#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 0.20 0.00 1.61 7.64 -1.26 -4.95 113.62 116.87 2jpn n SER 2 Ca 0.00 -2.06 0.12 0.00 1.01 0.00 0.00 58.87 57.95 2jpn n SER 2 Cb 0.00 -0.21 0.72 0.00 -1.01 0.00 0.00 64.21 63.71 2jpn n SER 2 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2jpn n HIS 3 N -0.12 0.00 -4.11 1.43 -0.00 -1.26 -4.85 115.22 106.31 2jpn n HIS 3 Ca 0.01 0.00 -0.09 0.00 -0.00 0.00 0.00 57.72 57.65 2jpn n HIS 3 Cb 0.69 -0.07 -0.10 0.00 -0.00 0.00 0.00 29.99 30.51 2jpn n HIS 3 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 2jpn s MET 4 N -2.13 0.68 0.00 -0.41 1.00 -1.26 -5.07 119.30 112.10 2jpn s MET 4 Ca 0.34 -1.21 0.28 0.00 0.00 0.00 0.00 55.69 55.10 2jpn s MET 4 Cb 0.17 0.02 1.37 0.00 0.00 0.00 0.00 34.83 36.40 2jpn s MET 4 CO 0.31 -0.06 1.96 1.28 0.00 0.00 0.00 175.02 178.51 2jpn n LEU 5 N 0.18 0.00 -2.31 -0.03 4.77 -1.26 -5.01 117.00 113.35 2jpn n LEU 5 Ca -0.14 0.35 -0.02 0.00 -0.03 0.00 0.00 56.01 56.16 2jpn n LEU 5 Cb 0.60 -0.35 -0.02 0.00 -2.33 0.00 0.00 43.42 41.32 2jpn n LEU 5 CO 0.28 -0.02 -0.51 -0.11 -1.33 0.00 0.00 177.39 175.71 2jpn n LEU 6 N -1.35 -5.85 -0.66 2.23 7.94 -1.26 -4.51 117.00 113.54 2jpn n LEU 6 Ca 0.12 2.28 -0.09 0.00 -1.11 0.00 0.00 56.01 57.21 2jpn n LEU 6 Cb 0.26 -2.98 -0.04 0.00 0.53 0.00 0.00 43.42 41.19 2jpn n LEU 6 CO 0.23 -3.03 -0.08 -0.62 -1.11 0.00 0.00 177.39 172.78 2jpn n GLU 7 N 1.55 -1.72 0.00 1.96 1.02 -1.26 -4.41 120.64 117.78 2jpn n GLU 7 Ca -0.18 0.80 0.00 0.00 -0.02 0.00 0.00 57.16 57.76 2jpn n GLU 7 Cb 0.27 -5.22 0.00 0.00 -0.02 0.00 0.00 31.44 26.48 2jpn n GLU 7 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 2jpn n PHE 8 N -2.19 0.00 0.14 -0.32 1.16 -1.26 -4.71 117.46 110.28 2jpn n PHE 8 Ca -0.09 0.00 0.01 0.00 -1.87 0.00 0.00 57.45 55.51 2jpn n PHE 8 Cb 0.56 -0.35 0.33 0.00 -1.61 0.00 0.00 39.48 38.42 2jpn n PHE 8 CO 0.00 0.00 0.00 0.87 -1.87 0.00 0.00 176.76 175.76 2jpn h LYS 9 N 0.00 0.14 0.00 3.97 1.57 -1.90 -3.39 116.57 116.97 2jpn h LYS 9 Ca 0.00 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2jpn h LYS 9 Cb 0.00 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.30 2jpn h LYS 9 CO 0.00 0.44 -0.04 1.96 -0.57 0.00 0.00 179.45 181.24 2jpn h GLN 10 N 0.13 0.00 -0.42 3.15 4.20 -1.84 -1.00 115.11 119.33 2jpn h GLN 10 Ca 0.02 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.78 2jpn h GLN 10 Cb 0.60 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.36 2jpn h GLN 10 CO 0.04 0.04 0.28 0.27 -0.67 0.00 0.00 178.83 178.79 2jpn h PHE 11 N 0.00 0.37 0.00 2.96 -0.00 -1.93 -1.72 116.94 116.61 2jpn h PHE 11 Ca -0.00 0.01 -0.06 0.00 -0.00 0.00 0.00 57.97 57.92 2jpn h PHE 11 Cb 0.34 -0.12 -0.01 0.00 -0.00 0.00 0.00 35.95 36.16 2jpn h PHE 11 CO 0.00 0.21 -0.28 -0.07 -0.00 0.00 0.00 178.31 178.17 2jpn h LEU 12 N 0.38 0.00 0.00 2.10 4.07 -1.50 -3.20 115.31 117.15 2jpn h LEU 12 Ca 0.18 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.14 2jpn h LEU 12 Cb 0.24 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.98 2jpn h LEU 12 CO -0.04 0.28 -1.75 -1.22 -1.08 0.00 0.00 178.44 174.62 2jpn n TYR 13 N -3.19 0.20 0.08 1.13 4.01 -0.72 -3.43 117.16 115.23 2jpn n TYR 13 Ca 0.03 0.06 -0.11 0.00 -0.16 0.00 0.00 57.90 57.72 2jpn n TYR 13 Cb 0.62 -0.58 -0.02 0.00 -0.31 0.00 0.00 39.34 39.05 2jpn n TYR 13 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 2jpn h GLU 14 N 0.00 0.29 -0.45 -0.72 4.57 -1.50 -3.35 114.58 113.42 2jpn h GLU 14 Ca 0.00 -0.32 0.00 0.00 -1.18 0.00 0.00 59.36 57.86 2jpn h GLU 14 Cb 0.98 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.64 2jpn h GLU 14 CO 0.00 1.02 0.28 0.00 -1.18 0.00 0.00 179.01 179.12 2jpn h ALA 15 N 0.87 1.65 -0.09 2.92 0.00 -1.62 -3.35 119.26 119.65 2jpn h ALA 15 Ca -0.06 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.83 2jpn h ALA 15 Cb 1.53 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 2jpn h ALA 15 CO 0.15 0.31 0.07 0.77 0.00 0.00 0.00 179.25 180.55 2jpn h SER 16 N 0.61 0.00 0.00 0.00 0.02 -1.70 -3.20 113.55 109.28 2jpn h SER 16 Ca 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 2jpn h SER 16 Cb -0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.50 2jpn h SER 16 CO -0.03 0.00 0.00 -0.38 -1.14 0.00 0.00 176.83 175.28 2jpn n ILE 17 N -4.33 0.08 0.13 3.27 -0.00 -1.25 -4.78 119.36 112.47 2jpn n ILE 17 Ca -0.01 -0.10 -0.01 0.00 -0.00 0.00 0.00 62.75 62.63 2jpn n ILE 17 Cb 0.18 1.34 0.24 0.00 -0.00 0.00 0.00 39.64 41.40 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 0.13 0.00 4.38 3.58 -1.69 -3.32 116.42 119.51 2jpn h ASP 18 Ca 0.00 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.39 2jpn h ASP 18 Cb 0.71 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.73 2jpn h ASP 18 CO 0.00 0.57 -0.65 -1.84 -2.88 0.00 0.00 179.24 174.44 2jpn n GLU 19 N -3.99 0.64 -0.01 0.28 0.28 -1.26 -4.87 120.64 111.71 2jpn n GLU 19 Ca -0.02 0.00 -0.11 0.00 -0.16 0.00 0.00 57.16 56.87 2jpn n GLU 19 Cb 0.50 -0.83 -0.06 0.00 1.43 0.00 0.00 31.44 32.48 2jpn n GLU 19 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 177.13 177.32 2jpn h PHE 20 N 0.00 0.13 -0.21 -1.84 3.04 -1.87 -1.44 116.94 114.75 2jpn h PHE 20 Ca 0.00 -0.00 0.04 0.00 3.98 0.00 0.00 57.97 61.99 2jpn h PHE 20 Cb 0.65 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 39.11 2jpn h PHE 20 CO 0.00 0.18 0.15 0.52 -2.02 0.00 0.00 178.31 177.14 2jpn h MET 21 N 0.05 0.10 -0.16 1.11 2.86 -1.89 0.38 114.93 117.38 2jpn h MET 21 Ca 0.03 -0.01 -0.21 0.00 -2.06 0.00 0.00 59.70 57.46 2jpn h MET 21 Cb 0.09 -0.02 0.01 0.00 0.06 0.00 0.00 31.60 31.74 2jpn h MET 21 CO -0.00 0.07 -0.74 0.78 1.06 0.00 0.00 176.91 178.07 2jpn h GLY 22 N 0.11 0.80 0.95 8.32 0.00 -1.72 0.98 103.07 112.51 2jpn h GLY 22 Ca 0.09 -1.10 -0.07 0.00 0.00 0.00 0.00 47.33 46.25 2jpn h GLY 22 CO -0.01 0.98 -0.03 0.07 0.00 0.00 0.00 176.54 177.54 2jpn h LYS 23 N 0.50 0.72 -0.24 4.80 2.10 0.77 0.14 116.57 125.37 2jpn h LYS 23 Ca -0.04 -0.25 -0.16 0.00 -2.00 0.00 0.00 60.65 58.20 2jpn h LYS 23 Cb 1.35 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 32.63 2jpn h LYS 23 CO 0.15 0.83 -0.48 -0.84 -2.00 0.00 0.00 179.45 177.11 2jpn h ILE 24 N 0.54 1.30 0.00 0.07 3.07 -1.18 -1.59 117.51 119.72 2jpn h ILE 24 Ca 0.11 -1.69 -0.01 0.00 1.55 0.00 0.00 64.86 64.82 2jpn h ILE 24 Cb 0.53 1.77 -0.00 0.00 -0.27 0.00 0.00 36.82 38.84 2jpn h ILE 24 CO 0.03 0.54 -0.04 0.00 -1.05 0.00 0.00 178.15 177.62 2jpn h ALA 25 N 0.63 1.11 -0.40 0.16 0.00 -0.57 -1.41 119.26 118.79 2jpn h ALA 25 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2jpn h ALA 25 Cb 1.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2jpn h ALA 25 CO 0.11 0.05 0.00 -1.13 0.00 0.00 0.00 179.25 178.28 2jpn n SER 26 N -3.30 3.37 -4.58 0.00 3.41 0.48 -4.98 113.62 108.01 2jpn n SER 26 Ca -0.02 -2.22 -0.41 0.00 -0.26 0.00 0.00 58.87 55.96 2jpn n SER 26 Cb 0.20 -0.34 -0.03 0.00 -0.26 0.00 0.00 64.21 63.78 2jpn n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jpn n GLN 28 N 8.64 0.82 -3.70 0.00 6.02 -1.26 -4.74 117.38 123.16 2jpn n GLN 28 Ca 0.15 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 57.01 2jpn n GLN 28 Cb 0.49 -1.02 -0.09 0.00 1.02 0.00 0.00 30.24 30.64 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 -2.00 -0.00 0.21 5.09 -4.23 -1.26 -5.03 115.64 108.41 2jpn s THR 29 Ca 0.02 0.01 0.01 0.00 -1.18 0.00 0.00 61.69 60.54 2jpn s THR 29 Cb 0.01 -0.70 -0.06 0.00 1.34 0.00 0.00 72.50 73.08 2jpn s THR 29 CO 0.01 0.00 1.52 0.25 -0.54 0.00 0.00 174.62 175.86 2jpn h LEU 30 N 5.48 0.43 -1.27 4.79 5.85 -1.85 -0.53 115.31 128.22 2jpn h LEU 30 Ca -0.28 -0.25 0.04 0.00 0.84 0.00 0.00 57.88 58.23 2jpn h LEU 30 Cb 1.18 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 42.04 2jpn h LEU 30 CO 0.19 0.94 0.51 -0.08 -0.34 0.00 0.00 178.44 179.66 2jpn h GLU 31 N 0.28 0.92 -0.13 1.25 4.81 -1.96 0.20 114.58 119.96 2jpn h GLU 31 Ca -0.01 -0.06 -0.19 0.00 -0.13 0.00 0.00 59.36 58.98 2jpn h GLU 31 Cb 1.14 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 30.31 2jpn h GLU 31 CO 0.10 0.61 -0.70 0.78 -0.73 0.00 0.00 179.01 179.07 2jpn h GLY 32 N 0.95 0.63 0.86 1.92 0.00 -1.91 -2.23 103.07 103.29 2jpn h GLY 32 Ca 0.31 -0.85 0.03 0.00 0.00 0.00 0.00 47.33 46.82 2jpn h GLY 32 CO -0.09 0.76 0.36 -2.00 0.00 0.00 0.00 176.54 175.56 2jpn h LEU 33 N 0.40 0.58 -1.16 3.11 5.85 -0.05 0.18 115.31 124.23 2jpn h LEU 33 Ca -0.03 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.62 2jpn h LEU 33 Cb 1.29 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.19 2jpn h LEU 33 CO 0.13 0.40 -0.23 -0.33 -0.34 0.00 0.00 178.44 178.07 2jpn h GLU 34 N 0.70 0.30 -0.22 1.25 4.39 -0.73 0.55 114.58 120.83 2jpn h GLU 34 Ca 0.24 -0.10 -0.15 0.00 0.34 0.00 0.00 59.36 59.69 2jpn h GLU 34 Cb 0.03 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2jpn h GLU 34 CO -0.10 0.52 -0.44 0.93 -1.16 0.00 0.00 179.01 178.76 2jpn h GLU 35 N 0.27 0.68 -0.64 2.33 4.39 -0.78 -0.21 114.58 120.62 2jpn h GLU 35 Ca 0.04 -0.44 -0.02 0.00 0.34 0.00 0.00 59.36 59.29 2jpn h GLU 35 Cb 0.57 0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.24 2jpn h GLU 35 CO 0.04 1.06 0.33 -0.07 -1.16 0.00 0.00 179.01 179.21 2jpn h LEU 36 N 0.38 0.80 -0.63 1.33 4.07 -0.53 0.26 115.31 120.99 2jpn h LEU 36 Ca 0.01 -0.07 -0.04 0.00 0.08 0.00 0.00 57.88 57.86 2jpn h LEU 36 Cb 1.04 -0.20 -0.03 0.00 1.08 0.00 0.00 40.66 42.55 2jpn h LEU 36 CO 0.10 0.66 0.25 -0.08 -1.08 0.00 0.00 178.44 178.29 2jpn h GLU 37 N 0.90 0.94 -0.13 1.13 4.22 0.22 0.11 114.58 121.96 2jpn h GLU 37 Ca 0.23 -0.18 -0.02 0.00 0.08 0.00 0.00 59.36 59.47 2jpn h GLU 37 Cb 0.06 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 2jpn h GLU 37 CO -0.03 0.80 -0.01 0.00 -2.18 0.00 0.00 179.01 177.59 2jpn h ALA 38 N 1.10 0.18 -0.33 2.92 0.00 -0.80 -2.29 119.26 120.03 2jpn h ALA 38 Ca 0.21 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2jpn h ALA 38 Cb 0.21 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2jpn h ALA 38 CO -0.02 -0.11 0.07 -0.92 0.00 0.00 0.00 179.25 178.28 2jpn h TYR 39 N -0.04 0.49 0.60 0.00 3.20 0.16 0.17 116.97 121.55 2jpn h TYR 39 Ca 0.04 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 2jpn h TYR 39 Cb 0.39 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.52 2jpn h TYR 39 CO 0.04 0.44 -0.32 -0.92 -1.64 0.00 0.00 178.16 175.76 2jpn h TYR 40 N 0.48 -0.84 -0.43 -3.82 3.20 -0.85 -0.78 116.97 113.93 2jpn h TYR 40 Ca 0.11 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.94 2jpn h TYR 40 Cb 0.21 0.29 -0.02 0.00 1.54 0.00 0.00 36.73 38.74 2jpn h TYR 40 CO 0.01 -0.50 0.16 0.87 -1.64 0.00 0.00 178.16 177.06 2jpn h LYS 41 N -0.85 0.61 -0.55 1.82 1.79 -0.48 -2.28 116.57 116.63 2jpn h LYS 41 Ca -0.08 -0.08 -0.11 0.00 -2.18 0.00 0.00 60.65 58.20 2jpn h LYS 41 Cb 0.67 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 31.19 2jpn h LYS 41 CO 0.11 0.52 -0.08 0.87 -1.08 0.00 0.00 179.45 179.79 2jpn h LYS 42 N 0.61 1.02 -0.24 3.15 1.79 -0.71 -3.28 116.57 118.91 2jpn h LYS 42 Ca 0.15 -0.37 -0.11 0.00 -2.18 0.00 0.00 60.65 58.14 2jpn h LYS 42 Cb 0.14 -0.07 -0.00 0.00 -1.58 0.00 0.00 32.23 30.71 2jpn h LYS 42 CO -0.01 1.05 -0.28 -0.09 -1.08 0.00 0.00 179.45 179.04 2jpn h ARG 43 N 0.90 0.61 -0.99 3.15 2.43 -0.59 -3.38 114.38 116.51 2jpn h ARG 43 Ca 0.15 -0.34 0.23 0.00 -0.81 0.00 0.00 59.98 59.21 2jpn h ARG 43 Cb 0.64 0.02 -0.09 0.00 -0.42 0.00 0.00 29.97 30.12 2jpn h ARG 43 CO 0.04 0.94 0.63 0.28 -1.51 0.00 0.00 179.97 180.36 2jpn h VAL 44 N 0.32 0.62 0.00 0.20 2.07 -1.50 0.15 116.25 118.11 2jpn h VAL 44 Ca 0.03 -0.17 -0.22 0.00 0.82 0.00 0.00 66.70 67.17 2jpn h VAL 44 Cb 0.85 0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 2jpn h VAL 44 CO 0.07 0.09 -1.09 0.07 0.02 0.00 0.00 177.57 176.73 2jpn h LYS 45 N 0.49 0.00 0.00 1.57 2.10 -1.76 -3.31 116.57 115.66 2jpn h LYS 45 Ca 0.55 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.20 2jpn h LYS 45 Cb 1.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 2jpn h LYS 45 CO -0.28 0.94 0.00 -1.91 -2.00 0.00 0.00 179.45 176.20 2jpn n GLU 46 N -3.31 0.12 0.00 0.07 4.07 0.47 -4.86 120.64 117.19 2jpn n GLU 46 Ca -0.02 0.15 0.00 0.00 -0.06 0.00 0.00 57.16 57.22 2jpn n GLU 46 Cb 0.95 -1.65 0.00 0.00 -0.06 0.00 0.00 31.44 30.68 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 -1.86 0.00 -2.70 6.31 5.66 -0.83 -5.10 114.28 115.76 2jpn n THR 47 Ca 0.06 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 60.99 2jpn n THR 47 Cb 0.35 0.00 0.11 0.00 -1.55 0.00 0.00 70.33 69.24 2jpn n THR 47 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 2jpn n GLU 48 N 0.00 1.13 -1.45 1.09 0.28 -1.25 -4.98 120.64 115.47 2jpn n GLU 48 Ca 0.00 -1.77 -0.57 0.00 -0.16 0.00 0.00 57.16 54.67 2jpn n GLU 48 Cb 0.00 -0.09 -0.09 0.00 1.43 0.00 0.00 31.44 32.68 2jpn n GLU 48 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 2jpn n LEU 49 N -0.54 1.58 -4.94 -1.84 -0.00 -1.26 -4.97 117.00 105.04 2jpn n LEU 49 Ca -0.04 0.70 -0.25 0.00 -0.00 0.00 0.00 56.01 56.42 2jpn n LEU 49 Cb 0.83 -1.07 0.06 0.00 -0.00 0.00 0.00 43.42 43.24 2jpn n LEU 49 CO -0.08 -0.70 0.56 -1.59 -0.00 0.00 0.00 177.39 175.58 2jpn s LYS 50 N 5.39 2.24 0.23 1.96 -2.85 -1.26 -4.99 119.74 120.46 2jpn s LYS 50 Ca 1.11 -0.41 -0.06 0.00 -1.00 0.00 0.00 55.97 55.60 2jpn s LYS 50 Cb -1.19 -2.25 0.33 0.00 -2.06 0.00 0.00 37.83 32.66 2jpn s LYS 50 CO 0.61 -1.13 1.80 -0.44 0.10 0.00 0.00 175.35 176.29 2jpn h ASP 51 N -0.45 0.58 -0.20 0.03 3.32 -2.00 -3.00 116.42 114.71 2jpn h ASP 51 Ca -0.44 0.05 0.01 0.00 0.02 0.00 0.00 57.03 56.67 2jpn h ASP 51 Cb 1.31 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.78 2jpn h ASP 51 CO 0.57 0.35 0.11 0.74 -1.72 0.00 0.00 179.24 179.29 2jpn h THR 52 N 0.71 1.02 -0.38 0.35 2.02 -1.97 -1.57 112.91 113.08 2jpn h THR 52 Ca 0.35 -0.08 -0.01 0.00 0.77 0.00 0.00 66.41 67.44 2jpn h THR 52 Cb 0.31 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 2jpn h THR 52 CO -0.23 0.04 0.19 -0.78 0.37 0.00 0.00 175.52 175.11 2jpn h ASP 53 N 0.23 0.50 -0.26 4.18 1.82 -1.85 -2.72 116.42 118.32 2jpn h ASP 53 Ca 0.08 -0.12 -0.02 0.00 -0.39 0.00 0.00 57.03 56.58 2jpn h ASP 53 Cb -0.00 -0.13 -0.01 0.00 0.68 0.00 0.00 39.33 39.87 2jpn h ASP 53 CO -0.04 0.47 0.10 -0.78 -1.61 0.00 0.00 179.24 177.38 2jpn h ASP 54 N 0.48 0.37 -0.15 2.28 3.58 -1.18 -1.27 116.42 120.53 2jpn h ASP 54 Ca 0.13 -0.18 -0.05 0.00 0.42 0.00 0.00 57.03 57.35 2jpn h ASP 54 Cb 0.10 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 41.05 2jpn h ASP 54 CO -0.02 0.45 -0.10 0.40 -2.88 0.00 0.00 179.24 177.10 2jpn h ILE 55 N 0.27 1.33 -0.02 2.25 5.03 -1.40 -0.92 117.51 124.04 2jpn h ILE 55 Ca 0.09 -1.19 -0.00 0.00 -0.12 0.00 0.00 64.86 63.64 2jpn h ILE 55 Cb 0.20 1.79 -0.00 0.00 -3.03 0.00 0.00 36.82 35.78 2jpn h ILE 55 CO -0.01 0.35 0.00 0.28 -0.68 0.00 0.00 178.15 178.10 2jpn h SER 56 N -0.02 0.03 -0.21 1.72 0.02 -1.18 -0.28 113.55 113.63 2jpn h SER 56 Ca 0.03 -0.23 -0.05 0.00 -0.84 0.00 0.00 61.79 60.70 2jpn h SER 56 Cb 0.59 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 2jpn h SER 56 CO 0.03 0.25 -0.08 1.62 -1.14 0.00 0.00 176.83 177.51 2jpn h VAL 57 N -0.20 1.30 -0.58 2.27 3.04 -1.38 -3.04 116.25 117.67 2jpn h VAL 57 Ca 0.01 -1.11 -0.03 0.00 -1.01 0.00 0.00 66.70 64.56 2jpn h VAL 57 Cb 0.23 1.59 -0.03 0.00 -2.01 0.00 0.00 31.29 31.08 2jpn h VAL 57 CO 0.00 0.34 0.25 -0.09 -1.01 0.00 0.00 177.57 177.06 2jpn h ARG 58 N 0.13 0.85 0.00 4.17 9.65 -1.07 0.26 114.38 128.38 2jpn h ARG 58 Ca 0.05 -0.14 -0.07 0.00 -1.10 0.00 0.00 59.98 58.72 2jpn h ARG 58 Cb 0.55 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.98 2jpn h ARG 58 CO 0.03 0.72 -0.33 0.22 2.80 0.00 0.00 179.97 183.41 2jpn h ASP 59 N 0.79 0.00 -0.16 -3.80 3.58 -1.09 0.57 116.42 116.31 2jpn h ASP 59 Ca 0.20 0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.54 2jpn h ASP 59 Cb 0.17 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.22 2jpn h ASP 59 CO -0.02 0.33 -0.33 0.00 -2.88 0.00 0.00 179.24 176.34 2jpn h ALA 60 N 1.67 0.25 0.08 -0.78 0.00 -1.35 0.21 119.26 119.34 2jpn h ALA 60 Ca -0.00 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 2jpn h ALA 60 Cb 0.61 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2jpn h ALA 60 CO 0.04 0.30 -0.04 1.25 0.00 0.00 0.00 179.25 180.81 2jpn h LEU 61 N 0.13 -0.09 -1.93 0.00 6.46 0.10 0.52 115.31 120.51 2jpn h LEU 61 Ca 0.00 -0.45 0.03 0.00 -0.12 0.00 0.00 57.88 57.34 2jpn h LEU 61 Cb 0.93 0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.87 2jpn h LEU 61 CO 0.07 0.43 0.11 0.00 -0.62 0.00 0.00 178.44 178.43 2jpn h ALA 62 N 0.20 2.03 -0.04 1.25 0.00 -0.07 0.10 119.26 122.73 2jpn h ALA 62 Ca -0.01 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.93 2jpn h ALA 62 Cb 0.53 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 2jpn h ALA 62 CO 0.02 -0.06 -0.30 0.78 0.00 0.00 0.00 179.25 179.69 2jpn h GLY 63 N 0.09 -0.46 1.59 0.00 0.00 -0.41 -2.94 103.07 100.93 2jpn h GLY 63 Ca 0.07 0.37 -0.13 0.00 0.00 0.00 0.00 47.33 47.64 2jpn h GLY 63 CO -0.01 -0.22 -0.43 1.70 0.00 0.00 0.00 176.54 177.58 2jpn h LYS 64 N -0.43 0.45 -0.40 4.80 1.63 0.59 -3.35 116.57 119.86 2jpn h LYS 64 Ca 0.07 -0.24 0.05 0.00 -0.85 0.00 0.00 60.65 59.69 2jpn h LYS 64 Cb 0.54 0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 32.13 2jpn h LYS 64 CO -0.28 0.80 0.13 -0.09 -3.45 0.00 0.00 179.45 176.56 2jpn h ARG 65 N 0.37 0.27 -0.63 1.90 2.43 -0.62 0.27 114.38 118.37 2jpn h ARG 65 Ca 0.03 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2jpn h ARG 65 Cb 0.91 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.37 2jpn h ARG 65 CO 0.08 0.18 0.39 0.00 -1.51 0.00 0.00 179.97 179.10 2jpn h ALA 66 N 1.27 1.50 -0.12 2.80 0.00 -1.69 0.10 119.26 123.13 2jpn h ALA 66 Ca 0.19 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2jpn h ALA 66 Cb 0.19 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2jpn h ALA 66 CO -0.21 0.44 -0.03 0.93 0.00 0.00 0.00 179.25 180.38 2jpn h GLU 67 N 0.86 0.23 -0.14 0.00 4.39 -0.97 -2.08 114.58 116.86 2jpn h GLU 67 Ca 0.23 -0.09 -0.09 0.00 0.34 0.00 0.00 59.36 59.75 2jpn h GLU 67 Cb -0.05 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 2jpn h GLU 67 CO -0.04 0.53 -0.33 -0.07 -1.16 0.00 0.00 179.01 177.94 2jpn h LEU 68 N -0.08 0.28 -0.41 1.33 3.38 -0.05 -0.92 115.31 118.83 2jpn h LEU 68 Ca 0.03 -0.10 -0.17 0.00 0.09 0.00 0.00 57.88 57.73 2jpn h LEU 68 Cb 0.44 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2jpn h LEU 68 CO 0.01 0.60 -0.79 -0.33 0.09 0.00 0.00 178.44 178.02 2jpn h GLU 69 N 0.24 0.10 0.00 1.13 5.08 -0.86 -0.75 114.58 119.52 2jpn h GLU 69 Ca 0.03 -0.10 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 2jpn h GLU 69 Cb 0.70 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 2jpn h GLU 69 CO 0.05 0.84 -0.37 0.22 -1.00 0.00 0.00 179.01 178.76 2jpn h ASP 70 N 0.06 0.00 -0.54 1.42 3.58 -1.18 -3.25 116.42 116.51 2jpn h ASP 70 Ca -0.02 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.26 2jpn h ASP 70 Cb 1.39 0.00 -0.10 0.00 1.72 0.00 0.00 39.33 42.34 2jpn h ASP 70 CO 0.11 0.37 0.21 -0.24 -2.88 0.00 0.00 179.24 176.81 2jpn n SER 71 N -4.00 3.96 0.24 2.28 2.88 -0.36 -4.75 113.62 113.86 2jpn n SER 71 Ca -0.02 -2.87 0.11 0.00 -1.33 0.00 0.00 58.87 54.76 2jpn n SER 71 Cb 0.41 -0.68 0.57 0.00 -0.75 0.00 0.00 64.21 63.76 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 1.83 0.00 -0.75 -3.46 3.58 -1.32 -3.45 116.42 112.86 2jpn h ASP 72 Ca 0.21 0.00 -0.59 0.00 0.42 0.00 0.00 57.03 57.07 2jpn h ASP 72 Cb 1.90 0.00 0.04 0.00 1.72 0.00 0.00 39.33 42.98 2jpn h ASP 72 CO 0.54 0.00 0.04 0.47 -2.88 0.00 0.00 179.24 177.41 2jpn n ASP 73 N -2.42 -0.02 -4.54 2.28 9.92 -1.26 -4.98 116.55 115.53 2jpn n ASP 73 Ca -0.01 0.87 -0.26 0.00 -0.53 0.00 0.00 54.79 54.86 2jpn n ASP 73 Cb 0.33 -0.69 -0.09 0.00 -0.64 0.00 0.00 41.12 40.02 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 -0.01 1.93 0.10 -1.24 2.02 -1.26 -4.84 118.70 115.41 2jpn s GLU 74 Ca 0.68 -1.44 -0.36 0.00 0.02 0.00 0.00 54.97 53.87 2jpn s GLU 74 Cb -0.95 -2.03 -0.17 0.00 0.10 0.00 0.00 34.13 31.08 2jpn s GLU 74 CO 0.43 0.40 1.21 0.28 0.02 0.00 0.00 175.26 177.59 2jpn n VAL 75 N -0.22 0.34 0.00 2.63 0.31 -1.26 -2.03 118.33 118.10 2jpn n VAL 75 Ca -0.09 -0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 2jpn n VAL 75 Cb 0.57 -0.65 0.00 0.00 -0.91 0.00 0.00 33.84 32.85 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 2.05 0.00 0.07 5.55 0.28 0.27 -4.52 120.64 124.34 2jpn n GLU 76 Ca 0.18 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 57.08 2jpn n GLU 76 Cb 0.19 -1.52 0.01 0.00 1.43 0.00 0.00 31.44 31.55 2jpn n GLU 76 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 2jpn h GLU 77 N 0.00 0.33 0.00 3.44 5.08 -1.99 -3.39 114.58 118.04 2jpn h GLU 77 Ca 0.00 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 2jpn h GLU 77 Cb 0.00 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2jpn h GLU 77 CO 0.00 0.98 -0.02 -1.13 -1.00 0.00 0.00 179.01 177.84 2jpn n SER 78 N -3.77 0.00 0.00 1.42 3.41 -0.86 -5.01 113.62 108.82 2jpn n SER 78 Ca -0.04 -1.04 0.00 0.00 -0.26 0.00 0.00 58.87 57.53 2jpn n SER 78 Cb 0.76 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.70 2jpn n SER 78 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21