 43.54 2jpn n LEU 6 CO 0.44 0.00 0.19 -0.62 -1.51 0.00 0.00 177.39 175.89 2jpn n GLU 7 N -1.15 0.25 -3.83 3.23 1.02 -1.26 -5.06 120.64 113.84 2jpn n GLU 7 Ca 0.00 -0.45 -0.12 0.00 -0.02 0.00 0.00 57.16 56.57 2jpn n GLU 7 Cb 0.00 -0.65 -0.10 0.00 -0.02 0.00 0.00 31.44 30.67 2jpn n GLU 7 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 2jpn s PHE 8 N -0.14 -0.06 0.49 -0.32 5.36 -1.26 -5.10 117.98 116.95 2jpn s PHE 8 Ca 0.00 0.08 0.18 0.00 -0.96 0.00 0.00 56.93 56.23 2jpn s PHE 8 Cb 0.00 0.01 1.22 0.00 -0.34 0.00 0.00 43.02 43.91 2jpn s PHE 8 CO 0.00 -0.30 2.06 1.57 -1.46 0.00 0.00 175.22 177.08 2jpn h LYS 9 N 4.32 0.14 0.00 10.12 2.10 -1.97 -3.38 116.57 127.89 2jpn h LYS 9 Ca -0.30 -0.01 -0.04 0.00 -2.00 0.00 0.00 60.65 58.30 2jpn h LYS 9 Cb 1.19 -0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 32.48 2jpn h LYS 9 CO 0.40 0.09 -0.20 1.96 -2.00 0.00 0.00 179.45 179.69 2jpn h GLN 10 N 0.14 0.00 -0.38 0.07 4.20 -1.99 0.33 115.11 117.48 2jpn h GLN 10 Ca 0.15 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.90 2jpn h GLN 10 Cb 0.44 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 2jpn h GLN 10 CO -0.02 0.20 0.26 0.27 -0.67 0.00 0.00 178.83 178.87 2jpn h PHE 11 N 0.00 0.35 0.00 2.96 -0.00 -2.01 -1.89 116.94 116.36 2jpn h PHE 11 Ca -0.00 0.01 -0.05 0.00 -0.00 0.00 0.00 57.97 57.92 2jpn h PHE 11 Cb 0.38 -0.12 -0.01 0.00 -0.00 0.00 0.00 35.95 36.21 2jpn h PHE 11 CO 0.00 0.20 -0.38 -0.07 -0.00 0.00 0.00 178.31 178.06 2jpn h LEU 12 N 0.36 0.00 0.00 2.10 4.07 -1.24 -3.02 115.31 117.58 2jpn h LEU 12 Ca 0.16 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 57.99 2jpn h LEU 12 Cb 0.19 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.90 2jpn h LEU 12 CO -0.04 0.24 -1.68 -1.22 -1.08 0.00 0.00 178.44 174.66 2jpn n TYR 13 N -3.10 0.54 0.11 1.13 4.02 -0.86 -3.49 117.16 115.52 2jpn n TYR 13 Ca 0.02 0.17 -0.02 0.00 -0.01 0.00 0.00 57.90 58.06 2jpn n TYR 13 Cb 0.63 -0.90 0.05 0.00 -0.02 0.00 0.00 39.34 39.11 2jpn n TYR 13 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 176.86 177.34 2jpn h GLU 14 N 0.00 0.00 -0.81 -0.72 4.81 -1.51 -3.37 114.58 112.98 2jpn h GLU 14 Ca -0.16 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.18 2jpn h GLU 14 Cb 1.45 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.75 2jpn h GLU 14 CO 0.02 0.73 0.43 0.00 -0.73 0.00 0.00 179.01 179.46 2jpn h ALA 15 N 1.27 1.18 -0.01 2.92 0.00 -1.56 -3.28 119.26 119.77 2jpn h ALA 15 Ca -0.01 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2jpn h ALA 15 Cb 1.39 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 2jpn h ALA 15 CO 0.09 -0.02 0.04 0.77 0.00 0.00 0.00 179.25 180.13 2jpn h SER 16 N 0.67 0.00 0.00 0.00 0.02 -1.72 -2.49 113.55 110.03 2jpn h SER 16 Ca 0.42 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.37 2jpn h SER 16 Cb 0.49 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.03 2jpn h SER 16 CO -0.30 0.00 0.00 -0.38 -1.14 0.00 0.00 176.83 175.01 2jpn n ILE 17 N -3.37 0.00 0.18 3.27 -0.00 -1.24 -4.65 119.36 113.56 2jpn n ILE 17 Ca -0.03 -0.35 0.05 0.00 -0.00 0.00 0.00 62.75 62.43 2jpn n ILE 17 Cb 0.11 1.19 0.23 0.00 -0.00 0.00 0.00 39.64 41.18 2jpn n ILE 17 CO 0.00 0.00 0.00 -0.78 -0.00 0.00 0.00 176.55 175.77 2jpn h ASP 18 N 0.00 0.00 0.00 4.38 3.58 -1.53 -3.38 116.42 119.47 2jpn h ASP 18 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2jpn h ASP 18 Cb 0.10 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.15 2jpn h ASP 18 CO 0.00 0.39 -0.19 -0.62 -2.88 0.00 0.00 179.24 175.93 2jpn n GLU 19 N -3.36 0.00 -0.16 0.28 1.02 -1.26 -4.93 120.64 112.22 2jpn n GLU 19 Ca 0.01 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.10 2jpn n GLU 19 Cb 0.58 -0.18 0.05 0.00 -0.02 0.00 0.00 31.44 31.87 2jpn n GLU 19 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 2jpn h PHE 20 N 0.00 0.43 -0.96 -0.32 -1.00 -1.83 -0.73 116.94 112.53 2jpn h PHE 20 Ca 0.00 0.02 0.04 0.00 2.81 0.00 0.00 57.97 60.85 2jpn h PHE 20 Cb 0.19 -0.12 -0.06 0.00 3.61 0.00 0.00 35.95 39.57 2jpn h PHE 20 CO 0.00 0.21 0.63 0.52 -1.61 0.00 0.00 178.31 178.05 2jpn h MET 21 N 0.47 1.14 -0.18 1.51 2.86 -1.83 0.23 114.93 119.13 2jpn h MET 21 Ca 0.22 -0.07 -0.21 0.00 -2.06 0.00 0.00 59.70 57.58 2jpn h MET 21 Cb 0.14 -0.26 0.01 0.00 0.06 0.00 0.00 31.60 31.55 2jpn h MET 21 CO -0.16 0.76 -0.71 0.78 1.06 0.00 0.00 176.91 178.63 2jpn h GLY 22 N 1.18 0.83 0.90 8.32 0.00 -1.68 -1.37 103.07 111.26 2jpn h GLY 22 Ca 0.39 -1.11 0.02 0.00 0.00 0.00 0.00 47.33 46.63 2jpn h GLY 22 CO -0.13 0.99 0.45 0.07 0.00 0.00 0.00 176.54 177.92 2jpn h LYS 23 N 0.53 0.86 0.19 4.80 2.10 0.55 0.15 116.57 125.75 2jpn h LYS 23 Ca -0.03 -0.05 -0.01 0.00 -2.00 0.00 0.00 60.65 58.56 2jpn h LYS 23 Cb 1.32 -0.19 0.00 0.00 -0.90 0.00 0.00 32.23 32.46 2jpn h LYS 23 CO 0.14 0.57 -0.09 -0.84 -2.00 0.00 0.00 179.45 177.23 2jpn h ILE 24 N 0.88 0.81 0.00 0.07 3.07 -0.76 -1.10 117.51 120.48 2jpn h ILE 24 Ca 0.28 -1.01 -0.02 0.00 1.55 0.00 0.00 64.86 65.66 2jpn h ILE 24 Cb -0.01 1.32 -0.00 0.00 -0.27 0.00 0.00 36.82 37.85 2jpn h ILE 24 CO -0.10 0.19 -0.11 0.00 -1.05 0.00 0.00 178.15 177.09 2jpn h ALA 25 N -0.28 1.03 -0.31 0.16 0.00 -1.14 -1.80 119.26 116.92 2jpn h ALA 25 Ca -0.03 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2jpn h ALA 25 Cb 0.52 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2jpn h ALA 25 CO 0.04 0.13 0.00 0.45 0.00 0.00 0.00 179.25 179.87 2jpn n SER 26 N -3.26 3.12 0.05 0.00 2.88 0.52 -4.75 113.62 112.18 2jpn n SER 26 Ca 0.00 -2.26 0.12 0.00 -1.33 0.00 0.00 58.87 55.40 2jpn n SER 26 Cb 0.35 -0.30 0.58 0.00 -0.75 0.00 0.00 64.21 64.09 2jpn n SER 26 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jpn n GLN 28 N -4.47 0.00 -3.78 0.00 6.02 -1.26 -4.89 117.38 109.00 2jpn n GLN 28 Ca 0.05 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.91 2jpn n GLN 28 Cb 0.30 -3.24 -0.12 0.00 1.02 0.00 0.00 30.24 28.20 2jpn n GLN 28 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2jpn s THR 29 N -2.27 -0.01 0.23 5.09 -4.23 -1.26 -5.03 115.64 108.16 2jpn s THR 29 Ca 0.00 0.04 0.03 0.00 -1.18 0.00 0.00 61.69 60.58 2jpn s THR 29 Cb 0.00 -0.33 -0.04 0.00 1.34 0.00 0.00 72.50 73.48 2jpn s THR 29 CO 0.00 0.01 1.57 0.25 -0.54 0.00 0.00 174.62 175.91 2jpn h LEU 30 N 6.13 0.34 -1.44 4.79 5.85 -1.88 -1.68 115.31 127.41 2jpn h LEU 30 Ca -0.29 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.23 2jpn h LEU 30 Cb 1.19 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.10 2jpn h LEU 30 CO 0.37 0.84 0.20 -0.08 -0.34 0.00 0.00 178.44 179.43 2jpn h GLU 31 N 0.23 0.58 -0.16 1.25 4.81 -1.96 0.18 114.58 119.52 2jpn h GLU 31 Ca -0.00 -0.06 -0.18 0.00 -0.13 0.00 0.00 59.36 58.99 2jpn h GLU 31 Cb 1.07 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 30.34 2jpn h GLU 31 CO 0.09 0.45 -0.59 0.78 -0.73 0.00 0.00 179.01 179.02 2jpn h GLY 32 N 0.70 0.74 0.87 1.92 0.00 -1.86 -2.80 103.07 102.64 2jpn h GLY 32 Ca 0.15 -1.00 0.03 0.00 0.00 0.00 0.00 47.33 46.51 2jpn h GLY 32 CO -0.02 0.89 0.47 -2.00 0.00 0.00 0.00 176.54 175.88 2jpn h LEU 33 N 0.36 0.78 -1.40 3.11 5.85 -0.23 0.31 115.31 124.09 2jpn h LEU 33 Ca -0.03 -0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.65 2jpn h LEU 33 Cb 1.22 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 2jpn h LEU 33 CO 0.12 0.54 -0.04 -0.33 -0.34 0.00 0.00 178.44 178.39 2jpn h GLU 34 N 0.92 0.35 -0.08 1.25 4.39 -0.83 0.50 114.58 121.08 2jpn h GLU 34 Ca 0.30 -0.07 -0.18 0.00 0.34 0.00 0.00 59.36 59.75 2jpn h GLU 34 Cb 0.02 -0.05 0.01 0.00 -0.10 0.00 0.00 28.75 28.62 2jpn h GLU 34 CO -0.11 0.41 -0.66 0.93 -1.16 0.00 0.00 179.01 178.42 2jpn h GLU 35 N 0.34 0.59 -0.66 2.33 4.39 -0.85 -1.34 114.58 119.38 2jpn h GLU 35 Ca 0.07 -0.53 -0.02 0.00 0.34 0.00 0.00 59.36 59.23 2jpn h GLU 35 Cb 0.29 0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.03 2jpn h GLU 35 CO 0.01 1.15 0.34 -0.07 -1.16 0.00 0.00 179.01 179.28 2jpn h LEU 36 N 0.21 0.82 -0.31 1.33 4.07 -0.37 0.27 115.31 121.33 2jpn h LEU 36 Ca -0.06 -0.07 -0.02 0.00 0.08 0.00 0.00 57.88 57.81 2jpn h LEU 36 Cb 1.32 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.84 2jpn h LEU 36 CO 0.13 0.68 0.13 -0.08 -1.08 0.00 0.00 178.44 178.22 2jpn h GLU 37 N 0.92 0.46 -0.27 1.13 4.22 0.11 0.26 114.58 121.41 2jpn h GLU 37 Ca 0.23 -0.08 -0.02 0.00 0.08 0.00 0.00 59.36 59.57 2jpn h GLU 37 Cb 0.05 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2jpn h GLU 37 CO -0.03 0.47 0.07 0.00 -2.18 0.00 0.00 179.01 177.33 2jpn h ALA 38 N 0.97 0.35 -0.28 2.92 0.00 -1.04 -1.57 119.26 120.62 2jpn h ALA 38 Ca 0.10 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2jpn h ALA 38 Cb 0.17 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2jpn h ALA 38 CO -0.01 -0.00 -0.11 -0.92 0.00 0.00 0.00 179.25 178.21 2jpn h TYR 39 N 0.26 0.49 0.62 0.00 5.03 -0.09 0.18 116.97 123.47 2jpn h TYR 39 Ca 0.08 -0.07 -0.03 0.00 2.58 0.00 0.00 58.73 61.30 2jpn h TYR 39 Cb 0.27 -0.13 0.00 0.00 1.55 0.00 0.00 36.73 38.42 2jpn h TYR 39 CO 0.01 0.57 -0.32 -0.92 -1.32 0.00 0.00 178.16 176.18 2jpn h TYR 40 N 0.43 -0.82 -0.46 -3.82 3.20 -0.48 -0.74 116.97 114.28 2jpn h TYR 40 Ca 0.08 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.94 2jpn h TYR 40 Cb 0.46 0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.99 2jpn h TYR 40 CO 0.01 -0.50 0.29 0.87 -1.64 0.00 0.00 178.16 177.19 2jpn h LYS 41 N -0.86 0.62 -0.03 1.82 1.79 -0.56 -0.76 116.57 118.59 2jpn h LYS 41 Ca -0.08 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.34 2jpn h LYS 41 Cb 0.67 -0.14 -0.00 0.00 -1.58 0.00 0.00 32.23 31.18 2jpn h LYS 41 CO 0.12 0.42 -0.00 0.87 -1.08 0.00 0.00 179.45 179.79 2jpn h LYS 42 N 0.63 0.06 -0.15 3.15 1.79 -0.62 -3.11 116.57 118.32 2jpn h LYS 42 Ca 0.17 -0.02 -0.07 0.00 -2.18 0.00 0.00 60.65 58.55 2jpn h LYS 42 Cb -0.04 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.60 2jpn h LYS 42 CO -0.03 0.36 -0.17 -0.09 -1.08 0.00 0.00 179.45 178.44 2jpn h ARG 43 N -0.24 0.37 -0.68 3.15 2.43 -0.55 -2.84 114.38 116.02 2jpn h ARG 43 Ca 0.01 -0.20 0.04 0.00 -0.81 0.00 0.00 59.98 59.02 2jpn h ARG 43 Cb 0.33 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.85 2jpn h ARG 43 CO 0.00 0.77 0.45 -0.24 -1.51 0.00 0.00 179.97 179.44 2jpn h VAL 44 N -0.01 1.08 -0.98 0.20 3.04 -1.26 0.20 116.25 118.53 2jpn h VAL 44 Ca 0.02 -0.27 0.02 0.00 -1.01 0.00 0.00 66.70 65.46 2jpn h VAL 44 Cb 0.71 0.22 -0.05 0.00 -2.01 0.00 0.00 31.29 30.15 2jpn h VAL 44 CO 0.04 0.15 0.65 0.50 -1.01 0.00 0.00 177.57 177.89 2jpn h LYS 45 N 0.80 1.26 0.00 4.17 3.64 -1.61 -2.77 116.57 122.06 2jpn h LYS 45 Ca 0.28 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 2jpn h LYS 45 Cb 0.10 -0.28 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 2jpn h LYS 45 CO -0.08 0.83 0.00 -1.91 -2.27 0.00 0.00 179.45 176.02 2jpn n GLU 46 N -4.42 0.07 0.00 1.90 4.07 0.60 -4.88 120.64 117.98 2jpn n GLU 46 Ca 0.12 0.24 0.00 0.00 -0.06 0.00 0.00 57.16 57.46 2jpn n GLU 46 Cb 0.04 -1.62 0.00 0.00 -0.06 0.00 0.00 31.44 29.80 2jpn n GLU 46 CO 0.00 0.00 0.00 -2.37 -0.06 0.00 0.00 177.13 174.70 2jpn n THR 47 N -1.76 0.00 -3.09 6.31 5.66 -0.62 -5.08 114.28 115.70 2jpn n THR 47 Ca 0.04 0.00 -0.17 0.00 -3.05 0.00 0.00 64.05 60.87 2jpn n THR 47 Cb 0.24 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.01 2jpn n THR 47 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2jpn n GLU 48 N 0.00 0.90 -1.54 1.09 1.02 -1.24 -4.90 120.64 115.98 2jpn n GLU 48 Ca 0.00 -3.01 -0.36 0.00 -0.02 0.00 0.00 57.16 53.76 2jpn n GLU 48 Cb 0.00 -1.47 -0.06 0.00 -0.02 0.00 0.00 31.44 29.89 2jpn n GLU 48 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2jpn n LEU 49 N 0.65 1.79 -4.19 -4.62 0.00 -1.26 -4.97 117.00 104.39 2jpn n LEU 49 Ca 0.20 -0.39 -0.35 0.00 0.00 0.00 0.00 56.01 55.48 2jpn n LEU 49 Cb 0.63 -1.42 0.10 0.00 0.00 0.00 0.00 43.42 42.73 2jpn n LEU 49 CO 0.17 -1.42 -0.99 2.29 0.00 0.00 0.00 177.39 177.44 2jpn n LYS 50 N 8.85 -0.67 -0.25 1.96 0.00 -1.26 -4.94 118.16 121.85 2jpn n LYS 50 Ca 0.44 -0.18 -0.03 0.00 -0.00 0.00 0.00 58.31 58.54 2jpn n LYS 50 Cb 0.42 -1.44 0.15 0.00 -0.00 0.00 0.00 35.03 34.15 2jpn n LYS 50 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.40 177.78 2jpn h ASP 51 N -1.52 0.98 -0.76 -5.58 2.03 -2.01 -3.26 116.42 106.30 2jpn h ASP 51 Ca -0.46 -0.11 0.02 0.00 -0.73 0.00 0.00 57.03 55.75 2jpn h ASP 51 Cb 1.35 -0.25 -0.04 0.00 -0.83 0.00 0.00 39.33 39.55 2jpn h ASP 51 CO 0.31 0.82 0.50 0.74 -1.03 0.00 0.00 179.24 180.58 2jpn h THR 52 N 1.08 1.16 0.07 1.15 2.02 -1.97 -1.90 112.91 114.52 2jpn h THR 52 Ca 0.27 -0.34 -0.00 0.00 0.77 0.00 0.00 66.41 67.10 2jpn h THR 52 Cb 0.09 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.58 2jpn h THR 52 CO -0.04 0.18 -0.03 -0.78 0.37 0.00 0.00 175.52 175.22 2jpn h ASP 53 N 1.00 -0.08 -0.38 4.18 1.82 -1.87 -3.06 116.42 118.03 2jpn h ASP 53 Ca 0.29 -0.07 0.00 0.00 -0.39 0.00 0.00 57.03 56.86 2jpn h ASP 53 Cb -0.07 0.02 -0.02 0.00 0.68 0.00 0.00 39.33 39.95 2jpn h ASP 53 CO -0.08 0.02 0.25 -0.78 -1.61 0.00 0.00 179.24 177.03 2jpn h ASP 54 N -0.17 0.44 -0.17 2.28 1.82 -1.45 0.09 116.42 119.26 2jpn h ASP 54 Ca -0.01 -0.02 -0.05 0.00 -0.39 0.00 0.00 57.03 56.56 2jpn h ASP 54 Cb 0.15 -0.11 -0.00 0.00 0.68 0.00 0.00 39.33 40.04 2jpn h ASP 54 CO 0.02 0.33 -0.10 0.16 -1.61 0.00 0.00 179.24 178.04 2jpn h ILE 55 N 0.51 1.32 -0.01 2.25 3.07 -1.65 0.20 117.51 123.20 2jpn h ILE 55 Ca 0.14 -1.17 -0.00 0.00 1.55 0.00 0.00 64.86 65.38 2jpn h ILE 55 Cb -0.05 1.74 -0.00 0.00 -0.27 0.00 0.00 36.82 38.24 2jpn h ILE 55 CO -0.03 0.35 0.00 -1.28 -1.05 0.00 0.00 178.15 176.14 2jpn h SER 56 N 0.03 0.02 -0.19 2.16 0.87 -1.18 -1.08 113.55 114.18 2jpn h SER 56 Ca 0.03 -0.23 -0.05 0.00 -1.23 0.00 0.00 61.79 60.32 2jpn h SER 56 Cb 0.59 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.54 2jpn h SER 56 CO 0.03 0.24 -0.07 -0.37 -0.53 0.00 0.00 176.83 176.13 2jpn h VAL 57 N -0.21 1.30 -0.18 2.23 -1.51 -1.15 -2.71 116.25 114.02 2jpn h VAL 57 Ca 0.00 -1.08 -0.12 0.00 -1.23 0.00 0.00 66.70 64.28 2jpn h VAL 57 Cb 0.23 1.62 -0.01 0.00 -2.13 0.00 0.00 31.29 31.00 2jpn h VAL 57 CO 0.00 0.32 -0.40 -0.09 -1.23 0.00 0.00 177.57 176.18 2jpn h ARG 58 N 0.07 0.41 -0.01 5.19 9.65 -0.45 0.51 114.38 129.75 2jpn h ARG 58 Ca 0.04 -0.20 -0.14 0.00 -1.10 0.00 0.00 59.98 58.58 2jpn h ARG 58 Cb 0.53 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.09 2jpn h ARG 58 CO 0.02 0.75 -0.67 0.22 2.80 0.00 0.00 179.97 183.09 2jpn h ASP 59 N 0.35 0.05 -0.09 -3.80 3.58 -1.26 0.30 116.42 115.54 2jpn h ASP 59 Ca 0.03 -0.04 -0.06 0.00 0.42 0.00 0.00 57.03 57.39 2jpn h ASP 59 Cb 0.85 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.88 2jpn h ASP 59 CO 0.07 0.71 -0.17 0.00 -2.88 0.00 0.00 179.24 176.96 2jpn h ALA 60 N 1.29 0.15 0.08 -0.78 0.00 -1.04 -0.75 119.26 118.21 2jpn h ALA 60 Ca -0.01 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 2jpn h ALA 60 Cb 1.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2jpn h ALA 60 CO 0.09 0.07 -0.04 1.25 0.00 0.00 0.00 179.25 180.62 2jpn h LEU 61 N -0.17 -0.09 -1.89 0.00 6.46 0.11 0.54 115.31 120.27 2jpn h LEU 61 Ca 0.01 -0.45 -0.01 0.00 -0.12 0.00 0.00 57.88 57.31 2jpn h LEU 61 Cb 0.75 0.02 -0.00 0.00 -0.73 0.00 0.00 40.66 40.70 2jpn h LEU 61 CO 0.04 0.43 0.01 0.00 -0.62 0.00 0.00 178.44 178.30 2jpn h ALA 62 N 0.18 1.91 0.14 1.25 0.00 -0.61 0.12 119.26 122.26 2jpn h ALA 62 Ca -0.01 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.89 2jpn h ALA 62 Cb 0.53 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 2jpn h ALA 62 CO 0.02 0.07 -0.36 0.78 0.00 0.00 0.00 179.25 179.75 2jpn h GLY 63 N 0.15 -0.72 1.59 0.00 0.00 -0.54 -2.90 103.07 100.66 2jpn h GLY 63 Ca 0.02 0.43 -0.13 0.00 0.00 0.00 0.00 47.33 47.65 2jpn h GLY 63 CO -0.00 -0.26 -0.43 1.70 0.00 0.00 0.00 176.54 177.55 2jpn h LYS 64 N -0.61 0.45 -0.41 4.80 1.63 0.24 -3.37 116.57 119.30 2jpn h LYS 64 Ca 0.02 -0.23 0.05 0.00 -0.85 0.00 0.00 60.65 59.64 2jpn h LYS 64 Cb 0.63 0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 32.22 2jpn h LYS 64 CO -0.20 0.80 0.13 -0.09 -3.45 0.00 0.00 179.45 176.63 2jpn h ARG 65 N 0.37 0.27 -0.64 1.90 2.43 -0.54 0.22 114.38 118.39 2jpn h ARG 65 Ca 0.03 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.19 2jpn h ARG 65 Cb 0.91 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.36 2jpn h ARG 65 CO 0.08 0.18 0.43 0.00 -1.51 0.00 0.00 179.97 179.14 2jpn h ALA 66 N 1.28 1.54 -0.12 2.80 0.00 -1.71 0.32 119.26 123.36 2jpn h ALA 66 Ca 0.19 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 2jpn h ALA 66 Cb 0.19 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2jpn h ALA 66 CO -0.21 0.43 -0.02 0.93 0.00 0.00 0.00 179.25 180.38 2jpn h GLU 67 N 0.87 0.23 -0.14 0.00 4.39 -1.05 -0.93 114.58 117.96 2jpn h GLU 67 Ca 0.24 -0.09 -0.09 0.00 0.34 0.00 0.00 59.36 59.76 2jpn h GLU 67 Cb -0.10 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 2jpn h GLU 67 CO -0.05 0.52 -0.31 -0.07 -1.16 0.00 0.00 179.01 177.93 2jpn h LEU 68 N -0.07 0.27 -0.39 1.33 3.38 -0.14 0.16 115.31 119.85 2jpn h LEU 68 Ca 0.03 -0.09 -0.18 0.00 0.09 0.00 0.00 57.88 57.73 2jpn h LEU 68 Cb 0.43 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2jpn h LEU 68 CO 0.01 0.58 -0.80 -0.33 0.09 0.00 0.00 178.44 177.99 2jpn h GLU 69 N 0.24 0.15 0.00 1.13 5.08 -0.98 -1.05 114.58 119.14 2jpn h GLU 69 Ca 0.03 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2jpn h GLU 69 Cb 0.67 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.96 2jpn h GLU 69 CO 0.05 0.87 0.00 -0.25 -1.00 0.00 0.00 179.01 178.68 2jpn n ASP 70 N -3.68 0.54 -1.38 1.42 8.00 -0.35 -2.87 116.55 118.22 2jpn n ASP 70 Ca -0.03 0.61 0.05 0.00 0.71 0.00 0.00 54.79 56.14 2jpn n ASP 70 Cb 0.76 -0.74 0.31 0.00 -0.02 0.00 0.00 41.12 41.43 2jpn n ASP 70 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2jpn n SER 71 N -2.08 4.55 0.22 -2.24 2.88 0.02 -4.74 113.62 112.23 2jpn n SER 71 Ca 0.03 -3.07 0.17 0.00 -1.33 0.00 0.00 58.87 54.68 2jpn n SER 71 Cb 0.26 -0.62 0.86 0.00 -0.75 0.00 0.00 64.21 63.95 2jpn n SER 71 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 2jpn h ASP 72 N 2.58 0.00 -1.05 -3.46 3.58 -1.11 -3.43 116.42 113.53 2jpn h ASP 72 Ca 0.05 0.00 -0.55 0.00 0.42 0.00 0.00 57.03 56.95 2jpn h ASP 72 Cb 1.76 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.78 2jpn h ASP 72 CO 0.39 0.00 1.58 0.47 -2.88 0.00 0.00 179.24 178.80 2jpn n ASP 73 N -3.70 1.81 -4.64 2.28 9.92 -1.26 -4.88 116.55 116.08 2jpn n ASP 73 Ca 0.01 0.02 -0.43 0.00 -0.53 0.00 0.00 54.79 53.86 2jpn n ASP 73 Cb 0.30 -1.31 -0.02 0.00 -0.64 0.00 0.00 41.12 39.45 2jpn n ASP 73 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2jpn s GLU 74 N 7.62 3.91 0.00 -1.24 2.02 -1.11 -3.65 118.70 126.24 2jpn s GLU 74 Ca 1.11 1.63 0.00 0.00 0.02 0.00 0.00 54.97 57.73 2jpn s GLU 74 Cb -0.69 -3.96 0.00 0.00 0.10 0.00 0.00 34.13 29.58 2jpn s GLU 74 CO 0.40 -1.14 0.00 0.28 0.02 0.00 0.00 175.26 174.82 2jpn n VAL 75 N 6.14 0.00 0.00 2.63 0.31 -1.26 -1.62 118.33 124.53 2jpn n VAL 75 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.50 2jpn n VAL 75 Cb 0.45 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.38 2jpn n VAL 75 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 2jpn n GLU 76 N 0.00 0.00 0.11 5.55 0.28 -1.24 -5.05 120.64 120.29 2jpn n GLU 76 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2jpn n GLU 76 Cb 0.00 -0.38 0.00 0.00 1.43 0.00 0.00 31.44 32.49 2jpn n GLU 76 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 2jpn n GLU 77 N -0.54 0.00 -0.14 3.44 2.13 -0.82 -4.95 120.64 119.76 2jpn n GLU 77 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2jpn n GLU 77 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 2jpn n GLU 77 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2jpn n SER 78 N -2.93 0.00 -0.71 4.31 3.41 -0.85 -2.76 113.62 114.08 2jpn n SER 78 Ca 0.00 -0.65 0.13 0.00 -0.26 0.00 0.00 58.87 58.09 2jpn n SER 78 Cb 0.00 0.00 0.32 0.00 -0.26 0.00 0.00 64.21 64.27 2jpn n SER 78 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21