#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dja h SER 2 N 0.00 0.48 -3.39 1.61 4.64 -2.13 -3.44 113.55 111.32 2dja h SER 2 Ca 0.00 -0.94 -0.59 0.00 -0.47 0.00 0.00 61.79 59.78 2dja h SER 2 Cb 0.00 -0.16 -0.10 0.00 -0.31 0.00 0.00 62.40 61.83 2dja h SER 2 CO 0.00 1.44 -0.25 -0.55 -0.87 0.00 0.00 176.83 176.60 2dja s SER 3 N -7.02 6.46 -0.29 4.97 0.15 -1.26 -4.97 113.70 111.74 2dja s SER 3 Ca -0.14 0.55 0.20 0.00 0.70 0.00 0.00 55.95 57.26 2dja s SER 3 Cb 0.01 -2.22 0.48 0.00 -1.71 0.00 0.00 66.02 62.59 2dja s SER 3 CO 0.83 0.01 1.03 0.61 1.20 0.00 0.00 173.24 176.93 2dja n GLY 4 N 3.62 1.65 3.41 9.45 0.00 -1.26 -5.04 105.19 117.02 2dja n GLY 4 Ca -0.10 -1.17 -0.44 0.00 0.00 0.00 0.00 46.02 44.31 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 -3.45 6.41 0.28 1.61 0.15 -1.26 -4.89 113.70 112.55 2dja s SER 5 Ca 0.27 -1.72 0.02 0.00 0.70 0.00 0.00 55.95 55.22 2dja s SER 5 Cb 0.39 -2.35 0.59 0.00 -1.71 0.00 0.00 66.02 62.94 2dja s SER 5 CO -0.00 -1.09 1.81 0.28 1.20 0.00 0.00 173.24 175.44 2dja h SER 6 N 8.96 0.84 0.00 5.45 0.02 -2.06 -3.45 113.55 123.31 2dja h SER 6 Ca -0.09 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2dja h SER 6 Cb 1.06 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.50 2dja h SER 6 CO 1.07 0.41 0.00 0.61 -1.14 0.00 0.00 176.83 177.78 2dja n GLY 7 N -1.34 3.25 3.01 -3.77 0.00 -1.26 -4.69 105.19 100.39 2dja n GLY 7 Ca 0.20 -0.11 -0.12 0.00 0.00 0.00 0.00 46.02 45.99 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 0.00 0.02 0.50 1.61 -7.23 -1.26 -5.14 120.40 108.90 2dja s VAL 8 Ca 0.00 -0.14 -0.23 0.00 -1.81 0.00 0.00 61.98 59.79 2dja s VAL 8 Cb 0.00 -0.22 -0.06 0.00 0.56 0.00 0.00 36.38 36.66 2dja s VAL 8 CO 0.00 -0.08 1.39 -1.83 -0.31 0.00 0.00 175.10 174.27 2dja s GLU 9 N -0.22 3.39 0.23 4.82 -1.05 -1.26 -4.95 118.70 119.66 2dja s GLU 9 Ca -0.03 2.31 -0.30 0.00 -0.15 0.00 0.00 54.97 56.80 2dja s GLU 9 Cb -0.02 -2.44 -0.09 0.00 -0.44 0.00 0.00 34.13 31.14 2dja s GLU 9 CO 0.00 -1.02 1.29 -1.25 0.95 0.00 0.00 175.26 175.23 2dja s PRO 10 N -2.70 4.41 -0.04 -4.83 0.04 -1.26 -5.04 135.00 125.58 2dja s PRO 10 Ca 0.67 2.05 0.06 0.00 0.04 0.00 0.00 61.00 63.83 2dja s PRO 10 Cb -0.42 -3.17 -0.02 0.00 0.04 0.00 0.00 34.50 30.93 2dja s PRO 10 CO 0.51 -0.19 -0.23 0.08 0.04 0.00 0.00 177.00 177.21 2dja s VAL 11 N -0.23 2.26 1.09 -0.36 1.01 -1.26 -5.14 120.40 117.78 2dja s VAL 11 Ca 0.54 -1.02 -0.18 0.00 0.00 0.00 0.00 61.98 61.32 2dja s VAL 11 Cb -0.36 -1.82 0.27 0.00 0.00 0.00 0.00 36.38 34.47 2dja s VAL 11 CO 0.41 0.58 0.97 -0.81 0.00 0.00 0.00 175.10 176.24 2dja n PRO 12 N 2.58 -2.91 -2.93 2.72 -0.04 -1.26 -4.97 135.00 128.19 2dja n PRO 12 Ca -0.17 -1.55 -0.43 0.00 -0.04 0.00 0.00 63.50 61.32 2dja n PRO 12 Cb 0.52 -1.45 -0.05 0.00 -0.04 0.00 0.00 33.50 32.48 2dja n PRO 12 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2dja s ASP 13 N -4.11 6.45 -0.11 3.54 1.11 -1.26 -5.03 116.67 117.27 2dja s ASP 13 Ca 0.63 0.01 0.03 0.00 0.18 0.00 0.00 52.55 53.40 2dja s ASP 13 Cb -0.06 -2.40 0.00 0.00 1.07 0.00 0.00 42.92 41.53 2dja s ASP 13 CO 0.48 -0.92 -0.23 0.28 1.18 0.00 0.00 175.17 175.96 2dja s THR 14 N 3.37 2.04 0.90 -1.27 -1.32 -1.26 -5.12 115.64 112.97 2dja s THR 14 Ca 0.32 -0.99 -0.11 0.00 -1.21 0.00 0.00 61.69 59.70 2dja s THR 14 Cb -0.12 -1.77 0.13 0.00 -1.51 0.00 0.00 72.50 69.23 2dja s THR 14 CO 0.23 0.55 1.10 -1.38 -2.21 0.00 0.00 174.62 172.91 2dja s HIS 15 N 0.51 2.04 0.07 9.09 -3.43 -1.26 -5.04 115.29 117.27 2dja s HIS 15 Ca -0.15 1.53 0.05 0.00 -0.80 0.00 0.00 55.06 55.69 2dja s HIS 15 Cb -0.17 -3.18 -0.04 0.00 -1.43 0.00 0.00 32.58 27.76 2dja s HIS 15 CO 0.05 -2.53 -0.04 -1.17 -2.00 0.00 0.00 174.74 169.05 2dja s LEU 16 N -6.38 3.30 0.12 5.38 2.96 -1.26 -5.04 118.68 117.75 2dja s LEU 16 Ca 0.64 -0.22 -0.29 0.00 -0.22 0.00 0.00 54.13 54.05 2dja s LEU 16 Cb -0.20 -2.02 -0.07 0.00 0.50 0.00 0.00 46.19 44.40 2dja s LEU 16 CO 0.58 0.20 1.60 0.03 -1.32 0.00 0.00 176.35 177.44 2dja h ARG 17 N 3.75 -0.53 -6.05 1.98 2.47 -2.03 -3.41 114.38 110.56 2dja h ARG 17 Ca -0.48 0.04 -0.74 0.00 -1.26 0.00 0.00 59.98 57.53 2dja h ARG 17 Cb 1.17 0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 29.60 2dja h ARG 17 CO 0.56 -0.35 1.13 0.41 0.56 0.00 0.00 179.97 182.28 2dja n GLY 18 N -1.44 0.46 3.60 0.04 0.00 -1.26 -4.78 105.19 101.81 2dja n GLY 18 Ca -0.06 0.98 -0.45 0.00 0.00 0.00 0.00 46.02 46.50 2dja n GLY 18 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2dja n ILE 19 N 5.74 0.45 -4.56 -0.61 5.41 -1.26 -4.95 119.36 119.58 2dja n ILE 19 Ca 0.38 -0.31 -0.26 0.00 1.00 0.00 0.00 62.75 63.55 2dja n ILE 19 Cb 0.10 -2.28 -0.09 0.00 -0.71 0.00 0.00 39.64 36.66 2dja n ILE 19 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 2dja s THR 20 N 6.73 1.02 -0.02 1.39 -4.23 -1.26 -4.54 115.64 114.73 2dja s THR 20 Ca 0.98 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 59.19 2dja s THR 20 Cb -0.48 -2.50 -0.04 0.00 1.34 0.00 0.00 72.50 70.82 2dja s THR 20 CO 0.41 0.00 1.16 0.00 -0.54 0.00 0.00 174.62 175.65 2dja n LEU 22 N 4.66 -0.80 -0.25 0.00 4.77 -1.26 -0.01 117.00 124.11 2dja n LEU 22 Ca 0.10 1.51 -0.06 0.00 -0.03 0.00 0.00 56.01 57.53 2dja n LEU 22 Cb 0.47 -0.26 0.05 0.00 -2.33 0.00 0.00 43.42 41.35 2dja n LEU 22 CO 0.55 -1.18 1.07 0.44 -1.33 0.00 0.00 177.39 176.94 2dja h ASP 23 N 0.00 0.90 -3.69 -1.43 5.19 -1.98 -3.38 116.42 112.03 2dja h ASP 23 Ca 0.12 -0.12 -0.68 0.00 -0.62 0.00 0.00 57.03 55.73 2dja h ASP 23 Cb 0.31 -0.23 -0.35 0.00 0.18 0.00 0.00 39.33 39.24 2dja h ASP 23 CO -0.71 0.77 -0.67 -1.00 -3.12 0.00 0.00 179.24 174.51 2dja s HIS 24 N -5.74 3.44 -0.07 4.55 3.76 0.99 -4.97 115.29 117.25 2dja s HIS 24 Ca -0.13 -2.26 0.00 0.00 -0.15 0.00 0.00 55.06 52.52 2dja s HIS 24 Cb 0.14 -2.54 0.08 0.00 1.11 0.00 0.00 32.58 31.37 2dja s HIS 24 CO 0.80 -0.88 1.33 -0.85 -0.85 0.00 0.00 174.74 174.29 2dja n GLU 25 N 4.53 1.18 0.00 1.40 0.00 -0.98 -0.66 120.64 126.11 2dja n GLU 25 Ca -0.07 -0.41 0.00 0.00 0.00 0.00 0.00 57.16 56.68 2dja n GLU 25 Cb 0.42 -1.16 0.00 0.00 0.00 0.00 0.00 31.44 30.70 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 0.50 1.64 -4.55 -1.84 3.02 -1.26 -4.88 115.26 107.88 2dja n ASN 26 Ca 0.08 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.21 2dja n ASN 26 Cb 0.62 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.72 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 3.55 -0.23 3.52 0.41 -1.23 -4.93 118.70 118.38 2dja s GLU 27 Ca 0.00 -0.21 -0.29 0.00 -0.41 0.00 0.00 54.97 54.06 2dja s GLU 27 Cb 0.00 -3.84 -0.03 0.00 -1.78 0.00 0.00 34.13 28.48 2dja s GLU 27 CO 0.00 -0.71 1.71 0.15 -0.49 0.00 0.00 175.26 175.92 2dja s LYS 28 N 2.45 3.69 -0.40 1.61 3.01 -1.26 -1.88 119.74 126.95 2dja s LYS 28 Ca 0.19 1.69 -0.42 0.00 -1.01 0.00 0.00 55.97 56.42 2dja s LYS 28 Cb -0.15 -4.09 -0.17 0.00 -1.01 0.00 0.00 37.83 32.40 2dja s LYS 28 CO 0.14 -1.43 1.85 1.33 0.51 0.00 0.00 175.35 177.75 2dja n VAL 29 N 6.64 0.13 -1.33 3.17 0.24 -1.26 -4.81 118.33 121.11 2dja n VAL 29 Ca 0.20 -0.05 0.07 0.00 -2.04 0.00 0.00 64.34 62.52 2dja n VAL 29 Cb 0.45 -0.91 0.11 0.00 -1.47 0.00 0.00 33.84 32.03 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 6.01 1.78 -4.23 -1.34 0.23 -1.15 -4.90 115.26 111.65 2dja n ASN 30 Ca 0.36 -2.89 -0.13 0.00 -0.53 0.00 0.00 54.58 51.39 2dja n ASN 30 Cb 0.05 -0.39 -0.10 0.00 -2.08 0.00 0.00 39.78 37.26 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 -2.23 1.22 -0.17 -3.83 -1.94 -0.68 -3.16 119.30 108.51 2dja s MET 31 Ca 0.26 -1.64 -0.04 0.00 -1.71 0.00 0.00 55.69 52.56 2dja s MET 31 Cb 0.23 0.07 0.06 0.00 2.01 0.00 0.00 34.83 37.19 2dja s MET 31 CO 0.01 -0.33 0.07 -0.47 -0.01 0.00 0.00 175.02 174.30 2dja s TYR 32 N -3.99 0.46 0.20 -0.03 5.04 -1.23 -2.40 117.35 115.40 2dja s TYR 32 Ca 0.36 -0.44 -0.30 0.00 -2.44 0.00 0.00 57.07 54.24 2dja s TYR 32 Cb 0.07 -0.79 -0.09 0.00 0.35 0.00 0.00 41.96 41.51 2dja s TYR 32 CO 0.11 -0.52 1.27 0.00 -1.34 0.00 0.00 175.55 175.07 2dja h VAL 34 N 3.69 1.43 0.13 0.00 2.07 -1.05 -0.92 116.25 121.58 2dja h VAL 34 Ca -0.45 -2.29 -0.01 0.00 0.82 0.00 0.00 66.70 64.77 2dja h VAL 34 Cb 1.21 2.92 0.00 0.00 -1.52 0.00 0.00 31.29 33.91 2dja h VAL 34 CO 0.75 0.51 -0.06 0.28 0.02 0.00 0.00 177.57 179.07 2dja h SER 35 N -0.95 -0.15 0.13 0.57 0.02 -1.93 -3.17 113.55 108.06 2dja h SER 35 Ca -0.15 -0.14 -0.22 0.00 -0.84 0.00 0.00 61.79 60.44 2dja h SER 35 Cb 1.17 0.04 0.01 0.00 0.14 0.00 0.00 62.40 63.75 2dja h SER 35 CO -0.07 0.05 -0.87 0.44 -1.14 0.00 0.00 176.83 175.24 2dja h ASP 36 N -0.35 0.70 -3.23 3.07 3.32 -1.92 -3.48 116.42 114.54 2dja h ASP 36 Ca -0.02 -0.51 -0.14 0.00 0.02 0.00 0.00 57.03 56.38 2dja h ASP 36 Cb 0.28 -0.21 0.06 0.00 0.22 0.00 0.00 39.33 39.68 2dja h ASP 36 CO 0.03 1.30 -0.29 -0.67 -1.72 0.00 0.00 179.24 177.89 2dja n ASP 37 N -3.84 -2.69 -3.89 6.45 2.03 -0.36 -5.05 116.55 109.21 2dja n ASP 37 Ca -0.07 -0.23 -0.09 0.00 0.52 0.00 0.00 54.79 54.92 2dja n ASP 37 Cb 0.79 -2.31 -0.08 0.00 -0.72 0.00 0.00 41.12 38.81 2dja n ASP 37 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 2dja s GLN 38 N -4.92 0.76 -0.12 -0.67 2.00 -1.19 -4.95 119.66 110.57 2dja s GLN 38 Ca 0.09 -0.90 -0.30 0.00 -2.00 0.00 0.00 55.36 52.25 2dja s GLN 38 Cb -0.04 0.30 -0.02 0.00 0.80 0.00 0.00 33.01 34.05 2dja s GLN 38 CO 0.29 -0.22 1.17 -0.51 -0.50 0.00 0.00 175.29 175.51 2dja s LEU 39 N -2.63 4.22 0.21 3.68 1.43 -1.26 -1.44 118.68 122.89 2dja s LEU 39 Ca 0.02 1.68 0.04 0.00 -1.03 0.00 0.00 54.13 54.84 2dja s LEU 39 Cb 0.03 -3.55 -0.05 0.00 0.03 0.00 0.00 46.19 42.65 2dja s LEU 39 CO -0.09 -0.63 -0.04 0.27 0.23 0.00 0.00 176.35 176.10 2dja s ILE 40 N 2.68 1.15 0.20 -0.59 -4.36 -1.01 -4.88 121.20 114.39 2dja s ILE 40 Ca 0.53 -2.06 0.03 0.00 -0.26 0.00 0.00 60.65 58.89 2dja s ILE 40 Cb -0.21 -2.22 0.03 0.00 1.25 0.00 0.00 42.46 41.30 2dja s ILE 40 CO 0.17 -0.44 0.22 0.00 0.24 0.00 0.00 174.94 175.14 2dja h ALA 42 N 0.52 -0.71 -1.21 0.00 0.00 -1.92 -3.01 119.26 112.94 2dja h ALA 42 Ca -0.11 -0.19 0.39 0.00 0.00 0.00 0.00 54.91 55.00 2dja h ALA 42 Cb 0.45 0.27 -0.13 0.00 0.00 0.00 0.00 17.79 18.38 2dja h ALA 42 CO 0.16 -0.76 0.77 -0.07 0.00 0.00 0.00 179.25 179.35 2dja h LEU 43 N -0.98 0.32 0.26 0.00 3.38 -1.97 0.41 115.31 116.73 2dja h LEU 43 Ca -0.07 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2dja h LEU 43 Cb 0.62 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 2dja h LEU 43 CO 0.12 -0.14 -0.26 0.00 0.09 0.00 0.00 178.44 178.24 2dja h LYS 45 N -0.56 0.62 0.23 0.00 1.79 -0.67 0.36 116.57 118.34 2dja h LYS 45 Ca -0.01 -0.47 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 2dja h LYS 45 Cb 0.52 0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 31.22 2dja h LYS 45 CO -0.06 1.09 -0.41 -0.07 -1.08 0.00 0.00 179.45 178.92 2dja h LEU 46 N 0.44 -1.18 0.00 2.94 -0.00 -0.16 -3.36 115.31 113.99 2dja h LEU 46 Ca -0.02 0.11 0.00 0.00 -0.00 0.00 0.00 57.88 57.97 2dja h LEU 46 Cb 1.28 0.42 0.00 0.00 -0.00 0.00 0.00 40.66 42.35 2dja h LEU 46 CO 0.13 -0.47 -0.62 1.33 -0.00 0.00 0.00 178.44 178.81 2dja n VAL 47 N -4.81 0.00 -0.92 1.22 0.24 -0.43 -4.90 118.33 108.74 2dja n VAL 47 Ca -0.08 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 61.85 2dja n VAL 47 Cb 0.34 -0.52 0.07 0.00 -1.47 0.00 0.00 33.84 32.26 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 2.00 -3.12 0.27 7.63 0.00 0.13 -4.60 105.19 107.50 2dja n GLY 48 Ca 0.00 -0.41 0.09 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.26 0.00 -1.88 1.61 2.47 -1.90 -1.60 114.38 111.82 2dja h ARG 49 Ca -0.43 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 58.22 2dja h ARG 49 Cb 1.37 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 29.66 2dja h ARG 49 CO 0.26 0.00 0.08 0.72 0.56 0.00 0.00 179.97 181.59 2dja n HIS 50 N -2.50 0.31 -1.85 3.04 8.25 -1.16 -4.89 115.22 116.42 2dja n HIS 50 Ca -0.01 -1.18 -0.41 0.00 -0.26 0.00 0.00 57.72 55.87 2dja n HIS 50 Cb 0.49 -0.58 -0.03 0.00 1.12 0.00 0.00 29.99 30.99 2dja n HIS 50 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2dja s ARG 51 N -0.36 2.89 -0.66 -0.41 1.81 -0.60 -2.38 118.95 119.24 2dja s ARG 51 Ca 0.06 1.34 -0.03 0.00 -1.72 0.00 0.00 55.73 55.39 2dja s ARG 51 Cb 0.05 -4.35 0.00 0.00 -0.45 0.00 0.00 34.95 30.20 2dja s ARG 51 CO -0.00 -2.38 0.57 -3.47 -0.68 0.00 0.00 175.30 169.33 2dja n ASP 52 N 12.21 -3.34 -4.81 0.23 -0.08 -1.26 -5.04 116.55 114.46 2dja n ASP 52 Ca 0.26 -0.29 -0.23 0.00 -1.51 0.00 0.00 54.79 53.02 2dja n ASP 52 Cb 0.49 -2.83 0.08 0.00 2.34 0.00 0.00 41.12 41.20 2dja n ASP 52 CO 0.00 0.00 0.00 -1.00 0.12 0.00 0.00 177.20 176.32 2dja s HIS 53 N -3.17 2.19 -0.70 -0.67 3.76 -1.00 -5.05 115.29 110.66 2dja s HIS 53 Ca 0.18 -0.11 -0.14 0.00 -0.15 0.00 0.00 55.06 54.84 2dja s HIS 53 Cb -0.08 -2.92 0.18 0.00 1.11 0.00 0.00 32.58 30.87 2dja s HIS 53 CO 0.37 -1.37 0.63 -1.14 -0.85 0.00 0.00 174.74 172.39 2dja s GLN 54 N -5.01 3.28 -0.04 1.40 0.74 -1.26 -5.04 119.66 113.72 2dja s GLN 54 Ca 0.62 -2.16 0.05 0.00 0.05 0.00 0.00 55.36 53.92 2dja s GLN 54 Cb -0.08 -4.32 -0.02 0.00 1.10 0.00 0.00 33.01 29.68 2dja s GLN 54 CO 0.42 -1.29 -0.17 0.14 -0.55 0.00 0.00 175.29 173.83 2dja s VAL 55 N 0.73 2.81 -0.42 1.34 -7.23 -1.26 -0.39 120.40 115.97 2dja s VAL 55 Ca 0.12 -0.82 -0.11 0.00 -1.81 0.00 0.00 61.98 59.36 2dja s VAL 55 Cb -0.19 -2.07 0.07 0.00 0.56 0.00 0.00 36.38 34.75 2dja s VAL 55 CO -0.04 0.59 0.27 0.00 -0.31 0.00 0.00 175.10 175.61 2dja s ALA 56 N -0.70 3.34 0.40 1.32 0.00 -0.51 -4.89 121.76 120.71 2dja s ALA 56 Ca 0.11 -2.05 -0.23 0.00 0.00 0.00 0.00 51.96 49.80 2dja s ALA 56 Cb -0.10 -2.72 -0.14 0.00 0.00 0.00 0.00 23.12 20.16 2dja s ALA 56 CO 0.00 -1.61 0.41 0.43 0.00 0.00 0.00 175.76 174.99 2dja n SER 57 N 4.99 -1.49 -4.46 0.00 7.64 -1.26 -3.50 113.62 115.54 2dja n SER 57 Ca -0.11 0.90 -0.43 0.00 1.01 0.00 0.00 58.87 60.24 2dja n SER 57 Cb 0.44 -1.03 -0.03 0.00 -1.01 0.00 0.00 64.21 62.57 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 2.62 4.71 0.16 -3.43 1.43 -1.19 -4.92 118.68 118.07 2dja s LEU 58 Ca 0.62 -1.66 -0.24 0.00 -1.03 0.00 0.00 54.13 51.82 2dja s LEU 58 Cb -0.64 -2.42 0.06 0.00 0.03 0.00 0.00 46.19 43.22 2dja s LEU 58 CO 0.59 -1.22 0.74 0.20 0.23 0.00 0.00 176.35 176.89 2dja s ASN 59 N 3.77 -0.39 0.73 2.29 -0.87 -1.26 -5.04 114.94 114.17 2dja s ASN 59 Ca 0.30 -0.23 -0.03 0.00 -1.57 0.00 0.00 52.86 51.33 2dja s ASN 59 Cb -0.08 0.58 0.12 0.00 -0.02 0.00 0.00 41.25 41.85 2dja s ASN 59 CO -0.03 -1.01 1.01 -1.81 -2.57 0.00 0.00 177.10 172.69 2dja s ASP 60 N -2.78 4.34 0.12 -1.22 1.11 -1.26 -4.98 116.67 112.00 2dja s ASP 60 Ca 0.06 -0.16 -0.22 0.00 0.18 0.00 0.00 52.55 52.41 2dja s ASP 60 Cb -0.02 -0.26 -0.05 0.00 1.07 0.00 0.00 42.92 43.65 2dja s ASP 60 CO -0.05 -1.87 1.17 0.54 1.18 0.00 0.00 175.17 176.15 2dja n ARG 61 N -2.91 -0.32 -4.62 8.23 1.74 -1.26 -4.11 116.66 113.42 2dja n ARG 61 Ca 0.13 1.15 -0.33 0.00 -0.77 0.00 0.00 57.85 58.04 2dja n ARG 61 Cb 0.60 -1.69 -0.16 0.00 -1.02 0.00 0.00 32.46 30.18 2dja n ARG 61 CO 0.00 0.00 0.00 -0.59 -1.52 0.00 0.00 177.63 175.52 2dja s PHE 62 N -5.19 2.68 -0.85 -1.55 -0.12 -1.26 -5.06 117.98 106.62 2dja s PHE 62 Ca -0.09 -1.38 0.01 0.00 -0.05 0.00 0.00 56.93 55.42 2dja s PHE 62 Cb 0.08 -1.82 0.25 0.00 -0.63 0.00 0.00 43.02 40.89 2dja s PHE 62 CO 0.45 -0.63 0.91 -0.85 -0.05 0.00 0.00 175.22 175.04 2dja n GLU 63 N 4.12 2.97 -3.81 1.99 0.28 -1.26 -4.85 120.64 120.08 2dja n GLU 63 Ca -0.20 -4.56 -0.23 0.00 -0.16 0.00 0.00 57.16 52.01 2dja n GLU 63 Cb 0.51 -2.38 -0.06 0.00 1.43 0.00 0.00 31.44 30.94 2dja n GLU 63 CO 0.00 0.00 0.00 0.36 -0.16 0.00 0.00 177.13 177.33 2dja n LYS 64 N 1.63 -0.91 0.00 3.44 0.00 -1.26 -4.72 118.16 116.33 2dja n LYS 64 Ca 0.25 0.05 0.04 0.00 -0.00 0.00 0.00 58.31 58.64 2dja n LYS 64 Cb 0.37 -2.45 0.21 0.00 -0.00 0.00 0.00 35.03 33.17 2dja n LYS 64 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.40 178.87 2dja n LEU 65 N -3.58 0.00 -4.57 -5.58 -0.00 -1.26 -4.73 117.00 97.27 2dja n LEU 65 Ca -0.22 0.00 -0.17 0.00 -0.00 0.00 0.00 56.01 55.62 2dja n LEU 65 Cb 0.49 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.82 2dja n LEU 65 CO 0.60 0.00 1.20 -0.75 -0.00 0.00 0.00 177.39 178.44 2dja s LYS 66 N -2.00 1.59 0.57 1.47 2.36 -1.26 -4.91 119.74 117.57 2dja s LYS 66 Ca 0.11 -0.14 -0.00 0.00 -2.55 0.00 0.00 55.97 53.39 2dja s LYS 66 Cb 0.05 -4.94 0.03 0.00 -1.05 0.00 0.00 37.83 31.92 2dja s LYS 66 CO 0.08 -4.76 0.81 -0.65 1.55 0.00 0.00 175.35 172.39 2dja s GLN 67 N 8.29 2.54 -0.08 4.03 -0.21 -1.26 -5.11 119.66 127.86 2dja s GLN 67 Ca 0.83 -0.65 0.00 0.00 0.02 0.00 0.00 55.36 55.57 2dja s GLN 67 Cb -0.08 -2.43 0.02 0.00 1.00 0.00 0.00 33.01 31.52 2dja s GLN 67 CO 0.12 -0.76 -0.06 0.95 -2.12 0.00 0.00 175.29 173.41 2dja s THR 68 N -2.83 0.82 1.16 -0.19 -4.23 -1.26 -5.14 115.64 103.96 2dja s THR 68 Ca 0.57 -0.20 -0.17 0.00 -1.18 0.00 0.00 61.69 60.71 2dja s THR 68 Cb -0.10 -0.85 0.21 0.00 1.34 0.00 0.00 72.50 73.10 2dja s THR 68 CO 0.40 0.32 0.42 0.00 -0.54 0.00 0.00 174.62 175.21 2dja n LEU 69 N 4.64 -1.42 0.00 4.79 -0.00 -1.26 -4.98 117.00 118.77 2dja n LEU 69 Ca -0.15 -0.42 0.00 0.00 -0.00 0.00 0.00 56.01 55.44 2dja n LEU 69 Cb 0.50 -0.91 0.00 0.00 -0.00 0.00 0.00 43.42 43.02 2dja n LEU 69 CO 0.18 -3.53 0.19 -0.62 -0.00 0.00 0.00 177.39 173.61 2dja n GLU 70 N -3.03 0.00 -4.25 1.47 1.02 -1.26 -4.94 120.64 109.65 2dja n GLU 70 Ca 0.06 0.29 -0.20 0.00 -0.02 0.00 0.00 57.16 57.28 2dja n GLU 70 Cb 0.49 -1.03 -0.12 0.00 -0.02 0.00 0.00 31.44 30.76 2dja n GLU 70 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dja s MET 71 N -1.32 0.94 -0.48 3.49 0.23 -1.26 -5.11 119.30 115.79 2dja s MET 71 Ca 0.00 -0.98 0.03 0.00 -1.03 0.00 0.00 55.69 53.71 2dja s MET 71 Cb 0.00 -1.02 0.15 0.00 -1.53 0.00 0.00 34.83 32.43 2dja s MET 71 CO 0.00 0.24 0.31 1.21 -2.03 0.00 0.00 175.02 174.74 2dja s ASN 72 N -1.67 3.39 -0.29 -1.18 3.84 -1.26 -4.93 114.94 112.84 2dja s ASN 72 Ca 0.01 -2.92 0.16 0.00 0.21 0.00 0.00 52.86 50.32 2dja s ASN 72 Cb -0.10 -1.00 0.48 0.00 -0.55 0.00 0.00 41.25 40.09 2dja s ASN 72 CO 0.03 -0.22 1.11 0.18 -2.79 0.00 0.00 177.10 175.41 2dja n LEU 73 N 3.13 2.80 -4.40 3.21 4.77 -1.26 -4.99 117.00 120.26 2dja n LEU 73 Ca 0.15 -3.80 -0.44 0.00 -0.03 0.00 0.00 56.01 51.89 2dja n LEU 73 Cb 0.37 0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 2dja n LEU 73 CO 0.21 1.52 1.59 0.35 -1.33 0.00 0.00 177.39 179.73 2dja n THR 74 N -0.55 4.19 -1.79 -5.08 -2.24 -1.26 -4.80 114.28 102.76 2dja n THR 74 Ca 0.21 -4.55 -0.35 0.00 -2.27 0.00 0.00 64.05 57.09 2dja n THR 74 Cb 0.84 -2.44 0.05 0.00 -2.10 0.00 0.00 70.33 66.68 2dja n THR 74 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2dja n ASN 75 N 5.93 7.01 -3.38 3.42 6.94 -1.26 -4.86 115.26 129.06 2dja n ASN 75 Ca 0.40 -3.80 -0.12 0.00 -0.02 0.00 0.00 54.58 51.04 2dja n ASN 75 Cb 0.42 -0.89 -0.09 0.00 -2.36 0.00 0.00 39.78 36.86 2dja n ASN 75 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2dja s LEU 76 N -3.88 -0.49 -0.05 -4.53 0.20 -1.26 -5.13 118.68 103.54 2dja s LEU 76 Ca 0.56 -0.13 -0.02 0.00 0.69 0.00 0.00 54.13 55.23 2dja s LEU 76 Cb 0.46 0.87 0.03 0.00 -0.43 0.00 0.00 46.19 47.12 2dja s LEU 76 CO -0.20 -0.33 0.06 -0.69 -0.29 0.00 0.00 176.35 174.90 2dja s VAL 77 N 2.47 -0.10 0.15 1.68 1.01 -1.26 -5.14 120.40 119.21 2dja s VAL 77 Ca 0.11 0.38 -0.16 0.00 0.00 0.00 0.00 61.98 62.31 2dja s VAL 77 Cb -0.15 -0.19 0.03 0.00 0.00 0.00 0.00 36.38 36.07 2dja s VAL 77 CO -0.20 0.15 0.43 -0.54 0.00 0.00 0.00 175.10 174.93 2dja s LYS 78 N 2.16 1.19 0.33 2.72 1.02 -1.26 -5.19 119.74 120.72 2dja s LYS 78 Ca 0.05 -0.83 -0.09 0.00 0.02 0.00 0.00 55.97 55.12 2dja s LYS 78 Cb -0.12 0.47 0.02 0.00 -0.52 0.00 0.00 37.83 37.68 2dja s LYS 78 CO -0.03 -0.48 0.57 -1.54 -0.92 0.00 0.00 175.35 172.95 2dja s SER 79 N -2.85 0.39 0.00 2.83 1.04 -1.26 -5.16 113.70 108.70 2dja s SER 79 Ca 0.07 -1.23 0.00 0.00 0.48 0.00 0.00 55.95 55.27 2dja s SER 79 Cb 0.01 0.70 0.00 0.00 0.10 0.00 0.00 66.02 66.83 2dja s SER 79 CO -0.07 -1.37 0.00 0.61 0.98 0.00 0.00 173.24 173.39 2dja n GLY 80 N -0.51 -1.08 3.64 7.32 0.00 -1.26 -5.18 105.19 108.13 2dja n GLY 80 Ca -0.02 0.95 -0.29 0.00 0.00 0.00 0.00 46.02 46.65 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 0.00 -0.35 -0.28 1.61 0.04 -1.26 -5.09 135.00 129.67 2dja s PRO 81 Ca 0.00 0.24 -0.23 0.00 0.04 0.00 0.00 61.00 61.05 2dja s PRO 81 Cb 0.00 -1.67 0.13 0.00 0.04 0.00 0.00 34.50 33.00 2dja s PRO 81 CO 0.00 -3.19 1.04 0.45 0.04 0.00 0.00 177.00 175.34 2dja s SER 82 N -3.65 -0.44 0.20 6.66 0.15 -1.26 -5.19 113.70 110.18 2dja s SER 82 Ca 0.68 0.82 -0.02 0.00 0.70 0.00 0.00 55.95 58.13 2dja s SER 82 Cb -0.15 0.90 -0.04 0.00 -1.71 0.00 0.00 66.02 65.03 2dja s SER 82 CO 0.57 -0.14 0.15 -0.44 1.20 0.00 0.00 173.24 174.59 2dja s SER 83 N 0.45 0.15 0.00 5.45 0.01 -1.26 -5.38 113.70 113.11 2dja s SER 83 Ca 0.01 -1.36 0.00 0.00 1.31 0.00 0.00 55.95 55.91 2dja s SER 83 Cb -0.05 0.40 0.00 0.00 0.21 0.00 0.00 66.02 66.58 2dja s SER 83 CO -0.09 -0.86 0.09 0.61 0.41 0.00 0.00 173.24 173.40