#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 -0.36 0.64 1.61 1.04 -1.26 -5.18 113.70 110.19 2dja s SER 2 Ca 0.00 0.40 -0.02 0.00 0.48 0.00 0.00 55.95 56.81 2dja s SER 2 Cb 0.00 0.30 0.07 0.00 0.10 0.00 0.00 66.02 66.49 2dja s SER 2 CO 0.00 -0.33 0.90 -0.55 0.98 0.00 0.00 173.24 174.24 2dja s SER 3 N -1.09 4.87 0.06 7.02 0.15 -1.26 -5.11 113.70 118.34 2dja s SER 3 Ca -0.01 0.02 0.07 0.00 0.70 0.00 0.00 55.95 56.72 2dja s SER 3 Cb -0.01 -0.69 -0.03 0.00 -1.71 0.00 0.00 66.02 63.58 2dja s SER 3 CO 0.01 -1.48 -0.19 -0.83 1.20 0.00 0.00 173.24 171.96 2dja s GLY 4 N -4.54 1.06 0.15 9.45 0.00 -1.26 -5.14 107.32 107.04 2dja s GLY 4 Ca 0.61 -1.06 -0.24 0.00 0.00 0.00 0.00 44.72 44.03 2dja s GLY 4 CO 0.42 -1.03 1.07 -0.45 0.00 0.00 0.00 173.10 173.11 2dja s SER 5 N -1.45 -0.02 -0.05 1.64 0.15 -1.26 -5.19 113.70 107.52 2dja s SER 5 Ca 0.05 -0.57 -0.29 0.00 0.70 0.00 0.00 55.95 55.84 2dja s SER 5 Cb -0.09 0.44 0.10 0.00 -1.71 0.00 0.00 66.02 64.76 2dja s SER 5 CO 0.02 -0.87 0.85 -0.55 1.20 0.00 0.00 173.24 173.89 2dja s SER 6 N -3.37 -0.45 0.30 5.45 0.15 -1.26 -5.19 113.70 109.32 2dja s SER 6 Ca 0.21 0.30 0.00 0.00 0.70 0.00 0.00 55.95 57.16 2dja s SER 6 Cb -0.02 0.41 -0.02 0.00 -1.71 0.00 0.00 66.02 64.69 2dja s SER 6 CO 0.04 -0.56 0.34 -0.83 1.20 0.00 0.00 173.24 173.43 2dja s GLY 7 N -1.75 1.67 -0.28 9.45 0.00 -1.26 -5.17 107.32 109.98 2dja s GLY 7 Ca -0.01 -1.68 -0.16 0.00 0.00 0.00 0.00 44.72 42.86 2dja s GLY 7 CO -0.02 -1.20 0.72 0.54 0.00 0.00 0.00 173.10 173.15 2dja s VAL 8 N -3.50 0.00 -0.10 1.40 0.11 -1.26 -5.16 120.40 111.89 2dja s VAL 8 Ca 0.35 0.00 -0.03 0.00 -2.93 0.00 0.00 61.98 59.37 2dja s VAL 8 Cb 0.02 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.84 2dja s VAL 8 CO 0.20 0.00 0.03 -1.83 -3.33 0.00 0.00 175.10 170.17 2dja s GLU 9 N 1.54 3.11 0.90 1.54 -1.05 -1.26 -5.11 118.70 118.38 2dja s GLU 9 Ca -0.09 -0.35 -0.12 0.00 -0.15 0.00 0.00 54.97 54.26 2dja s GLU 9 Cb -0.05 -2.88 0.13 0.00 -0.44 0.00 0.00 34.13 30.89 2dja s GLU 9 CO -0.18 0.70 1.09 -1.25 0.95 0.00 0.00 175.26 176.57 2dja s PRO 10 N -0.85 1.19 -0.09 -4.83 0.04 -1.26 -5.06 135.00 124.13 2dja s PRO 10 Ca 0.13 0.80 0.03 0.00 0.04 0.00 0.00 61.00 62.00 2dja s PRO 10 Cb -0.12 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2dja s PRO 10 CO 0.03 -2.28 -0.20 0.08 0.04 0.00 0.00 177.00 174.66 2dja s VAL 11 N -2.94 1.74 -0.01 -0.36 1.01 -1.26 -5.11 120.40 113.48 2dja s VAL 11 Ca 0.64 -0.83 -0.30 0.00 0.00 0.00 0.00 61.98 61.48 2dja s VAL 11 Cb -0.18 -1.53 -0.06 0.00 0.00 0.00 0.00 36.38 34.62 2dja s VAL 11 CO 0.57 0.49 1.46 -2.16 0.00 0.00 0.00 175.10 175.46 2dja s PRO 12 N 0.47 4.25 -0.35 2.72 0.04 -1.26 -5.00 135.00 135.87 2dja s PRO 12 Ca -0.17 2.02 0.02 0.00 0.04 0.00 0.00 61.00 62.91 2dja s PRO 12 Cb -0.17 -3.64 0.11 0.00 0.04 0.00 0.00 34.50 30.83 2dja s PRO 12 CO 0.07 -0.64 0.11 -0.51 0.04 0.00 0.00 177.00 176.07 2dja s ASP 13 N 2.14 4.28 -0.11 6.66 1.01 -1.26 -5.09 116.67 124.31 2dja s ASP 13 Ca 0.66 -2.05 -0.29 0.00 0.71 0.00 0.00 52.55 51.57 2dja s ASP 13 Cb -0.32 -1.23 -0.05 0.00 1.01 0.00 0.00 42.92 42.34 2dja s ASP 13 CO 0.27 -0.37 1.65 -0.89 0.21 0.00 0.00 175.17 176.04 2dja s THR 14 N 1.06 3.61 0.27 -1.27 2.01 -1.26 -4.83 115.64 115.23 2dja s THR 14 Ca 0.12 0.72 -0.01 0.00 0.31 0.00 0.00 61.69 62.83 2dja s THR 14 Cb -0.19 -3.52 -0.02 0.00 0.01 0.00 0.00 72.50 68.77 2dja s THR 14 CO -0.14 -0.13 0.28 -1.00 -0.69 0.00 0.00 174.62 172.95 2dja s HIS 15 N 4.51 1.17 -0.27 4.92 3.76 -1.26 -5.14 115.29 122.98 2dja s HIS 15 Ca 0.73 -1.34 0.01 0.00 -0.15 0.00 0.00 55.06 54.32 2dja s HIS 15 Cb -0.31 -0.40 0.08 0.00 1.11 0.00 0.00 32.58 33.06 2dja s HIS 15 CO 0.29 -0.84 -0.01 -0.51 -0.85 0.00 0.00 174.74 172.82 2dja s LEU 16 N -3.21 3.11 0.08 0.89 1.43 -1.26 -5.09 118.68 114.64 2dja s LEU 16 Ca 0.35 -1.51 0.02 0.00 -1.03 0.00 0.00 54.13 51.97 2dja s LEU 16 Cb 0.03 -1.26 -0.04 0.00 0.03 0.00 0.00 46.19 44.95 2dja s LEU 16 CO 0.17 -0.30 0.13 -0.13 0.23 0.00 0.00 176.35 176.45 2dja s ARG 17 N 1.29 3.07 0.53 1.70 1.81 -1.26 -5.11 118.95 120.98 2dja s ARG 17 Ca 0.01 -0.62 -0.15 0.00 -1.72 0.00 0.00 55.73 53.25 2dja s ARG 17 Cb -0.19 -2.83 -0.07 0.00 -0.45 0.00 0.00 34.95 31.41 2dja s ARG 17 CO -0.10 0.58 0.98 0.20 -0.68 0.00 0.00 175.30 176.28 2dja s GLY 18 N -2.47 1.99 -0.34 -3.53 0.00 -1.26 -5.02 107.32 96.69 2dja s GLY 18 Ca 0.31 0.12 -0.16 0.00 0.00 0.00 0.00 44.72 44.99 2dja s GLY 18 CO 0.24 0.39 0.42 -0.42 0.00 0.00 0.00 173.10 173.73 2dja s ILE 19 N -2.71 5.11 0.26 0.90 1.09 -1.26 -5.05 121.20 119.54 2dja s ILE 19 Ca 0.58 0.20 0.01 0.00 -1.10 0.00 0.00 60.65 60.33 2dja s ILE 19 Cb -0.10 -3.87 -0.00 0.00 -1.06 0.00 0.00 42.46 37.43 2dja s ILE 19 CO 0.35 -0.12 0.02 0.35 -0.10 0.00 0.00 174.94 175.44 2dja n THR 20 N 5.30 0.00 -3.45 2.92 -2.24 -1.26 -4.29 114.28 111.26 2dja n THR 20 Ca -0.07 -1.31 -0.35 0.00 -2.27 0.00 0.00 64.05 60.05 2dja n THR 20 Cb 0.49 0.32 -0.06 0.00 -2.10 0.00 0.00 70.33 68.98 2dja n THR 20 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dja n LEU 22 N 0.72 0.00 -0.21 0.00 4.77 -1.26 -1.80 117.00 119.22 2dja n LEU 22 Ca -0.05 0.97 -0.02 0.00 -0.03 0.00 0.00 56.01 56.87 2dja n LEU 22 Cb 0.52 -0.47 0.08 0.00 -2.33 0.00 0.00 43.42 41.22 2dja n LEU 22 CO 0.43 -0.47 1.07 -0.78 -1.33 0.00 0.00 177.39 176.30 2dja h ASP 23 N 0.00 0.49 -3.59 -1.43 1.82 -1.97 -3.35 116.42 108.40 2dja h ASP 23 Ca 0.00 0.03 -0.69 0.00 -0.39 0.00 0.00 57.03 55.98 2dja h ASP 23 Cb 0.00 -0.07 -0.35 0.00 0.68 0.00 0.00 39.33 39.60 2dja h ASP 23 CO 0.00 0.33 -0.52 -1.00 -1.61 0.00 0.00 179.24 176.43 2dja s HIS 24 N -6.11 3.56 -0.10 0.28 0.09 -0.98 -4.94 115.29 107.08 2dja s HIS 24 Ca -0.13 -2.48 0.01 0.00 -0.00 0.00 0.00 55.06 52.46 2dja s HIS 24 Cb 0.15 -3.22 0.15 0.00 -0.00 0.00 0.00 32.58 29.66 2dja s HIS 24 CO 0.75 -0.95 1.25 -0.85 -0.00 0.00 0.00 174.74 174.95 2dja n GLU 25 N 4.41 1.28 0.00 1.40 0.00 -0.74 -0.75 120.64 126.24 2dja n GLU 25 Ca -0.01 -0.67 0.00 0.00 0.00 0.00 0.00 57.16 56.48 2dja n GLU 25 Cb 0.41 -1.26 0.00 0.00 0.00 0.00 0.00 31.44 30.58 2dja n GLU 25 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2dja n ASN 26 N 0.19 2.77 -4.73 -1.84 3.02 -1.26 -4.83 115.26 108.58 2dja n ASN 26 Ca 0.13 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.29 2dja n ASN 26 Cb 0.75 0.05 -0.05 0.00 -0.61 0.00 0.00 39.78 39.91 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 -1.67 4.39 0.13 3.52 0.41 -1.23 -4.97 118.70 119.28 2dja s GLU 27 Ca 0.00 0.71 -0.31 0.00 -0.41 0.00 0.00 54.97 54.96 2dja s GLU 27 Cb 0.00 -3.43 -0.08 0.00 -1.78 0.00 0.00 34.13 28.85 2dja s GLU 27 CO 0.00 0.14 1.33 0.15 -0.49 0.00 0.00 175.26 176.39 2dja s LYS 28 N 0.58 4.36 -0.72 1.61 -0.14 -1.26 -2.73 119.74 121.45 2dja s LYS 28 Ca 0.33 2.01 -0.26 0.00 -1.36 0.00 0.00 55.97 56.68 2dja s LYS 28 Cb -0.17 -3.25 -0.00 0.00 -1.68 0.00 0.00 37.83 32.73 2dja s LYS 28 CO 0.15 -0.35 1.65 0.14 -0.76 0.00 0.00 175.35 176.18 2dja s VAL 29 N 0.82 3.53 -0.87 3.17 -7.23 -1.26 -4.35 120.40 114.21 2dja s VAL 29 Ca 0.61 0.14 0.14 0.00 -1.81 0.00 0.00 61.98 61.06 2dja s VAL 29 Cb -0.35 -4.35 0.46 0.00 0.56 0.00 0.00 36.38 32.70 2dja s VAL 29 CO 0.32 -1.30 1.38 -0.46 -0.31 0.00 0.00 175.10 174.73 2dja n ASN 30 N 11.50 3.56 -4.16 4.85 0.23 -1.17 -4.87 115.26 125.20 2dja n ASN 30 Ca 0.18 -2.32 -0.22 0.00 -0.53 0.00 0.00 54.58 51.69 2dja n ASN 30 Cb 0.50 -0.39 -0.09 0.00 -2.08 0.00 0.00 39.78 37.73 2dja n ASN 30 CO 0.00 0.00 0.00 -0.04 -0.93 0.00 0.00 177.26 176.29 2dja s MET 31 N -1.58 1.74 -0.24 -3.83 -1.94 -1.16 -3.59 119.30 108.69 2dja s MET 31 Ca 0.35 -2.01 -0.06 0.00 -1.71 0.00 0.00 55.69 52.25 2dja s MET 31 Cb 0.22 -0.49 0.12 0.00 2.01 0.00 0.00 34.83 36.69 2dja s MET 31 CO 0.17 -0.40 0.48 -0.47 -0.01 0.00 0.00 175.02 174.80 2dja s TYR 32 N -3.38 -1.01 0.41 -0.03 6.14 -1.24 -2.84 117.35 115.40 2dja s TYR 32 Ca 0.31 1.59 -0.25 0.00 0.64 0.00 0.00 57.07 59.36 2dja s TYR 32 Cb 0.05 0.39 -0.08 0.00 0.42 0.00 0.00 41.96 42.73 2dja s TYR 32 CO 0.16 -0.61 1.23 0.00 0.64 0.00 0.00 175.55 176.96 2dja h VAL 34 N 2.32 1.05 0.01 0.00 2.07 -1.34 -2.17 116.25 118.19 2dja h VAL 34 Ca -0.49 -2.38 -0.00 0.00 0.82 0.00 0.00 66.70 64.64 2dja h VAL 34 Cb 1.24 2.71 0.00 0.00 -1.52 0.00 0.00 31.29 33.72 2dja h VAL 34 CO 0.62 0.68 -0.00 0.77 0.02 0.00 0.00 177.57 179.66 2dja h SER 35 N -0.37 -0.01 1.41 0.57 4.64 -1.94 -3.24 113.55 114.62 2dja h SER 35 Ca -0.30 -0.69 0.00 0.00 -0.47 0.00 0.00 61.79 60.33 2dja h SER 35 Cb 1.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.80 2dja h SER 35 CO 0.04 0.69 0.00 0.44 -0.87 0.00 0.00 176.83 177.13 2dja h ASP 36 N -0.71 0.00 -6.81 4.97 3.32 -1.93 -3.47 116.42 111.79 2dja h ASP 36 Ca -0.00 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.49 2dja h ASP 36 Cb 0.70 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.11 2dja h ASP 36 CO 0.00 0.00 -0.93 -0.90 -1.72 0.00 0.00 179.24 175.69 2dja n ASP 37 N -2.54 0.30 -4.00 6.45 5.68 -0.82 -4.95 116.55 116.68 2dja n ASP 37 Ca 0.04 -1.15 -0.11 0.00 -0.50 0.00 0.00 54.79 53.07 2dja n ASP 37 Cb 0.40 -2.28 -0.12 0.00 -1.14 0.00 0.00 41.12 37.99 2dja n ASP 37 CO 0.00 0.00 0.00 -1.58 -1.33 0.00 0.00 177.20 174.29 2dja s GLN 38 N -6.99 0.36 -0.05 0.11 0.74 -1.23 -4.94 119.66 107.64 2dja s GLN 38 Ca 0.01 -0.58 -0.30 0.00 0.05 0.00 0.00 55.36 54.54 2dja s GLN 38 Cb -0.00 -0.06 -0.05 0.00 1.10 0.00 0.00 33.01 34.00 2dja s GLN 38 CO 0.95 -0.00 1.45 -0.51 -0.55 0.00 0.00 175.29 176.63 2dja s LEU 39 N -1.28 4.29 0.47 3.68 1.43 -1.26 -2.24 118.68 123.76 2dja s LEU 39 Ca -0.11 2.06 0.03 0.00 -1.03 0.00 0.00 54.13 55.07 2dja s LEU 39 Cb -0.09 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.56 2dja s LEU 39 CO -0.00 -0.80 0.04 0.27 0.23 0.00 0.00 176.35 176.08 2dja s ILE 40 N 3.18 1.13 0.35 -0.59 -4.36 -1.13 -4.74 121.20 115.05 2dja s ILE 40 Ca 0.65 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 59.04 2dja s ILE 40 Cb -0.30 -2.34 0.00 0.00 1.25 0.00 0.00 42.46 41.08 2dja s ILE 40 CO 0.25 0.00 0.04 0.00 0.24 0.00 0.00 174.94 175.47 2dja h ALA 42 N 1.11 -0.61 -0.96 0.00 0.00 -1.90 -2.52 119.26 114.39 2dja h ALA 42 Ca -0.28 -0.11 0.20 0.00 0.00 0.00 0.00 54.91 54.71 2dja h ALA 42 Cb 0.88 0.33 -0.11 0.00 0.00 0.00 0.00 17.79 18.89 2dja h ALA 42 CO 0.47 -0.86 0.54 -0.07 0.00 0.00 0.00 179.25 179.33 2dja h LEU 43 N -0.61 0.64 -1.43 0.00 3.38 -1.97 0.34 115.31 115.67 2dja h LEU 43 Ca -0.03 0.11 0.12 0.00 0.09 0.00 0.00 57.88 58.17 2dja h LEU 43 Cb 0.52 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.23 2dja h LEU 43 CO 0.01 0.19 0.52 0.00 0.09 0.00 0.00 178.44 179.25 2dja h LYS 45 N 0.60 0.00 0.00 0.00 1.63 -0.38 -2.80 116.57 115.62 2dja h LYS 45 Ca 0.38 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.18 2dja h LYS 45 Cb 0.63 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.26 2dja h LYS 45 CO -0.14 0.48 0.00 1.28 -3.45 0.00 0.00 179.45 177.62 2dja n LEU 46 N -4.58 0.00 -0.05 5.20 4.32 0.84 -3.67 117.00 119.06 2dja n LEU 46 Ca -0.15 0.88 -0.06 0.00 -0.02 0.00 0.00 56.01 56.66 2dja n LEU 46 Cb 0.40 -0.39 -0.06 0.00 -1.62 0.00 0.00 43.42 41.75 2dja n LEU 46 CO 0.15 -0.39 -0.82 1.33 -1.22 0.00 0.00 177.39 176.44 2dja n VAL 47 N -2.59 0.61 -0.99 4.08 0.24 -0.90 -4.87 118.33 113.91 2dja n VAL 47 Ca 0.00 -0.31 -0.32 0.00 -2.04 0.00 0.00 64.34 61.67 2dja n VAL 47 Cb 0.00 -0.83 0.02 0.00 -1.47 0.00 0.00 33.84 31.56 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 2.71 -3.09 0.40 7.63 0.00 0.11 -4.63 105.19 108.33 2dja n GLY 48 Ca -0.17 -0.31 0.20 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.25 0.20 -0.06 1.61 3.08 -1.89 0.19 114.38 117.26 2dja h ARG 49 Ca -0.35 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 59.70 2dja h ARG 49 Cb 1.19 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 31.19 2dja h ARG 49 CO 0.31 0.14 0.30 0.45 -1.07 0.00 0.00 179.97 180.09 2dja h HIS 50 N 0.21 0.00 -1.10 3.04 3.86 -1.82 -1.57 115.15 117.77 2dja h HIS 50 Ca 0.37 0.00 0.30 0.00 -1.16 0.00 0.00 60.37 59.88 2dja h HIS 50 Cb 1.14 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 29.53 2dja h HIS 50 CO -0.00 0.00 0.73 0.07 0.86 0.00 0.00 177.93 179.59 2dja h ARG 51 N 0.00 0.24 0.12 2.45 0.11 -0.52 0.11 114.38 116.89 2dja h ARG 51 Ca 0.03 -0.01 -0.23 0.00 0.10 0.00 0.00 59.98 59.87 2dja h ARG 51 Cb 0.63 -0.05 0.02 0.00 1.11 0.00 0.00 29.97 31.68 2dja h ARG 51 CO -0.00 0.16 -0.96 0.22 0.10 0.00 0.00 179.97 179.49 2dja h ASP 52 N 0.25 0.64 -1.94 0.08 3.58 -1.51 -3.46 116.42 114.06 2dja h ASP 52 Ca 0.60 -0.87 -0.18 0.00 0.42 0.00 0.00 57.03 56.99 2dja h ASP 52 Cb 1.80 -0.20 0.11 0.00 1.72 0.00 0.00 39.33 42.76 2dja h ASP 52 CO -0.22 1.45 -0.09 1.41 -2.88 0.00 0.00 179.24 178.92 2dja n HIS 53 N -4.01 -2.84 -3.82 0.28 8.25 0.39 -4.98 115.22 108.50 2dja n HIS 53 Ca -0.13 -0.39 -0.36 0.00 -0.26 0.00 0.00 57.72 56.57 2dja n HIS 53 Cb 0.87 -0.66 -0.13 0.00 1.12 0.00 0.00 29.99 31.19 2dja n HIS 53 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2dja s GLN 54 N -3.95 2.36 0.13 -0.41 0.74 -1.26 -5.02 119.66 112.25 2dja s GLN 54 Ca 0.33 -1.42 -0.06 0.00 0.05 0.00 0.00 55.36 54.27 2dja s GLN 54 Cb -0.06 -3.40 -0.06 0.00 1.10 0.00 0.00 33.01 30.60 2dja s GLN 54 CO 0.28 -0.78 0.38 0.14 -0.55 0.00 0.00 175.29 174.76 2dja s VAL 55 N 1.27 5.16 -0.30 1.34 -7.23 -1.26 -0.84 120.40 118.54 2dja s VAL 55 Ca 0.00 0.11 0.02 0.00 -1.81 0.00 0.00 61.98 60.30 2dja s VAL 55 Cb -0.21 -3.62 0.09 0.00 0.56 0.00 0.00 36.38 33.20 2dja s VAL 55 CO -0.01 0.09 0.02 0.00 -0.31 0.00 0.00 175.10 174.89 2dja s ALA 56 N -1.61 2.30 0.75 1.32 0.00 -0.46 -4.93 121.76 119.13 2dja s ALA 56 Ca 0.39 -1.96 -0.17 0.00 0.00 0.00 0.00 51.96 50.22 2dja s ALA 56 Cb -0.12 -1.72 -0.11 0.00 0.00 0.00 0.00 23.12 21.17 2dja s ALA 56 CO 0.23 -1.51 -0.12 0.43 0.00 0.00 0.00 175.76 174.79 2dja n SER 57 N 4.52 -3.60 -2.45 0.00 7.64 -1.26 -3.72 113.62 114.74 2dja n SER 57 Ca -0.03 0.47 -0.33 0.00 1.01 0.00 0.00 58.87 59.99 2dja n SER 57 Cb 0.43 -0.95 0.04 0.00 -1.01 0.00 0.00 64.21 62.72 2dja n SER 57 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2dja n LEU 58 N 1.78 6.60 -3.67 -3.43 4.77 -1.24 -4.88 117.00 116.93 2dja n LEU 58 Ca 0.05 -4.69 -0.22 0.00 -0.03 0.00 0.00 56.01 51.12 2dja n LEU 58 Cb 0.51 -0.79 0.05 0.00 -2.33 0.00 0.00 43.42 40.86 2dja n LEU 58 CO 0.52 1.81 0.04 -3.20 -1.33 0.00 0.00 177.39 175.23 2dja n ASN 59 N -0.70 -2.67 -4.90 -1.43 2.85 -1.26 -4.98 115.26 102.17 2dja n ASN 59 Ca 0.53 -0.74 -0.28 0.00 -0.11 0.00 0.00 54.58 53.98 2dja n ASN 59 Cb 0.61 -4.37 0.06 0.00 1.24 0.00 0.00 39.78 37.32 2dja n ASN 59 CO 0.00 0.00 0.00 -1.81 -2.11 0.00 0.00 177.26 173.34 2dja s ASP 60 N -4.04 5.03 -0.84 1.20 1.01 -1.26 -4.89 116.67 112.88 2dja s ASP 60 Ca 0.20 0.81 -0.24 0.00 0.71 0.00 0.00 52.55 54.04 2dja s ASP 60 Cb -0.10 -1.51 -0.18 0.00 1.01 0.00 0.00 42.92 42.15 2dja s ASP 60 CO 0.79 -1.54 2.30 -2.11 0.21 0.00 0.00 175.17 174.82 2dja n ARG 61 N -3.03 0.40 -0.34 8.23 0.00 -1.26 -4.78 116.66 115.89 2dja n ARG 61 Ca 0.07 -0.89 -0.04 0.00 -0.00 0.00 0.00 57.85 56.99 2dja n ARG 61 Cb 0.59 -3.38 -0.01 0.00 -0.00 0.00 0.00 32.46 29.66 2dja n ARG 61 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2dja n PHE 62 N 17.20 -0.12 -3.58 2.89 -0.00 -1.26 -4.63 117.46 127.96 2dja n PHE 62 Ca 0.47 1.05 0.00 0.00 -0.00 0.00 0.00 57.45 58.97 2dja n PHE 62 Cb 0.41 -0.73 -0.06 0.00 -0.00 0.00 0.00 39.48 39.10 2dja n PHE 62 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 176.76 174.76 2dja s GLU 63 N -5.66 0.22 -1.66 -4.13 2.12 -1.26 -4.97 118.70 103.35 2dja s GLU 63 Ca -0.11 0.41 -0.09 0.00 0.36 0.00 0.00 54.97 55.54 2dja s GLU 63 Cb 0.14 0.10 0.09 0.00 0.26 0.00 0.00 34.13 34.72 2dja s GLU 63 CO 0.58 -0.05 0.27 1.63 -0.54 0.00 0.00 175.26 177.15 2dja n LYS 64 N 3.72 -1.15 -0.04 4.30 5.02 -1.26 -4.83 118.16 123.92 2dja n LYS 64 Ca -0.16 0.14 -0.07 0.00 -2.02 0.00 0.00 58.31 56.21 2dja n LYS 64 Cb 0.56 -4.11 -0.02 0.00 -0.02 0.00 0.00 35.03 31.44 2dja n LYS 64 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2dja n LEU 65 N -4.39 1.60 -4.53 -0.35 0.00 -1.26 -4.90 117.00 103.18 2dja n LEU 65 Ca -0.15 0.26 -0.42 0.00 0.00 0.00 0.00 56.01 55.69 2dja n LEU 65 Cb 0.60 -0.59 -0.03 0.00 0.00 0.00 0.00 43.42 43.40 2dja n LEU 65 CO 0.88 -0.38 0.99 -0.54 0.00 0.00 0.00 177.39 178.34 2dja s LYS 66 N -2.55 3.24 -0.11 1.96 1.02 -1.26 -5.00 119.74 117.04 2dja s LYS 66 Ca -0.19 -0.33 0.03 0.00 0.02 0.00 0.00 55.97 55.50 2dja s LYS 66 Cb 0.03 -4.15 0.01 0.00 -0.52 0.00 0.00 37.83 33.20 2dja s LYS 66 CO 0.27 -1.90 -0.20 -0.65 -0.92 0.00 0.00 175.35 171.95 2dja s GLN 67 N 4.93 2.72 0.02 1.68 -1.52 -1.26 -5.08 119.66 121.14 2dja s GLN 67 Ca 0.32 -0.75 -0.28 0.00 -1.95 0.00 0.00 55.36 52.70 2dja s GLN 67 Cb -0.11 -2.15 0.09 0.00 -0.22 0.00 0.00 33.01 30.62 2dja s GLN 67 CO 0.16 0.06 0.74 -0.08 -0.25 0.00 0.00 175.29 175.92 2dja s THR 68 N 0.64 0.00 1.08 -0.19 -1.32 -1.26 -5.17 115.64 109.43 2dja s THR 68 Ca -0.13 0.00 -0.17 0.00 -1.21 0.00 0.00 61.69 60.18 2dja s THR 68 Cb -0.16 -1.00 0.13 0.00 -1.51 0.00 0.00 72.50 69.96 2dja s THR 68 CO 0.03 0.00 0.09 0.18 -2.21 0.00 0.00 174.62 172.71 2dja n LEU 69 N 0.19 -1.86 -4.07 9.08 4.32 -1.26 -5.04 117.00 118.36 2dja n LEU 69 Ca -0.15 -0.27 -0.12 0.00 -0.02 0.00 0.00 56.01 55.45 2dja n LEU 69 Cb 0.61 -0.85 -0.11 0.00 -1.62 0.00 0.00 43.42 41.45 2dja n LEU 69 CO 0.16 -3.18 -0.39 -1.83 -1.22 0.00 0.00 177.39 170.93 2dja s GLU 70 N -3.44 0.56 0.43 3.23 -1.05 -1.26 -5.17 118.70 112.00 2dja s GLU 70 Ca 0.46 -0.87 0.08 0.00 -0.15 0.00 0.00 54.97 54.50 2dja s GLU 70 Cb -0.08 -0.20 0.01 0.00 -0.44 0.00 0.00 34.13 33.42 2dja s GLU 70 CO 0.51 0.02 0.55 -1.64 0.95 0.00 0.00 175.26 175.65 2dja s MET 71 N -2.08 2.75 0.82 -4.83 -1.94 -1.26 -5.07 119.30 107.68 2dja s MET 71 Ca -0.06 -1.32 -0.16 0.00 -1.71 0.00 0.00 55.69 52.44 2dja s MET 71 Cb -0.06 -2.69 -0.10 0.00 2.01 0.00 0.00 34.83 33.99 2dja s MET 71 CO -0.01 -0.30 -0.16 -1.71 -0.01 0.00 0.00 175.02 172.84 2dja n ASN 72 N -1.82 -3.77 -0.08 3.03 5.15 -1.26 -4.96 115.26 111.55 2dja n ASN 72 Ca 0.08 0.41 -0.16 0.00 -0.60 0.00 0.00 54.58 54.30 2dja n ASN 72 Cb 0.60 -0.96 -0.05 0.00 -0.53 0.00 0.00 39.78 38.84 2dja n ASN 72 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2dja n LEU 73 N 1.65 1.10 -3.14 1.20 7.99 -1.26 -4.97 117.00 119.57 2dja n LEU 73 Ca 0.04 0.19 -0.34 0.00 -0.01 0.00 0.00 56.01 55.89 2dja n LEU 73 Cb 0.52 -0.46 -0.10 0.00 -0.11 0.00 0.00 43.42 43.27 2dja n LEU 73 CO 0.52 0.30 1.45 0.41 -1.51 0.00 0.00 177.39 178.56 2dja n THR 74 N -3.70 0.00 -4.69 -5.08 -1.04 -1.26 -4.87 114.28 93.63 2dja n THR 74 Ca -0.30 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.38 2dja n THR 74 Cb 0.70 -0.36 -0.13 0.00 -1.82 0.00 0.00 70.33 68.73 2dja n THR 74 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 2dja s ASN 75 N 5.59 4.29 0.41 8.00 3.84 -1.26 -5.11 114.94 130.69 2dja s ASN 75 Ca 0.93 -0.21 -0.20 0.00 0.21 0.00 0.00 52.86 53.58 2dja s ASN 75 Cb -0.96 -1.44 -0.11 0.00 -0.55 0.00 0.00 41.25 38.19 2dja s ASN 75 CO 0.40 0.23 0.91 -0.76 -2.79 0.00 0.00 177.10 175.09 2dja s LEU 76 N -0.03 3.98 0.32 3.21 1.02 -1.26 -5.04 118.68 120.88 2dja s LEU 76 Ca -0.02 1.62 -0.27 0.00 0.02 0.00 0.00 54.13 55.48 2dja s LEU 76 Cb -0.14 -4.44 -0.09 0.00 0.02 0.00 0.00 46.19 41.54 2dja s LEU 76 CO 0.04 -0.32 1.01 0.54 0.02 0.00 0.00 176.35 177.63 2dja s VAL 77 N -2.12 3.88 -0.23 -1.59 0.11 -1.26 -5.05 120.40 114.13 2dja s VAL 77 Ca 0.60 1.65 -0.09 0.00 -2.93 0.00 0.00 61.98 61.21 2dja s VAL 77 Cb -0.10 -3.96 0.10 0.00 -1.53 0.00 0.00 36.38 30.90 2dja s VAL 77 CO 0.14 0.21 0.50 -0.75 -3.33 0.00 0.00 175.10 171.88 2dja s LYS 78 N -1.89 0.43 -0.20 1.54 2.20 -1.26 -5.14 119.74 115.42 2dja s LYS 78 Ca 0.49 1.15 -0.02 0.00 -0.36 0.00 0.00 55.97 57.23 2dja s LYS 78 Cb -0.24 0.45 -0.00 0.00 -1.51 0.00 0.00 37.83 36.53 2dja s LYS 78 CO 0.30 -0.22 -0.09 -1.12 -0.36 0.00 0.00 175.35 173.86 2dja s SER 79 N 2.52 4.01 0.00 1.43 0.01 -1.26 -4.99 113.70 115.42 2dja s SER 79 Ca -0.04 -0.44 0.00 0.00 1.31 0.00 0.00 55.95 56.78 2dja s SER 79 Cb -0.11 -1.67 0.00 0.00 0.21 0.00 0.00 66.02 64.45 2dja s SER 79 CO -0.15 0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.12 2dja n GLY 80 N 4.59 0.71 3.57 3.44 0.00 -1.26 -5.06 105.19 111.16 2dja n GLY 80 Ca -0.19 0.44 -0.27 0.00 0.00 0.00 0.00 46.02 46.00 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 2.42 2.54 0.18 1.61 0.04 -1.26 -4.83 135.00 135.70 2dja s PRO 81 Ca 0.00 -0.55 -0.22 0.00 0.04 0.00 0.00 61.00 60.27 2dja s PRO 81 Cb 0.00 -5.12 0.10 0.00 0.04 0.00 0.00 34.50 29.52 2dja s PRO 81 CO 0.00 -3.55 1.58 0.77 0.04 0.00 0.00 177.00 175.84 2dja h SER 82 N 10.82 -1.25 -2.57 6.66 0.02 -1.98 -3.41 113.55 121.83 2dja h SER 82 Ca 0.13 0.23 -0.48 0.00 -0.84 0.00 0.00 61.79 60.83 2dja h SER 82 Cb 0.99 0.61 0.23 0.00 0.14 0.00 0.00 62.40 64.36 2dja h SER 82 CO 1.21 -0.31 -1.03 -1.20 -1.14 0.00 0.00 176.83 174.36 2dja n SER 83 N -5.43 -2.42 0.00 3.07 7.64 -1.26 -5.03 113.62 110.20 2dja n SER 83 Ca 0.04 0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.94 2dja n SER 83 Cb 0.35 -1.01 0.00 0.00 -1.01 0.00 0.00 64.21 62.55 2dja n SER 83 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64