#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jpn h SER 2 N 0.00 0.00 -5.25 1.61 4.64 -2.13 -3.45 113.55 108.97 2jpn h SER 2 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 2jpn h SER 2 Cb 0.00 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 61.98 2jpn h SER 2 CO 0.00 0.00 -0.22 -2.28 -0.87 0.00 0.00 176.83 173.46 2jpn s HIS 3 N -3.49 0.35 0.83 4.77 5.65 -1.26 -5.17 115.29 116.96 2jpn s HIS 3 Ca 0.03 -0.70 -0.13 0.00 0.25 0.00 0.00 55.06 54.51 2jpn s HIS 3 Cb 0.09 0.06 0.09 0.00 -1.18 0.00 0.00 32.58 31.65 2jpn s HIS 3 CO 0.45 -0.83 1.20 -1.64 -0.65 0.00 0.00 174.74 173.27 2jpn s MET 4 N -3.98 1.51 0.46 2.88 1.00 -1.26 -4.96 119.30 114.96 2jpn s MET 4 Ca 0.19 1.74 0.16 0.00 0.00 0.00 0.00 55.69 57.78 2jpn s MET 4 Cb 0.02 -1.76 1.07 0.00 0.00 0.00 0.00 34.83 34.15 2jpn s MET 4 CO 0.03 -2.31 2.01 -0.07 0.00 0.00 0.00 175.02 174.68 2jpn h LEU 5 N -1.06 0.00 0.00 -0.03 3.38 -2.02 -3.46 115.31 112.11 2jpn h LEU 5 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2jpn h LEU 5 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 2jpn h LEU 5 CO 0.45 0.17 0.00 -0.11 0.09 0.00 0.00 178.44 179.04 2jpn n LEU 6 N -4.26 0.00 -3.74 1.67 7.94 -1.26 -4.78 117.00 112.56 2jpn n LEU 6 Ca -0.02 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.75 2jpn n LEU 6 Cb 0.23 0.00 -0.12 0.00 0.53 0.00 0.00 43.42 44.06 2jpn n LEU 6 CO 0.36 0.00 -0.06 -0.70 -1.11 0.00 0.00 177.39 175.87 2jpn s GLU 7 N 0.00 0.29 0.51 1.96 2.12 -1.26 -5.08 118.70 117.24 2jpn s GLU 7 Ca 0.00 0.51 0.20 0.00 0.36 0.00 0.00 54.97 56.04 2jpn s GLU 7 Cb 0.00 0.02 1.31 0.00 0.26 0.00 0.00 34.13 35.71 2jpn s GLU 7 CO 0.00 -0.11 2.10 0.27 -0.54 0.00 0.00 175.26 176.98 2jpn h PHE 8 N 6.53 0.00 -0.31 5.30 -0.00 -2.04 -3.21 116.94 123.21 2jpn h PHE 8 Ca -0.34 0.00 0.06 0.00 -0.00 0.00 0.00 57.97 57.69 2jpn h PHE 8 Cb 1.18 0.00 -0.02 0.00 -0.00 0.00 0.00 35.95 37.11 2jpn h PHE 8 CO 0.36 0.09 0.21 0.87 -0.00 0.00 0.00 178.31 179.84 2jpn h LYS 9 N 0.00 0.15 0.00 6.09 1.79 -1.98 -3.25 116.57 119.37 2jpn h LYS 9 Ca -0.00 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2jpn h LYS 9 Cb 0.17 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.79 2jpn h LYS 9 CO 0.01 0.10 0.00 1.04 -1.08 0.00 0.00 179.45 179.52 2jpn n GLN 10 N -4.48 0.11 0.02 3.15 6.02 -1.21 -1.99 117.38 119.01 2jpn n GLN 10 Ca 0.04 0.33 0.08 0.00 -0.01 0.00 0.00 57.00 57.44 2jpn n GLN 10 Cb 0.27 -1.71 0.51 0.00 1.02 0.00 0.00 30.24 30.33 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 -1.84 -1.48 116.94 115.06 2jpn h PHE 11 Ca 0.00 0.01 -0.07 0.00 -0.00 0.00 0.00 57.97 57.91 2jpn h PHE 11 Cb 0.35 -0.12 -0.01 0.00 -0.00 0.00 0.00 35.95 36.17 2jpn h PHE 11 CO 0.00 0.20 -0.41 -0.07 -0.00 0.00 0.00 178.31 178.03 2jpn h LEU 12 N 0.37 0.00 0.00 2.10 4.07 -1.69 -2.95 115.31 117.21 2jpn h LEU 12 Ca 0.17 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 58.04 2jpn h LEU 12 Cb 0.22 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.95 2jpn h LEU 12 CO -0.04 0.34 -1.30 -1.22 -1.08 0.00 0.00 178.44 175.14 2jpn n TYR 13 N -3.15 0.90 0.07 1.13 4.01 -0.75 -3.36 117.16 116.01 2jpn n TYR 13 Ca 0.02 0.28 -0.12 0.00 -0.16 0.00 0.00 57.90 57.92 2jpn n TYR 13 Cb 0.67 -1.00 -0.04 0.00 -0.31 0.00 0.00 39.34 38.66 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 0.34 -0.73 -0.72 4.57 -1.42 -3.37 114.58 113.25 2jpn h GLU 14 Ca -0.10 -0.38 0.07 0.00 -1.18 0.00 0.00 59.36 57.78 2jpn h GLU 14 Cb 1.32 0.11 -0.05 0.00 -0.16 0.00 0.00 28.75 29.98 2jpn h GLU 14 CO 0.02 1.07 0.48 0.00 -1.18 0.00 0.00 179.01 179.40 2jpn h ALA 15 N 0.80 1.72 -0.42 2.92 0.00 -1.54 -3.29 119.26 119.44 2jpn h ALA 15 Ca -0.07 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.85 2jpn h ALA 15 Cb 1.58 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.16 2jpn h ALA 15 CO 0.16 0.16 0.28 0.77 0.00 0.00 0.00 179.25 180.62 2jpn h SER 16 N 0.74 0.38 0.00 0.00 0.02 -1.71 -3.25 113.55 109.73 2jpn h SER 16 Ca 0.32 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.26 2jpn h SER 16 Cb 0.29 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.74 2jpn h SER 16 CO -0.11 0.26 0.00 -0.38 -1.14 0.00 0.00 176.83 175.47 2jpn n ILE 17 N -4.48 0.08 0.04 3.27 -0.00 -1.24 -4.74 119.36 112.30 2jpn n ILE 17 Ca 0.04 -0.11 -0.05 0.00 -0.00 0.00 0.00 62.75 62.64 2jpn n ILE 17 Cb 0.16 1.29 0.16 0.00 -0.00 0.00 0.00 39.64 41.25 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 0.43 0.00 4.38 3.58 -1.62 -3.37 116.42 119.81 2jpn h ASP 18 Ca 0.00 -0.19 0.00 0.00 0.42 0.00 0.00 57.03 57.26 2jpn h ASP 18 Cb 0.74 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.67 2jpn h ASP 18 CO 0.00 0.80 -0.07 -1.84 -2.88 0.00 0.00 179.24 175.25 2jpn n GLU 19 N -4.02 0.88 -0.10 0.28 0.28 -1.26 -4.90 120.64 111.80 2jpn n GLU 19 Ca -0.02 0.00 -0.07 0.00 -0.16 0.00 0.00 57.16 56.92 2jpn n GLU 19 Cb 0.51 -0.53 0.01 0.00 1.43 0.00 0.00 31.44 32.85 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 0.28 -0.43 -1.84 3.04 -1.85 0.15 116.94 116.29 2jpn h PHE 20 Ca 0.00 0.02 0.05 0.00 3.98 0.00 0.00 57.97 62.01 2jpn h PHE 20 Cb 0.06 -0.07 -0.02 0.00 2.56 0.00 0.00 35.95 38.47 2jpn h PHE 20 CO 0.00 0.14 0.29 0.52 -2.02 0.00 0.00 178.31 177.24 2jpn h MET 21 N 0.32 0.38 -0.16 1.11 2.86 -1.86 0.17 114.93 117.75 2jpn h MET 21 Ca 0.15 -0.02 -0.21 0.00 -2.06 0.00 0.00 59.70 57.56 2jpn h MET 21 Cb 0.09 -0.09 0.01 0.00 0.06 0.00 0.00 31.60 31.67 2jpn h MET 21 CO -0.13 0.25 -0.73 0.78 1.06 0.00 0.00 176.91 178.15 2jpn h GLY 22 N 0.40 0.82 0.97 8.32 0.00 -1.51 0.09 103.07 112.15 2jpn h GLY 22 Ca 0.18 -1.12 -0.05 0.00 0.00 0.00 0.00 47.33 46.34 2jpn h GLY 22 CO -0.04 1.00 0.08 0.07 0.00 0.00 0.00 176.54 177.64 2jpn h LYS 23 N 0.52 0.76 -0.21 4.80 2.10 0.20 0.24 116.57 124.97 2jpn h LYS 23 Ca -0.04 -0.20 -0.15 0.00 -2.00 0.00 0.00 60.65 58.26 2jpn h LYS 23 Cb 1.35 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 2jpn h LYS 23 CO 0.15 0.77 -0.45 -0.84 -2.00 0.00 0.00 179.45 177.08 2jpn h ILE 24 N 0.62 1.31 0.00 0.07 3.07 -1.06 -2.36 117.51 119.17 2jpn h ILE 24 Ca 0.14 -1.67 -0.01 0.00 1.55 0.00 0.00 64.86 64.87 2jpn h ILE 24 Cb 0.38 1.83 -0.00 0.00 -0.27 0.00 0.00 36.82 38.75 2jpn h ILE 24 CO 0.01 0.52 -0.05 0.00 -1.05 0.00 0.00 178.15 177.59 2jpn h ALA 25 N 0.61 1.11 -0.31 0.16 0.00 -0.60 -2.84 119.26 117.38 2jpn h ALA 25 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2jpn h ALA 25 Cb 1.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2jpn h ALA 25 CO 0.10 0.06 0.00 -1.13 0.00 0.00 0.00 179.25 178.28 2jpn n SER 26 N -3.30 3.13 0.24 0.00 3.41 0.80 -4.80 113.62 113.11 2jpn n SER 26 Ca -0.01 -2.26 0.16 0.00 -0.26 0.00 0.00 58.87 56.50 2jpn n SER 26 Cb 0.21 -0.30 0.80 0.00 -0.26 0.00 0.00 64.21 64.66 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 -2.71 0.00 -3.70 0.00 6.02 -1.26 -4.54 117.38 111.19 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 0.14 -4.09 -0.09 0.00 1.02 0.00 0.00 30.24 27.22 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 -0.99 -0.00 0.21 5.09 -4.23 -1.26 -4.94 115.64 109.52 2jpn s THR 29 Ca 0.00 0.00 -0.02 0.00 -1.18 0.00 0.00 61.69 60.49 2jpn s THR 29 Cb 0.00 -0.70 -0.01 0.00 1.34 0.00 0.00 72.50 73.13 2jpn s THR 29 CO 0.00 0.00 1.58 0.25 -0.54 0.00 0.00 174.62 175.91 2jpn h LEU 30 N 5.37 0.62 -1.27 4.79 5.85 -1.88 -0.50 115.31 128.29 2jpn h LEU 30 Ca -0.28 -0.28 -0.04 0.00 0.84 0.00 0.00 57.88 58.13 2jpn h LEU 30 Cb 1.18 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.01 2jpn h LEU 30 CO 0.19 0.96 0.08 -0.08 -0.34 0.00 0.00 178.44 179.25 2jpn h GLU 31 N 0.48 0.58 -0.15 1.25 4.81 -1.94 0.31 114.58 119.91 2jpn h GLU 31 Ca 0.04 -0.10 -0.18 0.00 -0.13 0.00 0.00 59.36 58.99 2jpn h GLU 31 Cb 0.92 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 30.21 2jpn h GLU 31 CO 0.08 0.54 -0.60 0.78 -0.73 0.00 0.00 179.01 179.09 2jpn h GLY 32 N 0.81 0.74 0.90 1.92 0.00 -1.82 -2.89 103.07 102.74 2jpn h GLY 32 Ca 0.13 -1.01 0.03 0.00 0.00 0.00 0.00 47.33 46.49 2jpn h GLY 32 CO -0.00 0.90 0.65 -2.00 0.00 0.00 0.00 176.54 176.09 2jpn h LEU 33 N 0.36 1.09 -1.39 3.11 5.85 0.06 0.36 115.31 124.75 2jpn h LEU 33 Ca -0.03 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.64 2jpn h LEU 33 Cb 1.23 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 2jpn h LEU 33 CO 0.13 0.75 0.03 -0.33 -0.34 0.00 0.00 178.44 178.68 2jpn h GLU 34 N 1.27 0.43 -0.09 1.25 4.39 -0.57 0.53 114.58 121.79 2jpn h GLU 34 Ca 0.39 -0.07 -0.23 0.00 0.34 0.00 0.00 59.36 59.79 2jpn h GLU 34 Cb -0.01 -0.07 0.01 0.00 -0.10 0.00 0.00 28.75 28.58 2jpn h GLU 34 CO -0.12 0.44 -0.85 0.93 -1.16 0.00 0.00 179.01 178.24 2jpn h GLU 35 N 0.42 0.68 -0.64 2.33 4.39 -0.86 -1.00 114.58 119.90 2jpn h GLU 35 Ca 0.10 -0.61 -0.02 0.00 0.34 0.00 0.00 59.36 59.17 2jpn h GLU 35 Cb 0.24 0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.00 2jpn h GLU 35 CO 0.00 1.21 0.31 -0.07 -1.16 0.00 0.00 179.01 179.31 2jpn h LEU 36 N 0.44 0.80 -0.34 1.33 3.38 -0.10 0.18 115.31 120.99 2jpn h LEU 36 Ca -0.07 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.76 2jpn h LEU 36 Cb 1.48 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 2jpn h LEU 36 CO 0.17 0.68 -0.05 -0.08 0.09 0.00 0.00 178.44 179.25 2jpn h GLU 37 N 0.89 0.64 -0.18 1.13 4.22 0.15 0.15 114.58 121.59 2jpn h GLU 37 Ca 0.22 -0.23 -0.02 0.00 0.08 0.00 0.00 59.36 59.42 2jpn h GLU 37 Cb 0.08 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2jpn h GLU 37 CO -0.03 0.79 0.05 0.00 -2.18 0.00 0.00 179.01 177.64 2jpn h ALA 38 N 0.83 0.24 -0.21 2.92 0.00 -1.04 -2.12 119.26 119.88 2jpn h ALA 38 Ca 0.09 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2jpn h ALA 38 Cb 0.53 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2jpn h ALA 38 CO 0.03 -0.13 -0.02 -0.92 0.00 0.00 0.00 179.25 178.21 2jpn h TYR 39 N 0.12 0.31 0.63 0.00 3.20 -0.29 0.24 116.97 121.18 2jpn h TYR 39 Ca 0.06 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.88 2jpn h TYR 39 Cb 0.25 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.43 2jpn h TYR 39 CO 0.01 0.34 -0.31 -0.92 -1.64 0.00 0.00 178.16 175.63 2jpn h TYR 40 N 0.30 -0.81 -0.59 -3.82 3.20 -0.70 -0.88 116.97 113.66 2jpn h TYR 40 Ca 0.07 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 2jpn h TYR 40 Cb 0.24 0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.75 2jpn h TYR 40 CO 0.00 -0.50 0.32 0.87 -1.64 0.00 0.00 178.16 177.22 2jpn h LYS 41 N -0.86 0.81 -0.53 1.82 1.79 -0.37 -2.40 116.57 116.84 2jpn h LYS 41 Ca -0.08 -0.08 -0.10 0.00 -2.18 0.00 0.00 60.65 58.20 2jpn h LYS 41 Cb 0.66 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 31.13 2jpn h LYS 41 CO 0.13 0.60 -0.06 0.87 -1.08 0.00 0.00 179.45 179.91 2jpn h LYS 42 N 0.82 0.98 -0.24 3.15 1.79 -0.57 -3.30 116.57 119.19 2jpn h LYS 42 Ca 0.21 -0.34 -0.11 0.00 -2.18 0.00 0.00 60.65 58.23 2jpn h LYS 42 Cb 0.02 -0.07 -0.00 0.00 -1.58 0.00 0.00 32.23 30.60 2jpn h LYS 42 CO -0.03 1.02 -0.28 -0.09 -1.08 0.00 0.00 179.45 178.98 2jpn h ARG 43 N 0.85 0.61 0.00 3.15 2.43 -0.66 -3.37 114.38 117.40 2jpn h ARG 43 Ca 0.14 -0.34 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 2jpn h ARG 43 Cb 0.61 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.19 2jpn h ARG 43 CO 0.04 0.94 0.00 1.33 -1.51 0.00 0.00 179.97 180.77 2jpn n VAL 44 N -4.32 0.68 0.11 0.20 0.24 -1.03 0.08 118.33 114.29 2jpn n VAL 44 Ca -0.05 0.11 0.01 0.00 -2.04 0.00 0.00 64.34 62.37 2jpn n VAL 44 Cb 0.46 -0.88 -0.01 0.00 -1.47 0.00 0.00 33.84 31.95 2jpn n VAL 44 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 2jpn h LYS 45 N 0.00 0.00 0.00 7.34 2.10 -1.78 -2.65 116.57 121.58 2jpn h LYS 45 Ca 0.00 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.63 2jpn h LYS 45 Cb 0.41 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.74 2jpn h LYS 45 CO 0.00 0.52 -0.10 1.49 -2.00 0.00 0.00 179.45 179.36 2jpn h GLU 46 N 0.00 0.00 0.00 0.07 4.81 -0.51 -3.44 114.58 115.51 2jpn h GLU 46 Ca -0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2jpn h GLU 46 Cb 1.47 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.85 2jpn h GLU 46 CO 0.07 0.10 0.00 -2.37 -0.73 0.00 0.00 179.01 176.08 2jpn n THR 47 N -3.20 0.00 0.00 0.32 5.66 -0.89 -5.12 114.28 111.05 2jpn n THR 47 Ca 0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 2jpn n THR 47 Cb 0.41 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.19 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 1.92 0.00 1.09 0.28 -1.00 -4.96 120.64 117.97 2jpn n GLU 48 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2jpn n GLU 48 Cb 0.00 -0.42 0.00 0.00 1.43 0.00 0.00 31.44 32.45 2jpn n GLU 48 CO 0.00 0.00 0.00 1.47 -0.16 0.00 0.00 177.13 178.44 2jpn n LEU 49 N -0.31 0.00 -4.18 -1.84 -0.00 -1.25 -4.79 117.00 104.63 2jpn n LEU 49 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 56.01 55.90 2jpn n LEU 49 Cb 0.00 -0.45 -0.10 0.00 -0.00 0.00 0.00 43.42 42.87 2jpn n LEU 49 CO 0.00 0.00 -0.26 -1.59 -0.00 0.00 0.00 177.39 175.54 2jpn s LYS 50 N -0.90 1.12 0.23 1.47 0.00 -1.26 -5.06 119.74 115.34 2jpn s LYS 50 Ca 0.00 -1.57 -0.06 0.00 0.00 0.00 0.00 55.97 54.34 2jpn s LYS 50 Cb 0.00 0.26 0.36 0.00 0.00 0.00 0.00 37.83 38.45 2jpn s LYS 50 CO 0.00 -0.35 1.80 -0.44 0.00 0.00 0.00 175.35 176.36 2jpn h ASP 51 N 2.69 0.58 -0.28 0.03 3.32 -1.98 -1.52 116.42 119.26 2jpn h ASP 51 Ca -0.36 0.05 0.01 0.00 0.02 0.00 0.00 57.03 56.75 2jpn h ASP 51 Cb 1.23 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.71 2jpn h ASP 51 CO 0.55 0.34 0.19 0.74 -1.72 0.00 0.00 179.24 179.33 2jpn h THR 52 N 0.71 1.05 0.04 0.35 2.02 -1.97 -0.02 112.91 115.10 2jpn h THR 52 Ca 0.37 -0.12 -0.00 0.00 0.77 0.00 0.00 66.41 67.43 2jpn h THR 52 Cb 0.34 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 2jpn h THR 52 CO -0.25 0.06 -0.02 -0.78 0.37 0.00 0.00 175.52 174.91 2jpn h ASP 53 N 0.35 -0.05 -0.20 4.18 1.82 -1.67 -3.35 116.42 117.50 2jpn h ASP 53 Ca 0.11 -0.62 -0.03 0.00 -0.39 0.00 0.00 57.03 56.09 2jpn h ASP 53 Cb 0.00 0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.01 2jpn h ASP 53 CO -0.02 0.64 0.00 -0.78 -1.61 0.00 0.00 179.24 177.47 2jpn h ASP 54 N -0.78 0.35 -0.15 2.28 3.58 -0.10 -0.68 116.42 120.93 2jpn h ASP 54 Ca -0.01 -0.31 -0.05 0.00 0.42 0.00 0.00 57.03 57.09 2jpn h ASP 54 Cb 0.66 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.61 2jpn h ASP 54 CO 0.01 0.57 -0.09 0.40 -2.88 0.00 0.00 179.24 177.25 2jpn h ILE 55 N 0.12 1.32 -0.00 2.25 2.04 -1.38 -1.84 117.51 120.01 2jpn h ILE 55 Ca 0.06 -1.17 -0.00 0.00 1.00 0.00 0.00 64.86 64.75 2jpn h ILE 55 Cb 0.39 1.77 -0.00 0.00 -0.74 0.00 0.00 36.82 38.24 2jpn h ILE 55 CO 0.01 0.34 0.00 0.28 0.00 0.00 0.00 178.15 178.79 2jpn h SER 56 N -0.01 0.00 -0.20 1.72 0.02 -1.57 -0.27 113.55 113.25 2jpn h SER 56 Ca 0.03 -0.24 -0.05 0.00 -0.84 0.00 0.00 61.79 60.69 2jpn h SER 56 Cb 0.58 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 2jpn h SER 56 CO 0.03 0.24 -0.07 1.62 -1.14 0.00 0.00 176.83 177.50 2jpn h VAL 57 N -0.23 1.30 -0.25 2.27 3.04 -1.27 -3.00 116.25 118.11 2jpn h VAL 57 Ca 0.00 -1.10 -0.13 0.00 -1.01 0.00 0.00 66.70 64.47 2jpn h VAL 57 Cb 0.24 1.60 -0.01 0.00 -2.01 0.00 0.00 31.29 31.11 2jpn h VAL 57 CO 0.00 0.33 -0.38 -0.09 -1.01 0.00 0.00 177.57 176.43 2jpn h ARG 58 N 0.11 0.56 -0.20 4.17 1.12 -1.26 0.29 114.38 119.16 2jpn h ARG 58 Ca 0.05 -0.27 -0.07 0.00 -1.11 0.00 0.00 59.98 58.58 2jpn h ARG 58 Cb 0.54 -0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.49 2jpn h ARG 58 CO 0.02 0.85 -0.16 0.22 -3.11 0.00 0.00 179.97 177.79 2jpn h ASP 59 N 0.46 0.33 -0.22 -3.80 3.58 -1.12 0.30 116.42 115.96 2jpn h ASP 59 Ca 0.05 -0.08 -0.15 0.00 0.42 0.00 0.00 57.03 57.26 2jpn h ASP 59 Cb 0.87 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.83 2jpn h ASP 59 CO 0.07 0.52 -0.45 0.00 -2.88 0.00 0.00 179.24 176.50 2jpn h ALA 60 N 1.52 0.35 0.11 -0.78 0.00 -1.30 0.63 119.26 119.80 2jpn h ALA 60 Ca 0.06 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 2jpn h ALA 60 Cb 0.48 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2jpn h ALA 60 CO 0.03 0.49 -0.05 1.25 0.00 0.00 0.00 179.25 180.97 2jpn h LEU 61 N 0.40 -0.12 -1.93 0.00 6.46 -0.15 0.37 115.31 120.33 2jpn h LEU 61 Ca 0.01 -0.27 0.01 0.00 -0.12 0.00 0.00 57.88 57.51 2jpn h LEU 61 Cb 1.05 0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 41.01 2jpn h LEU 61 CO 0.10 0.21 0.08 0.00 -0.62 0.00 0.00 178.44 178.20 2jpn h ALA 62 N 0.37 2.00 0.25 1.25 0.00 -0.56 0.14 119.26 122.71 2jpn h ALA 62 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2jpn h ALA 62 Cb 0.38 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2jpn h ALA 62 CO 0.02 -0.01 -0.27 0.78 0.00 0.00 0.00 179.25 179.77 2jpn h GLY 63 N 0.09 -0.60 1.60 0.00 0.00 -0.04 -2.70 103.07 101.42 2jpn h GLY 63 Ca 0.05 0.32 -0.13 0.00 0.00 0.00 0.00 47.33 47.56 2jpn h GLY 63 CO -0.01 -0.24 -0.44 1.70 0.00 0.00 0.00 176.54 177.55 2jpn h LYS 64 N -0.57 0.44 -0.33 4.80 1.63 0.14 -3.36 116.57 119.32 2jpn h LYS 64 Ca -0.00 -0.23 0.04 0.00 -0.85 0.00 0.00 60.65 59.61 2jpn h LYS 64 Cb 0.53 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 32.13 2jpn h LYS 64 CO -0.07 0.80 0.10 -0.09 -3.45 0.00 0.00 179.45 176.73 2jpn h ARG 65 N 0.36 0.22 -0.69 1.90 2.43 -0.41 0.12 114.38 118.32 2jpn h ARG 65 Ca 0.03 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.22 2jpn h ARG 65 Cb 0.92 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 30.38 2jpn h ARG 65 CO 0.08 0.15 0.45 0.00 -1.51 0.00 0.00 179.97 179.14 2jpn h ALA 66 N 1.23 1.63 -0.13 2.80 0.00 -1.68 0.51 119.26 123.63 2jpn h ALA 66 Ca 0.15 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2jpn h ALA 66 Cb 0.14 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2jpn h ALA 66 CO -0.17 0.29 -0.02 0.93 0.00 0.00 0.00 179.25 180.27 2jpn h GLU 67 N 0.80 0.24 -0.16 0.00 4.39 -1.15 -1.27 114.58 117.43 2jpn h GLU 67 Ca 0.28 -0.09 -0.09 0.00 0.34 0.00 0.00 59.36 59.80 2jpn h GLU 67 Cb 0.10 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 2jpn h GLU 67 CO -0.08 0.52 -0.31 -0.07 -1.16 0.00 0.00 179.01 177.92 2jpn h LEU 68 N -0.06 0.32 -0.37 1.33 3.38 -0.21 -0.20 115.31 119.50 2jpn h LEU 68 Ca 0.03 -0.11 -0.19 0.00 0.09 0.00 0.00 57.88 57.71 2jpn h LEU 68 Cb 0.43 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 2jpn h LEU 68 CO 0.01 0.62 -0.81 -0.33 0.09 0.00 0.00 178.44 178.02 2jpn h GLU 69 N 0.28 0.21 0.00 1.13 5.08 -0.93 -0.70 114.58 119.65 2jpn h GLU 69 Ca 0.04 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 2jpn h GLU 69 Cb 0.68 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.99 2jpn h GLU 69 CO 0.05 0.91 0.00 -0.44 -1.00 0.00 0.00 179.01 178.53 2jpn h ASP 70 N 0.13 0.00 -0.52 1.42 3.32 -1.05 -3.01 116.42 116.71 2jpn h ASP 70 Ca -0.04 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.91 2jpn h ASP 70 Cb 1.41 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.90 2jpn h ASP 70 CO 0.12 0.00 0.10 -0.24 -1.72 0.00 0.00 179.24 177.50 2jpn n SER 71 N -2.70 4.47 0.18 6.45 2.88 -0.10 -4.74 113.62 120.05 2jpn n SER 71 Ca 0.01 -3.17 0.18 0.00 -1.33 0.00 0.00 58.87 54.57 2jpn n SER 71 Cb 0.26 -0.66 0.81 0.00 -0.75 0.00 0.00 64.21 63.86 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 2.47 0.00 -0.17 -3.46 3.58 -1.04 -3.21 116.42 114.59 2jpn h ASP 72 Ca 0.13 0.00 -0.58 0.00 0.42 0.00 0.00 57.03 57.00 2jpn h ASP 72 Cb 1.92 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.98 2jpn h ASP 72 CO 0.49 0.00 2.06 0.47 -2.88 0.00 0.00 179.24 179.38 2jpn n ASP 73 N -3.59 2.94 -4.91 2.28 8.00 -1.26 -4.98 116.55 115.02 2jpn n ASP 73 Ca 0.03 -2.71 -0.28 0.00 0.71 0.00 0.00 54.79 52.54 2jpn n ASP 73 Cb 0.44 -1.36 0.08 0.00 -0.02 0.00 0.00 41.12 40.26 2jpn n ASP 73 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2jpn s GLU 74 N 5.17 2.16 0.20 -1.24 2.02 -1.21 -4.69 118.70 121.10 2jpn s GLU 74 Ca 0.59 0.01 -0.31 0.00 0.02 0.00 0.00 54.97 55.29 2jpn s GLU 74 Cb 0.10 -2.04 -0.16 0.00 0.10 0.00 0.00 34.13 32.13 2jpn s GLU 74 CO 0.10 -1.39 0.93 0.28 0.02 0.00 0.00 175.26 175.20 2jpn n VAL 75 N -3.13 1.47 0.00 2.63 0.31 -1.26 -2.41 118.33 115.95 2jpn n VAL 75 Ca 0.08 -0.37 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 2jpn n VAL 75 Cb 0.60 -0.58 0.00 0.00 -0.91 0.00 0.00 33.84 32.95 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 1.20 0.00 0.12 5.55 0.28 0.28 -4.45 120.64 123.62 2jpn n GLU 76 Ca 0.15 0.00 -0.02 0.00 -0.16 0.00 0.00 57.16 57.12 2jpn n GLU 76 Cb 0.26 -1.39 0.13 0.00 1.43 0.00 0.00 31.44 31.86 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 -1.97 -3.37 114.58 117.76 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 0.68 0.00 -1.13 -1.00 0.00 0.00 179.01 177.56 2jpn n SER 78 N -3.74 0.00 0.00 1.42 3.41 -1.01 -5.01 113.62 108.68 2jpn n SER 78 Ca -0.01 -1.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.60 2jpn n SER 78 Cb 0.66 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.61 2jpn n SER 78 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21