#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fnb n ARG 2 N 0.00 -1.81 0.00 0.03 1.85 -1.26 -4.87 116.66 110.60 2fnb n ARG 2 Ca 0.00 -0.50 0.00 0.00 -1.00 0.00 0.00 57.85 56.35 2fnb n ARG 2 Cb 0.00 -2.00 0.00 0.00 -1.05 0.00 0.00 32.46 29.41 2fnb n ARG 2 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2fnb n GLY 3 N 1.33 -0.56 2.94 2.89 0.00 -1.26 -5.06 105.19 105.47 2fnb n GLY 3 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2fnb n GLY 3 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2fnb n SER 4 N 0.00 3.50 0.04 1.61 3.41 -1.26 -4.19 113.62 116.73 2fnb n SER 4 Ca 0.00 -2.79 0.00 0.00 -0.26 0.00 0.00 58.87 55.82 2fnb n SER 4 Cb 0.00 -1.50 0.00 0.00 -0.26 0.00 0.00 64.21 62.45 2fnb n SER 4 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2fnb n GLU 5 N 6.62 0.00 -2.33 4.33 0.00 -1.26 -5.08 120.64 122.92 2fnb n GLU 5 Ca 0.51 0.00 -0.41 0.00 0.00 0.00 0.00 57.16 57.25 2fnb n GLU 5 Cb 0.40 -0.03 -0.03 0.00 0.00 0.00 0.00 31.44 31.78 2fnb n GLU 5 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2fnb s VAL 6 N -1.33 3.53 0.19 6.31 1.01 -1.26 -4.97 120.40 123.88 2fnb s VAL 6 Ca 0.00 1.24 -0.30 0.00 0.00 0.00 0.00 61.98 62.92 2fnb s VAL 6 Cb 0.00 -3.79 -0.09 0.00 0.00 0.00 0.00 36.38 32.50 2fnb s VAL 6 CO 0.00 0.18 1.34 -2.16 0.00 0.00 0.00 175.10 174.46 2fnb s PRO 7 N 0.04 4.36 0.38 2.72 0.04 -1.26 -4.58 135.00 136.69 2fnb s PRO 7 Ca 0.55 2.08 0.06 0.00 0.04 0.00 0.00 61.00 63.74 2fnb s PRO 7 Cb -0.33 -3.20 -0.00 0.00 0.04 0.00 0.00 34.50 31.01 2fnb s PRO 7 CO 0.36 -0.31 0.53 1.14 0.04 0.00 0.00 177.00 178.76 2fnb s GLN 8 N 0.13 3.00 -0.96 4.56 -2.07 -1.26 -4.72 119.66 118.35 2fnb s GLN 8 Ca 0.59 -1.03 -0.24 0.00 -1.82 0.00 0.00 55.36 52.86 2fnb s GLN 8 Cb -0.37 -2.76 -0.05 0.00 -1.09 0.00 0.00 33.01 28.74 2fnb s GLN 8 CO 0.37 -0.10 1.92 -0.51 -1.32 0.00 0.00 175.29 175.64 2fnb s LEU 9 N -4.29 3.17 0.08 2.60 1.43 -1.26 -4.79 118.68 115.62 2fnb s LEU 9 Ca 0.49 -0.88 0.21 0.00 -1.03 0.00 0.00 54.13 52.92 2fnb s LEU 9 Cb -0.10 -2.56 0.86 0.00 0.03 0.00 0.00 46.19 44.42 2fnb s LEU 9 CO 0.33 -2.72 1.66 0.41 0.23 0.00 0.00 176.35 176.26 2fnb n THR 10 N 7.80 0.69 -0.57 5.49 -1.04 -1.26 -2.02 114.28 123.36 2fnb n THR 10 Ca 0.41 0.13 0.09 0.00 -2.04 0.00 0.00 64.05 62.63 2fnb n THR 10 Cb 0.47 -0.87 0.30 0.00 -1.82 0.00 0.00 70.33 68.40 2fnb n THR 10 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2fnb n ASP 11 N -1.74 4.19 -4.55 8.00 2.03 -1.26 -5.00 116.55 118.22 2fnb n ASP 11 Ca 0.04 -2.42 -0.45 0.00 0.52 0.00 0.00 54.79 52.49 2fnb n ASP 11 Cb 0.25 -0.49 -0.04 0.00 -0.72 0.00 0.00 41.12 40.11 2fnb n ASP 11 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 2fnb n LEU 12 N 0.77 2.81 -4.01 -2.67 -0.00 -0.86 -4.22 117.00 108.82 2fnb n LEU 12 Ca 0.22 0.21 -0.14 0.00 -0.00 0.00 0.00 56.01 56.30 2fnb n LEU 12 Cb 0.78 -1.46 -0.12 0.00 -0.00 0.00 0.00 43.42 42.61 2fnb n LEU 12 CO 0.19 -0.77 -0.40 -0.44 -0.00 0.00 0.00 177.39 175.97 2fnb s SER 13 N 8.35 0.68 0.01 1.96 0.01 -0.01 -5.02 113.70 119.69 2fnb s SER 13 Ca 1.04 -0.37 0.04 0.00 1.31 0.00 0.00 55.95 57.97 2fnb s SER 13 Cb -0.49 0.01 -0.03 0.00 0.21 0.00 0.00 66.02 65.71 2fnb s SER 13 CO 0.39 -0.11 -0.07 -0.36 0.41 0.00 0.00 173.24 173.49 2fnb s PHE 14 N -0.90 2.86 0.33 2.43 0.08 -1.26 -0.34 117.98 121.18 2fnb s PHE 14 Ca -0.06 -0.06 -0.01 0.00 0.12 0.00 0.00 56.93 56.92 2fnb s PHE 14 Cb -0.07 -1.59 -0.01 0.00 -0.57 0.00 0.00 43.02 40.79 2fnb s PHE 14 CO 0.00 0.37 0.43 0.14 -0.10 0.00 0.00 175.22 176.06 2fnb s VAL 15 N -1.01 0.00 -1.39 -0.44 -7.23 0.72 -4.94 120.40 106.11 2fnb s VAL 15 Ca 0.17 -1.68 -0.03 0.00 -1.81 0.00 0.00 61.98 58.63 2fnb s VAL 15 Cb -0.11 -2.60 0.00 0.00 0.56 0.00 0.00 36.38 34.23 2fnb s VAL 15 CO 0.08 0.00 0.40 0.47 -0.31 0.00 0.00 175.10 175.74 2fnb n ASP 16 N -1.36 -0.67 -3.59 4.85 8.00 -1.26 -1.45 116.55 121.08 2fnb n ASP 16 Ca 0.02 -1.05 -0.41 0.00 0.71 0.00 0.00 54.79 54.06 2fnb n ASP 16 Cb 0.62 -2.86 -0.01 0.00 -0.02 0.00 0.00 41.12 38.85 2fnb n ASP 16 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2fnb n ILE 17 N -4.43 4.24 -2.58 0.53 5.41 -1.26 -3.54 119.36 117.74 2fnb n ILE 17 Ca -0.29 -3.44 -0.26 0.00 1.00 0.00 0.00 62.75 59.76 2fnb n ILE 17 Cb 0.68 -2.46 0.01 0.00 -0.71 0.00 0.00 39.64 37.17 2fnb n ILE 17 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 2fnb s THR 18 N 1.45 4.28 -1.76 1.39 -1.32 -1.15 -4.99 115.64 113.54 2fnb s THR 18 Ca 0.53 0.03 0.21 0.00 -1.21 0.00 0.00 61.69 61.26 2fnb s THR 18 Cb 0.15 -3.65 0.51 0.00 -1.51 0.00 0.00 72.50 68.01 2fnb s THR 18 CO -0.06 -0.62 1.67 0.47 -2.21 0.00 0.00 174.62 173.87 2fnb n ASP 19 N -2.37 0.00 -0.00 8.08 9.92 -1.26 -2.80 116.55 128.12 2fnb n ASP 19 Ca 0.02 -0.40 0.07 0.00 -0.53 0.00 0.00 54.79 53.95 2fnb n ASP 19 Cb 0.56 -0.12 -0.09 0.00 -0.64 0.00 0.00 41.12 40.83 2fnb n ASP 19 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 2fnb n SER 20 N -1.12 1.31 0.00 -2.24 3.41 -1.26 -4.66 113.62 109.06 2fnb n SER 20 Ca 0.14 -0.35 0.00 0.00 -0.26 0.00 0.00 58.87 58.40 2fnb n SER 20 Cb 0.11 1.37 0.00 0.00 -0.26 0.00 0.00 64.21 65.43 2fnb n SER 20 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2fnb n SER 21 N -1.70 0.00 -4.23 4.04 3.41 -1.12 -4.55 113.62 109.47 2fnb n SER 21 Ca -0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.28 2fnb n SER 21 Cb 0.30 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 64.08 2fnb n SER 21 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 2fnb s ILE 22 N -2.00 2.20 -0.14 -1.33 -1.16 -0.95 -2.92 121.20 114.90 2fnb s ILE 22 Ca 0.00 -0.96 -0.04 0.00 -0.51 0.00 0.00 60.65 59.14 2fnb s ILE 22 Cb 0.00 -1.86 -0.03 0.00 0.61 0.00 0.00 42.46 41.18 2fnb s ILE 22 CO 0.00 0.55 0.01 -0.83 -2.81 0.00 0.00 174.94 171.86 2fnb s GLY 23 N 0.44 1.83 -0.02 1.50 0.00 -0.53 -0.79 107.32 109.75 2fnb s GLY 23 Ca -0.15 -0.79 0.02 0.00 0.00 0.00 0.00 44.72 43.80 2fnb s GLY 23 CO 0.06 -0.20 -0.05 1.08 0.00 0.00 0.00 173.10 173.99 2fnb s LEU 24 N -0.07 3.25 0.06 0.66 1.02 0.92 -0.20 118.68 124.33 2fnb s LEU 24 Ca 0.04 -0.07 0.08 0.00 0.02 0.00 0.00 54.13 54.19 2fnb s LEU 24 Cb -0.13 -1.82 -0.03 0.00 0.02 0.00 0.00 46.19 44.23 2fnb s LEU 24 CO 0.02 0.31 -0.21 -0.60 0.02 0.00 0.00 176.35 175.89 2fnb s ARG 25 N -1.27 1.31 0.05 1.70 3.52 0.54 -2.09 118.95 122.72 2fnb s ARG 25 Ca 0.16 -1.01 -0.00 0.00 -0.13 0.00 0.00 55.73 54.74 2fnb s ARG 25 Cb -0.11 -1.48 0.00 0.00 -1.56 0.00 0.00 34.95 31.80 2fnb s ARG 25 CO 0.06 0.37 0.08 -2.67 -0.81 0.00 0.00 175.30 172.33 2fnb n TRP 26 N 1.60 -0.66 -3.52 5.12 2.14 -0.74 -0.83 117.44 120.56 2fnb n TRP 26 Ca -0.18 -0.34 -0.42 0.00 2.07 0.00 0.00 57.50 58.63 2fnb n TRP 26 Cb 0.53 0.09 -0.10 0.00 -0.81 0.00 0.00 31.31 31.02 2fnb n TRP 26 CO 0.00 0.00 0.00 0.99 2.07 0.00 0.00 177.69 180.75 2fnb s THR 27 N -2.53 4.74 0.34 -1.67 2.01 -1.26 -4.65 115.64 112.62 2fnb s THR 27 Ca 0.04 -1.05 -0.28 0.00 0.31 0.00 0.00 61.69 60.71 2fnb s THR 27 Cb -0.00 -3.77 -0.12 0.00 0.01 0.00 0.00 72.50 68.62 2fnb s THR 27 CO 0.03 -0.42 1.37 -0.81 -0.69 0.00 0.00 174.62 174.10 2fnb n PRO 28 N 5.05 2.32 -2.97 4.92 -0.04 -1.26 -4.92 135.00 138.10 2fnb n PRO 28 Ca -0.11 0.81 -0.43 0.00 -0.04 0.00 0.00 63.50 63.73 2fnb n PRO 28 Cb 0.45 -2.45 -0.05 0.00 -0.04 0.00 0.00 33.50 31.40 2fnb n PRO 28 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2fnb s LEU 29 N -1.25 4.31 0.00 1.53 1.02 -1.26 -4.96 118.68 118.07 2fnb s LEU 29 Ca 0.56 -0.24 0.00 0.00 0.02 0.00 0.00 54.13 54.47 2fnb s LEU 29 Cb -0.54 -2.88 0.00 0.00 0.02 0.00 0.00 46.19 42.79 2fnb s LEU 29 CO 0.61 -0.95 0.58 0.59 0.02 0.00 0.00 176.35 177.20 2fnb n ASN 30 N 6.75 1.69 -4.82 2.29 3.02 -1.26 -4.66 115.26 118.27 2fnb n ASN 30 Ca 0.01 -1.27 -0.33 0.00 -0.03 0.00 0.00 54.58 52.96 2fnb n ASN 30 Cb 0.48 -0.32 -0.06 0.00 -0.61 0.00 0.00 39.78 39.27 2fnb n ASN 30 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2fnb s SER 31 N 0.77 6.83 0.03 6.41 0.01 -1.26 -4.99 113.70 121.50 2fnb s SER 31 Ca 0.00 1.71 -0.02 0.00 1.31 0.00 0.00 55.95 58.95 2fnb s SER 31 Cb 0.00 -2.54 -0.27 0.00 0.21 0.00 0.00 66.02 63.42 2fnb s SER 31 CO 0.00 -0.44 0.97 0.77 0.41 0.00 0.00 173.24 174.95 2fnb h SER 32 N 1.76 0.34 1.03 2.44 4.64 -1.99 -3.37 113.55 118.40 2fnb h SER 32 Ca -0.49 -0.44 0.00 0.00 -0.47 0.00 0.00 61.79 60.39 2fnb h SER 32 Cb 1.19 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2fnb h SER 32 CO 0.61 1.36 0.00 0.41 -0.87 0.00 0.00 176.83 178.34 2fnb n THR 33 N -3.44 0.44 -1.53 2.95 -1.04 -1.26 -4.65 114.28 105.75 2fnb n THR 33 Ca -0.13 -0.02 -0.36 0.00 -2.04 0.00 0.00 64.05 61.51 2fnb n THR 33 Cb 1.03 -0.69 0.09 0.00 -1.82 0.00 0.00 70.33 68.94 2fnb n THR 33 CO 0.00 0.00 0.00 -0.51 -0.64 0.00 0.00 175.07 173.92 2fnb s ILE 34 N -3.07 2.09 -0.04 12.58 2.07 -1.26 -2.82 121.20 130.75 2fnb s ILE 34 Ca 0.11 0.05 -0.02 0.00 -1.41 0.00 0.00 60.65 59.37 2fnb s ILE 34 Cb 0.14 -2.81 -0.01 0.00 0.13 0.00 0.00 42.46 39.92 2fnb s ILE 34 CO 0.49 -0.02 -0.05 -0.38 -1.91 0.00 0.00 174.94 173.07 2fnb n ILE 35 N -2.40 0.36 -2.74 2.00 -0.00 -1.10 -4.92 119.36 110.57 2fnb n ILE 35 Ca 0.15 0.43 0.00 0.00 -0.00 0.00 0.00 62.75 63.32 2fnb n ILE 35 Cb 0.49 -1.73 0.00 0.00 -0.00 0.00 0.00 39.64 38.40 2fnb n ILE 35 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2fnb n GLY 36 N 1.70 1.48 3.10 7.39 0.00 -1.20 -4.17 105.19 113.49 2fnb n GLY 36 Ca -0.02 -0.67 -0.21 0.00 0.00 0.00 0.00 46.02 45.12 2fnb n GLY 36 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2fnb s TYR 37 N -2.56 1.14 -0.21 1.61 2.02 -1.26 -2.58 117.35 115.51 2fnb s TYR 37 Ca 0.00 -0.26 -0.01 0.00 -0.37 0.00 0.00 57.07 56.43 2fnb s TYR 37 Cb 0.00 -0.71 0.02 0.00 -0.40 0.00 0.00 41.96 40.87 2fnb s TYR 37 CO 0.00 -0.00 -0.13 0.50 -1.57 0.00 0.00 175.55 174.35 2fnb s ARG 38 N -0.60 2.98 0.07 -0.62 3.00 -0.03 -1.83 118.95 121.92 2fnb s ARG 38 Ca 0.03 -0.86 -0.12 0.00 -1.00 0.00 0.00 55.73 53.79 2fnb s ARG 38 Cb -0.06 -2.79 -0.06 0.00 0.00 0.00 0.00 34.95 32.04 2fnb s ARG 38 CO 0.00 -0.28 0.43 0.42 0.00 0.00 0.00 175.30 175.87 2fnb s ILE 39 N 1.33 5.03 -0.03 4.11 1.09 -0.21 -1.01 121.20 131.50 2fnb s ILE 39 Ca 0.03 0.63 -0.01 0.00 -1.10 0.00 0.00 60.65 60.19 2fnb s ILE 39 Cb -0.15 -3.68 0.02 0.00 -1.06 0.00 0.00 42.46 37.60 2fnb s ILE 39 CO -0.08 0.36 0.06 -0.89 -0.10 0.00 0.00 174.94 174.29 2fnb s THR 40 N -1.33 -0.04 -0.11 2.92 2.01 0.22 -1.15 115.64 118.16 2fnb s THR 40 Ca 0.31 0.13 -0.03 0.00 0.31 0.00 0.00 61.69 62.41 2fnb s THR 40 Cb -0.15 -0.11 -0.03 0.00 0.01 0.00 0.00 72.50 72.21 2fnb s THR 40 CO 0.17 0.05 0.03 0.68 -0.69 0.00 0.00 174.62 174.86 2fnb s VAL 41 N 0.73 4.54 0.16 3.82 -7.23 -0.01 -0.50 120.40 121.90 2fnb s VAL 41 Ca -0.06 -0.15 0.01 0.00 -1.81 0.00 0.00 61.98 59.97 2fnb s VAL 41 Cb -0.08 -2.94 -0.04 0.00 0.56 0.00 0.00 36.38 33.87 2fnb s VAL 41 CO -0.03 0.58 0.02 0.68 -0.31 0.00 0.00 175.10 176.05 2fnb s VAL 42 N -0.67 0.50 -0.27 1.32 -7.23 -0.83 -1.45 120.40 111.77 2fnb s VAL 42 Ca 0.11 -1.96 -0.29 0.00 -1.81 0.00 0.00 61.98 58.03 2fnb s VAL 42 Cb -0.12 -2.10 0.01 0.00 0.56 0.00 0.00 36.38 34.73 2fnb s VAL 42 CO 0.02 -0.47 1.13 0.00 -0.31 0.00 0.00 175.10 175.47 2fnb s ALA 43 N -3.78 3.55 0.00 1.32 0.00 -0.02 -1.11 121.76 121.73 2fnb s ALA 43 Ca 0.24 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.30 2fnb s ALA 43 Cb 0.07 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.54 2fnb s ALA 43 CO 0.03 -1.37 0.00 0.00 0.00 0.00 0.00 175.76 174.42 2fnb n ALA 44 N 6.81 0.00 1.53 0.00 0.00 0.36 -1.79 120.51 127.41 2fnb n ALA 44 Ca 0.13 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.67 2fnb n ALA 44 Cb 0.46 0.00 0.44 0.00 0.00 0.00 0.00 19.45 20.35 2fnb n ALA 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fnb n GLY 45 N 0.00 -0.22 0.24 0.00 0.00 -1.26 -4.33 105.19 99.62 2fnb n GLY 45 Ca 0.00 -0.30 0.15 0.00 0.00 0.00 0.00 46.02 45.87 2fnb n GLY 45 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2fnb n GLU 46 N -0.11 1.32 0.00 1.61 0.28 -0.74 -4.90 120.64 118.10 2fnb n GLU 46 Ca 0.15 -0.49 0.00 0.00 -0.16 0.00 0.00 57.16 56.66 2fnb n GLU 46 Cb 0.23 -1.49 0.00 0.00 1.43 0.00 0.00 31.44 31.61 2fnb n GLU 46 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2fnb n GLY 47 N 1.10 2.40 3.43 -1.84 0.00 -1.23 -4.95 105.19 104.09 2fnb n GLY 47 Ca 0.21 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.75 2fnb n GLY 47 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2fnb n ILE 48 N -1.90 0.04 -1.85 -0.61 5.41 -1.26 -4.92 119.36 114.27 2fnb n ILE 48 Ca 0.00 -0.19 -0.31 0.00 1.00 0.00 0.00 62.75 63.25 2fnb n ILE 48 Cb 0.00 -1.15 0.01 0.00 -0.71 0.00 0.00 39.64 37.80 2fnb n ILE 48 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2fnb s PRO 49 N 7.36 3.54 0.01 0.38 0.04 -1.26 -0.84 135.00 144.22 2fnb s PRO 49 Ca 1.19 0.78 0.00 0.00 0.04 0.00 0.00 61.00 63.01 2fnb s PRO 49 Cb -1.05 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 31.41 2fnb s PRO 49 CO 0.50 -0.62 0.00 -0.89 0.04 0.00 0.00 177.00 176.03 2fnb n ILE 50 N -2.76 0.07 -3.61 0.56 -0.00 -0.53 -4.81 119.36 108.30 2fnb n ILE 50 Ca 0.06 0.02 -0.08 0.00 -0.00 0.00 0.00 62.75 62.76 2fnb n ILE 50 Cb 0.54 -1.03 -0.02 0.00 -0.00 0.00 0.00 39.64 39.13 2fnb n ILE 50 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.55 176.67 2fnb s PHE 51 N -1.06 -0.32 0.01 1.39 5.36 -1.17 -5.03 117.98 117.17 2fnb s PHE 51 Ca 0.00 0.06 0.01 0.00 -0.96 0.00 0.00 56.93 56.04 2fnb s PHE 51 Cb 0.00 0.60 -0.01 0.00 -0.34 0.00 0.00 43.02 43.27 2fnb s PHE 51 CO 0.00 -0.83 -0.04 -1.83 -1.46 0.00 0.00 175.22 171.06 2fnb s GLU 52 N -3.49 0.29 0.18 10.12 1.03 -1.26 -0.83 118.70 124.74 2fnb s GLU 52 Ca 0.07 -0.37 0.02 0.00 0.03 0.00 0.00 54.97 54.72 2fnb s GLU 52 Cb -0.02 -0.13 -0.05 0.00 -0.80 0.00 0.00 34.13 33.14 2fnb s GLU 52 CO -0.04 0.02 0.01 0.34 -1.33 0.00 0.00 175.26 174.25 2fnb s ASP 53 N -0.76 1.22 0.06 0.83 -1.08 -0.30 -4.99 116.67 111.65 2fnb s ASP 53 Ca -0.06 -1.18 0.02 0.00 -0.52 0.00 0.00 52.55 50.81 2fnb s ASP 53 Cb -0.05 0.12 -0.03 0.00 -1.46 0.00 0.00 42.92 41.50 2fnb s ASP 53 CO -0.00 -0.57 -0.08 0.12 0.52 0.00 0.00 175.17 175.16 2fnb s PHE 54 N -3.66 0.76 0.36 -5.34 2.19 -1.26 -1.05 117.98 109.98 2fnb s PHE 54 Ca 0.25 -0.60 0.02 0.00 0.33 0.00 0.00 56.93 56.93 2fnb s PHE 54 Cb 0.06 -0.45 -0.01 0.00 -1.31 0.00 0.00 43.02 41.32 2fnb s PHE 54 CO 0.04 -0.09 0.07 1.33 1.83 0.00 0.00 175.22 178.40 2fnb n VAL 55 N 1.08 0.00 -0.06 3.12 0.24 -0.76 -5.00 118.33 116.94 2fnb n VAL 55 Ca -0.20 -1.93 -0.08 0.00 -2.04 0.00 0.00 64.34 60.10 2fnb n VAL 55 Cb 0.56 0.57 -0.07 0.00 -1.47 0.00 0.00 33.84 33.43 2fnb n VAL 55 CO 0.00 0.00 0.00 -0.78 -2.14 0.00 0.00 176.83 173.91 2fnb h ASP 56 N 1.18 0.00 0.00 -1.34 3.58 -1.90 -3.36 116.42 114.58 2fnb h ASP 56 Ca -0.29 -0.50 0.00 0.00 0.42 0.00 0.00 57.03 56.66 2fnb h ASP 56 Cb 1.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.05 2fnb h ASP 56 CO 0.47 0.78 0.00 -1.54 -2.88 0.00 0.00 179.24 176.07 2fnb n SER 57 N -4.68 0.00 -0.00 2.28 3.41 -1.26 -4.63 113.62 108.73 2fnb n SER 57 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 2fnb n SER 57 Cb 0.26 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 2fnb n SER 57 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2fnb n SER 58 N 0.00 1.64 -4.74 4.04 3.41 -1.26 -4.37 113.62 112.34 2fnb n SER 58 Ca 0.00 -1.85 -0.41 0.00 -0.26 0.00 0.00 58.87 56.35 2fnb n SER 58 Cb 0.00 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 63.90 2fnb n SER 58 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2fnb s VAL 59 N -0.87 3.72 0.00 -3.33 1.01 -1.26 -4.83 120.40 114.84 2fnb s VAL 59 Ca 0.01 1.55 0.00 0.00 0.00 0.00 0.00 61.98 63.54 2fnb s VAL 59 Cb 0.01 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 32.40 2fnb s VAL 59 CO 0.00 0.30 0.47 0.61 0.00 0.00 0.00 175.10 176.48 2fnb n GLY 60 N 1.79 -0.80 2.99 4.51 0.00 -1.26 -4.01 105.19 108.40 2fnb n GLY 60 Ca 0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.90 2fnb n GLY 60 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2fnb s TYR 61 N -0.08 -0.33 0.02 1.61 5.04 -1.26 -1.79 117.35 120.55 2fnb s TYR 61 Ca 0.00 0.82 -0.00 0.00 -2.44 0.00 0.00 57.07 55.45 2fnb s TYR 61 Cb 0.00 -0.05 -0.02 0.00 0.35 0.00 0.00 41.96 42.24 2fnb s TYR 61 CO 0.00 -0.29 -0.02 -0.47 -1.34 0.00 0.00 175.55 173.43 2fnb s TYR 62 N 1.95 0.29 -0.07 4.97 5.04 -0.89 -5.01 117.35 123.63 2fnb s TYR 62 Ca -0.02 -0.59 0.01 0.00 -2.44 0.00 0.00 57.07 54.03 2fnb s TYR 62 Cb -0.11 -0.21 0.02 0.00 0.35 0.00 0.00 41.96 42.00 2fnb s TYR 62 CO -0.08 -0.22 -0.08 0.99 -1.34 0.00 0.00 175.55 174.82 2fnb s THR 63 N -1.77 0.89 0.39 4.34 2.01 -1.26 -0.06 115.64 120.17 2fnb s THR 63 Ca -0.13 -0.29 -0.13 0.00 0.31 0.00 0.00 61.69 61.45 2fnb s THR 63 Cb -0.08 -0.87 -0.07 0.00 0.01 0.00 0.00 72.50 71.48 2fnb s THR 63 CO -0.02 0.32 0.78 -0.69 -0.69 0.00 0.00 174.62 174.31 2fnb s VAL 64 N 1.09 4.72 0.35 3.82 1.01 0.03 -4.94 120.40 126.48 2fnb s VAL 64 Ca -0.07 0.79 0.05 0.00 0.00 0.00 0.00 61.98 62.74 2fnb s VAL 64 Cb -0.14 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 2fnb s VAL 64 CO -0.01 -0.42 0.18 -0.89 0.00 0.00 0.00 175.10 173.97 2fnb s THR 65 N -2.26 0.33 0.00 3.92 2.01 -1.26 -2.24 115.64 116.14 2fnb s THR 65 Ca 0.53 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 60.53 2fnb s THR 65 Cb -0.10 -2.45 0.00 0.00 0.01 0.00 0.00 72.50 69.96 2fnb s THR 65 CO 0.26 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.80 2fnb n GLY 66 N -0.71 0.65 3.71 4.40 0.00 -1.26 -5.01 105.19 106.96 2fnb n GLY 66 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2fnb n GLY 66 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2fnb s LEU 67 N 0.00 2.93 -0.04 0.99 0.20 -1.26 -5.05 118.68 116.45 2fnb s LEU 67 Ca 0.00 2.07 0.00 0.00 0.69 0.00 0.00 54.13 56.89 2fnb s LEU 67 Cb 0.00 -4.55 0.03 0.00 -0.43 0.00 0.00 46.19 41.23 2fnb s LEU 67 CO 0.00 -2.69 -0.00 -0.70 -0.29 0.00 0.00 176.35 172.67 2fnb s GLU 68 N -4.71 0.41 1.06 1.98 2.56 -1.26 -4.94 118.70 113.79 2fnb s GLU 68 Ca 0.65 0.07 -0.14 0.00 0.00 0.00 0.00 54.97 55.56 2fnb s GLU 68 Cb -0.21 -0.62 0.22 0.00 2.00 0.00 0.00 34.13 35.52 2fnb s GLU 68 CO 0.57 -0.17 1.10 -1.25 -0.56 0.00 0.00 175.26 174.95 2fnb s PRO 69 N 1.23 -0.03 0.00 4.30 0.04 -1.26 -4.49 135.00 134.79 2fnb s PRO 69 Ca -0.07 0.37 0.00 0.00 0.04 0.00 0.00 61.00 61.35 2fnb s PRO 69 Cb -0.13 -1.70 0.00 0.00 0.04 0.00 0.00 34.50 32.71 2fnb s PRO 69 CO -0.02 -3.01 0.00 0.41 0.04 0.00 0.00 177.00 174.42 2fnb n GLY 70 N -1.01 1.09 3.34 0.56 0.00 -1.26 -5.05 105.19 102.85 2fnb n GLY 70 Ca 0.07 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.91 2fnb n GLY 70 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fnb s ILE 71 N -2.14 1.44 -0.18 -0.61 -1.09 -1.26 -5.11 121.20 112.24 2fnb s ILE 71 Ca 0.00 -2.12 -0.18 0.00 -2.23 0.00 0.00 60.65 56.12 2fnb s ILE 71 Cb 0.00 -2.14 -0.04 0.00 -1.58 0.00 0.00 42.46 38.70 2fnb s ILE 71 CO 0.00 -0.52 0.48 -0.62 -1.23 0.00 0.00 174.94 173.06 2fnb s ASP 72 N -3.30 6.57 -0.04 3.58 2.15 -1.26 -3.86 116.67 120.50 2fnb s ASP 72 Ca 0.24 0.68 -0.00 0.00 0.43 0.00 0.00 52.55 53.89 2fnb s ASP 72 Cb 0.02 -2.28 -0.03 0.00 -0.30 0.00 0.00 42.92 40.33 2fnb s ASP 72 CO 0.07 -0.11 0.00 -0.31 -0.17 0.00 0.00 175.17 174.65 2fnb s TYR 73 N 1.32 3.13 -0.40 -5.34 1.51 0.44 -0.49 117.35 117.51 2fnb s TYR 73 Ca 0.23 0.14 -0.16 0.00 -1.01 0.00 0.00 57.07 56.28 2fnb s TYR 73 Cb -0.15 -1.73 0.02 0.00 -0.11 0.00 0.00 41.96 39.98 2fnb s TYR 73 CO 0.09 0.47 0.36 -0.51 -1.11 0.00 0.00 175.55 174.85 2fnb s ASP 74 N -1.24 6.15 -0.47 2.29 1.11 -0.27 -1.93 116.67 122.31 2fnb s ASP 74 Ca 0.17 -0.71 -0.13 0.00 0.18 0.00 0.00 52.55 52.06 2fnb s ASP 74 Cb -0.11 -2.19 0.09 0.00 1.07 0.00 0.00 42.92 41.78 2fnb s ASP 74 CO 0.07 -0.48 0.37 -0.63 1.18 0.00 0.00 175.17 175.68 2fnb s ILE 75 N 1.90 4.79 0.12 0.77 1.09 -0.29 -1.97 121.20 127.62 2fnb s ILE 75 Ca 0.09 -1.37 -0.11 0.00 -1.10 0.00 0.00 60.65 58.16 2fnb s ILE 75 Cb -0.18 -3.97 -0.06 0.00 -1.06 0.00 0.00 42.46 37.19 2fnb s ILE 75 CO 0.12 -0.66 0.45 -0.94 -0.10 0.00 0.00 174.94 173.81 2fnb s SER 76 N 2.71 6.68 -0.43 3.58 1.04 0.35 -2.60 113.70 125.03 2fnb s SER 76 Ca 0.04 0.87 0.07 0.00 0.48 0.00 0.00 55.95 57.40 2fnb s SER 76 Cb -0.26 -2.21 0.23 0.00 0.10 0.00 0.00 66.02 63.89 2fnb s SER 76 CO 0.03 0.12 0.60 0.52 0.98 0.00 0.00 173.24 175.50 2fnb n VAL 77 N 0.71 -0.55 -2.99 5.02 0.31 -1.26 -0.61 118.33 118.96 2fnb n VAL 77 Ca -0.06 -3.10 -0.40 0.00 -0.01 0.00 0.00 64.34 60.78 2fnb n VAL 77 Cb 0.52 -0.85 -0.05 0.00 -0.91 0.00 0.00 33.84 32.55 2fnb n VAL 77 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2fnb s ILE 78 N -0.40 4.73 0.11 2.52 1.01 -0.18 -4.66 121.20 124.34 2fnb s ILE 78 Ca 0.34 1.62 -0.17 0.00 0.00 0.00 0.00 60.65 62.44 2fnb s ILE 78 Cb 0.16 -4.11 -0.07 0.00 0.01 0.00 0.00 42.46 38.44 2fnb s ILE 78 CO -0.15 0.37 0.57 -0.89 0.00 0.00 0.00 174.94 174.83 2fnb s THR 79 N -0.08 4.78 -0.02 2.92 2.01 -1.26 -0.85 115.64 123.14 2fnb s THR 79 Ca 0.38 1.05 0.04 0.00 0.31 0.00 0.00 61.69 63.47 2fnb s THR 79 Cb -0.20 -3.82 -0.01 0.00 0.01 0.00 0.00 72.50 68.48 2fnb s THR 79 CO 0.23 0.40 -0.14 -1.48 -0.69 0.00 0.00 174.62 172.93 2fnb s LEU 80 N -1.54 1.95 0.00 4.42 2.34 -1.06 -1.30 118.68 123.48 2fnb s LEU 80 Ca 0.34 -0.27 0.00 0.00 0.06 0.00 0.00 54.13 54.26 2fnb s LEU 80 Cb -0.17 -0.76 0.00 0.00 -0.56 0.00 0.00 46.19 44.70 2fnb s LEU 80 CO 0.19 0.15 0.00 2.30 -1.06 0.00 0.00 176.35 177.93 2fnb n ILE 81 N 2.94 0.00 -0.95 1.48 -5.35 -0.17 -2.70 119.36 114.61 2fnb n ILE 81 Ca -0.16 0.00 -0.37 0.00 -0.27 0.00 0.00 62.75 61.95 2fnb n ILE 81 Cb 0.54 0.00 -0.09 0.00 -1.74 0.00 0.00 39.64 38.35 2fnb n ILE 81 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 2fnb n ASN 82 N -2.16 0.40 -4.04 7.28 5.15 -1.13 -2.34 115.26 118.42 2fnb n ASN 82 Ca 0.00 0.34 -0.33 0.00 -0.60 0.00 0.00 54.58 53.99 2fnb n ASN 82 Cb 0.00 -0.64 -0.07 0.00 -0.53 0.00 0.00 39.78 38.54 2fnb n ASN 82 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2fnb n GLY 83 N 4.99 -0.27 3.66 8.20 0.00 -1.26 -4.86 105.19 115.66 2fnb n GLY 83 Ca 0.42 0.09 -0.06 0.00 0.00 0.00 0.00 46.02 46.46 2fnb n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fnb s GLY 84 N -3.26 -0.32 0.22 -0.02 0.00 -0.99 -5.17 107.32 97.78 2fnb s GLY 84 Ca 0.50 0.38 0.11 0.00 0.00 0.00 0.00 44.72 45.71 2fnb s GLY 84 CO 0.85 0.11 -0.22 -0.54 0.00 0.00 0.00 173.10 173.30 2fnb s GLU 85 N -3.35 1.59 0.02 2.90 2.02 -1.26 -1.00 118.70 119.62 2fnb s GLU 85 Ca 0.09 -1.59 -0.00 0.00 0.02 0.00 0.00 54.97 53.49 2fnb s GLU 85 Cb -0.02 -1.84 0.00 0.00 0.10 0.00 0.00 34.13 32.38 2fnb s GLU 85 CO -0.02 0.38 0.02 0.43 0.02 0.00 0.00 175.26 176.09 2fnb n SER 86 N -0.02 0.01 -4.81 -0.19 7.64 -0.42 -4.68 113.62 111.15 2fnb n SER 86 Ca -0.10 -1.01 -0.32 0.00 1.01 0.00 0.00 58.87 58.44 2fnb n SER 86 Cb 0.57 -0.02 0.02 0.00 -1.01 0.00 0.00 64.21 63.77 2fnb n SER 86 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2fnb s ALA 87 N -3.59 2.74 -0.58 -0.43 0.00 -1.26 -4.86 121.76 113.77 2fnb s ALA 87 Ca 0.01 0.34 -0.28 0.00 0.00 0.00 0.00 51.96 52.03 2fnb s ALA 87 Cb -0.00 -3.22 0.02 0.00 0.00 0.00 0.00 23.12 19.92 2fnb s ALA 87 CO 0.01 -0.87 1.27 -1.25 0.00 0.00 0.00 175.76 174.93 2fnb s PRO 88 N -4.23 3.43 -1.24 0.00 0.04 -1.26 -4.69 135.00 127.05 2fnb s PRO 88 Ca 0.63 0.30 -0.11 0.00 0.04 0.00 0.00 61.00 61.85 2fnb s PRO 88 Cb -0.16 -4.06 0.17 0.00 0.04 0.00 0.00 34.50 30.50 2fnb s PRO 88 CO 0.40 -1.79 1.66 2.41 0.04 0.00 0.00 177.00 179.72 2fnb n THR 89 N 6.72 4.33 -3.29 1.26 -1.04 -1.26 -4.98 114.28 116.03 2fnb n THR 89 Ca 0.10 -4.59 -0.41 0.00 -2.04 0.00 0.00 64.05 57.11 2fnb n THR 89 Cb 0.49 -2.40 -0.08 0.00 -1.82 0.00 0.00 70.33 66.52 2fnb n THR 89 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2fnb s THR 90 N 0.84 5.06 0.05 12.58 2.01 -1.26 -4.42 115.64 130.50 2fnb s THR 90 Ca 0.41 0.29 -0.08 0.00 0.31 0.00 0.00 61.69 62.61 2fnb s THR 90 Cb 0.04 -3.92 -0.05 0.00 0.01 0.00 0.00 72.50 68.58 2fnb s THR 90 CO 0.01 -0.16 0.34 -0.76 -0.69 0.00 0.00 174.62 173.35 2fnb s LEU 91 N 2.28 4.36 -0.13 4.42 1.43 -1.07 -4.92 118.68 125.04 2fnb s LEU 91 Ca 0.17 0.69 -0.05 0.00 -1.03 0.00 0.00 54.13 53.91 2fnb s LEU 91 Cb -0.16 -2.86 -0.04 0.00 0.03 0.00 0.00 46.19 43.17 2fnb s LEU 91 CO 0.13 0.20 0.04 -0.89 0.23 0.00 0.00 176.35 176.06 2fnb s THR 92 N -1.36 4.63 0.25 5.49 2.01 -1.26 -1.14 115.64 124.26 2fnb s THR 92 Ca 0.31 -0.11 -0.16 0.00 0.31 0.00 0.00 61.69 62.04 2fnb s THR 92 Cb -0.14 -3.02 0.01 0.00 0.01 0.00 0.00 72.50 69.36 2fnb s THR 92 CO 0.17 0.55 0.56 -1.58 -0.69 0.00 0.00 174.62 173.64 2fnb s GLN 93 N -0.34 1.59 -0.07 4.92 2.00 -0.82 -5.01 119.66 121.95 2fnb s GLN 93 Ca 0.08 -1.10 -0.13 0.00 -2.00 0.00 0.00 55.36 52.22 2fnb s GLN 93 Cb -0.12 0.53 -0.05 0.00 0.80 0.00 0.00 33.01 34.16 2fnb s GLN 93 CO 0.02 -0.69 0.33 -1.14 -0.50 0.00 0.00 175.29 173.30 2fnb s GLN 94 N -3.96 3.89 0.00 1.67 0.74 -1.26 -0.42 119.66 120.32 2fnb s GLN 94 Ca 0.16 0.22 0.00 0.00 0.05 0.00 0.00 55.36 55.80 2fnb s GLN 94 Cb -0.02 -3.26 0.00 0.00 1.10 0.00 0.00 33.01 30.82 2fnb s GLN 94 CO 0.06 0.60 0.00 2.41 -0.55 0.00 0.00 175.29 177.81