#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 0.35 -3.73 1.61 7.64 -1.26 -5.08 113.62 113.15 2jpn n SER 2 Ca 0.00 -1.38 -0.13 0.00 1.01 0.00 0.00 58.87 58.38 2jpn n SER 2 Cb 0.00 -0.05 -0.10 0.00 -1.01 0.00 0.00 64.21 63.05 2jpn n SER 2 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2jpn s HIS 3 N -0.23 -0.46 0.41 1.43 2.46 -1.26 -5.14 115.29 112.50 2jpn s HIS 3 Ca 0.01 1.10 0.00 0.00 0.47 0.00 0.00 55.06 56.64 2jpn s HIS 3 Cb 0.01 0.17 0.00 0.00 -0.13 0.00 0.00 32.58 32.63 2jpn s HIS 3 CO 0.00 -0.23 0.00 -1.33 -2.47 0.00 0.00 174.74 170.71 2jpn n MET 4 N 3.10 -2.58 0.16 2.88 0.00 -1.26 -4.66 117.12 114.77 2jpn n MET 4 Ca -0.15 1.95 0.13 0.00 0.00 0.00 0.00 57.70 59.63 2jpn n MET 4 Cb 0.57 -3.17 0.32 0.00 0.00 0.00 0.00 33.22 30.94 2jpn n MET 4 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 2jpn h LEU 5 N -1.34 0.00 0.00 4.03 4.07 -2.00 -3.48 115.31 116.59 2jpn h LEU 5 Ca -0.08 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.88 2jpn h LEU 5 Cb 1.29 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.03 2jpn h LEU 5 CO 0.04 0.00 0.00 0.18 -1.08 0.00 0.00 178.44 177.58 2jpn n LEU 6 N -2.65 0.92 -3.45 1.67 4.77 -1.26 -4.89 117.00 112.11 2jpn n LEU 6 Ca 0.05 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.00 2jpn n LEU 6 Cb 0.46 -1.67 -0.05 0.00 -2.33 0.00 0.00 43.42 39.83 2jpn n LEU 6 CO 0.31 -0.60 0.13 -0.70 -1.33 0.00 0.00 177.39 175.20 2jpn s GLU 7 N -1.20 0.48 0.49 3.23 2.12 -1.26 -5.08 118.70 117.49 2jpn s GLU 7 Ca 0.00 1.08 0.14 0.00 0.36 0.00 0.00 54.97 56.55 2jpn s GLU 7 Cb 0.00 0.44 1.15 0.00 0.26 0.00 0.00 34.13 35.98 2jpn s GLU 7 CO 0.00 -0.41 2.11 0.74 -0.54 0.00 0.00 175.26 177.16 2jpn h PHE 8 N 8.07 0.11 -0.32 5.30 0.04 -2.03 -2.98 116.94 125.13 2jpn h PHE 8 Ca -0.19 0.00 0.07 0.00 2.80 0.00 0.00 57.97 60.64 2jpn h PHE 8 Cb 1.13 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 39.23 2jpn h PHE 8 CO 0.16 0.09 0.22 0.87 -0.60 0.00 0.00 178.31 179.06 2jpn h LYS 9 N 0.12 0.13 0.00 1.51 1.57 -1.99 -3.21 116.57 114.70 2jpn h LYS 9 Ca 0.03 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2jpn h LYS 9 Cb 0.03 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2jpn h LYS 9 CO -0.00 0.08 0.00 1.04 -0.57 0.00 0.00 179.45 180.00 2jpn n GLN 10 N -4.47 0.01 -0.00 3.15 6.02 -1.13 -3.72 117.38 117.24 2jpn n GLN 10 Ca 0.04 0.15 0.08 0.00 -0.01 0.00 0.00 57.00 57.26 2jpn n GLN 10 Cb 0.30 -1.51 0.49 0.00 1.02 0.00 0.00 30.24 30.54 2jpn n GLN 10 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 2jpn h PHE 11 N 0.00 0.41 0.00 1.08 -0.00 -1.79 0.19 116.94 116.82 2jpn h PHE 11 Ca 0.00 0.01 -0.05 0.00 -0.00 0.00 0.00 57.97 57.93 2jpn h PHE 11 Cb 0.37 -0.14 -0.01 0.00 -0.00 0.00 0.00 35.95 36.17 2jpn h PHE 11 CO 0.00 0.23 -0.36 1.37 -0.00 0.00 0.00 178.31 179.55 2jpn h LEU 12 N 0.42 0.00 0.00 2.10 -0.00 -1.86 -1.87 115.31 114.09 2jpn h LEU 12 Ca 0.18 0.00 -0.14 0.00 -0.00 0.00 0.00 57.88 57.93 2jpn h LEU 12 Cb 0.21 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.84 2jpn h LEU 12 CO -0.04 0.21 -1.24 1.88 -0.00 0.00 0.00 178.44 179.25 2jpn h TYR 13 N 0.00 0.00 0.05 0.17 0.05 -1.51 -3.36 116.97 112.37 2jpn h TYR 13 Ca -0.01 0.00 -0.26 0.00 0.05 0.00 0.00 58.73 58.51 2jpn h TYR 13 Cb 1.17 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.92 2jpn h TYR 13 CO 0.00 0.49 -1.08 1.49 -1.05 0.00 0.00 178.16 178.01 2jpn h GLU 14 N 0.00 0.49 -1.25 4.88 4.81 -0.71 -3.34 114.58 119.45 2jpn h GLU 14 Ca -0.12 -0.60 0.41 0.00 -0.13 0.00 0.00 59.36 58.92 2jpn h GLU 14 Cb 1.48 0.18 -0.13 0.00 0.63 0.00 0.00 28.75 30.92 2jpn h GLU 14 CO 0.04 1.23 0.80 0.00 -0.73 0.00 0.00 179.01 180.35 2jpn h ALA 15 N 0.55 2.60 -0.32 2.92 0.00 -1.48 -2.96 119.26 120.58 2jpn h ALA 15 Ca -0.12 0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2jpn h ALA 15 Cb 1.74 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.70 2jpn h ALA 15 CO 0.19 -1.21 0.22 0.77 0.00 0.00 0.00 179.25 179.22 2jpn h SER 16 N 0.13 0.28 0.00 0.00 0.02 -1.71 -3.24 113.55 109.03 2jpn h SER 16 Ca 0.79 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.74 2jpn h SER 16 Cb 2.38 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 64.85 2jpn h SER 16 CO -0.43 0.19 0.00 -0.38 -1.14 0.00 0.00 176.83 175.07 2jpn n ILE 17 N -4.49 0.29 0.16 3.27 -0.00 -1.12 -4.70 119.36 112.77 2jpn n ILE 17 Ca 0.03 -0.39 0.01 0.00 -0.00 0.00 0.00 62.75 62.39 2jpn n ILE 17 Cb 0.16 1.06 0.24 0.00 -0.00 0.00 0.00 39.64 41.10 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 -1.59 -3.36 116.42 119.43 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 0.55 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.60 2jpn h ASP 18 CO 0.00 0.52 -0.29 -0.62 -2.88 0.00 0.00 179.24 175.98 2jpn n GLU 19 N -3.85 0.15 -0.11 0.28 1.02 -1.26 -4.88 120.64 111.99 2jpn n GLU 19 Ca -0.01 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.06 2jpn n GLU 19 Cb 0.55 -0.64 0.02 0.00 -0.02 0.00 0.00 31.44 31.34 2jpn n GLU 19 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2jpn h PHE 20 N 0.00 0.32 -0.25 -0.32 3.04 -1.84 0.42 116.94 118.31 2jpn h PHE 20 Ca 0.00 0.02 0.04 0.00 3.98 0.00 0.00 57.97 62.01 2jpn h PHE 20 Cb 0.29 -0.09 -0.01 0.00 2.56 0.00 0.00 35.95 38.69 2jpn h PHE 20 CO 0.00 0.16 0.17 0.52 -2.02 0.00 0.00 178.31 177.15 2jpn h MET 21 N 0.37 0.14 -0.16 1.11 2.86 -1.87 0.17 114.93 117.55 2jpn h MET 21 Ca 0.16 -0.01 -0.21 0.00 -2.06 0.00 0.00 59.70 57.58 2jpn h MET 21 Cb 0.09 -0.03 0.01 0.00 0.06 0.00 0.00 31.60 31.72 2jpn h MET 21 CO -0.12 0.09 -0.74 0.78 1.06 0.00 0.00 176.91 177.97 2jpn h GLY 22 N 0.14 0.81 0.95 8.32 0.00 -1.49 -0.47 103.07 111.34 2jpn h GLY 22 Ca 0.11 -1.12 -0.08 0.00 0.00 0.00 0.00 47.33 46.24 2jpn h GLY 22 CO -0.02 1.00 -0.10 0.07 0.00 0.00 0.00 176.54 177.49 2jpn h LYS 23 N 0.51 0.70 -0.28 4.80 2.10 0.13 0.24 116.57 124.78 2jpn h LYS 23 Ca -0.04 -0.28 -0.15 0.00 -2.00 0.00 0.00 60.65 58.18 2jpn h LYS 23 Cb 1.36 -0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 32.65 2jpn h LYS 23 CO 0.15 0.87 -0.42 -0.84 -2.00 0.00 0.00 179.45 177.21 2jpn h ILE 24 N 0.50 1.29 0.00 0.07 3.07 -1.10 -2.54 117.51 118.80 2jpn h ILE 24 Ca 0.09 -1.61 -0.01 0.00 1.55 0.00 0.00 64.86 64.88 2jpn h ILE 24 Cb 0.62 1.65 -0.00 0.00 -0.27 0.00 0.00 36.82 38.82 2jpn h ILE 24 CO 0.04 0.52 -0.06 0.00 -1.05 0.00 0.00 178.15 177.60 2jpn h ALA 25 N 0.68 1.13 -0.61 0.16 0.00 -0.82 -2.28 119.26 117.52 2jpn h ALA 25 Ca 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2jpn h ALA 25 Cb 1.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2jpn h ALA 25 CO 0.10 0.07 0.00 0.45 0.00 0.00 0.00 179.25 179.87 2jpn n SER 26 N -3.34 4.08 0.26 0.00 2.88 0.81 -4.73 113.62 113.58 2jpn n SER 26 Ca -0.01 -2.22 0.14 0.00 -1.33 0.00 0.00 58.87 55.44 2jpn n SER 26 Cb 0.21 -0.48 0.62 0.00 -0.75 0.00 0.00 64.21 63.81 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 -3.28 0.00 -3.70 0.00 6.02 -1.26 -4.53 117.38 110.63 2jpn n GLN 28 Ca -0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.86 2jpn n GLN 28 Cb 0.34 -4.03 -0.09 0.00 1.02 0.00 0.00 30.24 27.47 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 -1.13 -0.00 0.20 5.09 -4.23 -1.26 -5.04 115.64 109.27 2jpn s THR 29 Ca 0.00 0.01 -0.03 0.00 -1.18 0.00 0.00 61.69 60.48 2jpn s THR 29 Cb 0.00 -0.71 -0.03 0.00 1.34 0.00 0.00 72.50 73.11 2jpn s THR 29 CO 0.00 0.00 1.54 0.25 -0.54 0.00 0.00 174.62 175.87 2jpn h LEU 30 N 5.48 0.65 -1.22 4.79 5.85 -1.88 -0.05 115.31 128.93 2jpn h LEU 30 Ca -0.28 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.12 2jpn h LEU 30 Cb 1.18 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.99 2jpn h LEU 30 CO 0.19 1.02 0.39 -0.08 -0.34 0.00 0.00 178.44 179.62 2jpn h GLU 31 N 0.48 0.92 -0.17 1.25 4.81 -1.94 0.31 114.58 120.24 2jpn h GLU 31 Ca 0.03 -0.09 -0.20 0.00 -0.13 0.00 0.00 59.36 58.98 2jpn h GLU 31 Cb 0.99 -0.19 0.01 0.00 0.63 0.00 0.00 28.75 30.19 2jpn h GLU 31 CO 0.09 0.66 -0.66 0.78 -0.73 0.00 0.00 179.01 179.15 2jpn h GLY 32 N 0.98 0.83 0.89 1.92 0.00 -1.81 -2.79 103.07 103.08 2jpn h GLY 32 Ca 0.24 -1.12 0.03 0.00 0.00 0.00 0.00 47.33 46.49 2jpn h GLY 32 CO -0.04 1.00 0.64 -2.00 0.00 0.00 0.00 176.54 176.14 2jpn h LEU 33 N 0.48 1.07 -1.42 3.11 5.85 0.20 0.38 115.31 124.98 2jpn h LEU 33 Ca -0.03 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.64 2jpn h LEU 33 Cb 1.29 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 2jpn h LEU 33 CO 0.14 0.74 -0.05 -0.33 -0.34 0.00 0.00 178.44 178.60 2jpn h GLU 34 N 1.24 0.33 -0.12 1.25 4.39 -0.56 0.55 114.58 121.67 2jpn h GLU 34 Ca 0.39 -0.06 -0.23 0.00 0.34 0.00 0.00 59.36 59.80 2jpn h GLU 34 Cb -0.01 -0.05 0.01 0.00 -0.10 0.00 0.00 28.75 28.60 2jpn h GLU 34 CO -0.12 0.39 -0.82 0.93 -1.16 0.00 0.00 179.01 178.23 2jpn h GLU 35 N 0.32 0.74 -0.66 2.33 4.39 -0.82 -0.51 114.58 120.36 2jpn h GLU 35 Ca 0.07 -0.63 -0.02 0.00 0.34 0.00 0.00 59.36 59.12 2jpn h GLU 35 Cb 0.29 0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.05 2jpn h GLU 35 CO 0.01 1.24 0.34 -0.07 -1.16 0.00 0.00 179.01 179.37 2jpn h LEU 36 N 0.49 0.83 -0.38 1.33 3.38 -0.09 0.20 115.31 121.07 2jpn h LEU 36 Ca -0.06 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 2jpn h LEU 36 Cb 1.45 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 2jpn h LEU 36 CO 0.16 0.69 -0.17 -0.08 0.09 0.00 0.00 178.44 179.13 2jpn h GLU 37 N 0.93 0.79 -0.10 1.13 4.22 0.21 0.28 114.58 122.03 2jpn h GLU 37 Ca 0.23 -0.34 -0.01 0.00 0.08 0.00 0.00 59.36 59.32 2jpn h GLU 37 Cb 0.06 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 2jpn h GLU 37 CO -0.03 0.96 0.03 0.00 -2.18 0.00 0.00 179.01 177.79 2jpn h ALA 38 N 0.81 0.14 -0.20 2.92 0.00 -0.95 -2.20 119.26 119.77 2jpn h ALA 38 Ca 0.09 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2jpn h ALA 38 Cb 0.72 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2jpn h ALA 38 CO 0.05 -0.24 -0.02 -0.92 0.00 0.00 0.00 179.25 178.12 2jpn h TYR 39 N -0.03 0.29 0.61 0.00 5.03 -0.24 0.16 116.97 122.79 2jpn h TYR 39 Ca 0.03 -0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.30 2jpn h TYR 39 Cb 0.24 -0.09 0.00 0.00 1.55 0.00 0.00 36.73 38.43 2jpn h TYR 39 CO 0.00 0.33 -0.32 -0.92 -1.32 0.00 0.00 178.16 175.93 2jpn h TYR 40 N 0.28 -0.82 -0.75 -3.82 3.20 -0.44 0.07 116.97 114.70 2jpn h TYR 40 Ca 0.07 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.89 2jpn h TYR 40 Cb 0.24 0.28 -0.04 0.00 1.54 0.00 0.00 36.73 38.75 2jpn h TYR 40 CO 0.00 -0.50 0.37 0.87 -1.64 0.00 0.00 178.16 177.26 2jpn h LYS 41 N -0.85 1.06 -0.04 1.82 1.79 -0.53 -1.38 116.57 118.44 2jpn h LYS 41 Ca -0.08 -0.14 -0.01 0.00 -2.18 0.00 0.00 60.65 58.24 2jpn h LYS 41 Cb 0.67 -0.20 -0.00 0.00 -1.58 0.00 0.00 32.23 31.12 2jpn h LYS 41 CO 0.12 0.81 -0.01 0.87 -1.08 0.00 0.00 179.45 180.17 2jpn h LYS 42 N 1.06 0.08 -0.33 3.15 1.79 -0.67 -3.26 116.57 118.39 2jpn h LYS 42 Ca 0.26 -0.03 -0.16 0.00 -2.18 0.00 0.00 60.65 58.54 2jpn h LYS 42 Cb 0.09 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.74 2jpn h LYS 42 CO -0.03 0.41 -0.42 -0.09 -1.08 0.00 0.00 179.45 178.23 2jpn h ARG 43 N -0.26 0.86 -0.28 3.15 2.43 -0.93 -3.40 114.38 115.95 2jpn h ARG 43 Ca 0.01 -0.49 0.08 0.00 -0.81 0.00 0.00 59.98 58.77 2jpn h ARG 43 Cb 0.38 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 2jpn h ARG 43 CO 0.00 1.13 0.20 0.28 -1.51 0.00 0.00 179.97 180.08 2jpn h VAL 44 N 0.65 0.87 -0.22 0.20 2.07 -1.29 0.43 116.25 118.96 2jpn h VAL 44 Ca 0.04 -0.01 -0.09 0.00 0.82 0.00 0.00 66.70 67.46 2jpn h VAL 44 Cb 1.02 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 2jpn h VAL 44 CO 0.10 0.00 -0.27 0.07 0.02 0.00 0.00 177.57 177.49 2jpn h LYS 45 N 0.03 0.42 0.00 1.57 2.10 -1.76 -3.26 116.57 115.66 2jpn h LYS 45 Ca 0.13 -0.16 -0.11 0.00 -2.00 0.00 0.00 60.65 58.52 2jpn h LYS 45 Cb 0.50 -0.02 -0.02 0.00 -0.90 0.00 0.00 32.23 31.79 2jpn h LYS 45 CO -0.01 0.66 -0.50 1.49 -2.00 0.00 0.00 179.45 179.09 2jpn h GLU 46 N 0.37 0.00 0.00 0.07 4.81 -0.37 -3.48 114.58 115.99 2jpn h GLU 46 Ca 0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 2jpn h GLU 46 Cb 0.68 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.06 2jpn h GLU 46 CO 0.05 0.50 0.00 -2.37 -0.73 0.00 0.00 179.01 176.46 2jpn n THR 47 N -3.60 0.00 -1.87 0.32 5.66 -1.00 -5.11 114.28 108.67 2jpn n THR 47 Ca -0.00 0.00 0.05 0.00 -3.05 0.00 0.00 64.05 61.05 2jpn n THR 47 Cb 0.58 0.00 0.11 0.00 -1.55 0.00 0.00 70.33 69.47 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 0.82 -1.68 1.09 1.02 -1.26 -4.97 120.64 115.66 2jpn n GLU 48 Ca 0.00 -2.48 -0.53 0.00 -0.02 0.00 0.00 57.16 54.13 2jpn n GLU 48 Cb 0.00 -0.92 -0.06 0.00 -0.02 0.00 0.00 31.44 30.43 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 -0.49 2.57 -4.95 -4.62 -0.00 -1.26 -5.00 117.00 103.25 2jpn n LEU 49 Ca 0.12 1.06 -0.25 0.00 -0.00 0.00 0.00 56.01 56.94 2jpn n LEU 49 Cb 0.84 -1.23 0.02 0.00 -0.00 0.00 0.00 43.42 43.04 2jpn n LEU 49 CO -0.03 -0.44 0.15 -1.59 -0.00 0.00 0.00 177.39 175.48 2jpn s LYS 50 N 2.85 2.23 0.26 1.96 -2.85 -1.26 -5.03 119.74 117.91 2jpn s LYS 50 Ca 0.93 -1.98 -0.02 0.00 -1.00 0.00 0.00 55.97 53.90 2jpn s LYS 50 Cb -0.92 -2.22 0.48 0.00 -2.06 0.00 0.00 37.83 33.11 2jpn s LYS 50 CO 0.56 -0.76 1.81 0.38 0.10 0.00 0.00 175.35 177.44 2jpn h ASP 51 N 0.53 0.73 -0.16 0.03 2.03 -2.00 -3.07 116.42 114.51 2jpn h ASP 51 Ca -0.34 0.06 0.00 0.00 -0.73 0.00 0.00 57.03 56.02 2jpn h ASP 51 Cb 1.30 -0.08 -0.01 0.00 -0.83 0.00 0.00 39.33 39.71 2jpn h ASP 51 CO 0.52 0.39 0.10 0.74 -1.03 0.00 0.00 179.24 179.96 2jpn h THR 52 N 0.83 1.03 -0.34 1.15 2.02 -1.96 -1.92 112.91 113.72 2jpn h THR 52 Ca 0.45 -0.07 -0.01 0.00 0.77 0.00 0.00 66.41 67.54 2jpn h THR 52 Cb 0.47 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 2jpn h THR 52 CO -0.28 0.04 0.17 -2.24 0.37 0.00 0.00 175.52 173.58 2jpn h ASP 53 N 0.21 0.44 -0.28 4.18 3.04 -1.85 -3.20 116.42 118.96 2jpn h ASP 53 Ca 0.06 -0.12 -0.02 0.00 -3.24 0.00 0.00 57.03 53.71 2jpn h ASP 53 Cb -0.01 -0.11 -0.01 0.00 -1.04 0.00 0.00 39.33 38.15 2jpn h ASP 53 CO -0.02 0.44 0.10 -0.78 -2.04 0.00 0.00 179.24 176.94 2jpn h ASP 54 N 0.41 0.39 -0.16 4.15 3.58 -1.27 -0.44 116.42 123.10 2jpn h ASP 54 Ca 0.12 -0.18 -0.05 0.00 0.42 0.00 0.00 57.03 57.33 2jpn h ASP 54 Cb 0.11 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 41.06 2jpn h ASP 54 CO -0.02 0.47 -0.10 0.40 -2.88 0.00 0.00 179.24 177.12 2jpn h ILE 55 N 0.29 1.32 -0.02 2.25 5.03 -1.59 -0.73 117.51 124.07 2jpn h ILE 55 Ca 0.09 -1.17 -0.00 0.00 -0.12 0.00 0.00 64.86 63.66 2jpn h ILE 55 Cb 0.21 1.76 -0.00 0.00 -3.03 0.00 0.00 36.82 35.76 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 0.00 0.03 -0.22 1.72 0.02 -1.46 0.40 113.55 114.04 2jpn h SER 56 Ca 0.03 -0.23 -0.06 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 63.11 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 -0.19 1.29 -0.58 2.27 3.04 -1.21 -3.03 116.25 117.84 2jpn h VAL 57 Ca 0.01 -1.11 -0.05 0.00 -1.01 0.00 0.00 66.70 64.53 2jpn h VAL 57 Cb 0.23 1.56 -0.02 0.00 -2.01 0.00 0.00 31.29 31.05 2jpn h VAL 57 CO 0.00 0.34 0.16 -0.09 -1.01 0.00 0.00 177.57 176.97 2jpn h ARG 58 N 0.17 0.92 0.00 4.17 9.65 -1.03 0.32 114.38 128.58 2jpn h ARG 58 Ca 0.05 -0.21 -0.06 0.00 -1.10 0.00 0.00 59.98 58.66 2jpn h ARG 58 Cb 0.55 -0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 29.00 2jpn h ARG 58 CO 0.03 0.84 -0.29 0.22 2.80 0.00 0.00 179.97 183.57 2jpn h ASP 59 N 0.83 0.00 -0.19 -3.80 3.58 -0.96 0.53 116.42 116.40 2jpn h ASP 59 Ca 0.18 0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.51 2jpn h ASP 59 Cb 0.32 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.38 2jpn h ASP 59 CO -0.00 0.29 -0.38 0.00 -2.88 0.00 0.00 179.24 176.27 2jpn h ALA 60 N 1.71 0.31 0.09 -0.78 0.00 -1.34 -0.21 119.26 119.04 2jpn h ALA 60 Ca -0.00 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 2jpn h ALA 60 Cb 0.54 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2jpn h ALA 60 CO 0.04 0.39 -0.05 1.25 0.00 0.00 0.00 179.25 180.88 2jpn h LEU 61 N 0.27 -0.11 -1.95 0.00 6.46 0.25 0.50 115.31 120.73 2jpn h LEU 61 Ca 0.01 -0.38 0.00 0.00 -0.12 0.00 0.00 57.88 57.39 2jpn h LEU 61 Cb 0.98 0.03 -0.00 0.00 -0.73 0.00 0.00 40.66 40.93 2jpn h LEU 61 CO 0.08 0.35 0.05 0.00 -0.62 0.00 0.00 178.44 178.30 2jpn h ALA 62 N 0.23 1.98 0.22 1.25 0.00 -0.16 0.82 119.26 123.59 2jpn h ALA 62 Ca -0.01 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.90 2jpn h ALA 62 Cb 0.49 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2jpn h ALA 62 CO 0.02 0.02 -0.30 0.78 0.00 0.00 0.00 179.25 179.77 2jpn h GLY 63 N 0.07 -0.64 1.60 0.00 0.00 -0.44 -2.82 103.07 100.85 2jpn h GLY 63 Ca 0.03 0.35 -0.13 0.00 0.00 0.00 0.00 47.33 47.58 2jpn h GLY 63 CO -0.00 -0.25 -0.45 1.70 0.00 0.00 0.00 176.54 177.54 2jpn h LYS 64 N -0.58 0.43 -0.36 4.80 1.63 0.30 -3.33 116.57 119.46 2jpn h LYS 64 Ca 0.01 -0.23 0.05 0.00 -0.85 0.00 0.00 60.65 59.63 2jpn h LYS 64 Cb 0.57 0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 32.16 2jpn h LYS 64 CO -0.11 0.80 0.08 -0.09 -3.45 0.00 0.00 179.45 176.67 2jpn h ARG 65 N 0.35 0.20 -0.65 1.90 2.43 -0.59 0.15 114.38 118.17 2jpn h ARG 65 Ca 0.02 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.20 2jpn h ARG 65 Cb 0.93 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.40 2jpn h ARG 65 CO 0.08 0.13 0.43 0.00 -1.51 0.00 0.00 179.97 179.10 2jpn h ALA 66 N 1.26 1.59 -0.13 2.80 0.00 -1.63 0.14 119.26 123.29 2jpn h ALA 66 Ca 0.17 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2jpn h ALA 66 Cb 0.18 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2jpn h ALA 66 CO -0.21 0.35 -0.03 0.93 0.00 0.00 0.00 179.25 180.29 2jpn h GLU 67 N 0.82 0.24 -0.13 0.00 4.39 -1.20 -1.69 114.58 117.02 2jpn h GLU 67 Ca 0.25 -0.09 -0.09 0.00 0.34 0.00 0.00 59.36 59.77 2jpn h GLU 67 Cb -0.01 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 2jpn h GLU 67 CO -0.06 0.53 -0.32 -0.07 -1.16 0.00 0.00 179.01 177.93 2jpn h LEU 68 N -0.06 0.25 -0.41 1.33 3.38 -0.05 -0.31 115.31 119.44 2jpn h LEU 68 Ca 0.03 -0.09 -0.18 0.00 0.09 0.00 0.00 57.88 57.74 2jpn h LEU 68 Cb 0.44 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2jpn h LEU 68 CO 0.01 0.56 -0.79 -0.33 0.09 0.00 0.00 178.44 177.98 2jpn h GLU 69 N 0.22 0.13 0.00 1.13 5.08 -0.80 -0.86 114.58 119.48 2jpn h GLU 69 Ca 0.03 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2jpn h GLU 69 Cb 0.68 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.96 2jpn h GLU 69 CO 0.05 0.86 0.00 -0.44 -1.00 0.00 0.00 179.01 178.48 2jpn h ASP 70 N 0.08 0.00 -0.66 1.42 3.32 -1.07 -3.10 116.42 116.41 2jpn h ASP 70 Ca -0.03 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.79 2jpn h ASP 70 Cb 1.39 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.80 2jpn h ASP 70 CO 0.12 0.00 0.25 -0.24 -1.72 0.00 0.00 179.24 177.64 2jpn n SER 71 N -3.05 4.15 0.27 6.45 2.88 -0.15 -4.77 113.62 119.40 2jpn n SER 71 Ca 0.00 -3.36 0.18 0.00 -1.33 0.00 0.00 58.87 54.37 2jpn n SER 71 Cb 0.28 -0.72 0.90 0.00 -0.75 0.00 0.00 64.21 63.92 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 2.00 0.00 -3.40 -3.46 3.58 -1.17 -3.39 116.42 110.59 2jpn h ASP 72 Ca 0.29 0.00 -0.56 0.00 0.42 0.00 0.00 57.03 57.18 2jpn h ASP 72 Cb 2.21 0.00 -0.33 0.00 1.72 0.00 0.00 39.33 42.93 2jpn h ASP 72 CO 0.68 0.00 -0.83 -0.62 -2.88 0.00 0.00 179.24 175.59 2jpn s ASP 73 N -5.13 2.11 0.17 2.28 2.15 -1.26 -5.07 116.67 111.92 2jpn s ASP 73 Ca -0.04 -0.36 0.08 0.00 0.43 0.00 0.00 52.55 52.66 2jpn s ASP 73 Cb 0.13 -0.97 -0.04 0.00 -0.30 0.00 0.00 42.92 41.73 2jpn s ASP 73 CO 0.42 0.07 -0.18 -1.61 -0.17 0.00 0.00 175.17 173.70 2jpn s GLU 74 N 0.58 1.29 0.40 4.34 2.02 -1.26 -5.09 118.70 120.99 2jpn s GLU 74 Ca -0.16 -1.45 -0.25 0.00 0.02 0.00 0.00 54.97 53.14 2jpn s GLU 74 Cb -0.16 -1.31 -0.11 0.00 0.10 0.00 0.00 34.13 32.65 2jpn s GLU 74 CO 0.05 0.26 1.06 0.28 0.02 0.00 0.00 175.26 176.93 2jpn n VAL 75 N 0.16 2.39 0.00 2.63 0.31 -1.26 -2.70 118.33 119.86 2jpn n VAL 75 Ca -0.12 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.71 2jpn n VAL 75 Cb 0.58 -1.22 0.00 0.00 -0.91 0.00 0.00 33.84 32.29 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 0.21 0.00 0.28 5.55 0.28 -1.26 -4.35 120.64 121.35 2jpn n GLU 76 Ca 0.09 0.00 0.15 0.00 -0.16 0.00 0.00 57.16 57.24 2jpn n GLU 76 Cb 0.38 -0.69 0.84 0.00 1.43 0.00 0.00 31.44 33.40 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 0.00 -0.95 3.44 5.08 -2.03 -3.25 114.58 116.87 2jpn h GLU 77 Ca 0.00 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.01 2jpn h GLU 77 Cb 0.00 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 28.87 2jpn h GLU 77 CO 0.00 0.07 -1.12 0.43 -1.00 0.00 0.00 179.01 177.38 2jpn n SER 78 N -3.53 1.12 0.00 1.42 7.64 -1.10 -5.04 113.62 114.13 2jpn n SER 78 Ca -0.02 -2.70 0.00 0.00 1.01 0.00 0.00 58.87 57.16 2jpn n SER 78 Cb 0.19 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 63.00 2jpn n SER 78 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25