#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 -2.45 -0.32 0.03 0.00 -1.26 -4.94 116.66 107.73 2fnb n ARG 2 Ca 0.00 0.24 0.00 0.00 -0.00 0.00 0.00 57.85 58.09 2fnb n ARG 2 Cb 0.00 -4.84 0.00 0.00 -0.00 0.00 0.00 32.46 27.62 2fnb n ARG 2 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2fnb n GLY 3 N -0.93 4.32 2.41 2.89 0.00 -1.26 -5.11 105.19 107.51 2fnb n GLY 3 Ca 0.02 -2.06 -0.18 0.00 0.00 0.00 0.00 46.02 43.80 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 -0.45 -1.00 -0.06 1.61 3.41 -1.26 -5.04 113.62 110.83 2fnb n SER 4 Ca 0.00 -2.95 0.03 0.00 -0.26 0.00 0.00 58.87 55.69 2fnb n SER 4 Cb 0.00 0.33 0.37 0.00 -0.26 0.00 0.00 64.21 64.65 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 3.95 0.66 -5.82 4.33 4.57 -1.99 -3.34 114.58 116.94 2fnb h GLU 5 Ca -0.01 -0.04 -0.68 0.00 -1.18 0.00 0.00 59.36 57.44 2fnb h GLU 5 Cb 0.94 -0.15 -0.28 0.00 -0.16 0.00 0.00 28.75 29.10 2fnb h GLU 5 CO 0.41 0.44 -0.82 0.08 -1.18 0.00 0.00 179.01 177.94 2fnb s VAL 6 N -5.58 2.60 -0.31 0.32 1.01 -1.26 -5.03 120.40 112.15 2fnb s VAL 6 Ca -0.09 -0.86 -0.28 0.00 0.00 0.00 0.00 61.98 60.75 2fnb s VAL 6 Cb 0.17 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 2fnb s VAL 6 CO 0.75 0.56 1.93 -2.16 0.00 0.00 0.00 175.10 176.17 2fnb s PRO 7 N -0.10 3.22 0.83 2.72 0.04 -1.25 -4.84 135.00 135.61 2fnb s PRO 7 Ca -0.04 1.56 -0.12 0.00 0.04 0.00 0.00 61.00 62.45 2fnb s PRO 7 Cb -0.14 -4.26 0.10 0.00 0.04 0.00 0.00 34.50 30.24 2fnb s PRO 7 CO 0.04 -1.99 1.17 -0.65 0.04 0.00 0.00 177.00 175.61 2fnb s GLN 8 N 5.96 1.56 -1.05 4.56 -1.52 -1.26 -4.88 119.66 123.02 2fnb s GLN 8 Ca 0.85 1.61 -0.22 0.00 -1.95 0.00 0.00 55.36 55.65 2fnb s GLN 8 Cb -0.25 -1.78 -0.11 0.00 -0.22 0.00 0.00 33.01 30.65 2fnb s GLN 8 CO 0.33 -2.24 1.92 1.28 -0.25 0.00 0.00 175.29 176.33 2fnb n LEU 9 N -3.58 3.46 0.13 2.90 4.77 -1.26 -4.72 117.00 118.70 2fnb n LEU 9 Ca 0.12 -3.10 0.12 0.00 -0.03 0.00 0.00 56.01 53.12 2fnb n LEU 9 Cb 0.51 -1.53 0.63 0.00 -2.33 0.00 0.00 43.42 40.71 2fnb n LEU 9 CO 0.49 -1.28 1.12 0.74 -1.33 0.00 0.00 177.39 177.13 2fnb h THR 10 N 5.57 0.91 0.00 -5.08 2.02 -1.97 -1.69 112.91 112.67 2fnb h THR 10 Ca 0.29 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.45 2fnb h THR 10 Cb 0.84 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 68.09 2fnb h THR 10 CO 1.48 0.01 0.00 -0.67 0.37 0.00 0.00 175.52 176.71 2fnb n ASP 11 N -4.47 0.00 -4.67 4.18 -0.08 -1.26 -4.89 116.55 105.35 2fnb n ASP 11 Ca 0.03 -0.88 -0.48 0.00 -1.51 0.00 0.00 54.79 51.94 2fnb n ASP 11 Cb 0.29 -0.02 -0.05 0.00 2.34 0.00 0.00 41.12 43.68 2fnb n ASP 11 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 2fnb n LEU 12 N -1.02 3.00 -3.79 -2.67 -0.00 -0.64 -4.16 117.00 107.72 2fnb n LEU 12 Ca 0.22 1.05 -0.13 0.00 -0.00 0.00 0.00 56.01 57.15 2fnb n LEU 12 Cb 0.11 -1.36 -0.09 0.00 -0.00 0.00 0.00 43.42 42.09 2fnb n LEU 12 CO 0.17 -0.30 -0.04 -0.44 -0.00 0.00 0.00 177.39 176.78 2fnb s SER 13 N 2.21 -0.13 0.03 1.96 0.01 0.12 -4.97 113.70 112.93 2fnb s SER 13 Ca 0.86 0.02 0.05 0.00 1.31 0.00 0.00 55.95 58.19 2fnb s SER 13 Cb -0.75 0.29 -0.03 0.00 0.21 0.00 0.00 66.02 65.74 2fnb s SER 13 CO 0.46 -0.41 -0.11 -0.36 0.41 0.00 0.00 173.24 173.24 2fnb s PHE 14 N -1.28 2.77 0.23 2.43 0.08 -1.26 0.11 117.98 121.05 2fnb s PHE 14 Ca -0.13 -0.12 -0.06 0.00 0.12 0.00 0.00 56.93 56.73 2fnb s PHE 14 Cb -0.06 -1.53 -0.02 0.00 -0.57 0.00 0.00 43.02 40.84 2fnb s PHE 14 CO 0.03 0.35 0.30 0.14 -0.10 0.00 0.00 175.22 175.94 2fnb s VAL 15 N -1.02 0.00 -1.44 -0.44 -7.23 -0.29 -4.94 120.40 105.04 2fnb s VAL 15 Ca 0.17 -1.71 -0.08 0.00 -1.81 0.00 0.00 61.98 58.55 2fnb s VAL 15 Cb -0.11 -2.37 0.05 0.00 0.56 0.00 0.00 36.38 34.51 2fnb s VAL 15 CO 0.08 0.00 0.83 0.47 -0.31 0.00 0.00 175.10 176.17 2fnb n ASP 16 N -0.37 -3.05 -3.50 4.85 8.00 -1.26 -0.76 116.55 120.46 2fnb n ASP 16 Ca 0.00 -0.82 -0.39 0.00 0.71 0.00 0.00 54.79 54.30 2fnb n ASP 16 Cb 0.64 -3.87 -0.02 0.00 -0.02 0.00 0.00 41.12 37.85 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 -4.50 3.68 -1.69 0.53 -0.00 -1.26 -3.81 119.36 112.31 2fnb n ILE 17 Ca -0.12 -2.62 -0.30 0.00 -0.00 0.00 0.00 62.75 59.71 2fnb n ILE 17 Cb 0.60 -2.56 0.07 0.00 -0.00 0.00 0.00 39.64 37.74 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 2.86 3.26 -2.00 1.39 -1.32 -1.20 -4.97 115.64 113.65 2fnb s THR 18 Ca 0.57 0.41 0.06 0.00 -1.21 0.00 0.00 61.69 61.53 2fnb s THR 18 Cb 0.16 -3.26 0.18 0.00 -1.51 0.00 0.00 72.50 68.07 2fnb s THR 18 CO -0.06 -0.53 1.05 0.47 -2.21 0.00 0.00 174.62 173.33 2fnb n ASP 19 N -3.25 0.00 0.00 8.08 9.92 -1.26 -3.61 116.55 126.43 2fnb n ASP 19 Ca 0.07 -1.35 0.00 0.00 -0.53 0.00 0.00 54.79 52.98 2fnb n ASP 19 Cb 0.57 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.05 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 -0.63 1.54 -3.60 -2.24 3.41 -1.26 -4.58 113.62 106.26 2fnb n SER 20 Ca 0.05 -0.25 -0.04 0.00 -0.26 0.00 0.00 58.87 58.37 2fnb n SER 20 Cb 0.02 0.80 -0.02 0.00 -0.26 0.00 0.00 64.21 64.76 2fnb n SER 20 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2fnb s SER 21 N -1.11 -0.13 -0.05 4.04 1.04 -1.24 -4.59 113.70 111.66 2fnb s SER 21 Ca 0.00 -0.01 0.03 0.00 0.48 0.00 0.00 55.95 56.45 2fnb s SER 21 Cb 0.00 0.14 0.01 0.00 0.10 0.00 0.00 66.02 66.27 2fnb s SER 21 CO 0.00 -0.23 -0.12 -0.51 0.98 0.00 0.00 173.24 173.36 2fnb s ILE 22 N -2.41 1.09 0.21 -1.02 -1.16 -0.58 -3.24 121.20 114.08 2fnb s ILE 22 Ca 0.10 -0.50 -0.04 0.00 -0.51 0.00 0.00 60.65 59.70 2fnb s ILE 22 Cb -0.01 -0.97 -0.05 0.00 0.61 0.00 0.00 42.46 42.04 2fnb s ILE 22 CO -0.05 0.33 0.44 -0.83 -2.81 0.00 0.00 174.94 172.03 2fnb s GLY 23 N 0.36 2.00 0.13 1.50 0.00 0.06 -0.79 107.32 110.57 2fnb s GLY 23 Ca -0.08 -0.62 0.06 0.00 0.00 0.00 0.00 44.72 44.08 2fnb s GLY 23 CO 0.02 -0.54 -0.14 1.08 0.00 0.00 0.00 173.10 173.52 2fnb s LEU 24 N -3.13 2.42 0.03 0.66 1.02 0.44 -1.13 118.68 118.99 2fnb s LEU 24 Ca 0.42 -0.83 0.00 0.00 0.02 0.00 0.00 54.13 53.73 2fnb s LEU 24 Cb -0.11 -0.55 -0.02 0.00 0.02 0.00 0.00 46.19 45.52 2fnb s LEU 24 CO 0.27 -0.15 -0.03 -0.60 0.02 0.00 0.00 176.35 175.86 2fnb s ARG 25 N -2.77 0.38 0.00 1.70 3.52 0.12 -2.09 118.95 119.81 2fnb s ARG 25 Ca 0.10 -0.73 0.00 0.00 -0.13 0.00 0.00 55.73 54.98 2fnb s ARG 25 Cb -0.04 0.10 0.00 0.00 -1.56 0.00 0.00 34.95 33.44 2fnb s ARG 25 CO 0.03 -0.05 0.00 -2.67 -0.81 0.00 0.00 175.30 171.80 2fnb n TRP 26 N 1.33 -0.52 -3.82 5.12 2.14 0.13 -0.70 117.44 121.13 2fnb n TRP 26 Ca -0.22 0.00 -0.36 0.00 2.07 0.00 0.00 57.50 58.99 2fnb n TRP 26 Cb 0.56 0.00 -0.13 0.00 -0.81 0.00 0.00 31.31 30.93 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 -2.93 3.31 -0.02 -1.67 2.01 -1.26 -4.73 115.64 110.34 2fnb s THR 27 Ca 0.00 -1.52 -0.30 0.00 0.31 0.00 0.00 61.69 60.18 2fnb s THR 27 Cb 0.00 -3.01 -0.05 0.00 0.01 0.00 0.00 72.50 69.45 2fnb s THR 27 CO 0.00 -0.31 1.39 -2.16 -0.69 0.00 0.00 174.62 172.86 2fnb s PRO 28 N 1.26 4.28 -0.56 4.92 0.04 -1.26 -4.98 135.00 138.69 2fnb s PRO 28 Ca -0.00 1.93 -0.18 0.00 0.04 0.00 0.00 61.00 62.79 2fnb s PRO 28 Cb -0.21 -3.62 0.10 0.00 0.04 0.00 0.00 34.50 30.81 2fnb s PRO 28 CO -0.01 -0.60 0.64 -0.51 0.04 0.00 0.00 177.00 176.56 2fnb s LEU 29 N 2.61 5.50 -0.02 -3.56 1.43 -1.26 -4.94 118.68 118.45 2fnb s LEU 29 Ca 0.63 -1.43 -0.01 0.00 -1.03 0.00 0.00 54.13 52.29 2fnb s LEU 29 Cb -0.30 -2.30 -0.02 0.00 0.03 0.00 0.00 46.19 43.61 2fnb s LEU 29 CO 0.25 -1.01 2.16 0.59 0.23 0.00 0.00 176.35 178.57 2fnb n ASN 30 N 6.05 5.40 -0.11 2.29 3.02 -1.26 -4.74 115.26 125.90 2fnb n ASN 30 Ca -0.10 -2.45 0.04 0.00 -0.03 0.00 0.00 54.58 52.04 2fnb n ASN 30 Cb 0.42 -1.15 0.36 0.00 -0.61 0.00 0.00 39.78 38.80 2fnb n ASN 30 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2fnb h SER 31 N 1.22 0.62 0.00 6.41 0.02 -1.92 -3.48 113.55 116.43 2fnb h SER 31 Ca 0.03 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2fnb h SER 31 Cb 1.04 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.43 2fnb h SER 31 CO 0.06 0.44 0.00 -1.54 -1.14 0.00 0.00 176.83 174.65 2fnb n SER 32 N -4.46 0.00 0.00 3.07 3.41 -1.26 -4.90 113.62 109.48 2fnb n SER 32 Ca 0.07 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.82 2fnb n SER 32 Cb 0.11 0.00 0.76 0.00 -0.26 0.00 0.00 64.21 64.82 2fnb n SER 32 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2fnb n THR 33 N 0.00 0.05 -1.49 6.66 -1.04 -1.26 -4.84 114.28 112.36 2fnb n THR 33 Ca 0.00 0.01 -0.58 0.00 -2.04 0.00 0.00 64.05 61.44 2fnb n THR 33 Cb 0.00 -0.55 -0.08 0.00 -1.82 0.00 0.00 70.33 67.88 2fnb n THR 33 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2fnb n ILE 34 N -1.20 0.00 -0.06 12.58 0.00 -1.26 -4.25 119.36 125.17 2fnb n ILE 34 Ca 0.16 0.00 -0.05 0.00 0.00 0.00 0.00 62.75 62.86 2fnb n ILE 34 Cb 0.19 -0.20 -0.03 0.00 0.00 0.00 0.00 39.64 39.60 2fnb n ILE 34 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 2fnb h ILE 35 N 3.57 0.29 0.00 9.51 2.04 -1.70 -3.48 117.51 127.75 2fnb h ILE 35 Ca -0.44 -1.26 0.00 0.00 1.00 0.00 0.00 64.86 64.16 2fnb h ILE 35 Cb 1.30 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.97 2fnb h ILE 35 CO 0.73 0.10 0.00 0.61 0.00 0.00 0.00 178.15 179.59 2fnb n GLY 36 N 1.68 -0.59 3.05 5.37 0.00 -1.22 -4.48 105.19 108.99 2fnb n GLY 36 Ca -0.06 -0.59 -0.22 0.00 0.00 0.00 0.00 46.02 45.16 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 -3.17 1.13 -0.35 1.61 1.51 -1.26 -3.11 117.35 113.72 2fnb s TYR 37 Ca 0.00 -0.27 -0.08 0.00 -1.01 0.00 0.00 57.07 55.70 2fnb s TYR 37 Cb 0.00 -0.77 0.03 0.00 -0.11 0.00 0.00 41.96 41.11 2fnb s TYR 37 CO 0.00 -0.09 0.14 0.50 -1.11 0.00 0.00 175.55 175.00 2fnb s ARG 38 N 0.02 2.79 0.38 -0.62 3.00 0.33 -1.80 118.95 123.04 2fnb s ARG 38 Ca -0.01 -1.08 -0.11 0.00 -1.00 0.00 0.00 55.73 53.53 2fnb s ARG 38 Cb -0.08 -3.56 -0.07 0.00 0.00 0.00 0.00 34.95 31.24 2fnb s ARG 38 CO 0.00 -0.64 0.74 0.42 0.00 0.00 0.00 175.30 175.82 2fnb s ILE 39 N 1.48 4.79 -0.01 4.11 1.09 0.02 -0.82 121.20 131.86 2fnb s ILE 39 Ca 0.01 0.62 -0.06 0.00 -1.10 0.00 0.00 60.65 60.11 2fnb s ILE 39 Cb -0.19 -3.71 0.00 0.00 -1.06 0.00 0.00 42.46 37.50 2fnb s ILE 39 CO 0.04 -0.44 0.13 -0.89 -0.10 0.00 0.00 174.94 173.69 2fnb s THR 40 N -2.27 0.07 -0.04 2.92 2.01 0.11 -1.46 115.64 116.97 2fnb s THR 40 Ca 0.51 -0.56 0.01 0.00 0.31 0.00 0.00 61.69 61.96 2fnb s THR 40 Cb -0.10 -0.38 0.02 0.00 0.01 0.00 0.00 72.50 72.05 2fnb s THR 40 CO 0.29 -0.31 -0.06 0.68 -0.69 0.00 0.00 174.62 174.53 2fnb s VAL 41 N -1.09 0.63 0.22 3.82 -7.23 -0.49 -0.32 120.40 115.94 2fnb s VAL 41 Ca -0.12 -0.19 0.04 0.00 -1.81 0.00 0.00 61.98 59.91 2fnb s VAL 41 Cb -0.06 -0.63 -0.05 0.00 0.56 0.00 0.00 36.38 36.20 2fnb s VAL 41 CO 0.01 0.24 -0.03 0.68 -0.31 0.00 0.00 175.10 175.69 2fnb s VAL 42 N 0.81 1.12 -0.43 1.32 -7.23 -1.18 -1.34 120.40 113.48 2fnb s VAL 42 Ca -0.12 -2.05 -0.24 0.00 -1.81 0.00 0.00 61.98 57.76 2fnb s VAL 42 Cb -0.14 -2.25 0.02 0.00 0.56 0.00 0.00 36.38 34.57 2fnb s VAL 42 CO 0.01 -0.41 0.86 0.00 -0.31 0.00 0.00 175.10 175.25 2fnb s ALA 43 N -3.36 3.31 -0.43 1.32 0.00 -0.17 -1.09 121.76 121.34 2fnb s ALA 43 Ca 0.26 -0.78 -0.27 0.00 0.00 0.00 0.00 51.96 51.17 2fnb s ALA 43 Cb 0.05 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 2fnb s ALA 43 CO 0.07 -1.84 1.94 0.00 0.00 0.00 0.00 175.76 175.93 2fnb s ALA 44 N 3.46 2.47 0.00 0.00 0.00 0.72 -0.86 121.76 127.56 2fnb s ALA 44 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 51.96 52.30 2fnb s ALA 44 Cb -0.11 -4.15 0.00 0.00 0.00 0.00 0.00 23.12 18.85 2fnb s ALA 44 CO 0.22 -3.28 0.00 0.41 0.00 0.00 0.00 175.76 173.12 2fnb n GLY 45 N 5.62 0.91 0.00 0.00 0.00 -1.26 -4.44 105.19 106.02 2fnb n GLY 45 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 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 0.57 -1.22 1.61 4.07 -1.14 -5.00 120.64 119.52 2fnb n GLU 46 Ca 0.00 -0.08 -0.08 0.00 -0.06 0.00 0.00 57.16 56.95 2fnb n GLU 46 Cb 0.00 -0.43 -0.03 0.00 -0.06 0.00 0.00 31.44 30.92 2fnb n GLU 46 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2fnb n GLY 47 N 0.10 0.75 3.42 8.31 0.00 -0.04 -4.92 105.19 112.82 2fnb n GLY 47 Ca 0.00 -0.02 -0.49 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 -2.19 0.06 -2.34 -0.61 5.41 -1.23 -4.68 119.36 113.78 2fnb n ILE 48 Ca -0.08 -0.19 -0.41 0.00 1.00 0.00 0.00 62.75 63.07 2fnb n ILE 48 Cb 0.55 -1.20 -0.03 0.00 -0.71 0.00 0.00 39.64 38.24 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 7.13 4.50 0.00 0.38 0.04 -1.26 -1.00 135.00 144.79 2fnb s PRO 49 Ca 1.18 1.94 0.00 0.00 0.04 0.00 0.00 61.00 64.16 2fnb s PRO 49 Cb -1.04 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 30.32 2fnb s PRO 49 CO 0.50 -0.02 0.00 -0.89 0.04 0.00 0.00 177.00 176.63 2fnb n ILE 50 N 1.73 0.00 -3.97 0.56 -0.00 -0.45 -4.94 119.36 112.30 2fnb n ILE 50 Ca 0.02 0.32 -0.11 0.00 -0.00 0.00 0.00 62.75 62.98 2fnb n ILE 50 Cb 0.44 -1.13 -0.03 0.00 -0.00 0.00 0.00 39.64 38.92 2fnb n ILE 50 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.55 177.27 2fnb s PHE 51 N -0.65 0.51 0.10 1.39 -0.71 -1.16 -5.04 117.98 112.42 2fnb s PHE 51 Ca 0.00 -0.91 0.03 0.00 -1.04 0.00 0.00 56.93 55.01 2fnb s PHE 51 Cb 0.00 0.31 -0.04 0.00 -1.21 0.00 0.00 43.02 42.08 2fnb s PHE 51 CO 0.00 -1.22 -0.09 -1.83 -1.34 0.00 0.00 175.22 170.74 2fnb s GLU 52 N -3.20 0.86 0.21 1.99 -1.05 -1.26 -1.39 118.70 114.86 2fnb s GLU 52 Ca 0.23 -1.22 -0.17 0.00 -0.15 0.00 0.00 54.97 53.65 2fnb s GLU 52 Cb -0.02 -0.45 0.02 0.00 -0.44 0.00 0.00 34.13 33.24 2fnb s GLU 52 CO 0.14 0.05 0.54 0.34 0.95 0.00 0.00 175.26 177.28 2fnb s ASP 53 N -2.66 -0.24 0.48 0.83 2.15 -0.53 -4.98 116.67 111.72 2fnb s ASP 53 Ca 0.08 -0.56 0.04 0.00 0.43 0.00 0.00 52.55 52.55 2fnb s ASP 53 Cb -0.00 0.60 -0.02 0.00 -0.30 0.00 0.00 42.92 43.19 2fnb s ASP 53 CO -0.01 -1.10 0.13 -0.36 -0.17 0.00 0.00 175.17 173.66 2fnb s PHE 54 N -3.90 2.09 0.35 -5.34 0.40 -1.26 -0.80 117.98 109.52 2fnb s PHE 54 Ca 0.11 -0.80 0.02 0.00 -0.60 0.00 0.00 56.93 55.66 2fnb s PHE 54 Cb -0.02 -1.78 -0.01 0.00 0.51 0.00 0.00 43.02 41.72 2fnb s PHE 54 CO 0.00 0.11 0.07 1.33 0.70 0.00 0.00 175.22 177.43 2fnb n VAL 55 N -1.32 0.00 0.11 -0.44 0.24 -0.74 -4.82 118.33 111.36 2fnb n VAL 55 Ca -0.09 -1.88 -0.04 0.00 -2.04 0.00 0.00 64.34 60.29 2fnb n VAL 55 Cb 0.66 0.57 -0.02 0.00 -1.47 0.00 0.00 33.84 33.57 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 1.17 -0.24 0.00 -1.34 1.82 -1.93 -3.39 116.42 112.51 2fnb h ASP 56 Ca -0.28 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.37 2fnb h ASP 56 Cb 0.98 0.06 0.00 0.00 0.68 0.00 0.00 39.33 41.05 2fnb h ASP 56 CO 0.45 -0.15 0.00 -1.54 -1.61 0.00 0.00 179.24 176.39 2fnb n SER 57 N -2.86 0.00 -1.08 2.28 3.41 -1.26 -4.75 113.62 109.35 2fnb n SER 57 Ca -0.03 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.59 2fnb n SER 57 Cb 0.11 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.07 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 0.48 -4.73 4.04 3.41 -1.26 -4.72 113.62 110.83 2fnb n SER 58 Ca 0.00 -1.96 -0.41 0.00 -0.26 0.00 0.00 58.87 56.24 2fnb n SER 58 Cb 0.00 -0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 63.71 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 0.00 3.76 -0.99 -3.33 1.01 -1.26 -4.75 120.40 114.84 2fnb s VAL 59 Ca 0.19 1.40 0.10 0.00 0.00 0.00 0.00 61.98 63.66 2fnb s VAL 59 Cb 0.21 -3.90 0.02 0.00 0.00 0.00 0.00 36.38 32.72 2fnb s VAL 59 CO -0.09 0.19 0.68 0.61 0.00 0.00 0.00 175.10 176.48 2fnb n GLY 60 N 2.55 -0.25 3.21 4.51 0.00 -1.26 -4.52 105.19 109.43 2fnb n GLY 60 Ca 0.06 -0.28 -0.10 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.17 -0.66 0.17 1.61 6.14 -1.26 -0.69 117.35 121.48 2fnb s TYR 61 Ca 0.09 1.33 0.01 0.00 0.64 0.00 0.00 57.07 59.14 2fnb s TYR 61 Cb 0.08 0.22 -0.04 0.00 0.42 0.00 0.00 41.96 42.64 2fnb s TYR 61 CO 0.21 -0.41 0.01 -0.47 0.64 0.00 0.00 175.55 175.53 2fnb s TYR 62 N 2.19 1.14 -0.04 4.97 5.04 -0.89 -4.98 117.35 124.79 2fnb s TYR 62 Ca -0.04 -1.06 -0.02 0.00 -2.44 0.00 0.00 57.07 53.51 2fnb s TYR 62 Cb -0.11 -0.65 0.02 0.00 0.35 0.00 0.00 41.96 41.57 2fnb s TYR 62 CO -0.12 -0.27 0.08 0.99 -1.34 0.00 0.00 175.55 174.89 2fnb s THR 63 N -3.73 -0.03 0.12 4.34 2.01 -1.26 -0.42 115.64 116.67 2fnb s THR 63 Ca 0.24 0.10 0.03 0.00 0.31 0.00 0.00 61.69 62.37 2fnb s THR 63 Cb 0.06 -0.14 -0.04 0.00 0.01 0.00 0.00 72.50 72.40 2fnb s THR 63 CO 0.04 0.04 0.16 -0.69 -0.69 0.00 0.00 174.62 173.47 2fnb s VAL 64 N 0.59 4.81 0.35 3.82 1.01 0.03 -4.95 120.40 126.06 2fnb s VAL 64 Ca -0.05 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 61.19 2fnb s VAL 64 Cb -0.06 -3.40 -0.06 0.00 0.00 0.00 0.00 36.38 32.86 2fnb s VAL 64 CO -0.02 0.01 0.06 -0.89 0.00 0.00 0.00 175.10 174.26 2fnb s THR 65 N -1.59 1.17 0.00 3.92 2.01 -1.26 -1.53 115.64 118.36 2fnb s THR 65 Ca 0.32 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 60.32 2fnb s THR 65 Cb -0.11 -2.72 0.00 0.00 0.01 0.00 0.00 72.50 69.67 2fnb s THR 65 CO 0.25 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.79 2fnb n GLY 66 N -0.76 0.83 3.89 4.40 0.00 -1.26 -5.01 105.19 107.28 2fnb n GLY 66 Ca -0.04 -0.58 -0.29 0.00 0.00 0.00 0.00 46.02 45.11 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 0.00 3.83 -0.01 0.99 1.43 -1.26 -5.01 118.68 118.65 2fnb s LEU 67 Ca 0.00 1.00 0.00 0.00 -1.03 0.00 0.00 54.13 54.10 2fnb s LEU 67 Cb 0.00 -3.88 0.02 0.00 0.03 0.00 0.00 46.19 42.35 2fnb s LEU 67 CO 0.00 -0.40 0.01 -1.61 0.23 0.00 0.00 176.35 174.57 2fnb s GLU 68 N -4.00 0.09 0.67 1.70 0.41 -1.26 -4.82 118.70 111.48 2fnb s GLU 68 Ca 0.49 0.06 -0.11 0.00 -0.41 0.00 0.00 54.97 55.00 2fnb s GLU 68 Cb -0.10 -0.22 -0.01 0.00 -1.78 0.00 0.00 34.13 32.01 2fnb s GLU 68 CO 0.34 -0.07 1.06 -1.25 -0.49 0.00 0.00 175.26 174.84 2fnb s PRO 69 N 0.56 3.20 0.00 0.39 0.04 -1.26 -4.13 135.00 133.80 2fnb s PRO 69 Ca -0.05 0.72 0.00 0.00 0.04 0.00 0.00 61.00 61.71 2fnb s PRO 69 Cb -0.07 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.43 2fnb s PRO 69 CO -0.01 -0.85 0.00 0.41 0.04 0.00 0.00 177.00 176.59 2fnb n GLY 70 N -2.62 2.13 3.45 0.56 0.00 -0.90 -5.03 105.19 102.77 2fnb n GLY 70 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.31 2.74 -0.03 -0.61 1.09 -1.26 -4.90 121.20 115.92 2fnb s ILE 71 Ca 0.00 -1.23 -0.28 0.00 -1.10 0.00 0.00 60.65 58.04 2fnb s ILE 71 Cb 0.00 -2.15 -0.03 0.00 -1.06 0.00 0.00 42.46 39.22 2fnb s ILE 71 CO 0.00 0.32 0.92 -0.62 -0.10 0.00 0.00 174.94 175.46 2fnb s ASP 72 N -1.48 7.27 -0.13 3.58 -1.08 -1.26 -3.93 116.67 119.64 2fnb s ASP 72 Ca 0.15 1.54 0.02 0.00 -0.52 0.00 0.00 52.55 53.73 2fnb s ASP 72 Cb -0.10 -2.53 -0.00 0.00 -1.46 0.00 0.00 42.92 38.82 2fnb s ASP 72 CO 0.05 -0.25 -0.18 -0.31 0.52 0.00 0.00 175.17 175.00 2fnb s TYR 73 N 1.09 2.70 -1.01 -5.34 1.51 -0.25 -0.20 117.35 115.85 2fnb s TYR 73 Ca 0.48 -0.97 -0.20 0.00 -1.01 0.00 0.00 57.07 55.38 2fnb s TYR 73 Cb -0.20 -1.81 0.10 0.00 -0.11 0.00 0.00 41.96 39.94 2fnb s TYR 73 CO 0.25 -0.40 1.32 -0.51 -1.11 0.00 0.00 175.55 175.10 2fnb s ASP 74 N 0.53 6.63 -0.31 2.29 1.01 -0.25 -2.39 116.67 124.18 2fnb s ASP 74 Ca -0.12 -1.93 -0.25 0.00 0.71 0.00 0.00 52.55 50.96 2fnb s ASP 74 Cb -0.16 -2.48 0.01 0.00 1.01 0.00 0.00 42.92 41.30 2fnb s ASP 74 CO 0.04 -1.21 0.88 -0.63 0.21 0.00 0.00 175.17 174.47 2fnb s ILE 75 N 3.56 4.70 -0.04 0.77 1.09 -0.72 -3.07 121.20 127.49 2fnb s ILE 75 Ca 0.40 1.37 0.05 0.00 -1.10 0.00 0.00 60.65 61.36 2fnb s ILE 75 Cb -0.02 -4.24 -0.02 0.00 -1.06 0.00 0.00 42.46 37.12 2fnb s ILE 75 CO -0.08 -0.33 -0.17 -0.44 -0.10 0.00 0.00 174.94 173.83 2fnb s SER 76 N 1.63 3.82 -0.19 3.58 0.01 0.57 -1.25 113.70 121.86 2fnb s SER 76 Ca 0.37 -0.26 -0.04 0.00 1.31 0.00 0.00 55.95 57.33 2fnb s SER 76 Cb -0.13 -0.74 0.09 0.00 0.21 0.00 0.00 66.02 65.44 2fnb s SER 76 CO 0.13 0.34 0.23 -0.69 0.41 0.00 0.00 173.24 173.66 2fnb s VAL 77 N -0.70 -0.35 -0.01 3.43 1.01 -0.56 0.05 120.40 123.27 2fnb s VAL 77 Ca 0.11 -0.05 -0.00 0.00 0.00 0.00 0.00 61.98 62.04 2fnb s VAL 77 Cb -0.11 -0.64 -0.04 0.00 0.00 0.00 0.00 36.38 35.60 2fnb s VAL 77 CO 0.00 -0.15 0.05 -0.63 0.00 0.00 0.00 175.10 174.38 2fnb s ILE 78 N 2.35 4.56 -0.05 2.22 1.01 -0.00 -1.27 121.20 130.02 2fnb s ILE 78 Ca 0.06 -0.44 -0.01 0.00 0.00 0.00 0.00 60.65 60.26 2fnb s ILE 78 Cb -0.15 -3.06 -0.04 0.00 0.01 0.00 0.00 42.46 39.23 2fnb s ILE 78 CO -0.12 0.38 0.05 -0.89 0.00 0.00 0.00 174.94 174.37 2fnb s THR 79 N -1.14 4.61 -0.11 2.92 2.01 -1.26 -0.51 115.64 122.16 2fnb s THR 79 Ca 0.21 -0.30 -0.01 0.00 0.31 0.00 0.00 61.69 61.90 2fnb s THR 79 Cb -0.12 -3.03 0.03 0.00 0.01 0.00 0.00 72.50 69.39 2fnb s THR 79 CO 0.12 0.48 -0.03 -1.48 -0.69 0.00 0.00 174.62 173.02 2fnb s LEU 80 N -1.33 0.97 0.00 4.42 2.34 -1.18 -2.17 118.68 121.72 2fnb s LEU 80 Ca 0.18 -0.30 0.00 0.00 0.06 0.00 0.00 54.13 54.07 2fnb s LEU 80 Cb -0.12 -0.65 0.00 0.00 -0.56 0.00 0.00 46.19 44.87 2fnb s LEU 80 CO 0.08 -0.18 0.00 2.30 -1.06 0.00 0.00 176.35 177.49 2fnb n ILE 81 N 5.04 0.00 -1.46 1.48 -5.35 -0.42 -2.17 119.36 116.48 2fnb n ILE 81 Ca -0.10 0.00 -0.46 0.00 -0.27 0.00 0.00 62.75 61.92 2fnb n ILE 81 Cb 0.49 -0.14 -0.09 0.00 -1.74 0.00 0.00 39.64 38.17 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 -1.15 1.56 -3.34 7.28 5.15 -1.26 -3.63 115.26 119.86 2fnb n ASN 82 Ca 0.00 0.18 -0.23 0.00 -0.60 0.00 0.00 54.58 53.94 2fnb n ASN 82 Cb 0.00 -1.21 -0.01 0.00 -0.53 0.00 0.00 39.78 38.03 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 6.52 -0.48 3.58 8.20 0.00 -1.26 -4.86 105.19 116.88 2fnb n GLY 83 Ca 0.48 0.08 -0.15 0.00 0.00 0.00 0.00 46.02 46.43 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 -2.68 -0.53 0.05 -0.02 0.00 -1.24 -5.17 107.32 97.72 2fnb s GLY 84 Ca 0.39 1.73 0.08 0.00 0.00 0.00 0.00 44.72 46.92 2fnb s GLY 84 CO 0.47 1.37 -0.23 1.85 0.00 0.00 0.00 173.10 176.56 2fnb s GLU 85 N -0.40 1.52 0.00 2.90 2.12 -1.26 -1.30 118.70 122.29 2fnb s GLU 85 Ca -0.05 -1.01 0.00 0.00 0.36 0.00 0.00 54.97 54.27 2fnb s GLU 85 Cb -0.03 -1.67 0.00 0.00 0.26 0.00 0.00 34.13 32.69 2fnb s GLU 85 CO 0.05 0.43 0.00 0.43 -0.54 0.00 0.00 175.26 175.63 2fnb n SER 86 N 1.78 0.00 -4.95 -1.70 7.64 -0.92 -4.39 113.62 111.09 2fnb n SER 86 Ca -0.17 -0.54 -0.20 0.00 1.01 0.00 0.00 58.87 58.97 2fnb n SER 86 Cb 0.53 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.71 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 4.02 -0.39 -0.43 0.00 -1.26 -4.92 121.76 115.19 2fnb s ALA 87 Ca 0.00 -1.41 -0.28 0.00 0.00 0.00 0.00 51.96 50.27 2fnb s ALA 87 Cb 0.00 -1.59 -0.01 0.00 0.00 0.00 0.00 23.12 21.53 2fnb s ALA 87 CO 0.00 0.09 1.66 -1.25 0.00 0.00 0.00 175.76 176.26 2fnb s PRO 88 N -4.05 3.35 -1.08 0.00 0.04 -1.26 -4.63 135.00 127.36 2fnb s PRO 88 Ca 0.40 1.15 -0.19 0.00 0.04 0.00 0.00 61.00 62.40 2fnb s PRO 88 Cb -0.09 -4.16 0.10 0.00 0.04 0.00 0.00 34.50 30.39 2fnb s PRO 88 CO 0.29 -1.85 1.40 0.95 0.04 0.00 0.00 177.00 177.84 2fnb s THR 89 N 6.59 4.39 0.09 1.26 -4.23 -0.40 -4.92 115.64 118.43 2fnb s THR 89 Ca 0.72 -1.54 -0.09 0.00 -1.18 0.00 0.00 61.69 59.60 2fnb s THR 89 Cb -0.18 -4.98 -0.06 0.00 1.34 0.00 0.00 72.50 68.62 2fnb s THR 89 CO 0.32 -1.77 0.39 -0.89 -0.54 0.00 0.00 174.62 172.13 2fnb s THR 90 N 3.57 5.12 -0.09 3.99 2.01 -1.26 -1.50 115.64 127.48 2fnb s THR 90 Ca 0.43 0.34 -0.00 0.00 0.31 0.00 0.00 61.69 62.77 2fnb s THR 90 Cb -0.01 -3.63 0.02 0.00 0.01 0.00 0.00 72.50 68.89 2fnb s THR 90 CO -0.05 0.23 -0.05 -0.22 -0.69 0.00 0.00 174.62 173.84 2fnb s LEU 91 N -2.09 1.02 0.06 4.42 0.20 -0.38 -4.99 118.68 116.93 2fnb s LEU 91 Ca 0.35 -0.22 -0.18 0.00 0.69 0.00 0.00 54.13 54.77 2fnb s LEU 91 Cb -0.13 -0.68 -0.06 0.00 -0.43 0.00 0.00 46.19 44.88 2fnb s LEU 91 CO 0.19 -0.13 0.53 0.28 -0.29 0.00 0.00 176.35 176.93 2fnb s THR 92 N 1.68 4.82 0.15 3.68 -1.32 -1.26 -1.76 115.64 121.64 2fnb s THR 92 Ca 0.03 1.08 -0.16 0.00 -1.21 0.00 0.00 61.69 61.43 2fnb s THR 92 Cb -0.13 -3.83 0.03 0.00 -1.51 0.00 0.00 72.50 67.06 2fnb s THR 92 CO -0.06 0.53 0.44 -1.10 -2.21 0.00 0.00 174.62 172.22 2fnb s GLN 93 N -1.19 1.18 0.52 7.08 -1.52 -1.00 -4.99 119.66 119.74 2fnb s GLN 93 Ca 0.29 -0.79 0.06 0.00 -1.95 0.00 0.00 55.36 52.97 2fnb s GLN 93 Cb -0.18 0.48 0.05 0.00 -0.22 0.00 0.00 33.01 33.14 2fnb s GLN 93 CO 0.18 -0.48 0.72 -1.14 -0.25 0.00 0.00 175.29 174.32 2fnb s GLN 94 N -3.84 2.50 0.00 2.91 0.74 -1.26 -1.09 119.66 119.62 2fnb s GLN 94 Ca 0.06 -1.24 0.00 0.00 0.05 0.00 0.00 55.36 54.23 2fnb s GLN 94 Cb 0.01 -2.62 0.00 0.00 1.10 0.00 0.00 33.01 31.49 2fnb s GLN 94 CO -0.08 -0.65 0.46 0.25 -0.55 0.00 0.00 175.29 174.72