#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 0.32 -3.56 1.61 7.64 -1.26 -5.10 113.62 113.28 2jpn n SER 2 Ca 0.00 -1.95 -0.13 0.00 1.01 0.00 0.00 58.87 57.80 2jpn n SER 2 Cb 0.00 -0.19 -0.05 0.00 -1.01 0.00 0.00 64.21 62.96 2jpn n SER 2 CO 0.00 0.00 0.00 -1.38 -3.01 0.00 0.00 175.04 170.65 2jpn s HIS 3 N -0.36 0.94 0.09 1.43 0.00 -1.26 -5.20 115.29 110.94 2jpn s HIS 3 Ca 0.04 -1.19 0.03 0.00 -3.00 0.00 0.00 55.06 50.94 2jpn s HIS 3 Cb 0.03 -0.11 -0.03 0.00 -4.00 0.00 0.00 32.58 28.46 2jpn s HIS 3 CO 0.00 -1.02 -0.09 -1.64 -1.00 0.00 0.00 174.74 170.98 2jpn s MET 4 N -3.45 0.79 0.47 -0.38 1.00 -1.26 -5.07 119.30 111.40 2jpn s MET 4 Ca 0.30 -1.11 0.23 0.00 0.00 0.00 0.00 55.69 55.12 2jpn s MET 4 Cb 0.01 -0.46 1.15 0.00 0.00 0.00 0.00 34.83 35.53 2jpn s MET 4 CO 0.17 0.07 1.95 -0.07 0.00 0.00 0.00 175.02 177.14 2jpn h LEU 5 N 3.67 0.00 0.00 -0.03 3.38 -2.03 -3.47 115.31 116.82 2jpn h LEU 5 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2jpn h LEU 5 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2jpn h LEU 5 CO 0.52 0.20 0.00 -0.11 0.09 0.00 0.00 178.44 179.14 2jpn n LEU 6 N -3.67 0.00 -3.69 1.67 7.94 -1.26 -4.67 117.00 113.33 2jpn n LEU 6 Ca -0.01 0.00 -0.25 0.00 -1.11 0.00 0.00 56.01 54.63 2jpn n LEU 6 Cb 0.33 0.00 -0.17 0.00 0.53 0.00 0.00 43.42 44.11 2jpn n LEU 6 CO 0.33 0.00 -0.35 -1.61 -1.11 0.00 0.00 177.39 174.65 2jpn s GLU 7 N 0.00 0.33 0.00 1.96 2.02 -1.26 -5.06 118.70 116.69 2jpn s GLU 7 Ca 0.00 -0.11 0.18 0.00 0.02 0.00 0.00 54.97 55.06 2jpn s GLU 7 Cb 0.00 -1.64 0.84 0.00 0.10 0.00 0.00 34.13 33.43 2jpn s GLU 7 CO 0.00 -0.56 1.58 1.19 0.02 0.00 0.00 175.26 177.49 2jpn n PHE 8 N 5.18 0.00 0.08 1.61 3.72 -1.26 -3.84 117.46 122.95 2jpn n PHE 8 Ca -0.07 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.45 2jpn n PHE 8 Cb 0.49 -0.43 0.61 0.00 -0.94 0.00 0.00 39.48 39.21 2jpn n PHE 8 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 2jpn h LYS 9 N 0.00 0.12 0.00 -1.08 2.10 -1.97 -3.27 116.57 112.47 2jpn h LYS 9 Ca 0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 2jpn h LYS 9 Cb 0.27 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.57 2jpn h LYS 9 CO 0.00 0.08 0.00 1.04 -2.00 0.00 0.00 179.45 178.57 2jpn n GLN 10 N -4.47 0.14 0.02 0.07 6.02 -1.25 -2.51 117.38 115.40 2jpn n GLN 10 Ca 0.04 0.34 0.08 0.00 -0.01 0.00 0.00 57.00 57.45 2jpn n GLN 10 Cb 0.32 -1.75 0.51 0.00 1.02 0.00 0.00 30.24 30.34 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 0.00 1.08 -0.00 -1.89 -2.04 116.94 114.45 2jpn h PHE 11 Ca 0.00 0.01 -0.04 0.00 -0.00 0.00 0.00 57.97 57.94 2jpn h PHE 11 Cb 0.38 -0.12 -0.01 0.00 -0.00 0.00 0.00 35.95 36.20 2jpn h PHE 11 CO 0.00 0.21 -0.21 1.25 -0.00 0.00 0.00 178.31 179.56 2jpn h LEU 12 N 0.37 0.00 0.00 2.10 5.85 -1.79 -2.87 115.31 118.98 2jpn h LEU 12 Ca 0.17 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.79 2jpn h LEU 12 Cb 0.22 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 2jpn h LEU 12 CO -0.04 0.21 -1.45 -1.22 -0.34 0.00 0.00 178.44 175.60 2jpn n TYR 13 N -3.16 0.76 0.07 1.25 4.02 -0.80 -3.22 117.16 116.08 2jpn n TYR 13 Ca 0.03 0.24 -0.18 0.00 -0.01 0.00 0.00 57.90 57.98 2jpn n TYR 13 Cb 0.60 -0.95 -0.10 0.00 -0.02 0.00 0.00 39.34 38.87 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 0.55 -0.69 -0.72 4.81 -1.58 -3.37 114.58 113.58 2jpn h GLU 14 Ca -0.12 -0.66 0.16 0.00 -0.13 0.00 0.00 59.36 58.62 2jpn h GLU 14 Cb 1.36 0.20 -0.04 0.00 0.63 0.00 0.00 28.75 30.90 2jpn h GLU 14 CO 0.02 1.26 0.47 0.00 -0.73 0.00 0.00 179.01 180.04 2jpn h ALA 15 N 0.49 2.30 -0.08 2.92 0.00 -1.53 -3.16 119.26 120.20 2jpn h ALA 15 Ca -0.13 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.79 2jpn h ALA 15 Cb 1.76 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.53 2jpn h ALA 15 CO 0.20 -0.49 0.07 0.77 0.00 0.00 0.00 179.25 179.81 2jpn h SER 16 N 0.25 0.00 0.00 0.00 0.02 -1.71 -3.03 113.55 109.07 2jpn h SER 16 Ca 0.34 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 2jpn h SER 16 Cb 0.97 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.51 2jpn h SER 16 CO -0.07 0.00 -0.10 -0.38 -1.14 0.00 0.00 176.83 175.13 2jpn n ILE 17 N -4.17 0.81 1.01 3.27 -0.00 -1.19 -4.74 119.36 114.35 2jpn n ILE 17 Ca -0.01 -0.92 0.11 0.00 -0.00 0.00 0.00 62.75 61.93 2jpn n ILE 17 Cb 0.17 0.41 -0.04 0.00 -0.00 0.00 0.00 39.64 40.18 2jpn n ILE 17 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 2jpn n ASP 18 N -0.54 1.35 0.09 4.38 2.03 -1.15 -4.39 116.55 118.32 2jpn n ASP 18 Ca 0.04 -1.14 0.00 0.00 0.52 0.00 0.00 54.79 54.21 2jpn n ASP 18 Cb 0.51 0.74 0.00 0.00 -0.72 0.00 0.00 41.12 41.64 2jpn n ASP 18 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2jpn n GLU 19 N -0.93 0.00 -0.09 -0.67 1.02 -1.26 -4.93 120.64 113.78 2jpn n GLU 19 Ca 0.06 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.13 2jpn n GLU 19 Cb 0.38 -0.18 0.00 0.00 -0.02 0.00 0.00 31.44 31.62 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 0.20 -0.65 -0.32 -1.00 -1.85 -2.69 116.94 110.64 2jpn h PHE 20 Ca 0.00 0.02 0.04 0.00 2.81 0.00 0.00 57.97 60.84 2jpn h PHE 20 Cb 0.00 -0.05 -0.04 0.00 3.61 0.00 0.00 35.95 39.48 2jpn h PHE 20 CO 0.00 0.09 0.43 0.52 -1.61 0.00 0.00 178.31 177.74 2jpn h MET 21 N 0.25 0.71 -0.18 1.51 2.86 -1.89 0.41 114.93 118.61 2jpn h MET 21 Ca 0.14 -0.04 -0.21 0.00 -2.06 0.00 0.00 59.70 57.53 2jpn h MET 21 Cb 0.10 -0.16 0.01 0.00 0.06 0.00 0.00 31.60 31.61 2jpn h MET 21 CO -0.13 0.47 -0.71 0.78 1.06 0.00 0.00 176.91 178.38 2jpn h GLY 22 N 0.73 0.82 0.98 8.32 0.00 -1.82 -0.00 103.07 112.11 2jpn h GLY 22 Ca 0.27 -1.10 -0.02 0.00 0.00 0.00 0.00 47.33 46.47 2jpn h GLY 22 CO -0.08 0.98 0.25 0.07 0.00 0.00 0.00 176.54 177.77 2jpn h LYS 23 N 0.53 0.82 -0.21 4.80 2.10 -0.01 0.20 116.57 124.80 2jpn h LYS 23 Ca -0.03 -0.13 -0.10 0.00 -2.00 0.00 0.00 60.65 58.39 2jpn h LYS 23 Cb 1.32 -0.14 -0.00 0.00 -0.90 0.00 0.00 32.23 32.51 2jpn h LYS 23 CO 0.14 0.68 -0.24 -0.84 -2.00 0.00 0.00 179.45 177.19 2jpn h ILE 24 N 0.76 1.33 0.00 0.07 3.07 -0.71 -1.49 117.51 120.54 2jpn h ILE 24 Ca 0.19 -1.43 -0.00 0.00 1.55 0.00 0.00 64.86 65.17 2jpn h ILE 24 Cb 0.15 1.78 -0.00 0.00 -0.27 0.00 0.00 36.82 38.48 2jpn h ILE 24 CO -0.02 0.44 -0.02 0.00 -1.05 0.00 0.00 178.15 177.50 2jpn h ALA 25 N 0.64 1.17 -0.51 0.16 0.00 -0.80 -1.25 119.26 118.67 2jpn h ALA 25 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2jpn h ALA 25 Cb 0.80 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2jpn h ALA 25 CO 0.06 0.03 0.00 0.45 0.00 0.00 0.00 179.25 179.78 2jpn n SER 26 N -3.36 3.75 0.24 0.00 2.88 0.69 -4.76 113.62 113.06 2jpn n SER 26 Ca -0.02 -2.23 0.12 0.00 -1.33 0.00 0.00 58.87 55.40 2jpn n SER 26 Cb 0.13 -0.42 0.59 0.00 -0.75 0.00 0.00 64.21 63.76 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 -3.43 0.00 -3.70 0.00 6.02 -1.26 -4.60 117.38 110.40 2jpn n GLN 28 Ca -0.01 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.85 2jpn n GLN 28 Cb 0.35 -4.01 -0.09 0.00 1.02 0.00 0.00 30.24 27.51 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 -0.94 -0.00 0.21 5.09 -4.23 -1.26 -5.04 115.64 109.48 2jpn s THR 29 Ca 0.00 0.01 -0.02 0.00 -1.18 0.00 0.00 61.69 60.50 2jpn s THR 29 Cb 0.00 -0.69 -0.02 0.00 1.34 0.00 0.00 72.50 73.14 2jpn s THR 29 CO 0.00 0.00 1.57 0.25 -0.54 0.00 0.00 174.62 175.90 2jpn h LEU 30 N 5.51 0.59 -1.33 4.79 5.85 -1.88 -0.77 115.31 128.07 2jpn h LEU 30 Ca -0.28 -0.28 -0.02 0.00 0.84 0.00 0.00 57.88 58.14 2jpn h LEU 30 Cb 1.18 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 2jpn h LEU 30 CO 0.20 0.96 0.17 -0.08 -0.34 0.00 0.00 178.44 179.35 2jpn h GLU 31 N 0.44 0.63 -0.12 1.25 4.81 -1.94 0.32 114.58 119.98 2jpn h GLU 31 Ca 0.03 -0.09 -0.14 0.00 -0.13 0.00 0.00 59.36 59.04 2jpn h GLU 31 Cb 0.96 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 30.23 2jpn h GLU 31 CO 0.09 0.53 -0.46 0.78 -0.73 0.00 0.00 179.01 179.21 2jpn h GLY 32 N 0.78 0.58 1.06 1.92 0.00 -1.82 -2.90 103.07 102.69 2jpn h GLY 32 Ca 0.15 -0.78 0.04 0.00 0.00 0.00 0.00 47.33 46.74 2jpn h GLY 32 CO -0.01 0.70 0.53 -2.00 0.00 0.00 0.00 176.54 175.76 2jpn h LEU 33 N 0.13 0.85 -1.22 3.11 5.85 0.18 0.33 115.31 124.55 2jpn h LEU 33 Ca -0.02 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.62 2jpn h LEU 33 Cb 1.10 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.92 2jpn h LEU 33 CO 0.10 0.58 -0.18 -0.33 -0.34 0.00 0.00 178.44 178.26 2jpn h GLU 34 N 0.98 0.31 -0.10 1.25 4.39 -0.55 0.53 114.58 121.40 2jpn h GLU 34 Ca 0.33 -0.09 -0.23 0.00 0.34 0.00 0.00 59.36 59.71 2jpn h GLU 34 Cb 0.07 -0.03 0.01 0.00 -0.10 0.00 0.00 28.75 28.70 2jpn h GLU 34 CO -0.10 0.49 -0.85 0.93 -1.16 0.00 0.00 179.01 178.32 2jpn h GLU 35 N 0.29 0.70 -0.83 2.33 4.39 -0.77 -1.51 114.58 119.19 2jpn h GLU 35 Ca 0.05 -0.63 -0.02 0.00 0.34 0.00 0.00 59.36 59.11 2jpn h GLU 35 Cb 0.49 0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 29.25 2jpn h GLU 35 CO 0.03 1.23 0.43 -0.07 -1.16 0.00 0.00 179.01 179.48 2jpn h LEU 36 N 0.45 1.04 -0.33 1.33 3.38 -0.29 0.18 115.31 121.07 2jpn h LEU 36 Ca -0.07 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 2jpn h LEU 36 Cb 1.48 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2jpn h LEU 36 CO 0.17 0.85 0.11 -0.08 0.09 0.00 0.00 178.44 179.58 2jpn h GLU 37 N 1.16 0.51 -0.08 1.13 4.22 0.14 0.18 114.58 121.84 2jpn h GLU 37 Ca 0.29 -0.10 -0.01 0.00 0.08 0.00 0.00 59.36 59.62 2jpn h GLU 37 Cb 0.06 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 2jpn h GLU 37 CO -0.04 0.53 0.01 0.00 -2.18 0.00 0.00 179.01 177.33 2jpn h ALA 38 N 0.95 0.11 -0.31 2.92 0.00 -1.14 -2.23 119.26 119.56 2jpn h ALA 38 Ca 0.11 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2jpn h ALA 38 Cb 0.23 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2jpn h ALA 38 CO -0.01 -0.25 0.05 -0.92 0.00 0.00 0.00 179.25 178.13 2jpn h TYR 39 N -0.11 0.46 0.63 0.00 5.03 -0.27 0.16 116.97 122.86 2jpn h TYR 39 Ca 0.02 -0.03 -0.03 0.00 2.58 0.00 0.00 58.73 61.28 2jpn h TYR 39 Cb 0.29 -0.14 0.00 0.00 1.55 0.00 0.00 36.73 38.43 2jpn h TYR 39 CO 0.02 0.42 -0.32 -0.92 -1.32 0.00 0.00 178.16 176.04 2jpn h TYR 40 N 0.44 -0.84 -0.59 -3.82 3.20 -0.66 -0.36 116.97 114.35 2jpn h TYR 40 Ca 0.10 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.94 2jpn h TYR 40 Cb 0.22 0.28 -0.03 0.00 1.54 0.00 0.00 36.73 38.74 2jpn h TYR 40 CO 0.01 -0.51 0.30 0.87 -1.64 0.00 0.00 178.16 177.18 2jpn h LYS 41 N -0.87 0.82 -0.45 1.82 1.79 -0.56 -2.28 116.57 116.84 2jpn h LYS 41 Ca -0.08 -0.10 -0.09 0.00 -2.18 0.00 0.00 60.65 58.20 2jpn h LYS 41 Cb 0.68 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 31.15 2jpn h LYS 41 CO 0.12 0.63 -0.07 0.87 -1.08 0.00 0.00 179.45 179.92 2jpn h LYS 42 N 0.82 0.84 -0.25 3.15 1.79 -0.65 -3.25 116.57 119.02 2jpn h LYS 42 Ca 0.21 -0.30 -0.12 0.00 -2.18 0.00 0.00 60.65 58.25 2jpn h LYS 42 Cb 0.07 -0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2jpn h LYS 42 CO -0.03 0.93 -0.31 -0.09 -1.08 0.00 0.00 179.45 178.87 2jpn h ARG 43 N 0.68 0.66 -0.73 3.15 2.43 -0.84 -3.40 114.38 116.33 2jpn h ARG 43 Ca 0.12 -0.37 0.12 0.00 -0.81 0.00 0.00 59.98 59.04 2jpn h ARG 43 Cb 0.59 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.12 2jpn h ARG 43 CO 0.04 0.98 0.48 0.28 -1.51 0.00 0.00 179.97 180.24 2jpn h VAL 44 N 0.38 0.86 -0.04 0.20 2.07 -1.45 0.23 116.25 118.50 2jpn h VAL 44 Ca 0.03 -0.17 -0.10 0.00 0.82 0.00 0.00 66.70 67.28 2jpn h VAL 44 Cb 0.89 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 2jpn h VAL 44 CO 0.07 0.09 -0.46 0.07 0.02 0.00 0.00 177.57 177.37 2jpn h LYS 45 N 0.50 0.10 0.00 1.57 2.10 -1.77 -3.10 116.57 115.98 2jpn h LYS 45 Ca 0.35 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.95 2jpn h LYS 45 Cb 0.66 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.99 2jpn h LYS 45 CO -0.12 0.54 0.00 -1.91 -2.00 0.00 0.00 179.45 175.96 2jpn n GLU 46 N -3.99 0.02 0.00 0.07 4.07 0.79 -4.91 120.64 116.70 2jpn n GLU 46 Ca -0.02 0.03 0.00 0.00 -0.06 0.00 0.00 57.16 57.12 2jpn n GLU 46 Cb 0.49 -1.52 0.00 0.00 -0.06 0.00 0.00 31.44 30.35 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 -1.56 0.00 -2.41 6.31 5.66 -1.03 -5.12 114.28 116.14 2jpn n THR 47 Ca 0.07 0.00 0.04 0.00 -3.05 0.00 0.00 64.05 61.11 2jpn n THR 47 Cb 0.34 0.00 0.04 0.00 -1.55 0.00 0.00 70.33 69.15 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 0.14 -1.61 1.09 1.02 -1.25 -4.94 120.64 115.08 2jpn n GLU 48 Ca 0.00 -2.11 -0.50 0.00 -0.02 0.00 0.00 57.16 54.53 2jpn n GLU 48 Cb 0.00 -0.15 -0.05 0.00 -0.02 0.00 0.00 31.44 31.22 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 0.35 2.05 0.00 -4.62 -0.00 -1.26 -5.01 117.00 108.51 2jpn n LEU 49 Ca 0.07 1.11 -0.17 0.00 -0.00 0.00 0.00 56.01 57.02 2jpn n LEU 49 Cb 1.10 -1.26 -0.02 0.00 -0.00 0.00 0.00 43.42 43.25 2jpn n LEU 49 CO -0.04 -0.83 -0.05 2.29 -0.00 0.00 0.00 177.39 178.76 2jpn n LYS 50 N 2.80 1.14 -0.22 1.96 2.85 -1.26 -5.03 118.16 120.40 2jpn n LYS 50 Ca 0.18 -2.11 -0.01 0.00 -1.05 0.00 0.00 58.31 55.32 2jpn n LYS 50 Cb 0.22 0.40 0.10 0.00 -0.65 0.00 0.00 35.03 35.10 2jpn n LYS 50 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 177.40 177.73 2jpn h ASP 51 N 0.56 0.45 -0.49 -5.58 2.03 -2.00 -3.08 116.42 108.32 2jpn h ASP 51 Ca -0.23 0.04 0.01 0.00 -0.73 0.00 0.00 57.03 56.12 2jpn h ASP 51 Cb 0.75 -0.04 -0.02 0.00 -0.83 0.00 0.00 39.33 39.19 2jpn h ASP 51 CO 0.37 0.29 0.32 0.74 -1.03 0.00 0.00 179.24 179.93 2jpn h THR 52 N 0.59 1.12 -0.09 1.15 2.02 -1.96 -0.85 112.91 114.90 2jpn h THR 52 Ca 0.30 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 67.24 2jpn h THR 52 Cb 0.25 0.41 -0.00 0.00 -1.74 0.00 0.00 68.15 67.06 2jpn h THR 52 CO -0.22 0.12 0.01 -2.24 0.37 0.00 0.00 175.52 173.57 2jpn h ASP 53 N 0.65 0.14 -0.31 4.18 3.04 -1.85 -3.22 116.42 119.06 2jpn h ASP 53 Ca 0.18 -0.26 -0.01 0.00 -3.24 0.00 0.00 57.03 53.69 2jpn h ASP 53 Cb -0.07 -0.04 -0.01 0.00 -1.04 0.00 0.00 39.33 38.16 2jpn h ASP 53 CO -0.04 0.37 0.15 -0.78 -2.04 0.00 0.00 179.24 176.90 2jpn h ASP 54 N -0.09 0.40 -0.16 4.15 3.58 -1.10 -0.82 116.42 122.38 2jpn h ASP 54 Ca 0.03 -0.12 -0.05 0.00 0.42 0.00 0.00 57.03 57.31 2jpn h ASP 54 Cb 0.29 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 41.23 2jpn h ASP 54 CO 0.00 0.41 -0.10 0.40 -2.88 0.00 0.00 179.24 177.07 2jpn h ILE 55 N 0.36 1.32 -0.02 2.25 5.03 -1.45 -0.47 117.51 124.54 2jpn h ILE 55 Ca 0.11 -1.18 -0.00 0.00 -0.12 0.00 0.00 64.86 63.66 2jpn h ILE 55 Cb 0.11 1.77 -0.00 0.00 -3.03 0.00 0.00 36.82 35.67 2jpn h ILE 55 CO -0.01 0.35 0.01 0.28 -0.68 0.00 0.00 178.15 178.09 2jpn h SER 56 N 0.00 0.03 -0.22 1.72 0.02 -1.47 0.42 113.55 114.06 2jpn h SER 56 Ca 0.03 -0.23 -0.05 0.00 -0.84 0.00 0.00 61.79 60.69 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 0.26 -0.08 1.62 -1.14 0.00 0.00 176.83 177.52 2jpn h VAL 57 N -0.19 1.29 -0.56 2.27 3.04 -1.29 -3.08 116.25 117.74 2jpn h VAL 57 Ca 0.01 -1.10 -0.02 0.00 -1.01 0.00 0.00 66.70 64.57 2jpn h VAL 57 Cb 0.24 1.56 -0.03 0.00 -2.01 0.00 0.00 31.29 31.06 2jpn h VAL 57 CO 0.00 0.34 0.28 -0.09 -1.01 0.00 0.00 177.57 177.09 2jpn h ARG 58 N 0.16 0.79 0.00 4.17 9.65 -0.96 0.34 114.38 128.54 2jpn h ARG 58 Ca 0.05 -0.11 -0.06 0.00 -1.10 0.00 0.00 59.98 58.76 2jpn h ARG 58 Cb 0.55 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 28.97 2jpn h ARG 58 CO 0.03 0.64 -0.29 0.22 2.80 0.00 0.00 179.97 183.36 2jpn h ASP 59 N 0.75 0.00 -0.12 -3.80 3.58 -0.96 0.57 116.42 116.44 2jpn h ASP 59 Ca 0.19 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.56 2jpn h ASP 59 Cb 0.10 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.15 2jpn h ASP 59 CO -0.03 0.29 -0.24 0.00 -2.88 0.00 0.00 179.24 176.39 2jpn h ALA 60 N 1.71 0.19 0.09 -0.78 0.00 -1.36 -0.82 119.26 118.28 2jpn h ALA 60 Ca -0.00 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 2jpn h ALA 60 Cb 0.56 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2jpn h ALA 60 CO 0.04 0.16 -0.04 1.25 0.00 0.00 0.00 179.25 180.66 2jpn h LEU 61 N -0.04 -0.10 -1.89 0.00 6.46 0.51 0.49 115.31 120.73 2jpn h LEU 61 Ca 0.00 -0.43 -0.01 0.00 -0.12 0.00 0.00 57.88 57.33 2jpn h LEU 61 Cb 0.82 0.03 -0.00 0.00 -0.73 0.00 0.00 40.66 40.77 2jpn h LEU 61 CO 0.05 0.41 0.01 0.00 -0.62 0.00 0.00 178.44 178.29 2jpn h ALA 62 N 0.18 1.91 0.09 1.25 0.00 -0.10 0.12 119.26 122.72 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 0.52 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.24 2jpn h ALA 62 CO 0.02 0.07 -0.38 0.78 0.00 0.00 0.00 179.25 179.74 2jpn h GLY 63 N 0.16 -0.73 1.60 0.00 0.00 -0.64 -2.74 103.07 100.71 2jpn h GLY 63 Ca 0.02 0.45 -0.13 0.00 0.00 0.00 0.00 47.33 47.68 2jpn h GLY 63 CO -0.00 -0.26 -0.44 1.70 0.00 0.00 0.00 176.54 177.54 2jpn h LYS 64 N -0.59 0.44 -0.31 4.80 3.64 0.18 -3.32 116.57 121.41 2jpn h LYS 64 Ca 0.03 -0.23 0.05 0.00 -1.27 0.00 0.00 60.65 59.23 2jpn h LYS 64 Cb 0.64 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.42 2jpn h LYS 64 CO -0.24 0.80 0.03 -0.09 -2.27 0.00 0.00 179.45 177.68 2jpn h ARG 65 N 0.36 0.13 -0.65 1.90 2.43 -0.67 0.14 114.38 118.01 2jpn h ARG 65 Ca 0.03 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2jpn h ARG 65 Cb 0.92 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.41 2jpn h ARG 65 CO 0.08 0.08 0.43 0.00 -1.51 0.00 0.00 179.97 179.05 2jpn h ALA 66 N 1.24 1.60 -0.13 2.80 0.00 -1.62 0.12 119.26 123.27 2jpn h ALA 66 Ca 0.14 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 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 -0.22 0.35 -0.03 0.93 0.00 0.00 0.00 179.25 180.29 2jpn h GLU 67 N 0.82 0.25 -0.13 0.00 4.39 -1.23 -1.46 114.58 117.21 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 -0.00 -0.02 -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 0.26 -0.36 1.33 3.38 -0.04 -0.14 115.31 119.68 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 0.44 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 2jpn h LEU 68 CO 0.01 0.58 -0.82 -0.33 0.09 0.00 0.00 178.44 177.97 2jpn h GLU 69 N 0.22 0.18 0.00 1.13 5.08 -0.83 -1.01 114.58 119.36 2jpn h GLU 69 Ca 0.03 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2jpn h GLU 69 Cb 0.69 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.99 2jpn h GLU 69 CO 0.05 0.90 0.00 -0.44 -1.00 0.00 0.00 179.01 178.52 2jpn h ASP 70 N 0.11 0.00 -0.45 1.42 5.19 -1.05 -3.12 116.42 118.52 2jpn h ASP 70 Ca -0.03 0.00 -0.13 0.00 -0.62 0.00 0.00 57.03 56.24 2jpn h ASP 70 Cb 1.42 0.00 -0.08 0.00 0.18 0.00 0.00 39.33 40.85 2jpn h ASP 70 CO 0.12 0.00 0.08 -0.24 -3.12 0.00 0.00 179.24 176.08 2jpn n SER 71 N -2.33 3.74 0.33 6.45 2.88 -0.08 -4.83 113.62 119.77 2jpn n SER 71 Ca 0.02 -3.32 0.20 0.00 -1.33 0.00 0.00 58.87 54.45 2jpn n SER 71 Cb 0.25 -0.64 1.10 0.00 -0.75 0.00 0.00 64.21 64.17 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 1.78 0.00 -4.38 -3.46 3.58 -1.17 -3.41 116.42 109.36 2jpn h ASP 72 Ca 0.16 0.00 -0.36 0.00 0.42 0.00 0.00 57.03 57.26 2jpn h ASP 72 Cb 1.81 0.00 -0.24 0.00 1.72 0.00 0.00 39.33 42.62 2jpn h ASP 72 CO 0.45 0.00 -0.76 -0.62 -2.88 0.00 0.00 179.24 175.43 2jpn s ASP 73 N -5.18 1.14 0.29 2.28 -1.08 -1.26 -5.06 116.67 107.79 2jpn s ASP 73 Ca -0.05 -0.41 0.02 0.00 -0.52 0.00 0.00 52.55 51.60 2jpn s ASP 73 Cb 0.13 -0.05 -0.06 0.00 -1.46 0.00 0.00 42.92 41.48 2jpn s ASP 73 CO 0.41 -0.04 0.08 -1.61 0.52 0.00 0.00 175.17 174.53 2jpn s GLU 74 N -1.06 1.53 0.17 4.34 2.02 -1.26 -4.98 118.70 119.46 2jpn s GLU 74 Ca -0.02 -1.84 -0.32 0.00 0.02 0.00 0.00 54.97 52.80 2jpn s GLU 74 Cb -0.07 -0.53 -0.16 0.00 0.10 0.00 0.00 34.13 33.46 2jpn s GLU 74 CO 0.01 -0.25 0.99 0.28 0.02 0.00 0.00 175.26 176.30 2jpn n VAL 75 N -0.57 1.18 0.00 2.63 0.31 -1.26 -1.82 118.33 118.80 2jpn n VAL 75 Ca -0.01 -0.30 0.00 0.00 -0.01 0.00 0.00 64.34 64.02 2jpn n VAL 75 Cb 0.66 -0.58 0.00 0.00 -0.91 0.00 0.00 33.84 33.02 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 1.40 0.00 0.15 5.55 0.28 0.22 -4.45 120.64 123.79 2jpn n GLU 76 Ca 0.15 0.00 0.01 0.00 -0.16 0.00 0.00 57.16 57.16 2jpn n GLU 76 Cb 0.24 -1.87 0.20 0.00 1.43 0.00 0.00 31.44 31.43 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 0.00 3.44 5.08 -2.00 -3.37 114.58 117.73 2jpn h GLU 77 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2jpn h GLU 77 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2jpn h GLU 77 CO 0.00 0.56 0.00 -1.13 -1.00 0.00 0.00 179.01 177.44 2jpn n SER 78 N -3.66 0.00 0.00 1.42 3.41 -0.75 -4.96 113.62 109.07 2jpn n SER 78 Ca -0.01 -0.92 0.00 0.00 -0.26 0.00 0.00 58.87 57.68 2jpn n SER 78 Cb 0.61 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.56 2jpn n SER 78 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21