#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 -0.33 0.16 1.61 0.01 -1.26 -5.19 113.70 108.71 2dja s SER 2 Ca 0.00 -0.40 0.00 0.00 1.31 0.00 0.00 55.95 56.86 2dja s SER 2 Cb 0.00 0.64 -0.04 0.00 0.21 0.00 0.00 66.02 66.83 2dja s SER 2 CO 0.00 -1.15 0.04 -0.44 0.41 0.00 0.00 173.24 172.09 2dja s SER 3 N -2.86 0.81 0.16 2.44 0.01 -1.26 -5.17 113.70 107.82 2dja s SER 3 Ca 0.09 -1.21 0.07 0.00 1.31 0.00 0.00 55.95 56.20 2dja s SER 3 Cb -0.04 0.20 -0.04 0.00 0.21 0.00 0.00 66.02 66.35 2dja s SER 3 CO 0.01 -0.66 -0.15 -0.83 0.41 0.00 0.00 173.24 172.02 2dja s GLY 4 N -3.13 1.26 0.19 3.44 0.00 -1.26 -5.16 107.32 102.67 2dja s GLY 4 Ca 0.26 -1.46 -0.14 0.00 0.00 0.00 0.00 44.72 43.37 2dja s GLY 4 CO 0.04 -1.53 0.45 -0.56 0.00 0.00 0.00 173.10 171.50 2dja s SER 5 N -2.79 -0.15 -0.13 1.64 0.01 -1.26 -5.18 113.70 105.84 2dja s SER 5 Ca 0.15 -0.66 -0.17 0.00 1.31 0.00 0.00 55.95 56.58 2dja s SER 5 Cb -0.03 0.54 0.04 0.00 0.21 0.00 0.00 66.02 66.78 2dja s SER 5 CO 0.05 -1.02 0.45 -0.44 0.41 0.00 0.00 173.24 172.68 2dja s SER 6 N -2.92 -0.43 0.00 2.44 0.01 -1.26 -5.16 113.70 106.37 2dja s SER 6 Ca 0.13 0.73 0.00 0.00 1.31 0.00 0.00 55.95 58.13 2dja s SER 6 Cb 0.00 0.77 0.00 0.00 0.21 0.00 0.00 66.02 67.01 2dja s SER 6 CO -0.00 -0.26 0.00 0.61 0.41 0.00 0.00 173.24 174.00 2dja n GLY 7 N 2.35 4.78 3.36 3.44 0.00 -1.26 -5.16 105.19 112.70 2dja n GLY 7 Ca -0.15 -1.01 -0.31 0.00 0.00 0.00 0.00 46.02 44.55 2dja n GLY 7 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dja s VAL 8 N 3.42 2.29 0.09 1.61 -7.23 -1.26 -5.14 120.40 114.18 2dja s VAL 8 Ca 0.00 -1.20 0.03 0.00 -1.81 0.00 0.00 61.98 59.00 2dja s VAL 8 Cb 0.00 -1.87 -0.04 0.00 0.56 0.00 0.00 36.38 35.04 2dja s VAL 8 CO 0.00 0.46 -0.09 -1.83 -0.31 0.00 0.00 175.10 173.33 2dja s GLU 9 N -1.00 0.78 0.03 4.82 -1.05 -1.26 -5.17 118.70 115.85 2dja s GLU 9 Ca 0.12 -1.13 -0.00 0.00 -0.15 0.00 0.00 54.97 53.80 2dja s GLU 9 Cb -0.10 -0.39 0.01 0.00 -0.44 0.00 0.00 34.13 33.21 2dja s GLU 9 CO 0.01 0.05 0.02 -0.35 0.95 0.00 0.00 175.26 175.94 2dja n PRO 10 N 0.57 -1.06 -1.21 -4.83 -0.04 -1.26 -4.86 135.00 122.31 2dja n PRO 10 Ca -0.16 -0.04 -0.47 0.00 -0.04 0.00 0.00 63.50 62.79 2dja n PRO 10 Cb 0.58 -0.03 -0.06 0.00 -0.04 0.00 0.00 33.50 33.95 2dja n PRO 10 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2dja n VAL 11 N -2.56 0.20 -0.63 0.52 0.31 -1.26 -4.83 118.33 110.08 2dja n VAL 11 Ca 0.00 -0.05 -0.08 0.00 -0.01 0.00 0.00 64.34 64.21 2dja n VAL 11 Cb 0.01 0.00 0.06 0.00 -0.91 0.00 0.00 33.84 33.01 2dja n VAL 11 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2dja n PRO 12 N 1.17 -1.56 -5.17 5.55 -0.04 -1.26 -4.47 135.00 129.21 2dja n PRO 12 Ca 0.16 -0.44 -0.32 0.00 -0.04 0.00 0.00 63.50 62.86 2dja n PRO 12 Cb 0.08 -0.41 -0.15 0.00 -0.04 0.00 0.00 33.50 32.97 2dja n PRO 12 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2dja s ASP 13 N -2.25 3.33 0.91 3.54 2.15 -1.26 -4.90 116.67 118.19 2dja s ASP 13 Ca 0.18 -0.42 -0.11 0.00 0.43 0.00 0.00 52.55 52.63 2dja s ASP 13 Cb -0.02 -0.70 0.14 0.00 -0.30 0.00 0.00 42.92 42.04 2dja s ASP 13 CO 0.14 0.29 1.10 0.42 -0.17 0.00 0.00 175.17 176.95 2dja s THR 14 N -0.42 2.49 1.13 1.71 -4.23 -1.26 -4.84 115.64 110.22 2dja s THR 14 Ca 0.04 0.16 -0.13 0.00 -1.18 0.00 0.00 61.69 60.59 2dja s THR 14 Cb -0.12 -2.40 0.26 0.00 1.34 0.00 0.00 72.50 71.59 2dja s THR 14 CO 0.01 -0.21 1.04 -1.38 -0.54 0.00 0.00 174.62 173.55 2dja s HIS 15 N -2.74 1.51 -0.06 3.99 -3.43 -1.26 -5.05 115.29 108.24 2dja s HIS 15 Ca 0.65 1.16 0.00 0.00 -0.80 0.00 0.00 55.06 56.07 2dja s HIS 15 Cb -0.21 -3.14 0.02 0.00 -1.43 0.00 0.00 32.58 27.83 2dja s HIS 15 CO 0.58 -3.66 -0.03 -0.48 -2.00 0.00 0.00 174.74 169.15 2dja s LEU 16 N -7.06 1.06 -0.82 5.38 2.34 -1.26 -5.08 118.68 113.24 2dja s LEU 16 Ca 0.68 -0.12 0.01 0.00 0.06 0.00 0.00 54.13 54.76 2dja s LEU 16 Cb -0.24 -0.47 0.22 0.00 -0.56 0.00 0.00 46.19 45.14 2dja s LEU 16 CO 0.63 -0.11 0.76 -1.14 -1.06 0.00 0.00 176.35 175.43 2dja n ARG 17 N 4.49 2.56 -3.36 1.48 3.00 -1.26 -4.82 116.66 118.75 2dja n ARG 17 Ca -0.18 -4.53 -0.19 0.00 -0.00 0.00 0.00 57.85 52.95 2dja n ARG 17 Cb 0.50 -2.36 0.06 0.00 0.00 0.00 0.00 32.46 30.67 2dja n ARG 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2dja n GLY 18 N 1.87 -1.11 0.47 5.14 0.00 -1.26 -4.92 105.19 105.38 2dja n GLY 18 Ca 0.23 0.55 -0.15 0.00 0.00 0.00 0.00 46.02 46.64 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 -1.30 0.02 -5.51 -0.61 2.04 -2.00 -3.44 117.51 106.72 2dja h ILE 19 Ca -0.62 0.00 -0.37 0.00 1.00 0.00 0.00 64.86 64.87 2dja h ILE 19 Cb 1.32 0.02 0.04 0.00 -0.74 0.00 0.00 36.82 37.47 2dja h ILE 19 CO 0.45 0.00 0.02 0.35 0.00 0.00 0.00 178.15 178.97 2dja n THR 20 N -5.45 0.00 -3.07 -0.27 -2.24 -1.26 -4.30 114.28 97.69 2dja n THR 20 Ca -0.07 -1.36 -0.36 0.00 -2.27 0.00 0.00 64.05 59.99 2dja n THR 20 Cb 0.39 -0.82 -0.06 0.00 -2.10 0.00 0.00 70.33 67.74 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 3.45 -0.22 -0.66 0.00 3.38 -1.91 -2.54 115.31 116.80 2dja h LEU 22 Ca -0.48 0.02 0.10 0.00 0.09 0.00 0.00 57.88 57.61 2dja h LEU 22 Cb 1.19 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.95 2dja h LEU 22 CO 0.65 -0.09 0.28 0.44 0.09 0.00 0.00 178.44 179.82 2dja h ASP 23 N -0.12 0.32 -3.70 -0.43 3.32 -1.98 -3.35 116.42 110.47 2dja h ASP 23 Ca -0.00 0.08 -0.68 0.00 0.02 0.00 0.00 57.03 56.44 2dja h ASP 23 Cb 0.12 0.03 -0.35 0.00 0.22 0.00 0.00 39.33 39.35 2dja h ASP 23 CO -0.03 0.18 -0.68 -1.00 -1.72 0.00 0.00 179.24 175.98 2dja s HIS 24 N -6.07 3.46 -0.11 4.55 3.76 -1.07 -4.97 115.29 114.83 2dja s HIS 24 Ca -0.13 -2.33 0.00 0.00 -0.15 0.00 0.00 55.06 52.46 2dja s HIS 24 Cb 0.18 -2.54 0.11 0.00 1.11 0.00 0.00 32.58 31.44 2dja s HIS 24 CO 0.75 -0.89 1.61 -0.85 -0.85 0.00 0.00 174.74 174.51 2dja n GLU 25 N 4.51 1.29 0.00 1.40 0.28 -0.98 -1.54 120.64 125.60 2dja n GLU 25 Ca -0.07 -0.63 0.00 0.00 -0.16 0.00 0.00 57.16 56.30 2dja n GLU 25 Cb 0.42 -1.25 0.00 0.00 1.43 0.00 0.00 31.44 32.05 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 0.61 1.13 -4.67 -1.84 4.13 -1.26 -4.87 115.26 108.49 2dja n ASN 26 Ca 0.12 0.00 -0.39 0.00 1.68 0.00 0.00 54.58 55.99 2dja n ASN 26 Cb 0.63 0.00 -0.06 0.00 -1.54 0.00 0.00 39.78 38.81 2dja n ASN 26 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 2dja s GLU 27 N -1.77 4.22 -0.32 3.52 0.41 -1.24 -4.93 118.70 118.60 2dja s GLU 27 Ca 0.00 0.53 -0.29 0.00 -0.41 0.00 0.00 54.97 54.80 2dja s GLU 27 Cb 0.00 -3.55 0.00 0.00 -1.78 0.00 0.00 34.13 28.80 2dja s GLU 27 CO 0.00 -0.16 1.33 0.15 -0.49 0.00 0.00 175.26 176.09 2dja s LYS 28 N 1.64 3.85 -0.35 1.61 1.02 -1.26 -2.09 119.74 124.16 2dja s LYS 28 Ca 0.27 1.21 -0.32 0.00 0.02 0.00 0.00 55.97 57.14 2dja s LYS 28 Cb -0.16 -3.91 -0.14 0.00 -0.52 0.00 0.00 37.83 33.11 2dja s LYS 28 CO 0.10 -1.20 1.23 1.33 -0.92 0.00 0.00 175.35 175.90 2dja n VAL 29 N 6.36 0.00 -0.01 3.17 0.24 -1.26 -4.78 118.33 122.04 2dja n VAL 29 Ca 0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.45 2dja n VAL 29 Cb 0.47 -0.35 0.00 0.00 -1.47 0.00 0.00 33.84 32.49 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 3.53 0.55 -4.43 -1.34 6.94 -0.53 -4.90 115.26 115.08 2dja n ASN 30 Ca 0.27 -0.78 -0.21 0.00 -0.02 0.00 0.00 54.58 53.84 2dja n ASN 30 Cb -0.04 0.43 -0.10 0.00 -2.36 0.00 0.00 39.78 37.70 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 -0.43 1.58 -0.12 -3.83 -1.94 -0.51 -2.62 119.30 111.43 2dja s MET 31 Ca 0.00 -1.84 -0.04 0.00 -1.71 0.00 0.00 55.69 52.10 2dja s MET 31 Cb 0.00 -0.96 0.05 0.00 2.01 0.00 0.00 34.83 35.93 2dja s MET 31 CO 0.00 -0.09 0.10 -0.47 -0.01 0.00 0.00 175.02 174.55 2dja s TYR 32 N -3.19 0.06 0.29 -0.03 5.04 -1.23 -0.92 117.35 117.37 2dja s TYR 32 Ca 0.33 0.03 -0.29 0.00 -2.44 0.00 0.00 57.07 54.69 2dja s TYR 32 Cb 0.07 -0.54 -0.10 0.00 0.35 0.00 0.00 41.96 41.73 2dja s TYR 32 CO 0.13 -0.39 1.34 0.00 -1.34 0.00 0.00 175.55 175.29 2dja h VAL 34 N 3.27 0.92 -0.38 0.00 2.07 -1.70 -0.61 116.25 119.82 2dja h VAL 34 Ca -0.48 -2.42 -0.13 0.00 0.82 0.00 0.00 66.70 64.50 2dja h VAL 34 Cb 1.22 2.67 -0.01 0.00 -1.52 0.00 0.00 31.29 33.66 2dja h VAL 34 CO 0.70 0.78 -0.29 -1.28 0.02 0.00 0.00 177.57 177.51 2dja h SER 35 N -0.13 0.90 0.90 0.57 0.87 -1.93 -3.18 113.55 111.55 2dja h SER 35 Ca -0.34 -0.44 -0.16 0.00 -1.23 0.00 0.00 61.79 59.62 2dja h SER 35 Cb 1.91 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 63.59 2dja h SER 35 CO 0.09 1.15 -1.19 0.44 -0.53 0.00 0.00 176.83 176.80 2dja h ASP 36 N 0.66 0.00 -5.73 6.23 3.32 -1.94 -3.48 116.42 115.48 2dja h ASP 36 Ca 0.07 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.76 2dja h ASP 36 Cb 0.86 0.00 0.16 0.00 0.22 0.00 0.00 39.33 40.57 2dja h ASP 36 CO 0.08 0.58 -0.73 0.47 -1.72 0.00 0.00 179.24 177.91 2dja n ASP 37 N -2.99 -3.75 -4.08 6.45 8.00 -0.24 -5.01 116.55 114.93 2dja n ASP 37 Ca -0.07 -0.59 -0.09 0.00 0.71 0.00 0.00 54.79 54.76 2dja n ASP 37 Cb 0.82 -5.09 -0.10 0.00 -0.02 0.00 0.00 41.12 36.73 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 -5.73 0.58 -0.02 -1.24 -0.44 -1.18 -4.96 119.66 106.66 2dja s GLN 38 Ca 0.23 -1.07 -0.30 0.00 -2.50 0.00 0.00 55.36 51.72 2dja s GLN 38 Cb -0.10 0.08 -0.03 0.00 -1.64 0.00 0.00 33.01 31.31 2dja s GLN 38 CO 0.73 -0.07 1.07 -0.51 0.50 0.00 0.00 175.29 177.02 2dja s LEU 39 N -2.52 4.32 0.33 3.68 1.43 -1.26 -1.55 118.68 123.11 2dja s LEU 39 Ca 0.01 1.74 0.03 0.00 -1.03 0.00 0.00 54.13 54.88 2dja s LEU 39 Cb 0.02 -3.57 -0.05 0.00 0.03 0.00 0.00 46.19 42.62 2dja s LEU 39 CO -0.06 -0.41 0.08 0.27 0.23 0.00 0.00 176.35 176.46 2dja s ILE 40 N 1.48 0.90 0.28 -0.59 -4.36 -0.10 -4.88 121.20 113.93 2dja s ILE 40 Ca 0.53 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.95 2dja s ILE 40 Cb -0.23 -2.66 0.02 0.00 1.25 0.00 0.00 42.46 40.84 2dja s ILE 40 CO 0.25 0.00 0.19 0.00 0.24 0.00 0.00 174.94 175.62 2dja h ALA 42 N 0.74 0.21 -0.10 0.00 0.00 -1.90 -2.66 119.26 115.54 2dja h ALA 42 Ca -0.18 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2dja h ALA 42 Cb 0.64 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2dja h ALA 42 CO 0.28 -0.19 0.07 -0.07 0.00 0.00 0.00 179.25 179.34 2dja h LEU 43 N 0.10 0.12 -1.83 0.00 3.38 -1.96 0.72 115.31 115.83 2dja h LEU 43 Ca 0.05 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2dja h LEU 43 Cb 0.19 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2dja h LEU 43 CO -0.00 0.09 0.00 0.00 0.09 0.00 0.00 178.44 178.61 2dja n LYS 45 N -2.66 1.09 0.00 0.00 3.00 -0.07 -1.08 118.16 118.43 2dja n LYS 45 Ca -0.01 -0.06 0.00 0.00 -0.00 0.00 0.00 58.31 58.24 2dja n LYS 45 Cb 0.12 -1.22 0.00 0.00 0.00 0.00 0.00 35.03 33.94 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 -1.99 0.90 -0.26 3.14 4.32 0.05 -4.30 117.00 118.86 2dja n LEU 46 Ca -0.06 0.34 0.09 0.00 -0.02 0.00 0.00 56.01 56.36 2dja n LEU 46 Cb 0.42 -0.35 0.16 0.00 -1.62 0.00 0.00 43.42 42.04 2dja n LEU 46 CO 0.19 -0.35 0.51 1.33 -1.22 0.00 0.00 177.39 177.85 2dja n VAL 47 N -1.56 2.00 0.00 4.08 0.24 -0.66 -4.93 118.33 117.51 2dja n VAL 47 Ca 0.00 -2.56 0.00 0.00 -2.04 0.00 0.00 64.34 59.74 2dja n VAL 47 Cb 0.00 -0.24 0.00 0.00 -1.47 0.00 0.00 33.84 32.13 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 -1.32 1.16 0.13 7.63 0.00 0.29 -4.95 105.19 108.13 2dja n GLY 48 Ca 0.17 -0.92 -0.11 0.00 0.00 0.00 0.00 46.02 45.16 2dja n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dja n ARG 49 N 0.00 0.37 -0.86 1.61 5.12 -1.15 -4.64 116.66 117.11 2dja n ARG 49 Ca 0.00 0.09 -0.11 0.00 -1.93 0.00 0.00 57.85 55.90 2dja n ARG 49 Cb 0.00 -1.27 -0.14 0.00 -1.16 0.00 0.00 32.46 29.89 2dja n ARG 49 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2dja n HIS 50 N -3.03 0.08 0.09 -1.55 8.25 -0.24 -4.25 115.22 114.57 2dja n HIS 50 Ca -0.27 -1.33 -0.19 0.00 -0.26 0.00 0.00 57.72 55.68 2dja n HIS 50 Cb 0.77 -1.45 -0.15 0.00 1.12 0.00 0.00 29.99 30.29 2dja n HIS 50 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2dja h ARG 51 N 3.53 0.33 0.06 -0.41 3.08 -1.75 -3.38 114.38 115.84 2dja h ARG 51 Ca 0.18 -0.56 -0.33 0.00 0.07 0.00 0.00 59.98 59.34 2dja h ARG 51 Cb 1.25 0.21 -0.03 0.00 0.08 0.00 0.00 29.97 31.47 2dja h ARG 51 CO 0.33 1.23 -1.87 -0.25 -1.07 0.00 0.00 179.97 178.34 2dja n ASP 52 N -3.54 2.00 -4.20 7.04 9.92 -1.26 -4.97 116.55 121.54 2dja n ASP 52 Ca -0.14 0.25 -0.37 0.00 -0.53 0.00 0.00 54.79 53.99 2dja n ASP 52 Cb 1.05 -0.84 0.03 0.00 -0.64 0.00 0.00 41.12 40.72 2dja n ASP 52 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 2dja n HIS 53 N -3.86 -3.32 -2.92 1.24 8.25 -1.26 -4.84 115.22 108.52 2dja n HIS 53 Ca -0.36 0.27 -0.43 0.00 -0.26 0.00 0.00 57.72 56.94 2dja n HIS 53 Cb 0.90 -1.64 -0.05 0.00 1.12 0.00 0.00 29.99 30.32 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 -1.64 3.27 -0.13 -0.41 0.74 -1.26 -5.01 119.66 115.22 2dja s GLN 54 Ca 0.53 -0.44 -0.07 0.00 0.05 0.00 0.00 55.36 55.42 2dja s GLN 54 Cb -0.37 -4.07 -0.04 0.00 1.10 0.00 0.00 33.01 29.63 2dja s GLN 54 CO 0.70 -1.43 0.14 0.14 -0.55 0.00 0.00 175.29 174.28 2dja s VAL 55 N 3.63 5.47 -0.48 1.34 -7.23 -1.26 -1.83 120.40 120.04 2dja s VAL 55 Ca 0.26 0.20 -0.14 0.00 -1.81 0.00 0.00 61.98 60.48 2dja s VAL 55 Cb -0.14 -3.39 0.08 0.00 0.56 0.00 0.00 36.38 33.49 2dja s VAL 55 CO 0.17 0.60 0.39 0.00 -0.31 0.00 0.00 175.10 175.95 2dja s ALA 56 N -0.85 3.53 0.47 1.32 0.00 -0.78 -4.93 121.76 120.53 2dja s ALA 56 Ca 0.14 -2.20 -0.20 0.00 0.00 0.00 0.00 51.96 49.70 2dja s ALA 56 Cb -0.12 -3.03 -0.13 0.00 0.00 0.00 0.00 23.12 19.84 2dja s ALA 56 CO 0.03 -1.77 0.23 0.43 0.00 0.00 0.00 175.76 174.68 2dja n SER 57 N 5.16 -2.25 -3.94 0.00 7.64 -1.26 -3.57 113.62 115.39 2dja n SER 57 Ca -0.12 0.77 -0.31 0.00 1.01 0.00 0.00 58.87 60.22 2dja n SER 57 Cb 0.43 -0.99 -0.15 0.00 -1.01 0.00 0.00 64.21 62.49 2dja n SER 57 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2dja s LEU 58 N 3.17 3.83 0.19 -3.43 1.43 -1.08 -4.91 118.68 117.88 2dja s LEU 58 Ca 0.62 -1.88 0.09 0.00 -1.03 0.00 0.00 54.13 51.92 2dja s LEU 58 Cb -0.55 -1.38 -0.04 0.00 0.03 0.00 0.00 46.19 44.24 2dja s LEU 58 CO 0.61 -0.36 -0.18 0.21 0.23 0.00 0.00 176.35 176.85 2dja s ASN 59 N 1.14 2.84 0.24 2.29 3.84 -1.26 -4.88 114.94 119.16 2dja s ASN 59 Ca 0.08 -0.92 0.08 0.00 0.21 0.00 0.00 52.86 52.32 2dja s ASN 59 Cb -0.19 -0.18 -0.05 0.00 -0.55 0.00 0.00 41.25 40.28 2dja s ASN 59 CO -0.12 -0.04 -0.13 -1.81 -2.79 0.00 0.00 177.10 172.21 2dja s ASP 60 N -2.90 2.87 -0.48 -4.21 1.11 -1.26 -5.06 116.67 106.74 2dja s ASP 60 Ca 0.19 -1.07 -0.44 0.00 0.18 0.00 0.00 52.55 51.42 2dja s ASP 60 Cb -0.05 -0.18 -0.19 0.00 1.07 0.00 0.00 42.92 43.57 2dja s ASP 60 CO 0.08 -0.17 1.74 -2.11 1.18 0.00 0.00 175.17 175.89 2dja n ARG 61 N -0.49 0.00 -3.85 8.23 1.85 -1.26 -4.88 116.66 116.26 2dja n ARG 61 Ca -0.07 0.00 -0.32 0.00 -1.00 0.00 0.00 57.85 56.47 2dja n ARG 61 Cb 0.61 -1.43 -0.12 0.00 -1.05 0.00 0.00 32.46 30.47 2dja n ARG 61 CO 0.00 0.00 0.00 0.12 -0.01 0.00 0.00 177.63 177.74 2dja s PHE 62 N 4.04 3.38 -0.10 2.89 5.36 -1.26 -5.02 117.98 127.27 2dja s PHE 62 Ca 1.06 -3.09 -0.03 0.00 -0.96 0.00 0.00 56.93 53.90 2dja s PHE 62 Cb -1.43 -2.93 0.04 0.00 -0.34 0.00 0.00 43.02 38.37 2dja s PHE 62 CO 0.72 -0.72 0.08 -2.00 -1.46 0.00 0.00 175.22 171.83 2dja s GLU 63 N -0.59 -0.01 -1.28 10.12 2.56 -1.26 -4.86 118.70 123.37 2dja s GLU 63 Ca 0.20 0.20 -0.07 0.00 0.00 0.00 0.00 54.97 55.30 2dja s GLU 63 Cb -0.18 -1.04 0.01 0.00 2.00 0.00 0.00 34.13 34.91 2dja s GLU 63 CO -0.05 -0.47 1.11 1.63 -0.56 0.00 0.00 175.26 176.92 2dja n LYS 64 N 5.29 -7.46 -1.79 4.30 4.01 -1.26 -4.90 118.16 116.36 2dja n LYS 64 Ca -0.05 0.81 -0.42 0.00 -0.51 0.00 0.00 58.31 58.14 2dja n LYS 64 Cb 0.50 -5.77 -0.03 0.00 -0.51 0.00 0.00 35.03 29.22 2dja n LYS 64 CO 0.00 0.00 0.00 -1.17 -1.11 0.00 0.00 177.40 175.12 2dja s LEU 65 N -6.92 4.39 0.87 -0.35 1.98 -1.26 -4.96 118.68 112.44 2dja s LEU 65 Ca 0.45 2.60 -0.10 0.00 -2.89 0.00 0.00 54.13 54.19 2dja s LEU 65 Cb -0.20 -3.55 0.12 0.00 0.66 0.00 0.00 46.19 43.22 2dja s LEU 65 CO 0.70 -0.98 1.13 -0.75 -1.89 0.00 0.00 176.35 174.57 2dja s LYS 66 N 3.41 1.35 -0.36 1.98 2.20 -1.26 -4.96 119.74 122.09 2dja s LYS 66 Ca 0.81 1.46 0.05 0.00 -0.36 0.00 0.00 55.97 57.93 2dja s LYS 66 Cb -0.42 -1.77 0.45 0.00 -1.51 0.00 0.00 37.83 34.58 2dja s LYS 66 CO 0.36 -2.37 1.31 0.00 -0.36 0.00 0.00 175.35 174.29 2dja n GLN 67 N -4.03 3.46 -4.27 4.03 -0.00 -1.26 -5.02 117.38 110.29 2dja n GLN 67 Ca 0.11 -4.08 -0.15 0.00 -0.00 0.00 0.00 57.00 52.88 2dja n GLN 67 Cb 0.52 -2.28 -0.10 0.00 -0.00 0.00 0.00 30.24 28.38 2dja n GLN 67 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 2dja s THR 68 N -4.73 1.13 -0.25 -0.39 -4.23 -1.26 -5.16 115.64 100.75 2dja s THR 68 Ca 0.53 -2.06 -0.26 0.00 -1.18 0.00 0.00 61.69 58.72 2dja s THR 68 Cb 0.42 -1.99 0.08 0.00 1.34 0.00 0.00 72.50 72.36 2dja s THR 68 CO 0.00 -0.63 0.80 -1.48 -0.54 0.00 0.00 174.62 172.77 2dja s LEU 69 N -3.21 -0.66 -0.07 4.79 2.34 -1.26 -5.17 118.68 115.45 2dja s LEU 69 Ca 0.20 1.20 0.02 0.00 0.06 0.00 0.00 54.13 55.62 2dja s LEU 69 Cb 0.03 2.32 -0.02 0.00 -0.56 0.00 0.00 46.19 47.96 2dja s LEU 69 CO 0.03 -0.27 -0.12 -0.70 -1.06 0.00 0.00 176.35 174.23 2dja s GLU 70 N 0.12 2.74 -0.07 1.48 2.12 -1.26 -5.12 118.70 118.72 2dja s GLU 70 Ca -0.01 -0.66 -0.15 0.00 0.36 0.00 0.00 54.97 54.51 2dja s GLU 70 Cb -0.04 -2.48 0.03 0.00 0.26 0.00 0.00 34.13 31.90 2dja s GLU 70 CO 0.00 0.55 0.37 -1.64 -0.54 0.00 0.00 175.26 174.00 2dja s MET 71 N -0.52 0.60 0.18 4.30 -1.94 -1.26 -5.18 119.30 115.48 2dja s MET 71 Ca 0.07 0.14 -0.02 0.00 -1.71 0.00 0.00 55.69 54.18 2dja s MET 71 Cb -0.12 0.28 -0.04 0.00 2.01 0.00 0.00 34.83 36.96 2dja s MET 71 CO 0.02 -0.14 0.12 0.54 -0.01 0.00 0.00 175.02 175.55 2dja s ASN 72 N -0.68 0.18 0.31 3.03 4.22 -1.26 -5.14 114.94 115.60 2dja s ASN 72 Ca -0.08 -1.31 -0.29 0.00 -2.14 0.00 0.00 52.86 49.04 2dja s ASN 72 Cb -0.04 0.37 -0.10 0.00 1.28 0.00 0.00 41.25 42.76 2dja s ASN 72 CO 0.03 -0.82 1.30 -1.48 -2.04 0.00 0.00 177.10 174.09 2dja s LEU 73 N -3.12 4.43 -0.22 3.54 0.05 -1.26 -5.02 118.68 117.09 2dja s LEU 73 Ca 0.34 2.62 -0.04 0.00 0.05 0.00 0.00 54.13 57.09 2dja s LEU 73 Cb 0.07 -3.64 0.07 0.00 -2.05 0.00 0.00 46.19 40.64 2dja s LEU 73 CO 0.09 -0.51 0.10 0.42 -0.55 0.00 0.00 176.35 175.90 2dja s THR 74 N -0.91 -0.04 0.70 5.48 -4.23 -1.26 -4.87 115.64 110.51 2dja s THR 74 Ca 0.50 -0.41 -0.12 0.00 -1.18 0.00 0.00 61.69 60.49 2dja s THR 74 Cb -0.39 -0.75 0.16 0.00 1.34 0.00 0.00 72.50 72.86 2dja s THR 74 CO 0.49 -0.44 0.92 0.59 -0.54 0.00 0.00 174.62 175.64 2dja n ASN 75 N 5.25 -0.07 -3.50 3.99 3.02 -1.26 -4.92 115.26 117.77 2dja n ASN 75 Ca -0.07 -1.31 -0.32 0.00 -0.03 0.00 0.00 54.58 52.85 2dja n ASN 75 Cb 0.46 -0.71 0.01 0.00 -0.61 0.00 0.00 39.78 38.93 2dja n ASN 75 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 2dja n LEU 76 N 0.00 -3.27 -4.67 3.41 7.94 -1.26 -4.38 117.00 114.77 2dja n LEU 76 Ca 0.12 0.50 -0.43 0.00 -1.11 0.00 0.00 56.01 55.09 2dja n LEU 76 Cb 0.41 -0.70 -0.02 0.00 0.53 0.00 0.00 43.42 43.64 2dja n LEU 76 CO 0.29 -4.09 0.91 0.54 -1.11 0.00 0.00 177.39 173.93 2dja s VAL 77 N -1.66 4.62 0.30 1.96 0.11 -1.26 -4.58 120.40 119.90 2dja s VAL 77 Ca 0.46 1.93 -0.05 0.00 -2.93 0.00 0.00 61.98 61.39 2dja s VAL 77 Cb -0.38 -4.24 -0.00 0.00 -1.53 0.00 0.00 36.38 30.22 2dja s VAL 77 CO 0.56 -0.10 0.44 -0.54 -3.33 0.00 0.00 175.10 172.13 2dja s LYS 78 N 2.80 1.74 -0.08 1.54 1.02 -1.26 -5.00 119.74 120.49 2dja s LYS 78 Ca 0.48 -1.61 -0.29 0.00 0.02 0.00 0.00 55.97 54.56 2dja s LYS 78 Cb -0.18 0.43 -0.07 0.00 -0.52 0.00 0.00 37.83 37.49 2dja s LYS 78 CO 0.12 -0.71 2.10 -1.13 -0.92 0.00 0.00 175.35 174.81 2dja n SER 79 N -1.02 3.75 -3.63 2.83 3.41 -1.26 -4.68 113.62 113.03 2dja n SER 79 Ca 0.00 0.57 -0.09 0.00 -0.26 0.00 0.00 58.87 59.09 2dja n SER 79 Cb 0.62 -1.54 -0.07 0.00 -0.26 0.00 0.00 64.21 62.96 2dja n SER 79 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dja s GLY 80 N 6.32 -0.12 0.58 5.00 0.00 -1.26 -4.96 107.32 112.88 2dja s GLY 80 Ca 0.95 2.66 -0.10 0.00 0.00 0.00 0.00 44.72 48.23 2dja s GLY 80 CO 0.39 1.70 0.51 -1.55 0.00 0.00 0.00 173.10 174.15 2dja n PRO 81 N 1.89 -2.02 -3.80 2.90 -0.04 -1.26 -4.69 135.00 127.98 2dja n PRO 81 Ca -0.12 -0.82 -0.03 0.00 -0.04 0.00 0.00 63.50 62.49 2dja n PRO 81 Cb 0.56 -0.77 -0.00 0.00 -0.04 0.00 0.00 33.50 33.26 2dja n PRO 81 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2dja s SER 82 N -2.89 -0.10 0.18 3.54 1.04 -1.26 -4.50 113.70 109.71 2dja s SER 82 Ca 0.33 -0.51 -0.22 0.00 0.48 0.00 0.00 55.95 56.03 2dja s SER 82 Cb -0.03 0.49 0.08 0.00 0.10 0.00 0.00 66.02 66.65 2dja s SER 82 CO 0.26 -0.93 1.04 -0.94 0.98 0.00 0.00 173.24 173.65 2dja s SER 83 N -3.12 -0.01 0.00 7.02 1.04 -1.26 -5.22 113.70 112.15 2dja s SER 83 Ca 0.16 -0.65 0.00 0.00 0.48 0.00 0.00 55.95 55.94 2dja s SER 83 Cb -0.02 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.60 2dja s SER 83 CO 0.03 -0.97 0.11 0.61 0.98 0.00 0.00 173.24 174.00