#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 -0.69 0.03 1.61 0.01 -1.26 -5.18 113.70 108.23 2dja s SER 2 Ca 0.00 1.31 -0.29 0.00 1.31 0.00 0.00 55.95 58.28 2dja s SER 2 Cb 0.00 1.32 0.11 0.00 0.21 0.00 0.00 66.02 67.66 2dja s SER 2 CO 0.00 -0.25 1.21 -0.55 0.41 0.00 0.00 173.24 174.07 2dja s SER 3 N 0.29 -0.08 0.00 2.44 0.15 -1.26 -5.11 113.70 110.13 2dja s SER 3 Ca -0.00 -0.22 0.00 0.00 0.70 0.00 0.00 55.95 56.43 2dja s SER 3 Cb -0.04 0.24 0.00 0.00 -1.71 0.00 0.00 66.02 64.51 2dja s SER 3 CO 0.01 -0.45 0.00 0.61 1.20 0.00 0.00 173.24 174.61 2dja n GLY 4 N -0.52 1.15 2.36 9.45 0.00 -1.26 -4.98 105.19 111.39 2dja n GLY 4 Ca -0.07 -0.36 -0.10 0.00 0.00 0.00 0.00 46.02 45.49 2dja n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dja n SER 5 N 0.00 -3.45 -3.85 1.61 2.88 -1.26 -5.04 113.62 104.51 2dja n SER 5 Ca 0.00 -0.26 -0.26 0.00 -1.33 0.00 0.00 58.87 57.02 2dja n SER 5 Cb 0.00 -2.59 -0.17 0.00 -0.75 0.00 0.00 64.21 60.70 2dja n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dja s SER 6 N -3.28 2.31 0.00 -3.46 1.04 -1.26 -4.83 113.70 104.22 2dja s SER 6 Ca 0.19 -0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.21 2dja s SER 6 Cb -0.09 -0.75 0.00 0.00 0.10 0.00 0.00 66.02 65.29 2dja s SER 6 CO 0.33 -0.18 0.00 0.61 0.98 0.00 0.00 173.24 174.99 2dja n GLY 7 N 4.98 2.51 3.10 7.32 0.00 -1.26 -4.35 105.19 117.48 2dja n GLY 7 Ca -0.11 -0.29 -0.15 0.00 0.00 0.00 0.00 46.02 45.47 2dja n GLY 7 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2dja n VAL 8 N 0.00 -0.30 -2.40 1.61 3.14 -1.26 -4.85 118.33 114.27 2dja n VAL 8 Ca 0.00 0.00 -0.35 0.00 -2.96 0.00 0.00 64.34 61.03 2dja n VAL 8 Cb 0.00 -0.75 -0.02 0.00 -1.06 0.00 0.00 33.84 32.02 2dja n VAL 8 CO 0.00 0.00 0.00 -1.83 -6.46 0.00 0.00 176.83 168.54 2dja s GLU 9 N -5.68 3.70 0.00 1.45 4.04 -1.26 -4.84 118.70 116.11 2dja s GLU 9 Ca 0.26 1.55 0.00 0.00 0.04 0.00 0.00 54.97 56.81 2dja s GLU 9 Cb -0.15 -2.19 0.00 0.00 0.02 0.00 0.00 34.13 31.82 2dja s GLU 9 CO 0.32 -0.55 0.00 -0.35 -1.84 0.00 0.00 175.26 172.84 2dja n PRO 10 N -0.85 -0.76 -1.14 -4.83 -0.04 -1.26 -4.14 135.00 121.98 2dja n PRO 10 Ca 0.09 0.00 -0.46 0.00 -0.04 0.00 0.00 63.50 63.09 2dja n PRO 10 Cb 0.51 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.89 2dja n PRO 10 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2dja n VAL 11 N -2.25 0.00 -1.11 0.52 3.14 -1.26 -4.88 118.33 112.49 2dja n VAL 11 Ca 0.00 0.00 -0.29 0.00 -2.96 0.00 0.00 64.34 61.09 2dja n VAL 11 Cb 0.00 -0.35 0.22 0.00 -1.06 0.00 0.00 33.84 32.65 2dja n VAL 11 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 2dja s PRO 12 N 2.55 -0.64 -0.29 1.45 0.04 -1.26 -5.03 135.00 131.82 2dja s PRO 12 Ca 0.75 0.15 -0.07 0.00 0.04 0.00 0.00 61.00 61.87 2dja s PRO 12 Cb -1.04 -1.65 0.01 0.00 0.04 0.00 0.00 34.50 31.86 2dja s PRO 12 CO 0.55 -3.37 0.09 -0.51 0.04 0.00 0.00 177.00 173.80 2dja s ASP 13 N -3.72 5.17 0.21 6.66 1.01 -1.26 -5.06 116.67 119.68 2dja s ASP 13 Ca 0.69 -0.66 -0.29 0.00 0.71 0.00 0.00 52.55 53.00 2dja s ASP 13 Cb -0.13 -1.90 -0.16 0.00 1.01 0.00 0.00 42.92 41.74 2dja s ASP 13 CO 0.57 -0.18 0.68 0.41 0.21 0.00 0.00 175.17 176.85 2dja n THR 14 N 4.88 1.84 -2.38 -1.27 -1.04 -1.26 -4.79 114.28 110.26 2dja n THR 14 Ca -0.15 -0.46 -0.39 0.00 -2.04 0.00 0.00 64.05 61.01 2dja n THR 14 Cb 0.48 -0.24 -0.03 0.00 -1.82 0.00 0.00 70.33 68.72 2dja n THR 14 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 2dja s HIS 15 N -0.92 2.12 0.14 -1.42 2.46 -1.26 -4.96 115.29 111.45 2dja s HIS 15 Ca 0.65 0.09 0.06 0.00 0.47 0.00 0.00 55.06 56.32 2dja s HIS 15 Cb -0.90 -4.46 -0.04 0.00 -0.13 0.00 0.00 32.58 27.06 2dja s HIS 15 CO 0.57 -2.09 -0.13 -0.48 -2.47 0.00 0.00 174.74 170.14 2dja s LEU 16 N 6.83 2.47 -0.39 8.88 0.05 -1.26 -5.12 118.68 130.13 2dja s LEU 16 Ca 0.48 -0.90 -0.11 0.00 0.05 0.00 0.00 54.13 53.65 2dja s LEU 16 Cb -0.08 -0.50 0.04 0.00 -2.05 0.00 0.00 46.19 43.60 2dja s LEU 16 CO 0.11 -0.21 0.22 -0.60 -0.55 0.00 0.00 176.35 175.32 2dja s ARG 17 N -3.14 2.79 0.00 1.48 6.06 -1.26 -4.64 118.95 120.24 2dja s ARG 17 Ca 0.13 -1.15 0.00 0.00 -2.50 0.00 0.00 55.73 52.21 2dja s ARG 17 Cb -0.02 -3.76 0.00 0.00 0.06 0.00 0.00 34.95 31.23 2dja s ARG 17 CO 0.03 -0.75 0.00 0.41 -2.50 0.00 0.00 175.30 172.48 2dja n GLY 18 N 5.00 0.17 0.14 8.12 0.00 -1.26 -5.09 105.19 112.27 2dja n GLY 18 Ca -0.12 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.85 2dja n GLY 18 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2dja h ILE 19 N 0.00 0.19 -2.60 -0.61 1.08 -2.03 -3.47 117.51 110.08 2dja h ILE 19 Ca 0.00 -0.92 -0.36 0.00 -0.39 0.00 0.00 64.86 63.19 2dja h ILE 19 Cb 0.00 0.34 0.20 0.00 -3.07 0.00 0.00 36.82 34.29 2dja h ILE 19 CO 0.00 0.06 -0.35 0.35 -0.69 0.00 0.00 178.15 177.51 2dja n THR 20 N -4.94 0.00 -2.49 -0.27 -2.24 -1.26 -4.51 114.28 98.58 2dja n THR 20 Ca -0.04 -0.18 -0.37 0.00 -2.27 0.00 0.00 64.05 61.18 2dja n THR 20 Cb 0.15 -0.79 -0.04 0.00 -2.10 0.00 0.00 70.33 67.55 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 2.75 -0.27 -0.33 0.00 3.38 -1.91 -2.90 115.31 116.02 2dja h LEU 22 Ca -0.48 0.02 0.06 0.00 0.09 0.00 0.00 57.88 57.57 2dja h LEU 22 Cb 1.22 0.09 -0.06 0.00 0.09 0.00 0.00 40.66 42.00 2dja h LEU 22 CO 0.63 -0.12 -0.04 -0.78 0.09 0.00 0.00 178.44 178.21 2dja h ASP 23 N -0.18 -0.22 -3.57 -0.43 1.82 -1.98 -3.36 116.42 108.50 2dja h ASP 23 Ca -0.01 0.09 -0.70 0.00 -0.39 0.00 0.00 57.03 56.02 2dja h ASP 23 Cb 0.16 0.17 -0.30 0.00 0.68 0.00 0.00 39.33 40.04 2dja h ASP 23 CO -0.02 -0.07 -0.55 -1.00 -1.61 0.00 0.00 179.24 175.99 2dja s HIS 24 N -6.20 3.35 -0.08 0.28 0.09 -1.17 -4.96 115.29 106.60 2dja s HIS 24 Ca -0.14 -1.68 0.00 0.00 -0.00 0.00 0.00 55.06 53.24 2dja s HIS 24 Cb 0.13 -2.69 0.07 0.00 -0.00 0.00 0.00 32.58 30.09 2dja s HIS 24 CO 0.70 -0.83 1.69 -0.85 -0.00 0.00 0.00 174.74 175.46 2dja n GLU 25 N 4.79 1.21 0.00 1.40 0.28 -1.10 -2.03 120.64 125.20 2dja n GLU 25 Ca -0.10 -0.45 0.00 0.00 -0.16 0.00 0.00 57.16 56.46 2dja n GLU 25 Cb 0.43 -1.17 0.00 0.00 1.43 0.00 0.00 31.44 32.13 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 1.02 -4.59 -1.84 3.02 -1.26 -4.89 115.26 107.56 2dja n ASN 26 Ca 0.09 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.25 2dja n ASN 26 Cb 0.57 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.64 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 -1.41 3.93 -0.01 3.52 0.41 -1.23 -4.92 118.70 118.99 2dja s GLU 27 Ca 0.00 -0.16 -0.30 0.00 -0.41 0.00 0.00 54.97 54.10 2dja s GLU 27 Cb 0.00 -3.68 -0.05 0.00 -1.78 0.00 0.00 34.13 28.62 2dja s GLU 27 CO 0.00 -0.28 1.33 0.15 -0.49 0.00 0.00 175.26 175.98 2dja s LYS 28 N 1.95 4.31 -0.32 1.61 1.02 -1.26 -2.11 119.74 124.94 2dja s LYS 28 Ca 0.12 1.87 -0.40 0.00 0.02 0.00 0.00 55.97 57.58 2dja s LYS 28 Cb -0.16 -3.55 -0.15 0.00 -0.52 0.00 0.00 37.83 33.45 2dja s LYS 28 CO 0.11 -0.52 1.84 1.33 -0.92 0.00 0.00 175.35 177.19 2dja n VAL 29 N 4.60 0.26 -0.92 3.17 0.24 -1.26 -4.73 118.33 119.68 2dja n VAL 29 Ca 0.12 -0.08 0.06 0.00 -2.04 0.00 0.00 64.34 62.40 2dja n VAL 29 Cb 0.44 -1.21 0.09 0.00 -1.47 0.00 0.00 33.84 31.69 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 6.19 1.90 -4.05 -1.34 6.94 -0.70 -4.87 115.26 119.33 2dja n ASN 30 Ca 0.31 -2.62 -0.08 0.00 -0.02 0.00 0.00 54.58 52.18 2dja n ASN 30 Cb 0.12 -0.28 -0.09 0.00 -2.36 0.00 0.00 39.78 37.17 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 -1.98 0.69 -0.30 -3.83 -1.94 -0.13 -3.56 119.30 108.24 2dja s MET 31 Ca 0.19 -1.19 0.02 0.00 -1.71 0.00 0.00 55.69 53.01 2dja s MET 31 Cb 0.17 0.24 0.09 0.00 2.01 0.00 0.00 34.83 37.34 2dja s MET 31 CO 0.02 -0.16 0.01 -0.47 -0.01 0.00 0.00 175.02 174.42 2dja s TYR 32 N -3.92 3.07 -0.37 -0.03 5.04 -1.19 -0.97 117.35 118.98 2dja s TYR 32 Ca 0.08 -2.44 -0.28 0.00 -2.44 0.00 0.00 57.07 51.99 2dja s TYR 32 Cb 0.07 -2.31 -0.02 0.00 0.35 0.00 0.00 41.96 40.05 2dja s TYR 32 CO -0.09 -0.89 1.87 0.00 -1.34 0.00 0.00 175.55 175.09 2dja h VAL 34 N 6.88 1.21 -0.74 0.00 2.07 -1.49 0.48 116.25 124.66 2dja h VAL 34 Ca -0.32 -0.69 0.08 0.00 0.82 0.00 0.00 66.70 66.59 2dja h VAL 34 Cb 1.18 1.20 -0.10 0.00 -1.52 0.00 0.00 31.29 32.05 2dja h VAL 34 CO 1.06 0.22 -0.40 -0.24 0.02 0.00 0.00 177.57 178.23 2dja n SER 35 N -4.73 -0.71 -0.90 0.57 2.88 -1.25 -0.09 113.62 109.39 2dja n SER 35 Ca -0.03 1.31 0.02 0.00 -1.33 0.00 0.00 58.87 58.84 2dja n SER 35 Cb 0.18 -0.20 0.21 0.00 -0.75 0.00 0.00 64.21 63.64 2dja n SER 35 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 2dja n ASP 36 N -4.97 2.76 -3.82 -3.46 5.75 -1.21 -4.97 116.55 106.64 2dja n ASP 36 Ca 0.03 -3.50 -0.25 0.00 -0.01 0.00 0.00 54.79 51.06 2dja n ASP 36 Cb 0.22 -0.58 -0.07 0.00 -1.03 0.00 0.00 41.12 39.66 2dja n ASP 36 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2dja n ASP 37 N -1.00 0.28 -4.36 -1.12 9.92 0.14 -4.89 116.55 115.52 2dja n ASP 37 Ca 0.27 -0.94 -0.27 0.00 -0.53 0.00 0.00 54.79 53.31 2dja n ASP 37 Cb 0.92 -1.17 -0.13 0.00 -0.64 0.00 0.00 41.12 40.10 2dja n ASP 37 CO 0.00 0.00 0.00 -1.58 0.13 0.00 0.00 177.20 175.75 2dja s GLN 38 N -6.10 1.31 0.08 -1.24 2.00 0.41 -4.92 119.66 111.20 2dja s GLN 38 Ca 0.13 -1.29 -0.28 0.00 -2.00 0.00 0.00 55.36 51.91 2dja s GLN 38 Cb -0.08 -1.74 -0.05 0.00 0.80 0.00 0.00 33.01 31.94 2dja s GLN 38 CO 0.74 0.41 0.90 -0.51 -0.50 0.00 0.00 175.29 176.34 2dja s LEU 39 N -2.01 4.47 0.23 3.68 1.43 -1.26 0.11 118.68 125.33 2dja s LEU 39 Ca 0.12 1.67 0.01 0.00 -1.03 0.00 0.00 54.13 54.90 2dja s LEU 39 Cb -0.10 -3.48 -0.04 0.00 0.03 0.00 0.00 46.19 42.60 2dja s LEU 39 CO 0.05 -0.06 0.15 0.27 0.23 0.00 0.00 176.35 176.99 2dja s ILE 40 N 0.10 0.06 0.26 -0.59 -4.36 -0.14 -4.87 121.20 111.65 2dja s ILE 40 Ca 0.45 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.87 2dja s ILE 40 Cb -0.22 -2.51 0.03 0.00 1.25 0.00 0.00 42.46 41.00 2dja s ILE 40 CO 0.28 0.00 0.23 0.00 0.24 0.00 0.00 174.94 175.69 2dja h ALA 42 N 0.63 -0.48 -1.00 0.00 0.00 -1.90 -2.83 119.26 113.68 2dja h ALA 42 Ca -0.16 -0.12 0.11 0.00 0.00 0.00 0.00 54.91 54.74 2dja h ALA 42 Cb 0.59 0.19 -0.08 0.00 0.00 0.00 0.00 17.79 18.49 2dja h ALA 42 CO 0.24 -0.75 0.63 -0.07 0.00 0.00 0.00 179.25 179.31 2dja h LEU 43 N -0.54 0.95 -2.05 0.00 3.38 -1.96 0.44 115.31 115.53 2dja h LEU 43 Ca -0.05 0.04 0.11 0.00 0.09 0.00 0.00 57.88 58.07 2dja h LEU 43 Cb 0.40 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2dja h LEU 43 CO 0.08 0.52 0.31 0.00 0.09 0.00 0.00 178.44 179.44 2dja n LYS 45 N -4.21 0.68 0.00 0.00 0.00 0.18 -2.36 118.16 112.45 2dja n LYS 45 Ca 0.06 0.08 0.00 0.00 0.00 0.00 0.00 58.31 58.45 2dja n LYS 45 Cb 0.49 -1.57 0.00 0.00 0.00 0.00 0.00 35.03 33.95 2dja n LYS 45 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2dja n LEU 46 N -2.94 0.18 -1.37 3.14 4.32 0.13 -4.14 117.00 116.32 2dja n LEU 46 Ca -0.34 0.71 -0.05 0.00 -0.02 0.00 0.00 56.01 56.32 2dja n LEU 46 Cb 1.10 -0.43 0.11 0.00 -1.62 0.00 0.00 43.42 42.58 2dja n LEU 46 CO 0.39 -0.43 0.23 1.33 -1.22 0.00 0.00 177.39 177.70 2dja n VAL 47 N -1.79 1.97 -3.43 4.08 0.24 -0.09 -4.90 118.33 114.41 2dja n VAL 47 Ca 0.00 -3.27 -0.01 0.00 -2.04 0.00 0.00 64.34 59.02 2dja n VAL 47 Cb 0.00 -0.26 0.00 0.00 -1.47 0.00 0.00 33.84 32.11 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 -0.75 2.87 0.14 7.63 0.00 0.44 -4.91 105.19 110.62 2dja n GLY 48 Ca 0.25 -2.17 -0.12 0.00 0.00 0.00 0.00 46.02 43.97 2dja n GLY 48 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2dja h ARG 49 N 0.00 0.38 -1.98 1.61 3.08 -1.86 -3.13 114.38 112.47 2dja h ARG 49 Ca -0.01 -0.16 -0.09 0.00 0.07 0.00 0.00 59.98 59.78 2dja h ARG 49 Cb 0.05 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 2dja h ARG 49 CO 0.02 0.67 -0.13 0.72 -1.07 0.00 0.00 179.97 180.19 2dja n HIS 50 N -4.60 0.08 0.09 3.04 8.25 -0.99 -4.17 115.22 116.92 2dja n HIS 50 Ca -0.05 -1.24 -0.23 0.00 -0.26 0.00 0.00 57.72 55.94 2dja n HIS 50 Cb 0.31 -0.95 -0.15 0.00 1.12 0.00 0.00 29.99 30.32 2dja n HIS 50 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 2dja h ARG 51 N 1.81 0.42 -0.99 -0.41 0.11 -1.47 -3.35 114.38 110.51 2dja h ARG 51 Ca 0.09 -0.72 -0.65 0.00 0.10 0.00 0.00 59.98 58.80 2dja h ARG 51 Cb 1.19 0.27 -0.30 0.00 1.11 0.00 0.00 29.97 32.24 2dja h ARG 51 CO 0.13 1.35 0.78 -3.47 0.10 0.00 0.00 179.97 178.86 2dja n ASP 52 N -3.68 6.97 -4.82 0.08 2.03 -1.26 -4.91 116.55 110.97 2dja n ASP 52 Ca -0.22 -3.76 -0.28 0.00 0.52 0.00 0.00 54.79 51.05 2dja n ASP 52 Cb 1.06 -0.94 -0.04 0.00 -0.72 0.00 0.00 41.12 40.48 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 -3.74 1.98 -1.09 -0.67 3.76 -1.26 -5.07 115.29 109.22 2dja s HIS 53 Ca 0.63 -0.80 -0.11 0.00 -0.15 0.00 0.00 55.06 54.64 2dja s HIS 53 Cb 0.50 -1.85 0.24 0.00 1.11 0.00 0.00 32.58 32.59 2dja s HIS 53 CO 0.01 -0.09 1.13 -1.14 -0.85 0.00 0.00 174.74 173.80 2dja s GLN 54 N -4.06 4.09 0.33 1.40 0.74 -1.26 -5.01 119.66 115.88 2dja s GLN 54 Ca 0.29 -2.95 -0.26 0.00 0.05 0.00 0.00 55.36 52.49 2dja s GLN 54 Cb 0.01 -4.65 -0.10 0.00 1.10 0.00 0.00 33.01 29.37 2dja s GLN 54 CO 0.17 -1.37 0.96 0.14 -0.55 0.00 0.00 175.29 174.63 2dja s VAL 55 N -0.39 4.16 -0.32 1.34 -7.23 -1.26 -1.39 120.40 115.32 2dja s VAL 55 Ca 0.31 1.78 0.03 0.00 -1.81 0.00 0.00 61.98 62.30 2dja s VAL 55 Cb -0.08 -3.98 0.09 0.00 0.56 0.00 0.00 36.38 32.97 2dja s VAL 55 CO -0.07 0.13 0.02 0.00 -0.31 0.00 0.00 175.10 174.87 2dja s ALA 56 N -1.62 2.67 0.08 1.32 0.00 -0.36 -4.89 121.76 118.95 2dja s ALA 56 Ca 0.51 -2.27 -0.25 0.00 0.00 0.00 0.00 51.96 49.95 2dja s ALA 56 Cb -0.19 -1.85 -0.14 0.00 0.00 0.00 0.00 23.12 20.95 2dja s ALA 56 CO 0.24 -1.58 0.58 0.45 0.00 0.00 0.00 175.76 175.45 2dja n SER 57 N 4.36 -0.48 -0.01 0.00 2.88 -1.26 -3.19 113.62 115.92 2dja n SER 57 Ca -0.00 0.85 -0.11 0.00 -1.33 0.00 0.00 58.87 58.28 2dja n SER 57 Cb 0.42 -0.69 -0.09 0.00 -0.75 0.00 0.00 64.21 63.10 2dja n SER 57 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2dja h LEU 58 N 1.46 -0.08 -8.99 2.46 3.38 -1.91 -3.44 115.31 108.19 2dja h LEU 58 Ca -0.29 -0.54 -0.62 0.00 0.09 0.00 0.00 57.88 56.51 2dja h LEU 58 Cb 1.06 0.02 -0.17 0.00 0.09 0.00 0.00 40.66 41.66 2dja h LEU 58 CO 0.45 0.61 -0.56 0.21 0.09 0.00 0.00 178.44 179.24 2dja s ASN 59 N -5.76 5.65 -0.02 -0.43 2.47 -1.26 -5.08 114.94 110.51 2dja s ASN 59 Ca -0.14 0.02 -0.24 0.00 0.42 0.00 0.00 52.86 52.93 2dja s ASN 59 Cb -0.01 -1.99 -0.05 0.00 -1.45 0.00 0.00 41.25 37.76 2dja s ASN 59 CO 0.52 0.10 0.72 -1.81 -3.72 0.00 0.00 177.10 172.90 2dja s ASP 60 N 0.83 7.07 -0.22 -4.21 1.01 -1.26 -5.04 116.67 114.85 2dja s ASP 60 Ca 0.05 1.29 -0.29 0.00 0.71 0.00 0.00 52.55 54.31 2dja s ASP 60 Cb -0.13 -2.43 0.15 0.00 1.01 0.00 0.00 42.92 41.52 2dja s ASP 60 CO 0.02 -0.04 1.14 -0.60 0.21 0.00 0.00 175.17 175.90 2dja s ARG 61 N 0.36 0.39 1.20 8.23 3.00 -1.26 -5.17 118.95 125.69 2dja s ARG 61 Ca 0.37 0.17 -0.17 0.00 -1.00 0.00 0.00 55.73 55.09 2dja s ARG 61 Cb -0.19 0.18 0.27 0.00 0.00 0.00 0.00 34.95 35.22 2dja s ARG 61 CO 0.20 -0.11 0.61 1.19 0.00 0.00 0.00 175.30 177.19 2dja n PHE 62 N 0.96 -3.05 -4.33 5.12 3.72 -1.26 -5.05 117.46 113.56 2dja n PHE 62 Ca -0.08 -0.37 -0.15 0.00 -0.05 0.00 0.00 57.45 56.80 2dja n PHE 62 Cb 0.58 -1.35 -0.04 0.00 -0.94 0.00 0.00 39.48 37.73 2dja n PHE 62 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2dja n GLU 63 N -3.49 1.11 -2.37 -1.08 1.02 -1.26 -5.04 120.64 109.52 2dja n GLU 63 Ca 0.10 -1.86 -0.37 0.00 -0.02 0.00 0.00 57.16 55.01 2dja n GLU 63 Cb 0.43 0.70 -0.03 0.00 -0.02 0.00 0.00 31.44 32.52 2dja n GLU 63 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2dja s LYS 64 N -2.88 3.35 -0.30 3.49 2.20 -1.26 -4.64 119.74 119.70 2dja s LYS 64 Ca 0.05 -1.52 0.15 0.00 -0.36 0.00 0.00 55.97 54.29 2dja s LYS 64 Cb 0.00 -5.39 0.48 0.00 -1.51 0.00 0.00 37.83 31.41 2dja s LYS 64 CO 0.03 -2.91 1.11 1.47 -0.36 0.00 0.00 175.35 174.69 2dja n LEU 65 N 10.83 2.89 -4.84 5.43 -0.00 -1.26 -5.08 117.00 124.97 2dja n LEU 65 Ca 0.45 -3.89 -0.30 0.00 -0.00 0.00 0.00 56.01 52.27 2dja n LEU 65 Cb 0.47 0.13 -0.04 0.00 -0.00 0.00 0.00 43.42 43.97 2dja n LEU 65 CO 0.72 1.57 -0.10 -0.54 -0.00 0.00 0.00 177.39 179.03 2dja s LYS 66 N -3.61 2.23 -0.23 1.47 1.02 -1.26 -5.08 119.74 114.28 2dja s LYS 66 Ca 0.36 -2.25 -0.19 0.00 0.02 0.00 0.00 55.97 53.92 2dja s LYS 66 Cb 0.38 -1.79 -0.16 0.00 -0.52 0.00 0.00 37.83 35.74 2dja s LYS 66 CO -0.02 -0.52 0.01 0.94 -0.92 0.00 0.00 175.35 174.84 2dja n GLN 67 N -1.54 0.57 -3.66 1.68 7.27 -1.26 -5.04 117.38 115.40 2dja n GLN 67 Ca -0.12 0.47 -0.12 0.00 0.07 0.00 0.00 57.00 57.30 2dja n GLN 67 Cb 0.66 -1.66 -0.06 0.00 2.41 0.00 0.00 30.24 31.59 2dja n GLN 67 CO 0.00 0.00 0.00 -0.08 0.07 0.00 0.00 177.06 177.05 2dja s THR 68 N -2.41 0.06 -0.22 1.69 -1.32 -1.26 -5.17 115.64 107.00 2dja s THR 68 Ca -0.31 -0.47 -0.19 0.00 -1.21 0.00 0.00 61.69 59.50 2dja s THR 68 Cb 0.08 -0.98 0.06 0.00 -1.51 0.00 0.00 72.50 70.16 2dja s THR 68 CO 0.54 -0.26 0.57 -1.48 -2.21 0.00 0.00 174.62 171.78 2dja s LEU 69 N -2.09 -0.23 0.14 9.08 0.05 -1.26 -5.17 118.68 119.20 2dja s LEU 69 Ca -0.04 1.16 -0.06 0.00 0.05 0.00 0.00 54.13 55.24 2dja s LEU 69 Cb -0.00 1.96 -0.06 0.00 -2.05 0.00 0.00 46.19 46.04 2dja s LEU 69 CO -0.03 -0.20 0.40 -0.70 -0.55 0.00 0.00 176.35 175.26 2dja s GLU 70 N 0.44 3.66 0.23 1.48 2.12 -1.26 -5.04 118.70 120.33 2dja s GLU 70 Ca -0.01 -0.01 -0.31 0.00 0.36 0.00 0.00 54.97 55.00 2dja s GLU 70 Cb -0.04 -2.84 -0.12 0.00 0.26 0.00 0.00 34.13 31.39 2dja s GLU 70 CO -0.01 0.46 1.68 -1.64 -0.54 0.00 0.00 175.26 175.21 2dja s MET 71 N -2.56 4.13 -0.02 4.30 -1.94 -1.26 -5.00 119.30 116.95 2dja s MET 71 Ca 0.41 2.58 -0.05 0.00 -1.71 0.00 0.00 55.69 56.92 2dja s MET 71 Cb -0.12 -3.06 0.00 0.00 2.01 0.00 0.00 34.83 33.66 2dja s MET 71 CO 0.23 -0.71 0.11 0.54 -0.01 0.00 0.00 175.02 175.18 2dja s ASN 72 N 0.99 -0.03 0.90 3.03 4.22 -1.26 -5.15 114.94 117.64 2dja s ASN 72 Ca 0.71 -0.01 -0.15 0.00 -2.14 0.00 0.00 52.86 51.27 2dja s ASN 72 Cb -0.49 0.22 -0.04 0.00 1.28 0.00 0.00 41.25 42.22 2dja s ASN 72 CO 0.36 -0.20 0.05 0.18 -2.04 0.00 0.00 177.10 175.45 2dja n LEU 73 N 2.23 -1.90 -3.74 3.54 4.77 -1.26 -5.00 117.00 115.64 2dja n LEU 73 Ca -0.18 0.35 -0.25 0.00 -0.03 0.00 0.00 56.01 55.90 2dja n LEU 73 Cb 0.57 -1.06 -0.17 0.00 -2.33 0.00 0.00 43.42 40.43 2dja n LEU 73 CO 0.21 -4.30 -0.37 0.42 -1.33 0.00 0.00 177.39 172.02 2dja s THR 74 N -2.17 0.39 -1.15 -5.08 -4.23 -1.26 -4.88 115.64 97.25 2dja s THR 74 Ca 0.53 -0.21 -0.02 0.00 -1.18 0.00 0.00 61.69 60.82 2dja s THR 74 Cb -0.24 -0.75 0.02 0.00 1.34 0.00 0.00 72.50 72.86 2dja s THR 74 CO 0.70 -0.01 0.04 0.59 -0.54 0.00 0.00 174.62 175.40 2dja n ASN 75 N 5.12 0.52 -4.62 3.99 4.13 -1.26 -4.74 115.26 118.40 2dja n ASN 75 Ca -0.08 -0.93 -0.43 0.00 1.68 0.00 0.00 54.58 54.82 2dja n ASN 75 Cb 0.49 -1.16 -0.03 0.00 -1.54 0.00 0.00 39.78 37.54 2dja n ASN 75 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2dja s LEU 76 N -6.14 3.73 -0.29 3.41 0.20 -1.26 -4.92 118.68 113.41 2dja s LEU 76 Ca 0.06 1.75 -0.25 0.00 0.69 0.00 0.00 54.13 56.38 2dja s LEU 76 Cb -0.03 -3.52 0.15 0.00 -0.43 0.00 0.00 46.19 42.35 2dja s LEU 76 CO 0.73 -1.55 1.20 0.54 -0.29 0.00 0.00 176.35 176.98 2dja s VAL 77 N 6.45 0.00 0.48 1.68 0.11 -1.26 -5.17 120.40 122.68 2dja s VAL 77 Ca 0.84 0.00 -0.04 0.00 -2.93 0.00 0.00 61.98 59.85 2dja s VAL 77 Cb -0.29 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.54 2dja s VAL 77 CO 0.34 0.00 0.76 -1.59 -3.33 0.00 0.00 175.10 171.28 2dja s LYS 78 N 0.13 3.35 0.54 1.54 -2.85 -1.26 -5.10 119.74 116.09 2dja s LYS 78 Ca 0.05 -0.00 0.02 0.00 -1.00 0.00 0.00 55.97 55.04 2dja s LYS 78 Cb -0.05 -2.42 0.03 0.00 -2.06 0.00 0.00 37.83 33.34 2dja s LYS 78 CO -0.10 -0.26 0.76 -1.54 0.10 0.00 0.00 175.35 174.31 2dja s SER 79 N -4.15 5.28 0.00 0.03 1.04 -1.26 -4.75 113.70 109.89 2dja s SER 79 Ca 0.48 -0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.82 2dja s SER 79 Cb -0.10 -0.80 0.00 0.00 0.10 0.00 0.00 66.02 65.22 2dja s SER 79 CO 0.43 -1.13 0.00 0.61 0.98 0.00 0.00 173.24 174.13 2dja n GLY 80 N -2.30 -0.53 2.51 7.32 0.00 -1.26 -4.59 105.19 106.34 2dja n GLY 80 Ca 0.08 -0.84 -0.21 0.00 0.00 0.00 0.00 46.02 45.05 2dja n GLY 80 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dja n PRO 81 N 0.00 -2.54 -3.71 1.61 -0.04 -1.26 -4.82 135.00 124.23 2dja n PRO 81 Ca 0.00 -1.26 -0.37 0.00 -0.04 0.00 0.00 63.50 61.84 2dja n PRO 81 Cb 0.00 -1.17 -0.07 0.00 -0.04 0.00 0.00 33.50 32.22 2dja n PRO 81 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2dja s SER 82 N -3.62 6.43 0.33 3.54 0.01 -1.26 -4.00 113.70 115.13 2dja s SER 82 Ca 0.51 0.51 -0.18 0.00 1.31 0.00 0.00 55.95 58.11 2dja s SER 82 Cb -0.05 -2.13 0.03 0.00 0.21 0.00 0.00 66.02 64.09 2dja s SER 82 CO 0.39 0.28 0.73 -0.44 0.41 0.00 0.00 173.24 174.61 2dja s SER 83 N -0.45 -0.09 0.00 2.44 0.01 -1.26 -5.03 113.70 109.32 2dja s SER 83 Ca 0.15 -0.90 0.32 0.00 1.31 0.00 0.00 55.95 56.84 2dja s SER 83 Cb -0.13 0.77 1.89 0.00 0.21 0.00 0.00 66.02 68.77 2dja s SER 83 CO 0.04 -1.49 2.22 0.61 0.41 0.00 0.00 173.24 175.03