#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dja s SER 2 N 0.00 0.21 -0.01 1.61 0.15 -1.26 -5.05 113.70 109.35 2dja s SER 2 Ca 0.00 -0.24 -0.02 0.00 0.70 0.00 0.00 55.95 56.39 2dja s SER 2 Cb 0.00 0.03 -0.27 0.00 -1.71 0.00 0.00 66.02 64.07 2dja s SER 2 CO 0.00 -0.12 0.80 0.77 1.20 0.00 0.00 173.24 175.88 2dja h SER 3 N 5.44 0.35 -4.33 5.45 4.64 -2.14 -3.50 113.55 119.47 2dja h SER 3 Ca -0.28 -0.53 0.00 0.00 -0.47 0.00 0.00 61.79 60.51 2dja h SER 3 Cb 1.21 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2dja h SER 3 CO 0.46 1.45 0.00 0.61 -0.87 0.00 0.00 176.83 178.48 2dja n GLY 4 N 1.69 -2.87 3.56 -0.77 0.00 -1.26 -5.00 105.19 100.54 2dja n GLY 4 Ca -0.18 -1.72 -0.24 0.00 0.00 0.00 0.00 46.02 43.88 2dja n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dja s SER 5 N -1.63 4.10 -0.25 1.61 0.15 -1.26 -5.14 113.70 111.29 2dja s SER 5 Ca 0.00 -0.77 -0.26 0.00 0.70 0.00 0.00 55.95 55.63 2dja s SER 5 Cb 0.00 -0.61 0.08 0.00 -1.71 0.00 0.00 66.02 63.78 2dja s SER 5 CO 0.00 0.04 0.76 -0.44 1.20 0.00 0.00 173.24 174.80 2dja s SER 6 N -3.37 -0.70 0.48 5.45 0.01 -1.26 -5.18 113.70 109.13 2dja s SER 6 Ca 0.29 1.28 0.05 0.00 1.31 0.00 0.00 55.95 58.88 2dja s SER 6 Cb -0.07 1.28 0.05 0.00 0.21 0.00 0.00 66.02 67.50 2dja s SER 6 CO 0.17 -0.28 0.45 0.61 0.41 0.00 0.00 173.24 174.60 2dja n GLY 7 N 2.41 2.54 3.27 3.44 0.00 -1.26 -5.15 105.19 110.44 2dja n GLY 7 Ca -0.14 -2.26 -0.13 0.00 0.00 0.00 0.00 46.02 43.49 2dja n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dja s VAL 8 N -2.25 -0.01 0.02 1.61 0.11 -1.26 -5.17 120.40 113.45 2dja s VAL 8 Ca 0.34 0.02 -0.01 0.00 -2.93 0.00 0.00 61.98 59.40 2dja s VAL 8 Cb -0.03 -0.54 -0.02 0.00 -1.53 0.00 0.00 36.38 34.26 2dja s VAL 8 CO 0.22 0.01 0.00 -1.61 -3.33 0.00 0.00 175.10 170.39 2dja s GLU 9 N 0.42 0.33 0.35 1.54 8.01 -1.26 -5.15 118.70 122.94 2dja s GLU 9 Ca -0.02 -0.54 -0.28 0.00 0.01 0.00 0.00 54.97 54.14 2dja s GLU 9 Cb -0.04 0.12 -0.09 0.00 -4.31 0.00 0.00 34.13 29.81 2dja s GLU 9 CO -0.02 -0.06 1.21 -1.25 0.01 0.00 0.00 175.26 175.15 2dja s PRO 10 N -1.39 4.30 -0.04 0.39 0.04 -1.26 -5.05 135.00 132.00 2dja s PRO 10 Ca -0.15 1.99 0.03 0.00 0.04 0.00 0.00 61.00 62.91 2dja s PRO 10 Cb -0.09 -2.95 0.01 0.00 0.04 0.00 0.00 34.50 31.50 2dja s PRO 10 CO -0.00 -0.15 -0.10 0.08 0.04 0.00 0.00 177.00 176.86 2dja s VAL 11 N -1.24 0.91 1.01 -0.36 1.01 -1.26 -5.15 120.40 115.32 2dja s VAL 11 Ca 0.51 -0.41 -0.13 0.00 0.00 0.00 0.00 61.98 61.96 2dja s VAL 11 Cb -0.35 -0.81 0.20 0.00 0.00 0.00 0.00 36.38 35.42 2dja s VAL 11 CO 0.45 0.28 1.09 -2.16 0.00 0.00 0.00 175.10 174.77 2dja s PRO 12 N 0.30 0.30 -0.48 2.72 0.04 -1.26 -4.99 135.00 131.64 2dja s PRO 12 Ca -0.06 0.48 0.03 0.00 0.04 0.00 0.00 61.00 61.50 2dja s PRO 12 Cb -0.11 -1.73 0.43 0.00 0.04 0.00 0.00 34.50 33.14 2dja s PRO 12 CO 0.01 -2.81 1.45 -3.47 0.04 0.00 0.00 177.00 172.23 2dja n ASP 13 N -4.22 5.79 -2.17 6.66 2.03 -1.26 -4.76 116.55 118.62 2dja n ASP 13 Ca 0.05 -3.76 -0.28 0.00 0.52 0.00 0.00 54.79 51.32 2dja n ASP 13 Cb 0.57 -0.60 0.08 0.00 -0.72 0.00 0.00 41.12 40.45 2dja n ASP 13 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2dja n THR 14 N -0.67 3.29 0.29 5.18 -2.24 -1.26 -4.60 114.28 114.26 2dja n THR 14 Ca 0.48 -2.38 -0.12 0.00 -2.27 0.00 0.00 64.05 59.76 2dja n THR 14 Cb 0.73 -1.11 -0.06 0.00 -2.10 0.00 0.00 70.33 67.78 2dja n THR 14 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2dja h HIS 15 N 1.68 -0.73 -6.19 4.78 3.86 -2.03 -3.46 115.15 113.06 2dja h HIS 15 Ca 0.51 -0.02 -0.26 0.00 -1.16 0.00 0.00 60.37 59.44 2dja h HIS 15 Cb 1.11 0.24 -0.07 0.00 1.06 0.00 0.00 27.41 29.75 2dja h HIS 15 CO 1.25 -0.45 -0.42 1.28 0.86 0.00 0.00 177.93 180.45 2dja n LEU 16 N -5.22 -0.32 -3.65 2.43 7.99 -1.26 -4.85 117.00 112.12 2dja n LEU 16 Ca -0.10 -0.55 -0.13 0.00 -0.01 0.00 0.00 56.01 55.23 2dja n LEU 16 Cb 0.31 -0.67 -0.07 0.00 -0.11 0.00 0.00 43.42 42.87 2dja n LEU 16 CO 0.24 0.23 0.36 -0.60 -1.51 0.00 0.00 177.39 176.11 2dja s ARG 17 N -5.14 0.76 0.10 3.23 6.06 -1.26 -5.14 118.95 117.57 2dja s ARG 17 Ca 0.05 0.97 -0.30 0.00 -2.50 0.00 0.00 55.73 53.94 2dja s ARG 17 Cb -0.03 0.34 -0.07 0.00 0.06 0.00 0.00 34.95 35.26 2dja s ARG 17 CO 0.42 -0.10 1.22 0.20 -2.50 0.00 0.00 175.30 174.54 2dja s GLY 18 N 0.56 2.43 0.69 8.12 0.00 -1.26 -5.00 107.32 112.86 2dja s GLY 18 Ca -0.02 0.91 -0.15 0.00 0.00 0.00 0.00 44.72 45.46 2dja s GLY 18 CO -0.02 2.02 1.15 -0.42 0.00 0.00 0.00 173.10 175.83 2dja s ILE 19 N 0.73 2.85 0.60 0.90 1.01 -1.26 -4.90 121.20 121.13 2dja s ILE 19 Ca 0.58 0.40 -0.10 0.00 0.00 0.00 0.00 60.65 61.53 2dja s ILE 19 Cb -0.31 -2.94 0.15 0.00 0.01 0.00 0.00 42.46 39.37 2dja s ILE 19 CO 0.31 -0.24 0.57 0.35 0.00 0.00 0.00 174.94 175.94 2dja n THR 20 N -2.54 0.00 -3.07 2.92 -2.24 -1.26 -3.94 114.28 104.15 2dja n THR 20 Ca 0.12 -0.28 -0.31 0.00 -2.27 0.00 0.00 64.05 61.31 2dja n THR 20 Cb 0.51 -1.21 -0.04 0.00 -2.10 0.00 0.00 70.33 67.49 2dja n THR 20 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dja h LEU 22 N 1.69 -0.08 -0.42 0.00 3.38 -1.91 -2.84 115.31 115.13 2dja h LEU 22 Ca -0.47 0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.53 2dja h LEU 22 Cb 1.18 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.93 2dja h LEU 22 CO 0.65 -0.04 0.21 -0.78 0.09 0.00 0.00 178.44 178.57 2dja h ASP 23 N -0.07 0.31 -3.48 -0.43 1.82 -1.99 -3.35 116.42 109.24 2dja h ASP 23 Ca -0.00 0.02 -0.73 0.00 -0.39 0.00 0.00 57.03 55.92 2dja h ASP 23 Cb 0.06 -0.04 -0.30 0.00 0.68 0.00 0.00 39.33 39.73 2dja h ASP 23 CO -0.00 0.22 -0.31 -1.00 -1.61 0.00 0.00 179.24 176.54 2dja s HIS 24 N -6.15 3.46 -2.00 0.28 0.09 -1.20 -4.90 115.29 104.87 2dja s HIS 24 Ca -0.13 -1.99 0.15 0.00 -0.00 0.00 0.00 55.06 53.09 2dja s HIS 24 Cb 0.12 -3.51 0.88 0.00 -0.00 0.00 0.00 32.58 30.07 2dja s HIS 24 CO 0.72 -0.97 1.35 -0.85 -0.00 0.00 0.00 174.74 174.98 2dja n GLU 25 N 4.59 0.66 -0.07 1.40 0.28 -1.08 -1.50 120.64 124.93 2dja n GLU 25 Ca -0.03 0.00 -0.09 0.00 -0.16 0.00 0.00 57.16 56.88 2dja n GLU 25 Cb 0.41 -1.35 -0.09 0.00 1.43 0.00 0.00 31.44 31.84 2dja n GLU 25 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2dja n ASN 26 N -0.85 2.19 -4.64 -1.84 3.02 -1.26 -4.72 115.26 107.16 2dja n ASN 26 Ca 0.11 -0.04 -0.43 0.00 -0.03 0.00 0.00 54.58 54.19 2dja n ASN 26 Cb 0.05 0.33 -0.02 0.00 -0.61 0.00 0.00 39.78 39.53 2dja n ASN 26 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2dja s GLU 27 N -2.32 4.11 -0.65 3.52 8.01 -1.10 -4.92 118.70 125.34 2dja s GLU 27 Ca -0.14 1.23 -0.27 0.00 0.01 0.00 0.00 54.97 55.81 2dja s GLU 27 Cb 0.05 -3.74 0.01 0.00 -4.31 0.00 0.00 34.13 26.14 2dja s GLU 27 CO 0.47 -0.85 1.45 0.15 0.01 0.00 0.00 175.26 176.49 2dja s LYS 28 N 3.61 3.11 -0.42 1.61 3.01 -1.26 -1.12 119.74 128.27 2dja s LYS 28 Ca 0.48 0.17 -0.38 0.00 -1.01 0.00 0.00 55.97 55.22 2dja s LYS 28 Cb -0.15 -4.21 -0.16 0.00 -1.01 0.00 0.00 37.83 32.31 2dja s LYS 28 CO 0.14 -2.20 1.63 1.33 0.51 0.00 0.00 175.35 176.76 2dja n VAL 29 N 6.71 0.00 -2.12 3.17 0.24 -1.25 -4.75 118.33 120.33 2dja n VAL 29 Ca 0.10 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.39 2dja n VAL 29 Cb 0.50 -0.42 0.10 0.00 -1.47 0.00 0.00 33.84 32.54 2dja n VAL 29 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 2dja n ASN 30 N 5.20 2.03 -3.52 -1.34 6.94 -1.06 -4.92 115.26 118.59 2dja n ASN 30 Ca 0.39 -3.03 -0.12 0.00 -0.02 0.00 0.00 54.58 51.79 2dja n ASN 30 Cb -0.04 -0.42 -0.03 0.00 -2.36 0.00 0.00 39.78 36.93 2dja n ASN 30 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 2dja s MET 31 N -2.39 1.16 -0.16 -3.83 -1.94 -1.07 -3.60 119.30 107.47 2dja s MET 31 Ca 0.37 -0.49 -0.03 0.00 -1.71 0.00 0.00 55.69 53.83 2dja s MET 31 Cb 0.38 0.53 0.05 0.00 2.01 0.00 0.00 34.83 37.80 2dja s MET 31 CO -0.08 -0.48 0.04 -0.47 -0.01 0.00 0.00 175.02 174.03 2dja s TYR 32 N -3.49 0.73 0.04 -0.03 5.04 -1.26 -2.11 117.35 116.26 2dja s TYR 32 Ca 0.00 -0.57 -0.31 0.00 -2.44 0.00 0.00 57.07 53.75 2dja s TYR 32 Cb 0.00 -0.89 -0.06 0.00 0.35 0.00 0.00 41.96 41.36 2dja s TYR 32 CO -0.10 -0.53 1.33 0.00 -1.34 0.00 0.00 175.55 174.91 2dja h VAL 34 N 4.65 0.93 -0.22 0.00 2.07 -1.42 0.56 116.25 122.82 2dja h VAL 34 Ca -0.40 -1.38 0.03 0.00 0.82 0.00 0.00 66.70 65.77 2dja h VAL 34 Cb 1.19 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 32.57 2dja h VAL 34 CO 0.87 0.27 0.03 0.77 0.02 0.00 0.00 177.57 179.53 2dja h SER 35 N -0.91 -0.03 0.59 0.57 4.64 -1.93 -2.69 113.55 113.80 2dja h SER 35 Ca -0.01 0.04 -0.22 0.00 -0.47 0.00 0.00 61.79 61.12 2dja h SER 35 Cb 0.54 0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.69 2dja h SER 35 CO 0.02 0.02 -0.99 0.44 -0.87 0.00 0.00 176.83 175.45 2dja h ASP 36 N 0.11 0.32 -4.51 4.97 3.32 -1.93 -3.48 116.42 115.22 2dja h ASP 36 Ca 0.10 -0.29 -0.27 0.00 0.02 0.00 0.00 57.03 56.59 2dja h ASP 36 Cb 0.11 -0.10 0.11 0.00 0.22 0.00 0.00 39.33 39.67 2dja h ASP 36 CO -0.15 1.13 -0.50 0.47 -1.72 0.00 0.00 179.24 178.47 2dja n ASP 37 N -3.61 -4.42 -4.07 6.45 8.00 0.19 -5.03 116.55 114.07 2dja n ASP 37 Ca -0.05 -0.40 -0.11 0.00 0.71 0.00 0.00 54.79 54.94 2dja n ASP 37 Cb 0.88 -3.77 -0.11 0.00 -0.02 0.00 0.00 41.12 38.10 2dja n ASP 37 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 2dja s GLN 38 N -5.72 0.56 -0.13 -1.24 2.00 -1.14 -4.96 119.66 109.03 2dja s GLN 38 Ca 0.32 -0.91 -0.29 0.00 -2.00 0.00 0.00 55.36 52.48 2dja s GLN 38 Cb -0.14 -0.12 -0.01 0.00 0.80 0.00 0.00 33.01 33.54 2dja s GLN 38 CO 0.52 -0.01 1.05 -0.51 -0.50 0.00 0.00 175.29 175.84 2dja s LEU 39 N -2.04 4.21 0.39 3.68 1.43 -1.26 -2.04 118.68 123.04 2dja s LEU 39 Ca -0.04 1.53 0.03 0.00 -1.03 0.00 0.00 54.13 54.62 2dja s LEU 39 Cb -0.04 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.59 2dja s LEU 39 CO -0.02 -0.53 0.09 0.27 0.23 0.00 0.00 176.35 176.39 2dja s ILE 40 N 2.39 0.88 0.47 -0.59 -4.36 -0.90 -4.89 121.20 114.20 2dja s ILE 40 Ca 0.48 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.89 2dja s ILE 40 Cb -0.18 -2.50 0.02 0.00 1.25 0.00 0.00 42.46 41.05 2dja s ILE 40 CO 0.15 0.00 0.17 0.00 0.24 0.00 0.00 174.94 175.51 2dja h ALA 42 N 0.97 -0.66 -0.87 0.00 0.00 -1.92 -2.54 119.26 114.25 2dja h ALA 42 Ca -0.35 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 54.57 2dja h ALA 42 Cb 1.14 0.26 -0.07 0.00 0.00 0.00 0.00 17.79 19.12 2dja h ALA 42 CO 0.56 -0.87 0.56 -0.07 0.00 0.00 0.00 179.25 179.43 2dja h LEU 43 N -0.66 0.58 -1.05 0.00 3.38 -1.97 0.53 115.31 116.12 2dja h LEU 43 Ca -0.07 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2dja h LEU 43 Cb 0.51 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.14 2dja h LEU 43 CO 0.10 0.29 0.51 0.00 0.09 0.00 0.00 178.44 179.43 2dja h LYS 45 N 1.18 0.00 0.13 0.00 3.11 -0.61 -0.45 116.57 119.93 2dja h LYS 45 Ca 0.31 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 58.14 2dja h LYS 45 Cb -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.19 2dja h LYS 45 CO -0.06 0.56 -0.06 -0.07 -2.81 0.00 0.00 179.45 177.01 2dja h LEU 46 N 0.00 -0.15 0.00 5.20 4.07 0.35 -3.34 115.31 121.44 2dja h LEU 46 Ca -0.13 -0.30 0.00 0.00 0.08 0.00 0.00 57.88 57.52 2dja h LEU 46 Cb 1.73 0.04 0.00 0.00 1.08 0.00 0.00 40.66 43.50 2dja h LEU 46 CO 0.08 0.25 -0.55 1.33 -1.08 0.00 0.00 178.44 178.46 2dja n VAL 47 N -4.99 0.00 -0.79 1.22 0.24 -0.09 -4.85 118.33 109.06 2dja n VAL 47 Ca -0.09 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 61.91 2dja n VAL 47 Cb 0.23 -0.55 0.09 0.00 -1.47 0.00 0.00 33.84 32.15 2dja n VAL 47 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dja n GLY 48 N 1.89 -2.57 0.48 7.63 0.00 -0.19 -4.56 105.19 107.86 2dja n GLY 48 Ca 0.00 -0.43 0.29 0.00 0.00 0.00 0.00 46.02 45.88 2dja n GLY 48 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2dja h ARG 49 N -1.71 0.10 -1.95 1.61 1.12 -1.91 -0.50 114.38 111.13 2dja h ARG 49 Ca -0.38 -0.01 -0.06 0.00 -1.11 0.00 0.00 59.98 58.42 2dja h ARG 49 Cb 1.16 -0.02 -0.03 0.00 -0.01 0.00 0.00 29.97 31.08 2dja h ARG 49 CO 0.24 0.07 -0.01 0.72 -3.11 0.00 0.00 179.97 177.89 2dja n HIS 50 N -4.32 0.17 0.02 2.20 -0.00 -1.15 -4.59 115.22 107.55 2dja n HIS 50 Ca 0.23 -1.18 -0.10 0.00 -0.00 0.00 0.00 57.72 56.67 2dja n HIS 50 Cb 1.04 -0.71 -0.06 0.00 -0.00 0.00 0.00 29.99 30.26 2dja n HIS 50 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.34 176.25 2dja h ARG 51 N 1.35 -0.39 -2.25 -0.41 9.65 -1.21 -3.26 114.38 117.86 2dja h ARG 51 Ca 0.06 0.03 -0.61 0.00 -1.10 0.00 0.00 59.98 58.36 2dja h ARG 51 Cb 1.06 0.09 -0.41 0.00 -1.39 0.00 0.00 29.97 29.31 2dja h ARG 51 CO 0.12 -0.26 -0.52 -3.47 2.80 0.00 0.00 179.97 178.64 2dja n ASP 52 N -4.38 4.19 -4.62 -3.80 2.03 -1.26 -4.69 116.55 104.02 2dja n ASP 52 Ca -0.04 -3.53 -0.24 0.00 0.52 0.00 0.00 54.79 51.50 2dja n ASP 52 Cb 0.25 -0.67 -0.08 0.00 -0.72 0.00 0.00 41.12 39.90 2dja n ASP 52 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2dja s HIS 53 N -2.86 2.58 -0.73 -0.67 3.76 -1.23 -5.07 115.29 111.07 2dja s HIS 53 Ca 0.43 -0.33 -0.27 0.00 -0.15 0.00 0.00 55.06 54.73 2dja s HIS 53 Cb 0.19 -1.31 0.02 0.00 1.11 0.00 0.00 32.58 32.60 2dja s HIS 53 CO -0.05 0.56 1.36 -1.14 -0.85 0.00 0.00 174.74 174.62 2dja s GLN 54 N -3.68 3.12 -0.12 1.40 0.74 -1.26 -4.99 119.66 114.87 2dja s GLN 54 Ca 0.33 -0.13 -0.02 0.00 0.05 0.00 0.00 55.36 55.59 2dja s GLN 54 Cb -0.04 -4.22 -0.03 0.00 1.10 0.00 0.00 33.01 29.83 2dja s GLN 54 CO 0.19 -2.23 -0.05 0.14 -0.55 0.00 0.00 175.29 172.79 2dja s VAL 55 N 6.19 3.83 -1.19 1.34 -7.23 -1.26 -1.02 120.40 121.06 2dja s VAL 55 Ca 0.39 -0.40 -0.11 0.00 -1.81 0.00 0.00 61.98 60.05 2dja s VAL 55 Cb -0.09 -2.63 0.20 0.00 0.56 0.00 0.00 36.38 34.42 2dja s VAL 55 CO 0.16 0.54 1.43 0.00 -0.31 0.00 0.00 175.10 176.92 2dja n ALA 56 N 2.98 4.24 -1.47 1.32 0.00 -0.77 -4.87 120.51 121.95 2dja n ALA 56 Ca -0.18 -4.38 -0.45 0.00 0.00 0.00 0.00 53.44 48.43 2dja n ALA 56 Cb 0.53 -2.87 -0.02 0.00 0.00 0.00 0.00 19.45 17.09 2dja n ALA 56 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2dja n SER 57 N 4.49 -0.39 -3.84 0.00 7.64 -1.26 -4.14 113.62 116.13 2dja n SER 57 Ca 0.34 1.09 -0.25 0.00 1.01 0.00 0.00 58.87 61.06 2dja n SER 57 Cb 0.40 -1.09 -0.17 0.00 -1.01 0.00 0.00 64.21 62.34 2dja n SER 57 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 2dja s LEU 58 N 1.98 0.88 0.20 -3.43 2.34 -1.24 -5.02 118.68 114.38 2dja s LEU 58 Ca 0.62 -0.19 -0.21 0.00 0.06 0.00 0.00 54.13 54.40 2dja s LEU 58 Cb -0.78 -0.64 0.05 0.00 -0.56 0.00 0.00 46.19 44.26 2dja s LEU 58 CO 0.58 -0.16 0.61 0.54 -1.06 0.00 0.00 176.35 176.86 2dja s ASN 59 N 1.84 -0.40 1.29 1.48 2.20 -1.26 -4.92 114.94 115.17 2dja s ASN 59 Ca 0.05 -0.28 -0.20 0.00 -0.94 0.00 0.00 52.86 51.49 2dja s ASN 59 Cb -0.12 0.62 0.30 0.00 -2.00 0.00 0.00 41.25 40.05 2dja s ASN 59 CO -0.07 -1.09 0.96 0.47 -2.94 0.00 0.00 177.10 174.44 2dja n ASP 60 N -0.39 -2.54 -2.11 3.54 8.00 -1.26 -4.89 116.55 116.90 2dja n ASP 60 Ca -0.12 -1.04 -0.22 0.00 0.71 0.00 0.00 54.79 54.12 2dja n ASP 60 Cb 0.63 -0.93 0.02 0.00 -0.02 0.00 0.00 41.12 40.82 2dja n ASP 60 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2dja n ARG 61 N -4.85 2.07 -3.26 -1.24 3.00 -1.26 -4.92 116.66 106.21 2dja n ARG 61 Ca 0.14 -1.99 -0.39 0.00 -0.01 0.00 0.00 57.85 55.60 2dja n ARG 61 Cb 0.55 -1.83 -0.07 0.00 0.00 0.00 0.00 32.46 31.11 2dja n ARG 61 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2dja s PHE 62 N -2.07 3.40 -0.63 -1.55 0.08 -1.26 -5.03 117.98 110.93 2dja s PHE 62 Ca 0.42 0.80 -0.25 0.00 0.12 0.00 0.00 56.93 58.02 2dja s PHE 62 Cb 0.31 -2.65 0.04 0.00 -0.57 0.00 0.00 43.02 40.16 2dja s PHE 62 CO -0.06 -0.04 1.08 -1.83 -0.10 0.00 0.00 175.22 174.26 2dja s GLU 63 N 1.42 3.29 -1.35 0.44 -1.05 -1.26 -4.32 118.70 115.87 2dja s GLU 63 Ca 0.25 -0.27 -0.14 0.00 -0.15 0.00 0.00 54.97 54.66 2dja s GLU 63 Cb -0.15 -4.11 0.14 0.00 -0.44 0.00 0.00 34.13 29.56 2dja s GLU 63 CO 0.10 -1.76 0.35 1.63 0.95 0.00 0.00 175.26 176.53 2dja n LYS 64 N 8.18 -0.82 -3.10 -4.83 5.02 -1.26 -4.83 118.16 116.52 2dja n LYS 64 Ca 0.02 0.10 -0.40 0.00 -2.02 0.00 0.00 58.31 56.01 2dja n LYS 64 Cb 0.48 -3.33 -0.06 0.00 -0.02 0.00 0.00 35.03 32.10 2dja n LYS 64 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2dja s LEU 65 N -5.80 4.15 -0.99 -0.35 1.98 -1.26 -5.01 118.68 111.40 2dja s LEU 65 Ca 0.49 0.86 -0.05 0.00 -2.89 0.00 0.00 54.13 52.53 2dja s LEU 65 Cb -0.28 -2.92 0.25 0.00 0.66 0.00 0.00 46.19 43.90 2dja s LEU 65 CO 0.76 -0.28 0.93 -1.59 -1.89 0.00 0.00 176.35 174.28 2dja s LYS 66 N 1.94 3.71 0.63 1.98 -2.85 -1.26 -5.06 119.74 118.82 2dja s LYS 66 Ca 0.29 -3.23 -0.15 0.00 -1.00 0.00 0.00 55.97 51.88 2dja s LYS 66 Cb -0.16 -4.24 -0.02 0.00 -2.06 0.00 0.00 37.83 31.35 2dja s LYS 66 CO 0.10 -1.25 1.08 -1.14 0.10 0.00 0.00 175.35 174.24 2dja s GLN 67 N -1.27 3.09 0.36 1.78 2.00 -1.26 -5.05 119.66 119.31 2dja s GLN 67 Ca 0.29 1.27 -0.00 0.00 -2.00 0.00 0.00 55.36 54.91 2dja s GLN 67 Cb -0.09 -2.00 -0.03 0.00 0.80 0.00 0.00 33.01 31.69 2dja s GLN 67 CO -0.10 -1.01 0.58 -0.08 -0.50 0.00 0.00 175.29 174.18 2dja s THR 68 N -2.43 5.08 0.86 -0.34 -1.32 -1.26 -5.10 115.64 111.12 2dja s THR 68 Ca 0.65 -0.36 -0.13 0.00 -1.21 0.00 0.00 61.69 60.64 2dja s THR 68 Cb -0.18 -3.86 0.12 0.00 -1.51 0.00 0.00 72.50 67.07 2dja s THR 68 CO 0.40 -0.60 1.22 -0.76 -2.21 0.00 0.00 174.62 172.67 2dja s LEU 69 N -4.36 2.54 -0.06 9.08 1.43 -1.26 -5.08 118.68 120.97 2dja s LEU 69 Ca 0.41 0.64 0.05 0.00 -1.03 0.00 0.00 54.13 54.20 2dja s LEU 69 Cb -0.10 -3.00 -0.02 0.00 0.03 0.00 0.00 46.19 43.10 2dja s LEU 69 CO 0.37 -2.17 -0.21 -1.83 0.23 0.00 0.00 176.35 172.75 2dja s GLU 70 N -5.66 2.57 -0.58 1.70 -1.05 -1.26 -5.08 118.70 109.35 2dja s GLU 70 Ca 0.65 -0.82 -0.27 0.00 -0.15 0.00 0.00 54.97 54.38 2dja s GLU 70 Cb -0.09 -2.27 0.01 0.00 -0.44 0.00 0.00 34.13 31.34 2dja s GLU 70 CO 0.50 0.46 1.52 0.00 0.95 0.00 0.00 175.26 178.69 2dja s MET 71 N -0.33 3.15 -0.26 -4.83 0.23 -1.26 -4.94 119.30 111.06 2dja s MET 71 Ca 0.02 0.46 -0.21 0.00 -1.03 0.00 0.00 55.69 54.93 2dja s MET 71 Cb -0.13 -4.19 0.07 0.00 -1.53 0.00 0.00 34.83 29.05 2dja s MET 71 CO 0.02 -2.13 0.67 0.54 -2.03 0.00 0.00 175.02 172.10 2dja s ASN 72 N 5.22 -0.76 -0.47 -1.18 4.22 -1.26 -5.11 114.94 115.61 2dja s ASN 72 Ca 0.55 1.39 -0.42 0.00 -2.14 0.00 0.00 52.86 52.23 2dja s ASN 72 Cb -0.12 1.36 -0.18 0.00 1.28 0.00 0.00 41.25 43.60 2dja s ASN 72 CO 0.23 -0.24 1.82 0.18 -2.04 0.00 0.00 177.10 177.06 2dja n LEU 73 N 3.15 0.87 -4.20 3.54 7.99 -1.26 -4.88 117.00 122.21 2dja n LEU 73 Ca -0.16 0.82 -0.37 0.00 -0.01 0.00 0.00 56.01 56.29 2dja n LEU 73 Cb 0.56 -0.84 -0.12 0.00 -0.11 0.00 0.00 43.42 42.91 2dja n LEU 73 CO 0.03 -0.75 -0.23 0.42 -1.51 0.00 0.00 177.39 175.35 2dja s THR 74 N 4.57 3.48 0.05 -5.08 -4.23 -1.26 -5.08 115.64 108.09 2dja s THR 74 Ca 1.07 -1.54 0.08 0.00 -1.18 0.00 0.00 61.69 60.12 2dja s THR 74 Cb -1.41 -3.14 -0.03 0.00 1.34 0.00 0.00 72.50 69.27 2dja s THR 74 CO 0.68 -0.37 -0.21 0.20 -0.54 0.00 0.00 174.62 174.37 2dja s ASN 75 N 1.62 2.55 -0.16 3.99 -0.87 -1.26 -5.13 114.94 115.67 2dja s ASN 75 Ca 0.01 -0.55 -0.06 0.00 -1.57 0.00 0.00 52.86 50.69 2dja s ASN 75 Cb -0.21 -0.20 -0.04 0.00 -0.02 0.00 0.00 41.25 40.78 2dja s ASN 75 CO -0.01 0.15 0.03 -0.76 -2.57 0.00 0.00 177.10 173.94 2dja s LEU 76 N -1.30 3.63 -0.11 0.60 1.43 -1.26 -5.02 118.68 116.65 2dja s LEU 76 Ca 0.08 0.03 -0.04 0.00 -1.03 0.00 0.00 54.13 53.17 2dja s LEU 76 Cb -0.09 -1.90 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 2dja s LEU 76 CO 0.02 0.20 -0.07 0.58 0.23 0.00 0.00 176.35 177.31 2dja h VAL 77 N 4.86 0.00 -6.22 -1.59 2.07 -2.02 -3.47 116.25 109.88 2dja h VAL 77 Ca -0.37 -0.92 -0.47 0.00 0.82 0.00 0.00 66.70 65.76 2dja h VAL 77 Cb 1.18 0.00 -0.26 0.00 -1.52 0.00 0.00 31.29 30.68 2dja h VAL 77 CO 0.66 0.00 -0.69 2.29 0.02 0.00 0.00 177.57 179.86 2dja n LYS 78 N -4.51 -0.82 -0.05 1.57 2.85 -1.26 -4.79 118.16 111.15 2dja n LYS 78 Ca -0.03 0.10 -0.03 0.00 -1.05 0.00 0.00 58.31 57.30 2dja n LYS 78 Cb 0.11 -3.35 -0.01 0.00 -0.65 0.00 0.00 35.03 31.13 2dja n LYS 78 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 2dja h SER 79 N -0.73 0.00 -0.35 -5.58 0.87 -2.05 -3.47 113.55 102.23 2dja h SER 79 Ca -0.46 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 59.99 2dja h SER 79 Cb 1.04 0.00 -0.15 0.00 -0.44 0.00 0.00 62.40 62.85 2dja h SER 79 CO 0.64 0.57 -0.32 0.61 -0.53 0.00 0.00 176.83 177.81 2dja n GLY 80 N 1.69 -0.91 3.56 5.77 0.00 -1.26 -5.09 105.19 108.95 2dja n GLY 80 Ca -0.04 0.68 -0.27 0.00 0.00 0.00 0.00 46.02 46.39 2dja n GLY 80 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dja s PRO 81 N 0.71 2.55 -1.12 1.61 0.04 -1.26 -4.89 135.00 132.63 2dja s PRO 81 Ca 0.28 -0.40 -0.11 0.00 0.04 0.00 0.00 61.00 60.82 2dja s PRO 81 Cb 0.13 -5.09 0.24 0.00 0.04 0.00 0.00 34.50 29.83 2dja s PRO 81 CO -0.12 -3.45 1.19 -1.12 0.04 0.00 0.00 177.00 173.53 2dja s SER 82 N 7.84 7.21 -0.12 6.66 0.01 -1.26 -4.95 113.70 129.09 2dja s SER 82 Ca 0.70 -3.35 -0.29 0.00 1.31 0.00 0.00 55.95 54.32 2dja s SER 82 Cb -0.06 -2.27 0.08 0.00 0.21 0.00 0.00 66.02 63.98 2dja s SER 82 CO 0.01 -0.45 0.74 -0.94 0.41 0.00 0.00 173.24 173.01 2dja s SER 83 N 1.85 -0.64 0.00 2.44 1.04 -1.26 -5.30 113.70 111.83 2dja s SER 83 Ca 0.34 0.86 0.28 0.00 0.48 0.00 0.00 55.95 57.90 2dja s SER 83 Cb -0.08 0.74 1.69 0.00 0.10 0.00 0.00 66.02 68.47 2dja s SER 83 CO -0.06 -0.48 2.03 0.61 0.98 0.00 0.00 173.24 176.33