#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 0.00 -1.80 1.61 2.88 -1.26 -5.02 113.62 110.03 2jpn n SER 2 Ca 0.00 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.55 2jpn n SER 2 Cb 0.00 0.06 0.02 0.00 -0.75 0.00 0.00 64.21 63.54 2jpn n SER 2 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2jpn n HIS 3 N -1.68 0.19 -3.85 0.66 -0.00 -1.26 -5.10 115.22 104.17 2jpn n HIS 3 Ca 0.00 -0.94 -0.11 0.00 -0.00 0.00 0.00 57.72 56.68 2jpn n HIS 3 Cb 0.00 -0.00 -0.09 0.00 -0.00 0.00 0.00 29.99 29.90 2jpn n HIS 3 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2jpn s MET 4 N -0.87 0.62 -0.01 1.57 0.00 -1.26 -4.96 119.30 114.40 2jpn s MET 4 Ca 0.27 -0.52 -0.21 0.00 0.00 0.00 0.00 55.69 55.23 2jpn s MET 4 Cb 0.33 0.26 -0.22 0.00 0.00 0.00 0.00 34.83 35.20 2jpn s MET 4 CO -0.12 -0.17 1.12 -0.07 0.00 0.00 0.00 175.02 175.78 2jpn h LEU 5 N 3.76 0.43 0.00 0.18 4.07 -1.97 -3.45 115.31 118.34 2jpn h LEU 5 Ca -0.31 -0.72 0.00 0.00 0.08 0.00 0.00 57.88 56.92 2jpn h LEU 5 Cb 1.19 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.80 2jpn h LEU 5 CO 0.45 1.09 0.00 -0.11 -1.08 0.00 0.00 178.44 178.79 2jpn n LEU 6 N -4.34 0.00 -3.81 1.67 7.94 -1.26 -5.13 117.00 112.07 2jpn n LEU 6 Ca -0.09 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.68 2jpn n LEU 6 Cb 0.58 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.43 2jpn n LEU 6 CO 0.43 0.00 -0.08 -0.70 -1.11 0.00 0.00 177.39 175.93 2jpn s GLU 7 N -1.00 0.50 0.50 1.96 2.12 -1.26 -5.08 118.70 116.44 2jpn s GLU 7 Ca 0.00 -0.14 0.16 0.00 0.36 0.00 0.00 54.97 55.35 2jpn s GLU 7 Cb 0.00 0.22 1.21 0.00 0.26 0.00 0.00 34.13 35.82 2jpn s GLU 7 CO 0.00 -0.12 2.09 0.27 -0.54 0.00 0.00 175.26 176.96 2jpn h PHE 8 N 4.49 0.12 -0.10 5.30 -0.00 -1.96 -2.85 116.94 121.93 2jpn h PHE 8 Ca -0.29 0.00 -0.02 0.00 -0.00 0.00 0.00 57.97 57.66 2jpn h PHE 8 Cb 1.19 -0.04 -0.01 0.00 -0.00 0.00 0.00 35.95 37.09 2jpn h PHE 8 CO 0.52 0.07 -0.04 0.87 -0.00 0.00 0.00 178.31 179.73 2jpn h LYS 9 N 0.12 0.15 0.00 6.09 1.57 -2.00 -3.27 116.57 119.22 2jpn h LYS 9 Ca 0.10 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2jpn h LYS 9 Cb 0.25 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.53 2jpn h LYS 9 CO -0.01 0.20 0.00 1.04 -0.57 0.00 0.00 179.45 180.11 2jpn n GLN 10 N -4.40 0.03 0.02 3.15 6.02 -1.08 -2.21 117.38 118.91 2jpn n GLN 10 Ca -0.01 0.25 0.08 0.00 -0.01 0.00 0.00 57.00 57.31 2jpn n GLN 10 Cb 0.17 -1.56 0.51 0.00 1.02 0.00 0.00 30.24 30.39 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 0.36 -0.07 1.08 -0.00 -1.79 0.17 116.94 116.68 2jpn h PHE 11 Ca 0.00 0.01 -0.22 0.00 -0.00 0.00 0.00 57.97 57.76 2jpn h PHE 11 Cb 0.30 -0.12 0.01 0.00 -0.00 0.00 0.00 35.95 36.13 2jpn h PHE 11 CO 0.00 0.20 -0.85 -0.07 -0.00 0.00 0.00 178.31 177.59 2jpn h LEU 12 N 0.37 0.72 -0.09 2.10 4.07 -1.74 -3.22 115.31 117.52 2jpn h LEU 12 Ca 0.17 -0.51 -0.00 0.00 0.08 0.00 0.00 57.88 57.61 2jpn h LEU 12 Cb 0.22 -0.22 -0.00 0.00 1.08 0.00 0.00 40.66 41.75 2jpn h LEU 12 CO -0.04 1.30 -0.02 1.88 -1.08 0.00 0.00 178.44 180.48 2jpn h TYR 13 N 0.37 0.00 0.00 1.13 0.05 -1.40 0.21 116.97 117.33 2jpn h TYR 13 Ca -0.07 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.65 2jpn h TYR 13 Cb 1.47 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.20 2jpn h TYR 13 CO 0.07 0.02 -0.28 1.49 -1.05 0.00 0.00 178.16 178.41 2jpn h GLU 14 N 0.00 0.00 0.00 4.88 4.81 -1.14 -3.36 114.58 119.77 2jpn h GLU 14 Ca -0.00 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 59.02 2jpn h GLU 14 Cb 0.99 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.33 2jpn h GLU 14 CO 0.00 0.28 -2.01 0.00 -0.73 0.00 0.00 179.01 176.56 2jpn n ALA 15 N -2.29 1.97 0.11 2.92 0.00 -0.26 -4.41 120.51 118.55 2jpn n ALA 15 Ca -0.01 -0.89 0.09 0.00 0.00 0.00 0.00 53.44 52.63 2jpn n ALA 15 Cb 0.42 -0.56 0.56 0.00 0.00 0.00 0.00 19.45 19.88 2jpn n ALA 15 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2jpn h SER 16 N 0.00 0.19 0.00 0.00 0.87 -0.82 -3.33 113.55 110.46 2jpn h SER 16 Ca -0.29 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 2jpn h SER 16 Cb 1.73 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.65 2jpn h SER 16 CO 0.03 0.13 0.00 -0.38 -0.53 0.00 0.00 176.83 176.08 2jpn n ILE 17 N -4.49 0.00 0.12 2.23 -0.00 -1.26 -4.73 119.36 111.22 2jpn n ILE 17 Ca 0.02 0.00 0.05 0.00 -0.00 0.00 0.00 62.75 62.82 2jpn n ILE 17 Cb 0.18 0.62 0.01 0.00 -0.00 0.00 0.00 39.64 40.45 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 -1.77 -3.35 116.42 119.26 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 0.65 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.70 2jpn h ASP 18 CO 0.00 0.33 -0.49 -1.84 -2.88 0.00 0.00 179.24 174.35 2jpn n GLU 19 N -2.99 1.14 -0.08 0.28 0.28 -1.26 -4.81 120.64 113.20 2jpn n GLU 19 Ca -0.01 0.00 -0.08 0.00 -0.16 0.00 0.00 57.16 56.90 2jpn n GLU 19 Cb 0.69 -0.75 -0.01 0.00 1.43 0.00 0.00 31.44 32.80 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 0.26 -0.40 -1.84 3.04 -1.89 0.85 116.94 116.96 2jpn h PHE 20 Ca 0.00 0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.01 2jpn h PHE 20 Cb 0.49 -0.08 -0.02 0.00 2.56 0.00 0.00 35.95 38.91 2jpn h PHE 20 CO 0.00 0.15 0.27 0.52 -2.02 0.00 0.00 178.31 177.23 2jpn h MET 21 N 0.30 0.34 -0.18 1.11 2.86 -1.90 0.19 114.93 117.65 2jpn h MET 21 Ca 0.12 -0.02 -0.21 0.00 -2.06 0.00 0.00 59.70 57.53 2jpn h MET 21 Cb 0.04 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.63 2jpn h MET 21 CO -0.08 0.23 -0.70 0.78 1.06 0.00 0.00 176.91 178.19 2jpn h GLY 22 N 0.36 0.82 0.94 8.32 0.00 -1.64 -0.55 103.07 111.32 2jpn h GLY 22 Ca 0.17 -1.10 -0.09 0.00 0.00 0.00 0.00 47.33 46.32 2jpn h GLY 22 CO -0.04 0.98 -0.13 0.07 0.00 0.00 0.00 176.54 177.42 2jpn h LYS 23 N 0.53 0.68 -0.24 4.80 2.10 0.17 0.22 116.57 124.83 2jpn h LYS 23 Ca -0.03 -0.28 -0.08 0.00 -2.00 0.00 0.00 60.65 58.26 2jpn h LYS 23 Cb 1.32 -0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 32.61 2jpn h LYS 23 CO 0.14 0.87 -0.15 -0.84 -2.00 0.00 0.00 179.45 177.48 2jpn h ILE 24 N 0.46 1.31 0.00 0.07 3.07 -1.01 -2.50 117.51 118.91 2jpn h ILE 24 Ca 0.08 -1.25 -0.00 0.00 1.55 0.00 0.00 64.86 65.23 2jpn h ILE 24 Cb 0.65 1.61 -0.00 0.00 -0.27 0.00 0.00 36.82 38.81 2jpn h ILE 24 CO 0.04 0.39 -0.02 0.00 -1.05 0.00 0.00 178.15 177.51 2jpn h ALA 25 N 0.71 1.17 -0.61 0.16 0.00 -0.87 -1.58 119.26 118.24 2jpn h ALA 25 Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2jpn h ALA 25 Cb 0.66 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2jpn h ALA 25 CO 0.04 0.03 0.00 0.45 0.00 0.00 0.00 179.25 179.77 2jpn n SER 26 N -3.35 4.11 0.25 0.00 2.88 0.74 -4.74 113.62 113.51 2jpn n SER 26 Ca -0.02 -2.24 0.14 0.00 -1.33 0.00 0.00 58.87 55.42 2jpn n SER 26 Cb 0.13 -0.48 0.55 0.00 -0.75 0.00 0.00 64.21 63.66 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 -3.20 0.00 -3.70 0.00 6.02 -1.26 -4.56 117.38 110.68 2jpn n GLN 28 Ca 0.01 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.87 2jpn n GLN 28 Cb 0.37 -3.89 -0.09 0.00 1.02 0.00 0.00 30.24 27.66 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 -0.92 -0.00 0.21 5.09 -4.23 -1.26 -5.04 115.64 109.50 2jpn s THR 29 Ca 0.00 0.01 -0.04 0.00 -1.18 0.00 0.00 61.69 60.48 2jpn s THR 29 Cb 0.00 -0.70 0.02 0.00 1.34 0.00 0.00 72.50 73.15 2jpn s THR 29 CO 0.00 0.00 1.61 0.25 -0.54 0.00 0.00 174.62 175.94 2jpn h LEU 30 N 5.64 0.73 -1.33 4.79 5.85 -1.88 -0.22 115.31 128.89 2jpn h LEU 30 Ca -0.29 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.13 2jpn h LEU 30 Cb 1.18 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 2jpn h LEU 30 CO 0.20 0.99 0.28 -0.08 -0.34 0.00 0.00 178.44 179.49 2jpn h GLU 31 N 0.60 0.74 -0.15 1.25 4.81 -1.94 0.31 114.58 120.19 2jpn h GLU 31 Ca 0.07 -0.08 -0.18 0.00 -0.13 0.00 0.00 59.36 59.05 2jpn h GLU 31 Cb 0.81 -0.15 0.01 0.00 0.63 0.00 0.00 28.75 30.05 2jpn h GLU 31 CO 0.07 0.56 -0.60 0.78 -0.73 0.00 0.00 179.01 179.09 2jpn h GLY 32 N 0.83 0.74 1.10 1.92 0.00 -1.81 -2.84 103.07 103.01 2jpn h GLY 32 Ca 0.19 -1.01 0.03 0.00 0.00 0.00 0.00 47.33 46.55 2jpn h GLY 32 CO -0.03 0.90 0.52 -2.00 0.00 0.00 0.00 176.54 175.93 2jpn h LEU 33 N 0.36 0.85 -1.21 3.11 5.85 0.26 0.41 115.31 124.93 2jpn h LEU 33 Ca -0.03 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.61 2jpn h LEU 33 Cb 1.23 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 2jpn h LEU 33 CO 0.13 0.58 -0.19 -0.33 -0.34 0.00 0.00 178.44 178.29 2jpn h GLU 34 N 0.98 0.30 -0.08 1.25 4.39 -0.58 0.50 114.58 121.35 2jpn h GLU 34 Ca 0.32 -0.09 -0.23 0.00 0.34 0.00 0.00 59.36 59.70 2jpn h GLU 34 Cb 0.04 -0.03 0.01 0.00 -0.10 0.00 0.00 28.75 28.66 2jpn h GLU 34 CO -0.09 0.49 -0.86 0.93 -1.16 0.00 0.00 179.01 178.33 2jpn h GLU 35 N 0.28 0.63 -0.66 2.33 4.39 -0.82 0.56 114.58 121.28 2jpn h GLU 35 Ca 0.05 -0.57 -0.02 0.00 0.34 0.00 0.00 59.36 59.16 2jpn h GLU 35 Cb 0.51 0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.26 2jpn h GLU 35 CO 0.03 1.19 0.34 -0.07 -1.16 0.00 0.00 179.01 179.34 2jpn h LEU 36 N 0.40 0.82 -0.38 1.33 3.38 -0.08 0.18 115.31 120.96 2jpn h LEU 36 Ca -0.07 -0.07 -0.17 0.00 0.09 0.00 0.00 57.88 57.66 2jpn h LEU 36 Cb 1.48 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 42.02 2jpn h LEU 36 CO 0.16 0.68 -0.47 -0.08 0.09 0.00 0.00 178.44 178.82 2jpn h GLU 37 N 0.92 0.85 -0.37 1.13 4.22 0.11 0.23 114.58 121.67 2jpn h GLU 37 Ca 0.23 -0.50 -0.02 0.00 0.08 0.00 0.00 59.36 59.15 2jpn h GLU 37 Cb 0.06 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2jpn h GLU 37 CO -0.03 1.13 0.14 0.00 -2.18 0.00 0.00 179.01 178.07 2jpn h ALA 38 N 0.78 0.48 -0.18 2.92 0.00 -0.72 -2.10 119.26 120.44 2jpn h ALA 38 Ca 0.03 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 2jpn h ALA 38 Cb 1.06 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2jpn h ALA 38 CO 0.11 0.09 -0.03 -0.92 0.00 0.00 0.00 179.25 178.50 2jpn h TYR 39 N 0.45 0.26 0.52 0.00 3.20 -0.23 0.16 116.97 121.33 2jpn h TYR 39 Ca 0.12 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.95 2jpn h TYR 39 Cb 0.20 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.39 2jpn h TYR 39 CO 0.00 0.30 -0.27 -0.92 -1.64 0.00 0.00 178.16 175.63 2jpn h TYR 40 N 0.25 -0.70 -0.73 -3.82 5.03 -0.46 -1.97 116.97 114.57 2jpn h TYR 40 Ca 0.06 -0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.37 2jpn h TYR 40 Cb 0.22 0.24 -0.04 0.00 1.55 0.00 0.00 36.73 38.70 2jpn h TYR 40 CO 0.00 -0.43 0.48 0.87 -1.32 0.00 0.00 178.16 177.77 2jpn h LYS 41 N -0.73 0.95 -0.20 1.82 1.79 -0.45 -2.31 116.57 117.43 2jpn h LYS 41 Ca -0.07 -0.06 -0.09 0.00 -2.18 0.00 0.00 60.65 58.26 2jpn h LYS 41 Cb 0.57 -0.21 -0.01 0.00 -1.58 0.00 0.00 32.23 30.99 2jpn h LYS 41 CO 0.10 0.63 -0.26 0.87 -1.08 0.00 0.00 179.45 179.72 2jpn h LYS 42 N 0.98 0.38 -0.17 3.15 1.79 -0.64 -2.56 116.57 119.50 2jpn h LYS 42 Ca 0.27 -0.14 -0.08 0.00 -2.18 0.00 0.00 60.65 58.52 2jpn h LYS 42 Cb -0.10 -0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 30.52 2jpn h LYS 42 CO -0.06 0.61 -0.21 -0.09 -1.08 0.00 0.00 179.45 178.62 2jpn h ARG 43 N 0.34 0.44 0.00 3.15 2.43 -1.00 -3.40 114.38 116.34 2jpn h ARG 43 Ca 0.05 -0.25 -0.04 0.00 -0.81 0.00 0.00 59.98 58.94 2jpn h ARG 43 Cb 0.63 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.20 2jpn h ARG 43 CO 0.05 0.83 -0.17 0.28 -1.51 0.00 0.00 179.97 179.45 2jpn h VAL 44 N 0.08 0.71 -0.15 0.20 2.07 -1.01 0.19 116.25 118.33 2jpn h VAL 44 Ca 0.02 -0.70 -0.07 0.00 0.82 0.00 0.00 66.70 66.77 2jpn h VAL 44 Cb 0.77 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 2jpn h VAL 44 CO 0.05 0.17 -0.23 0.07 0.02 0.00 0.00 177.57 177.64 2jpn h LYS 45 N 0.00 0.27 0.00 1.57 2.10 -1.73 -3.29 116.57 115.49 2jpn h LYS 45 Ca -0.00 -0.09 0.00 0.00 -2.00 0.00 0.00 60.65 58.56 2jpn h LYS 45 Cb 0.42 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.72 2jpn h LYS 45 CO 0.02 0.50 -0.86 -1.91 -2.00 0.00 0.00 179.45 175.20 2jpn n GLU 46 N -4.17 0.20 0.00 0.07 4.07 0.60 -4.88 120.64 116.53 2jpn n GLU 46 Ca -0.01 0.01 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2jpn n GLU 46 Cb 0.35 -1.58 0.00 0.00 -0.06 0.00 0.00 31.44 30.16 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 -1.84 0.00 0.00 6.31 5.66 -0.87 -5.11 114.28 118.44 2jpn n THR 47 Ca 0.03 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.03 2jpn n THR 47 Cb 0.40 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.18 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 2.97 -0.67 1.09 1.02 -1.24 -4.88 120.64 118.92 2jpn n GLU 48 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2jpn n GLU 48 Cb 0.00 -0.70 0.00 0.00 -0.02 0.00 0.00 31.44 30.72 2jpn n GLU 48 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 2jpn n LEU 49 N -0.76 0.00 -4.83 -4.62 -0.00 -1.26 -4.98 117.00 100.56 2jpn n LEU 49 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 56.01 55.68 2jpn n LEU 49 Cb 0.06 -1.13 -0.03 0.00 -0.00 0.00 0.00 43.42 42.32 2jpn n LEU 49 CO 0.00 0.00 0.69 -0.75 -0.00 0.00 0.00 177.39 177.33 2jpn s LYS 50 N -3.17 3.87 0.24 1.47 2.47 -1.26 -4.96 119.74 118.40 2jpn s LYS 50 Ca 0.00 1.08 -0.05 0.00 -1.56 0.00 0.00 55.97 55.44 2jpn s LYS 50 Cb 0.00 -2.12 0.33 0.00 -1.46 0.00 0.00 37.83 34.58 2jpn s LYS 50 CO 0.00 -0.34 1.87 -0.44 0.16 0.00 0.00 175.35 176.59 2jpn h ASP 51 N 1.10 0.90 -0.55 1.43 3.32 -1.98 0.12 116.42 120.77 2jpn h ASP 51 Ca -0.48 0.01 0.02 0.00 0.02 0.00 0.00 57.03 56.60 2jpn h ASP 51 Cb 1.19 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 40.53 2jpn h ASP 51 CO 0.60 0.59 0.36 0.74 -1.72 0.00 0.00 179.24 179.82 2jpn h THR 52 N 1.04 1.10 -0.00 0.35 2.02 -2.00 0.18 112.91 115.60 2jpn h THR 52 Ca 0.38 -0.23 -0.01 0.00 0.77 0.00 0.00 66.41 67.32 2jpn h THR 52 Cb 0.12 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 66.89 2jpn h THR 52 CO -0.16 0.12 -0.03 0.44 0.37 0.00 0.00 175.52 176.27 2jpn h ASP 53 N 0.68 0.03 -0.24 4.18 3.32 -1.75 -3.37 116.42 119.26 2jpn h ASP 53 Ca 0.21 -0.74 -0.02 0.00 0.02 0.00 0.00 57.03 56.50 2jpn h ASP 53 Cb 0.02 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 2jpn h ASP 53 CO -0.05 0.76 0.07 -0.78 -1.72 0.00 0.00 179.24 177.52 2jpn h ASP 54 N -0.70 0.36 -0.15 6.45 1.82 0.12 -2.68 116.42 121.63 2jpn h ASP 54 Ca -0.00 -0.21 -0.05 0.00 -0.39 0.00 0.00 57.03 56.37 2jpn h ASP 54 Cb 0.76 -0.09 -0.00 0.00 0.68 0.00 0.00 39.33 40.68 2jpn h ASP 54 CO 0.01 0.48 -0.10 0.40 -1.61 0.00 0.00 179.24 178.41 2jpn h ILE 55 N 0.22 1.33 -0.02 2.25 2.04 -0.97 0.29 117.51 122.65 2jpn h ILE 55 Ca 0.08 -1.19 -0.00 0.00 1.00 0.00 0.00 64.86 64.74 2jpn h ILE 55 Cb 0.25 1.78 -0.00 0.00 -0.74 0.00 0.00 36.82 38.11 2jpn h ILE 55 CO -0.00 0.35 0.01 0.28 0.00 0.00 0.00 178.15 178.79 2jpn h SER 56 N -0.00 0.03 -0.21 1.72 0.02 -1.70 0.13 113.55 113.54 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 0.60 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 2jpn h SER 56 CO 0.03 0.26 -0.08 1.62 -1.14 0.00 0.00 176.83 177.52 2jpn h VAL 57 N -0.19 1.30 -0.83 2.27 3.04 -1.58 -3.17 116.25 117.10 2jpn h VAL 57 Ca 0.01 -1.10 0.02 0.00 -1.01 0.00 0.00 66.70 64.62 2jpn h VAL 57 Cb 0.24 1.58 -0.04 0.00 -2.01 0.00 0.00 31.29 31.05 2jpn h VAL 57 CO 0.00 0.34 0.55 0.03 -1.01 0.00 0.00 177.57 177.47 2jpn h ARG 58 N 0.14 1.04 -0.29 4.17 2.47 -0.63 0.40 114.38 121.68 2jpn h ARG 58 Ca 0.05 -0.06 -0.10 0.00 -1.26 0.00 0.00 59.98 58.61 2jpn h ARG 58 Cb 0.55 -0.23 -0.01 0.00 -1.65 0.00 0.00 29.97 28.62 2jpn h ARG 58 CO 0.03 0.69 -0.23 0.22 0.56 0.00 0.00 179.97 181.23 2jpn h ASP 59 N 1.07 0.56 -0.12 7.04 3.58 -0.82 0.37 116.42 128.10 2jpn h ASP 59 Ca 0.32 -0.19 -0.08 0.00 0.42 0.00 0.00 57.03 57.50 2jpn h ASP 59 Cb -0.05 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 40.85 2jpn h ASP 59 CO -0.08 0.79 -0.23 0.00 -2.88 0.00 0.00 179.24 176.84 2jpn h ALA 60 N 1.26 0.19 0.08 -0.78 0.00 -1.37 -0.33 119.26 118.31 2jpn h ALA 60 Ca 0.07 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 2jpn h ALA 60 Cb 0.67 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2jpn h ALA 60 CO 0.05 0.16 -0.04 1.25 0.00 0.00 0.00 179.25 180.67 2jpn h LEU 61 N -0.05 -0.10 -1.70 0.00 6.46 -0.14 0.47 115.31 120.25 2jpn h LEU 61 Ca 0.01 -0.41 -0.03 0.00 -0.12 0.00 0.00 57.88 57.33 2jpn h LEU 61 Cb 0.81 0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.76 2jpn h LEU 61 CO 0.05 0.39 -0.09 0.00 -0.62 0.00 0.00 178.44 178.17 2jpn h ALA 62 N 0.23 1.76 0.06 1.25 0.00 -0.45 0.49 119.26 122.60 2jpn h ALA 62 Ca -0.01 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.81 2jpn h ALA 62 Cb 0.50 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 2jpn h ALA 62 CO 0.02 0.18 -0.47 0.78 0.00 0.00 0.00 179.25 179.77 2jpn h GLY 63 N 0.42 -0.94 1.60 0.00 0.00 -0.58 -2.66 103.07 100.90 2jpn h GLY 63 Ca 0.02 0.57 -0.13 0.00 0.00 0.00 0.00 47.33 47.78 2jpn h GLY 63 CO 0.01 -0.26 -0.44 1.70 0.00 0.00 0.00 176.54 177.56 2jpn h LYS 64 N -0.66 0.44 -0.31 4.80 3.64 0.20 -3.34 116.57 121.34 2jpn h LYS 64 Ca 0.02 -0.23 0.05 0.00 -1.27 0.00 0.00 60.65 59.22 2jpn h LYS 64 Cb 0.70 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.49 2jpn h LYS 64 CO -0.30 0.80 0.04 -0.09 -2.27 0.00 0.00 179.45 177.63 2jpn h ARG 65 N 0.36 0.14 -0.66 1.90 2.43 -0.55 0.13 114.38 118.13 2jpn h ARG 65 Ca 0.03 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.22 2jpn h ARG 65 Cb 0.92 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.40 2jpn h ARG 65 CO 0.08 0.09 0.43 0.00 -1.51 0.00 0.00 179.97 179.06 2jpn h ALA 66 N 1.24 1.62 -0.12 2.80 0.00 -1.64 0.13 119.26 123.30 2jpn h ALA 66 Ca 0.15 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 2jpn h ALA 66 Cb 0.17 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2jpn h ALA 66 CO -0.21 0.32 -0.03 0.93 0.00 0.00 0.00 179.25 180.26 2jpn h GLU 67 N 0.80 0.23 -0.11 0.00 4.39 -1.23 -1.91 114.58 116.74 2jpn h GLU 67 Ca 0.26 -0.09 -0.09 0.00 0.34 0.00 0.00 59.36 59.78 2jpn h GLU 67 Cb 0.04 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2jpn h GLU 67 CO -0.07 0.52 -0.33 -0.07 -1.16 0.00 0.00 179.01 177.91 2jpn h LEU 68 N -0.09 0.23 -0.42 1.33 3.38 0.01 -0.05 115.31 119.70 2jpn h LEU 68 Ca 0.03 -0.08 -0.17 0.00 0.09 0.00 0.00 57.88 57.75 2jpn h LEU 68 Cb 0.44 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2jpn h LEU 68 CO 0.01 0.55 -0.79 -0.33 0.09 0.00 0.00 178.44 177.98 2jpn h GLU 69 N 0.20 0.11 0.00 1.13 5.08 -0.79 -0.67 114.58 119.64 2jpn h GLU 69 Ca 0.03 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.22 2jpn h GLU 69 Cb 0.68 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 2jpn h GLU 69 CO 0.05 0.84 -0.26 -0.44 -1.00 0.00 0.00 179.01 178.20 2jpn h ASP 70 N 0.07 0.00 -0.50 1.42 3.32 -1.08 -3.24 116.42 116.41 2jpn h ASP 70 Ca -0.02 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.90 2jpn h ASP 70 Cb 1.38 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.85 2jpn h ASP 70 CO 0.11 0.26 0.16 -0.24 -1.72 0.00 0.00 179.24 177.81 2jpn n SER 71 N -3.60 4.07 0.19 6.45 2.88 -0.05 -4.74 113.62 118.81 2jpn n SER 71 Ca -0.01 -2.81 0.18 0.00 -1.33 0.00 0.00 58.87 54.90 2jpn n SER 71 Cb 0.39 -0.67 0.73 0.00 -0.75 0.00 0.00 64.21 63.91 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 2.10 0.00 0.00 -3.46 3.58 -1.39 -2.02 116.42 115.23 2jpn h ASP 72 Ca 0.15 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.60 2jpn h ASP 72 Cb 1.81 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.86 2jpn h ASP 72 CO 0.49 0.00 -0.80 -0.67 -2.88 0.00 0.00 179.24 175.39 2jpn n ASP 73 N -3.30 1.38 -2.81 2.28 2.03 -1.26 -5.01 116.55 109.87 2jpn n ASP 73 Ca 0.04 -1.18 -0.14 0.00 0.52 0.00 0.00 54.79 54.03 2jpn n ASP 73 Cb 0.58 0.79 -0.01 0.00 -0.72 0.00 0.00 41.12 41.77 2jpn n ASP 73 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2jpn n GLU 74 N -0.95 -2.72 0.03 -0.67 1.02 -0.76 -4.85 120.64 111.74 2jpn n GLU 74 Ca 0.06 0.42 -0.10 0.00 -0.02 0.00 0.00 57.16 57.52 2jpn n GLU 74 Cb 0.38 -5.04 -0.08 0.00 -0.02 0.00 0.00 31.44 26.69 2jpn n GLU 74 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2jpn h VAL 75 N -0.34 0.88 0.00 2.62 2.07 -1.95 -3.46 116.25 116.07 2jpn h VAL 75 Ca -0.29 -1.25 0.00 0.00 0.82 0.00 0.00 66.70 65.98 2jpn h VAL 75 Cb 1.20 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 2jpn h VAL 75 CO 0.35 0.24 0.00 -1.84 0.02 0.00 0.00 177.57 176.34 2jpn n GLU 76 N -4.88 0.00 0.12 1.57 0.28 -1.26 -5.02 120.64 111.46 2jpn n GLU 76 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.93 2jpn n GLU 76 Cb 0.27 -0.11 0.00 0.00 1.43 0.00 0.00 31.44 33.03 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 -1.94 0.00 0.00 3.44 2.13 -1.26 -5.05 120.64 117.96 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 -3.24 0.00 0.00 4.31 3.41 -1.26 -2.76 113.62 114.08 2jpn n SER 78 Ca 0.00 -0.73 0.08 0.00 -0.26 0.00 0.00 58.87 57.97 2jpn n SER 78 Cb 0.00 0.00 0.50 0.00 -0.26 0.00 0.00 64.21 64.45 2jpn n SER 78 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21