#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fnb s ARG 2 N 0.00 0.91 0.40 3.17 1.70 -1.26 -5.14 118.95 118.73 2fnb s ARG 2 Ca 0.00 -1.18 -0.27 0.00 -0.47 0.00 0.00 55.73 53.81 2fnb s ARG 2 Cb 0.00 0.30 -0.10 0.00 -0.57 0.00 0.00 34.95 34.59 2fnb s ARG 2 CO 0.00 -0.28 1.42 0.20 -1.08 0.00 0.00 175.30 175.56 2fnb s GLY 3 N -2.95 2.94 -0.84 3.88 0.00 -1.26 -3.93 107.32 105.17 2fnb s GLY 3 Ca 0.13 1.46 -0.03 0.00 0.00 0.00 0.00 44.72 46.28 2fnb s GLY 3 CO -0.05 2.10 0.65 -1.14 0.00 0.00 0.00 173.10 174.66 2fnb n SER 4 N 0.19 -5.77 -0.07 1.64 3.41 -1.26 -4.88 113.62 106.88 2fnb n SER 4 Ca 0.03 -0.71 -0.15 0.00 -0.26 0.00 0.00 58.87 57.78 2fnb n SER 4 Cb 0.41 -2.91 -0.10 0.00 -0.26 0.00 0.00 64.21 61.35 2fnb n SER 4 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2fnb h GLU 5 N -0.24 -0.48 -3.64 4.33 4.22 -1.99 -3.39 114.58 113.39 2fnb h GLU 5 Ca -0.45 0.03 -0.28 0.00 0.08 0.00 0.00 59.36 58.75 2fnb h GLU 5 Cb 1.28 0.11 -0.32 0.00 0.50 0.00 0.00 28.75 30.32 2fnb h GLU 5 CO 0.36 -0.32 -0.73 0.08 -2.18 0.00 0.00 179.01 176.22 2fnb s VAL 6 N -5.67 -0.01 0.33 0.32 1.01 -1.26 -5.04 120.40 110.08 2fnb s VAL 6 Ca -0.15 0.11 -0.26 0.00 0.00 0.00 0.00 61.98 61.68 2fnb s VAL 6 Cb 0.08 -0.07 -0.10 0.00 0.00 0.00 0.00 36.38 36.29 2fnb s VAL 6 CO 0.61 0.06 0.99 -2.16 0.00 0.00 0.00 175.10 174.60 2fnb s PRO 7 N 0.63 4.50 0.62 2.72 0.04 -1.26 -4.42 135.00 137.82 2fnb s PRO 7 Ca -0.05 1.45 0.02 0.00 0.04 0.00 0.00 61.00 62.46 2fnb s PRO 7 Cb -0.08 -2.81 0.08 0.00 0.04 0.00 0.00 34.50 31.73 2fnb s PRO 7 CO -0.02 0.18 0.86 1.14 0.04 0.00 0.00 177.00 179.19 2fnb s GLN 8 N -2.03 2.16 -1.12 4.56 -2.07 -1.26 -4.70 119.66 115.19 2fnb s GLN 8 Ca 0.51 -1.10 -0.21 0.00 -1.82 0.00 0.00 55.36 52.74 2fnb s GLN 8 Cb -0.22 -2.47 0.03 0.00 -1.09 0.00 0.00 33.01 29.26 2fnb s GLN 8 CO 0.28 -1.02 1.67 -0.51 -1.32 0.00 0.00 175.29 174.39 2fnb s LEU 9 N -4.88 3.53 0.39 2.60 1.43 -1.26 -4.82 118.68 115.68 2fnb s LEU 9 Ca 0.62 -1.73 0.10 0.00 -1.03 0.00 0.00 54.13 52.08 2fnb s LEU 9 Cb -0.07 -2.57 0.89 0.00 0.03 0.00 0.00 46.19 44.46 2fnb s LEU 9 CO 0.41 -1.71 1.95 0.74 0.23 0.00 0.00 176.35 177.96 2fnb h THR 10 N 6.35 0.93 0.00 5.49 2.02 -1.96 -1.84 112.91 123.90 2fnb h THR 10 Ca 0.28 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 67.26 2fnb h THR 10 Cb 0.95 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 2fnb h THR 10 CO 1.39 0.11 0.00 -0.67 0.37 0.00 0.00 175.52 176.72 2fnb n ASP 11 N -4.49 0.00 -4.56 4.18 2.03 -1.26 -4.83 116.55 107.62 2fnb n ASP 11 Ca 0.12 -1.14 -0.46 0.00 0.52 0.00 0.00 54.79 53.84 2fnb n ASP 11 Cb 0.34 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.70 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 -0.70 2.95 -4.42 -2.67 -0.00 -0.69 -4.05 117.00 107.42 2fnb n LEU 12 Ca 0.07 0.31 -0.21 0.00 -0.00 0.00 0.00 56.01 56.18 2fnb n LEU 12 Cb 0.03 -1.46 -0.10 0.00 -0.00 0.00 0.00 43.42 41.89 2fnb n LEU 12 CO 0.05 -0.66 -0.37 -0.94 -0.00 0.00 0.00 177.39 175.48 2fnb s SER 13 N 7.77 2.72 0.53 1.96 1.04 -0.05 -5.01 113.70 122.67 2fnb s SER 13 Ca 1.03 -1.18 -0.02 0.00 0.48 0.00 0.00 55.95 56.26 2fnb s SER 13 Cb -0.51 -0.16 0.01 0.00 0.10 0.00 0.00 66.02 65.46 2fnb s SER 13 CO 0.40 -0.33 0.78 -0.36 0.98 0.00 0.00 173.24 174.71 2fnb s PHE 14 N -3.02 3.13 0.32 5.02 0.08 -1.26 -1.04 117.98 121.21 2fnb s PHE 14 Ca 0.29 0.31 -0.01 0.00 0.12 0.00 0.00 56.93 57.64 2fnb s PHE 14 Cb 0.03 -2.59 -0.01 0.00 -0.57 0.00 0.00 43.02 39.88 2fnb s PHE 14 CO 0.11 -0.68 0.39 0.14 -0.10 0.00 0.00 175.22 175.09 2fnb s VAL 15 N -2.77 0.00 -1.14 -0.44 -7.23 -0.42 -4.68 120.40 103.72 2fnb s VAL 15 Ca 0.53 -1.72 -0.08 0.00 -1.81 0.00 0.00 61.98 58.90 2fnb s VAL 15 Cb -0.10 -2.56 -0.03 0.00 0.56 0.00 0.00 36.38 34.24 2fnb s VAL 15 CO 0.40 0.00 0.86 0.47 -0.31 0.00 0.00 175.10 176.52 2fnb n ASP 16 N -1.26 -4.76 -3.27 4.85 8.00 -1.26 -0.70 116.55 118.16 2fnb n ASP 16 Ca 0.02 -0.80 -0.36 0.00 0.71 0.00 0.00 54.79 54.36 2fnb n ASP 16 Cb 0.62 -4.52 -0.03 0.00 -0.02 0.00 0.00 41.12 37.17 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 -3.78 4.04 -1.07 0.53 2.08 -1.26 -3.21 119.36 116.70 2fnb n ILE 17 Ca -0.14 -2.40 -0.29 0.00 0.56 0.00 0.00 62.75 60.47 2fnb n ILE 17 Cb 0.63 -2.54 0.21 0.00 -0.75 0.00 0.00 39.64 37.19 2fnb n ILE 17 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 2fnb s THR 18 N 2.32 1.80 -0.31 1.39 -1.32 -1.24 -4.98 115.64 113.30 2fnb s THR 18 Ca 0.66 0.00 0.11 0.00 -1.21 0.00 0.00 61.69 61.25 2fnb s THR 18 Cb 0.17 -2.45 0.75 0.00 -1.51 0.00 0.00 72.50 69.46 2fnb s THR 18 CO -0.06 0.00 1.73 0.47 -2.21 0.00 0.00 174.62 174.55 2fnb n ASP 19 N -4.54 5.14 0.00 8.08 8.00 -1.26 -4.25 116.55 127.71 2fnb n ASP 19 Ca 0.09 -3.02 0.00 0.00 0.71 0.00 0.00 54.79 52.56 2fnb n ASP 19 Cb 0.58 -0.71 0.00 0.00 -0.02 0.00 0.00 41.12 40.97 2fnb n ASP 19 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2fnb n SER 20 N 0.25 1.73 0.00 -2.24 3.41 -1.26 -4.84 113.62 110.67 2fnb n SER 20 Ca 0.33 -0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 2fnb n SER 20 Cb 1.25 0.93 0.00 0.00 -0.26 0.00 0.00 64.21 66.13 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 -1.10 0.00 -4.01 4.04 3.41 -1.26 -4.39 113.62 110.31 2fnb n SER 21 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.49 2fnb n SER 21 Cb 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 63.83 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 0.36 0.39 -1.33 2.07 -1.20 -3.61 121.20 115.88 2fnb s ILE 22 Ca 0.00 -0.81 0.02 0.00 -1.41 0.00 0.00 60.65 58.45 2fnb s ILE 22 Cb 0.00 -0.42 -0.01 0.00 0.13 0.00 0.00 42.46 42.16 2fnb s ILE 22 CO 0.00 -0.31 0.58 -0.83 -1.91 0.00 0.00 174.94 172.48 2fnb s GLY 23 N -1.19 1.52 0.17 1.50 0.00 0.12 -0.83 107.32 108.61 2fnb s GLY 23 Ca -0.09 -1.15 0.06 0.00 0.00 0.00 0.00 44.72 43.54 2fnb s GLY 23 CO -0.00 -1.03 -0.13 1.08 0.00 0.00 0.00 173.10 173.02 2fnb s LEU 24 N -4.39 2.52 -0.06 0.66 1.02 0.60 -1.30 118.68 117.74 2fnb s LEU 24 Ca 0.45 -0.99 -0.04 0.00 0.02 0.00 0.00 54.13 53.58 2fnb s LEU 24 Cb -0.10 -0.52 0.02 0.00 0.02 0.00 0.00 46.19 45.62 2fnb s LEU 24 CO 0.35 -0.24 0.14 -0.60 0.02 0.00 0.00 176.35 176.03 2fnb s ARG 25 N -3.55 0.13 0.29 1.70 3.52 -0.21 -3.33 118.95 117.50 2fnb s ARG 25 Ca 0.18 0.26 -0.07 0.00 -0.13 0.00 0.00 55.73 55.98 2fnb s ARG 25 Cb 0.00 -0.03 0.03 0.00 -1.56 0.00 0.00 34.95 33.39 2fnb s ARG 25 CO 0.04 -0.08 0.50 -2.67 -0.81 0.00 0.00 175.30 172.28 2fnb n TRP 26 N 3.49 -1.66 -3.63 5.12 2.14 0.18 -0.87 117.44 122.21 2fnb n TRP 26 Ca -0.18 -1.61 -0.40 0.00 2.07 0.00 0.00 57.50 57.38 2fnb n TRP 26 Cb 0.56 0.58 -0.11 0.00 -0.81 0.00 0.00 31.31 31.53 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 -2.51 4.16 0.18 -1.67 2.01 -1.26 -4.56 115.64 112.00 2fnb s THR 27 Ca 0.17 -1.32 -0.31 0.00 0.31 0.00 0.00 61.69 60.54 2fnb s THR 27 Cb -0.02 -3.50 -0.10 0.00 0.01 0.00 0.00 72.50 68.88 2fnb s THR 27 CO 0.12 -0.43 1.55 -2.16 -0.69 0.00 0.00 174.62 173.01 2fnb s PRO 28 N 1.43 4.22 -0.91 4.92 0.04 -1.26 -4.94 135.00 138.50 2fnb s PRO 28 Ca 0.02 2.36 -0.16 0.00 0.04 0.00 0.00 61.00 63.26 2fnb s PRO 28 Cb -0.22 -3.14 0.17 0.00 0.04 0.00 0.00 34.50 31.35 2fnb s PRO 28 CO 0.03 -0.58 0.99 -0.51 0.04 0.00 0.00 177.00 176.97 2fnb s LEU 29 N 0.84 5.80 -0.05 -3.56 1.43 -1.26 -4.91 118.68 116.97 2fnb s LEU 29 Ca 0.68 -2.41 -0.05 0.00 -1.03 0.00 0.00 54.13 51.32 2fnb s LEU 29 Cb -0.43 -2.32 -0.23 0.00 0.03 0.00 0.00 46.19 43.24 2fnb s LEU 29 CO 0.34 -0.82 3.23 0.59 0.23 0.00 0.00 176.35 179.91 2fnb n ASN 30 N 5.32 4.71 -4.68 2.29 3.02 -1.26 -4.79 115.26 119.87 2fnb n ASN 30 Ca 0.20 -2.37 -0.42 0.00 -0.03 0.00 0.00 54.58 51.97 2fnb n ASN 30 Cb 0.48 -1.25 -0.03 0.00 -0.61 0.00 0.00 39.78 38.36 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 2.14 7.11 0.00 6.41 0.01 -1.26 -4.98 113.70 123.12 2fnb s SER 31 Ca 0.59 1.37 0.00 0.00 1.31 0.00 0.00 55.95 59.22 2fnb s SER 31 Cb 0.28 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.99 2fnb s SER 31 CO -0.00 -0.45 0.31 -1.54 0.41 0.00 0.00 173.24 171.97 2fnb n SER 32 N 5.23 0.85 0.00 2.44 3.41 -1.26 -1.25 113.62 123.04 2fnb n SER 32 Ca 0.07 -1.11 0.00 0.00 -0.26 0.00 0.00 58.87 57.58 2fnb n SER 32 Cb 0.48 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 2fnb n SER 32 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2fnb n THR 33 N 1.77 0.00 -0.67 6.66 5.66 -1.26 -5.12 114.28 121.32 2fnb n THR 33 Ca 0.00 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.69 2fnb n THR 33 Cb 0.08 0.00 0.17 0.00 -1.55 0.00 0.00 70.33 69.04 2fnb n THR 33 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2fnb n ILE 34 N 0.00 0.00 -0.02 1.09 0.00 -0.38 -0.66 119.36 119.39 2fnb n ILE 34 Ca 0.00 -0.08 -0.05 0.00 0.00 0.00 0.00 62.75 62.62 2fnb n ILE 34 Cb 0.00 -0.93 -0.02 0.00 0.00 0.00 0.00 39.64 38.69 2fnb n ILE 34 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 2fnb n ILE 35 N -4.24 1.33 -3.06 9.51 5.41 -1.02 -4.77 119.36 122.52 2fnb n ILE 35 Ca 0.10 0.24 0.00 0.00 1.00 0.00 0.00 62.75 64.09 2fnb n ILE 35 Cb 0.53 -1.95 0.00 0.00 -0.71 0.00 0.00 39.64 37.50 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 2.45 -0.88 3.12 7.39 0.00 -1.21 -4.24 105.19 111.81 2fnb n GLY 36 Ca -0.08 -0.72 -0.19 0.00 0.00 0.00 0.00 46.02 45.03 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 -3.00 1.10 -0.11 1.61 2.02 -1.26 -2.84 117.35 114.86 2fnb s TYR 37 Ca 0.00 -0.34 0.03 0.00 -0.37 0.00 0.00 57.07 56.39 2fnb s TYR 37 Cb 0.00 -0.66 -0.01 0.00 -0.40 0.00 0.00 41.96 40.90 2fnb s TYR 37 CO 0.00 0.02 -0.20 0.50 -1.57 0.00 0.00 175.55 174.29 2fnb s ARG 38 N -1.05 3.16 -0.10 -0.62 3.00 0.09 -2.17 118.95 121.25 2fnb s ARG 38 Ca 0.01 -0.81 0.01 0.00 -1.00 0.00 0.00 55.73 53.94 2fnb s ARG 38 Cb -0.07 -2.42 -0.02 0.00 0.00 0.00 0.00 34.95 32.44 2fnb s ARG 38 CO 0.01 0.20 -0.14 0.42 0.00 0.00 0.00 175.30 175.78 2fnb s ILE 39 N 0.33 2.97 -0.02 4.11 1.09 -0.07 -0.52 121.20 129.09 2fnb s ILE 39 Ca -0.16 -0.71 0.04 0.00 -1.10 0.00 0.00 60.65 58.72 2fnb s ILE 39 Cb -0.17 -2.21 -0.01 0.00 -1.06 0.00 0.00 42.46 39.01 2fnb s ILE 39 CO 0.08 0.55 -0.14 -0.89 -0.10 0.00 0.00 174.94 174.43 2fnb s THR 40 N 0.01 1.16 -0.13 2.92 2.01 -0.04 -0.48 115.64 121.08 2fnb s THR 40 Ca -0.04 -0.61 0.01 0.00 0.31 0.00 0.00 61.69 61.36 2fnb s THR 40 Cb -0.14 -0.98 0.02 0.00 0.01 0.00 0.00 72.50 71.40 2fnb s THR 40 CO 0.04 0.33 -0.16 0.68 -0.69 0.00 0.00 174.62 174.82 2fnb s VAL 41 N -0.20 1.65 0.29 3.82 -7.23 -0.35 -0.04 120.40 118.33 2fnb s VAL 41 Ca 0.03 -0.71 0.08 0.00 -1.81 0.00 0.00 61.98 59.57 2fnb s VAL 41 Cb -0.07 -1.51 -0.06 0.00 0.56 0.00 0.00 36.38 35.30 2fnb s VAL 41 CO 0.00 0.47 -0.10 0.68 -0.31 0.00 0.00 175.10 175.84 2fnb s VAL 42 N 1.14 1.97 -0.54 1.32 -7.23 -0.72 -1.18 120.40 115.16 2fnb s VAL 42 Ca -0.02 -2.21 -0.24 0.00 -1.81 0.00 0.00 61.98 57.70 2fnb s VAL 42 Cb -0.14 -2.43 0.04 0.00 0.56 0.00 0.00 36.38 34.41 2fnb s VAL 42 CO -0.05 -0.33 0.92 0.00 -0.31 0.00 0.00 175.10 175.33 2fnb s ALA 43 N -2.81 3.18 -0.57 1.32 0.00 0.45 -0.68 121.76 122.65 2fnb s ALA 43 Ca 0.30 -1.22 -0.26 0.00 0.00 0.00 0.00 51.96 50.77 2fnb s ALA 43 Cb 0.01 -3.70 -0.05 0.00 0.00 0.00 0.00 23.12 19.39 2fnb s ALA 43 CO 0.13 -2.32 2.13 0.00 0.00 0.00 0.00 175.76 175.70 2fnb s ALA 44 N 3.84 1.85 0.00 0.00 0.00 0.48 -1.65 121.76 126.27 2fnb s ALA 44 Ca 0.30 -0.39 0.00 0.00 0.00 0.00 0.00 51.96 51.88 2fnb s ALA 44 Cb -0.13 -4.34 0.00 0.00 0.00 0.00 0.00 23.12 18.65 2fnb s ALA 44 CO 0.19 -4.27 0.00 0.41 0.00 0.00 0.00 175.76 172.10 2fnb n GLY 45 N 5.92 0.94 0.00 0.00 0.00 -1.26 -4.37 105.19 106.41 2fnb n GLY 45 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.31 2fnb n GLY 45 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2fnb n GLU 46 N 0.00 1.35 -0.73 1.61 2.13 -0.97 -5.02 120.64 119.02 2fnb n GLU 46 Ca 0.00 -0.09 0.00 0.00 0.66 0.00 0.00 57.16 57.73 2fnb n GLU 46 Cb 0.00 -0.43 0.00 0.00 0.27 0.00 0.00 31.44 31.28 2fnb n GLU 46 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2fnb n GLY 47 N 0.22 0.83 3.38 8.31 0.00 -0.66 -4.94 105.19 112.33 2fnb n GLY 47 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.00 0.03 -2.18 -0.61 5.41 -1.25 -4.61 119.36 114.15 2fnb n ILE 48 Ca 0.00 -0.09 -0.42 0.00 1.00 0.00 0.00 62.75 63.24 2fnb n ILE 48 Cb 0.00 -0.84 -0.03 0.00 -0.71 0.00 0.00 39.64 38.07 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 7.16 4.29 0.00 0.38 0.04 -1.26 -0.41 135.00 145.19 2fnb s PRO 49 Ca 1.22 2.04 0.00 0.00 0.04 0.00 0.00 61.00 64.30 2fnb s PRO 49 Cb -1.23 -3.46 0.00 0.00 0.04 0.00 0.00 34.50 29.84 2fnb s PRO 49 CO 0.55 -0.54 0.00 -0.89 0.04 0.00 0.00 177.00 176.16 2fnb n ILE 50 N 4.42 0.00 -4.08 0.56 2.08 -0.32 -4.93 119.36 117.09 2fnb n ILE 50 Ca 0.13 0.00 -0.13 0.00 0.56 0.00 0.00 62.75 63.31 2fnb n ILE 50 Cb 0.43 -0.18 -0.05 0.00 -0.75 0.00 0.00 39.64 39.09 2fnb n ILE 50 CO 0.00 0.00 0.00 0.72 0.56 0.00 0.00 176.55 177.83 2fnb s PHE 51 N 0.00 0.90 0.21 1.39 -0.71 -1.17 -5.03 117.98 113.57 2fnb s PHE 51 Ca 0.00 -1.17 0.08 0.00 -1.04 0.00 0.00 56.93 54.80 2fnb s PHE 51 Cb 0.00 -0.06 -0.05 0.00 -1.21 0.00 0.00 43.02 41.70 2fnb s PHE 51 CO 0.00 -1.06 -0.15 -1.83 -1.34 0.00 0.00 175.22 170.84 2fnb s GLU 52 N -3.38 1.35 0.17 1.99 -1.05 -1.26 -1.21 118.70 115.30 2fnb s GLU 52 Ca 0.29 -1.59 -0.10 0.00 -0.15 0.00 0.00 54.97 53.42 2fnb s GLU 52 Cb 0.00 -1.17 -0.00 0.00 -0.44 0.00 0.00 34.13 32.52 2fnb s GLU 52 CO 0.17 0.20 0.32 0.34 0.95 0.00 0.00 175.26 177.24 2fnb s ASP 53 N -3.30 -0.01 0.03 0.83 -1.08 0.37 -4.98 116.67 108.52 2fnb s ASP 53 Ca 0.23 -0.79 -0.04 0.00 -0.52 0.00 0.00 52.55 51.42 2fnb s ASP 53 Cb -0.01 0.46 -0.01 0.00 -1.46 0.00 0.00 42.92 41.89 2fnb s ASP 53 CO 0.07 -0.91 0.07 0.12 0.52 0.00 0.00 175.17 175.04 2fnb s PHE 54 N -3.95 0.21 0.35 -5.34 2.19 -1.26 -0.89 117.98 109.30 2fnb s PHE 54 Ca 0.15 -0.50 0.02 0.00 0.33 0.00 0.00 56.93 56.93 2fnb s PHE 54 Cb 0.03 -0.16 -0.01 0.00 -1.31 0.00 0.00 43.02 41.57 2fnb s PHE 54 CO -0.01 -0.33 0.07 1.33 1.83 0.00 0.00 175.22 178.11 2fnb n VAL 55 N 0.94 0.00 0.23 3.12 0.24 -0.92 -5.02 118.33 116.92 2fnb n VAL 55 Ca -0.20 -1.85 -0.10 0.00 -2.04 0.00 0.00 64.34 60.16 2fnb n VAL 55 Cb 0.58 0.54 -0.05 0.00 -1.47 0.00 0.00 33.84 33.44 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 1.13 -0.55 0.00 -1.34 3.58 -1.90 -3.38 116.42 113.95 2fnb h ASP 56 Ca -0.28 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.19 2fnb h ASP 56 Cb 0.96 0.14 0.00 0.00 1.72 0.00 0.00 39.33 42.15 2fnb h ASP 56 CO 0.45 -0.16 0.00 -1.54 -2.88 0.00 0.00 179.24 175.11 2fnb n SER 57 N -5.09 0.00 -0.75 2.28 3.41 -1.26 -4.56 113.62 107.66 2fnb n SER 57 Ca -0.08 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.63 2fnb n SER 57 Cb 0.26 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.27 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 2.54 -4.71 4.04 3.41 -1.26 -4.21 113.62 113.43 2fnb n SER 58 Ca 0.00 -1.77 -0.42 0.00 -0.26 0.00 0.00 58.87 56.42 2fnb n SER 58 Cb 0.00 0.11 -0.03 0.00 -0.26 0.00 0.00 64.21 64.03 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 -1.86 4.06 -0.56 -3.33 1.01 -1.26 -4.74 120.40 113.71 2fnb s VAL 59 Ca 0.23 1.48 0.07 0.00 0.00 0.00 0.00 61.98 63.75 2fnb s VAL 59 Cb 0.17 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.59 2fnb s VAL 59 CO 0.32 0.11 0.47 0.61 0.00 0.00 0.00 175.10 176.61 2fnb n GLY 60 N 3.22 -0.07 2.66 4.51 0.00 -1.26 -4.41 105.19 109.83 2fnb n GLY 60 Ca 0.09 -0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.21 0.09 -0.02 1.61 5.04 -1.26 -0.65 117.35 120.95 2fnb s TYR 61 Ca 0.05 0.07 0.02 0.00 -2.44 0.00 0.00 57.07 54.76 2fnb s TYR 61 Cb 0.05 -0.54 0.00 0.00 0.35 0.00 0.00 41.96 41.82 2fnb s TYR 61 CO 0.20 -0.32 -0.05 -0.47 -1.34 0.00 0.00 175.55 173.57 2fnb s TYR 62 N 2.17 0.56 -0.18 4.97 5.04 -1.21 -5.00 117.35 123.70 2fnb s TYR 62 Ca 0.04 -0.12 -0.03 0.00 -2.44 0.00 0.00 57.07 54.53 2fnb s TYR 62 Cb -0.14 -0.42 -0.01 0.00 0.35 0.00 0.00 41.96 41.74 2fnb s TYR 62 CO -0.05 -0.06 -0.07 0.99 -1.34 0.00 0.00 175.55 175.01 2fnb s THR 63 N 0.22 3.35 0.60 4.34 2.01 -1.26 -0.29 115.64 124.61 2fnb s THR 63 Ca -0.02 -0.53 -0.06 0.00 0.31 0.00 0.00 61.69 61.39 2fnb s THR 63 Cb -0.06 -2.48 0.01 0.00 0.01 0.00 0.00 72.50 69.98 2fnb s THR 63 CO -0.00 0.47 0.92 -0.69 -0.69 0.00 0.00 174.62 174.62 2fnb s VAL 64 N 0.93 3.49 0.15 3.82 1.01 -0.01 -4.97 120.40 124.81 2fnb s VAL 64 Ca -0.01 -0.03 0.03 0.00 0.00 0.00 0.00 61.98 61.97 2fnb s VAL 64 Cb -0.15 -3.40 -0.01 0.00 0.00 0.00 0.00 36.38 32.82 2fnb s VAL 64 CO 0.00 -0.41 0.14 0.41 0.00 0.00 0.00 175.10 175.24 2fnb n THR 65 N -2.63 0.00 -2.39 3.92 -1.04 -1.26 -3.22 114.28 107.66 2fnb n THR 65 Ca 0.05 -1.04 -0.02 0.00 -2.04 0.00 0.00 64.05 61.01 2fnb n THR 65 Cb 0.58 0.53 0.00 0.00 -1.82 0.00 0.00 70.33 69.62 2fnb n THR 65 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2fnb n GLY 66 N -0.28 0.65 3.96 3.41 0.00 -1.26 -4.95 105.19 106.72 2fnb n GLY 66 Ca 0.03 -0.68 -0.22 0.00 0.00 0.00 0.00 46.02 45.14 2fnb n GLY 66 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fnb s LEU 67 N -1.13 3.86 -0.10 0.99 1.43 -1.26 -5.02 118.68 117.45 2fnb s LEU 67 Ca 0.03 0.26 -0.07 0.00 -1.03 0.00 0.00 54.13 53.31 2fnb s LEU 67 Cb -0.01 -3.13 0.04 0.00 0.03 0.00 0.00 46.19 43.11 2fnb s LEU 67 CO 0.04 -0.49 0.25 -1.61 0.23 0.00 0.00 176.35 174.77 2fnb s GLU 68 N -4.39 0.26 1.00 1.70 0.41 -1.26 -4.89 118.70 111.53 2fnb s GLU 68 Ca 0.44 0.44 -0.13 0.00 -0.41 0.00 0.00 54.97 55.32 2fnb s GLU 68 Cb -0.10 0.02 0.19 0.00 -1.78 0.00 0.00 34.13 32.46 2fnb s GLU 68 CO 0.36 -0.10 1.10 -1.25 -0.49 0.00 0.00 175.26 174.88 2fnb s PRO 69 N 0.68 0.43 0.00 0.39 0.04 -1.26 -4.46 135.00 130.82 2fnb s PRO 69 Ca -0.04 0.42 0.00 0.00 0.04 0.00 0.00 61.00 61.41 2fnb s PRO 69 Cb -0.06 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.74 2fnb s PRO 69 CO -0.04 -2.71 0.00 0.41 0.04 0.00 0.00 177.00 174.70 2fnb n GLY 70 N -1.31 0.73 3.18 0.56 0.00 -0.21 -5.02 105.19 103.11 2fnb n GLY 70 Ca 0.06 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.42 1.21 0.22 -0.61 -1.09 -1.26 -5.03 121.20 112.23 2fnb s ILE 71 Ca 0.00 -1.19 -0.23 0.00 -2.23 0.00 0.00 60.65 57.00 2fnb s ILE 71 Cb 0.00 -1.12 -0.08 0.00 -1.58 0.00 0.00 42.46 39.68 2fnb s ILE 71 CO 0.00 -0.08 0.79 -0.62 -1.23 0.00 0.00 174.94 173.80 2fnb s ASP 72 N -1.45 7.23 -0.15 3.58 -1.08 -1.26 -4.02 116.67 119.52 2fnb s ASP 72 Ca 0.01 1.58 -0.02 0.00 -0.52 0.00 0.00 52.55 53.60 2fnb s ASP 72 Cb -0.09 -2.48 0.05 0.00 -1.46 0.00 0.00 42.92 38.94 2fnb s ASP 72 CO 0.02 0.08 0.02 -0.31 0.52 0.00 0.00 175.17 175.50 2fnb s TYR 73 N -1.40 0.91 -0.62 -5.34 1.51 -1.25 -0.39 117.35 110.77 2fnb s TYR 73 Ca 0.42 -0.62 -0.25 0.00 -1.01 0.00 0.00 57.07 55.61 2fnb s TYR 73 Cb -0.19 -0.96 0.04 0.00 -0.11 0.00 0.00 41.96 40.74 2fnb s TYR 73 CO 0.23 -0.51 1.07 -0.51 -1.11 0.00 0.00 175.55 174.72 2fnb s ASP 74 N 1.89 6.28 -0.48 2.29 1.01 0.14 -3.50 116.67 124.30 2fnb s ASP 74 Ca 0.01 -0.45 -0.20 0.00 0.71 0.00 0.00 52.55 52.62 2fnb s ASP 74 Cb -0.15 -2.48 0.04 0.00 1.01 0.00 0.00 42.92 41.34 2fnb s ASP 74 CO -0.07 -1.46 0.67 -0.63 0.21 0.00 0.00 175.17 173.88 2fnb s ILE 75 N 4.56 4.80 0.08 0.77 1.09 -0.54 -1.76 121.20 130.19 2fnb s ILE 75 Ca 0.32 -0.12 -0.13 0.00 -1.10 0.00 0.00 60.65 59.62 2fnb s ILE 75 Cb -0.12 -4.28 -0.06 0.00 -1.06 0.00 0.00 42.46 36.94 2fnb s ILE 75 CO 0.17 -0.74 0.45 -0.94 -0.10 0.00 0.00 174.94 173.78 2fnb s SER 76 N 2.37 6.75 -0.06 3.58 1.04 0.94 -1.38 113.70 126.93 2fnb s SER 76 Ca 0.20 0.93 -0.02 0.00 0.48 0.00 0.00 55.95 57.54 2fnb s SER 76 Cb -0.16 -2.23 0.03 0.00 0.10 0.00 0.00 66.02 63.76 2fnb s SER 76 CO 0.16 0.20 0.04 -0.69 0.98 0.00 0.00 173.24 173.93 2fnb s VAL 77 N -1.32 0.06 -0.11 5.02 1.01 0.30 -0.87 120.40 124.49 2fnb s VAL 77 Ca 0.32 0.28 0.02 0.00 0.00 0.00 0.00 61.98 62.60 2fnb s VAL 77 Cb -0.15 -0.32 -0.00 0.00 0.00 0.00 0.00 36.38 35.91 2fnb s VAL 77 CO 0.17 0.17 -0.20 -0.63 0.00 0.00 0.00 175.10 174.61 2fnb s ILE 78 N 2.10 2.42 -0.06 2.22 1.01 0.32 -1.83 121.20 127.39 2fnb s ILE 78 Ca 0.05 -0.89 -0.20 0.00 0.00 0.00 0.00 60.65 59.61 2fnb s ILE 78 Cb -0.12 -1.97 -0.05 0.00 0.01 0.00 0.00 42.46 40.33 2fnb s ILE 78 CO -0.04 0.55 0.56 -0.89 0.00 0.00 0.00 174.94 175.11 2fnb s THR 79 N 0.37 5.05 -0.11 2.92 2.01 -1.26 -0.73 115.64 123.89 2fnb s THR 79 Ca -0.15 1.15 0.03 0.00 0.31 0.00 0.00 61.69 63.02 2fnb s THR 79 Cb -0.17 -3.90 0.01 0.00 0.01 0.00 0.00 72.50 68.45 2fnb s THR 79 CO 0.07 0.36 -0.19 -1.48 -0.69 0.00 0.00 174.62 172.69 2fnb s LEU 80 N 0.25 1.92 0.00 4.42 2.34 -1.13 -1.19 118.68 125.29 2fnb s LEU 80 Ca 0.30 -0.50 0.00 0.00 0.06 0.00 0.00 54.13 53.99 2fnb s LEU 80 Cb -0.17 -1.25 0.00 0.00 -0.56 0.00 0.00 46.19 44.21 2fnb s LEU 80 CO 0.15 0.07 0.02 2.30 -1.06 0.00 0.00 176.35 177.83 2fnb n ILE 81 N 3.97 0.00 -0.94 1.48 -5.35 -0.24 -2.45 119.36 115.83 2fnb n ILE 81 Ca -0.20 -1.72 -0.42 0.00 -0.27 0.00 0.00 62.75 60.14 2fnb n ILE 81 Cb 0.52 0.31 -0.09 0.00 -1.74 0.00 0.00 39.64 38.63 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 -1.27 0.51 -1.96 7.28 5.15 0.17 -1.30 115.26 123.84 2fnb n ASN 82 Ca -0.14 0.45 -0.05 0.00 -0.60 0.00 0.00 54.58 54.24 2fnb n ASN 82 Cb 0.46 -0.66 -0.01 0.00 -0.53 0.00 0.00 39.78 39.04 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 5.42 -0.12 3.24 8.20 0.00 -1.26 -4.87 105.19 115.79 2fnb n GLY 83 Ca 0.41 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.34 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 -1.78 -0.03 0.00 -0.02 0.00 -0.42 -5.17 107.32 99.91 2fnb s GLY 84 Ca 0.00 -0.40 0.04 0.00 0.00 0.00 0.00 44.72 44.35 2fnb s GLY 84 CO 0.00 -0.61 -0.11 -0.54 0.00 0.00 0.00 173.10 171.84 2fnb s GLU 85 N -3.70 0.87 0.23 2.90 2.02 -1.26 -1.08 118.70 118.68 2fnb s GLU 85 Ca 0.03 -0.48 -0.03 0.00 0.02 0.00 0.00 54.97 54.52 2fnb s GLU 85 Cb 0.03 -0.84 0.05 0.00 0.10 0.00 0.00 34.13 33.48 2fnb s GLU 85 CO -0.10 0.22 0.32 0.43 0.02 0.00 0.00 175.26 176.15 2fnb n SER 86 N 2.57 0.17 -4.76 -0.19 7.64 -0.34 -4.55 113.62 114.17 2fnb n SER 86 Ca -0.15 -1.20 -0.41 0.00 1.01 0.00 0.00 58.87 58.11 2fnb n SER 86 Cb 0.56 -0.23 -0.01 0.00 -1.01 0.00 0.00 64.21 63.51 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 -3.51 3.71 -1.03 -0.43 0.00 -1.26 -4.80 121.76 114.44 2fnb s ALA 87 Ca 0.19 1.55 -0.23 0.00 0.00 0.00 0.00 51.96 53.48 2fnb s ALA 87 Cb -0.01 -3.63 -0.01 0.00 0.00 0.00 0.00 23.12 19.47 2fnb s ALA 87 CO 0.13 -0.98 1.76 -1.25 0.00 0.00 0.00 175.76 175.43 2fnb s PRO 88 N -0.79 3.04 -0.92 0.00 0.04 -1.26 -4.64 135.00 130.47 2fnb s PRO 88 Ca 0.61 -0.88 -0.22 0.00 0.04 0.00 0.00 61.00 60.56 2fnb s PRO 88 Cb -0.47 -5.24 0.08 0.00 0.04 0.00 0.00 34.50 28.91 2fnb s PRO 88 CO 0.50 -2.97 1.25 0.99 0.04 0.00 0.00 177.00 176.81 2fnb s THR 89 N 7.93 4.27 0.17 1.26 2.01 -0.76 -4.87 115.64 125.64 2fnb s THR 89 Ca 0.60 -0.93 -0.05 0.00 0.31 0.00 0.00 61.69 61.62 2fnb s THR 89 Cb -0.02 -4.89 -0.06 0.00 0.01 0.00 0.00 72.50 67.54 2fnb s THR 89 CO -0.01 -1.70 0.42 -0.89 -0.69 0.00 0.00 174.62 171.75 2fnb s THR 90 N 4.04 5.12 0.02 -0.82 2.01 -1.26 -0.54 115.64 124.21 2fnb s THR 90 Ca 0.37 0.10 0.02 0.00 0.31 0.00 0.00 61.69 62.49 2fnb s THR 90 Cb -0.05 -3.63 -0.01 0.00 0.01 0.00 0.00 72.50 68.82 2fnb s THR 90 CO -0.05 -0.01 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.03 2fnb s LEU 91 N -2.76 2.12 -0.08 4.42 1.43 -0.48 -4.96 118.68 118.37 2fnb s LEU 91 Ca 0.42 -0.32 0.03 0.00 -1.03 0.00 0.00 54.13 53.23 2fnb s LEU 91 Cb -0.12 -0.30 0.01 0.00 0.03 0.00 0.00 46.19 45.81 2fnb s LEU 91 CO 0.24 -0.03 -0.17 0.28 0.23 0.00 0.00 176.35 176.90 2fnb s THR 92 N -0.69 1.51 -0.20 5.49 -1.32 -1.26 -1.46 115.64 117.70 2fnb s THR 92 Ca -0.02 -0.69 -0.11 0.00 -1.21 0.00 0.00 61.69 59.66 2fnb s THR 92 Cb -0.06 -1.34 0.06 0.00 -1.51 0.00 0.00 72.50 69.65 2fnb s THR 92 CO 0.00 0.44 0.48 -1.10 -2.21 0.00 0.00 174.62 172.23 2fnb s GLN 93 N 0.61 0.47 0.20 7.08 -1.52 -1.23 -5.03 119.66 120.25 2fnb s GLN 93 Ca -0.15 0.89 -0.30 0.00 -1.95 0.00 0.00 55.36 53.85 2fnb s GLN 93 Cb -0.16 0.03 -0.08 0.00 -0.22 0.00 0.00 33.01 32.57 2fnb s GLN 93 CO 0.05 -0.15 1.04 -1.14 -0.25 0.00 0.00 175.29 174.83 2fnb s GLN 94 N 1.41 4.68 0.00 2.91 0.74 -1.26 -3.76 119.66 124.38 2fnb s GLN 94 Ca -0.09 1.64 0.30 0.00 0.05 0.00 0.00 55.36 57.25 2fnb s GLN 94 Cb -0.07 -3.28 1.46 0.00 1.10 0.00 0.00 33.01 32.22 2fnb s GLN 94 CO -0.14 0.23 1.98 0.25 -0.55 0.00 0.00 175.29 177.06