#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 0.27 0.00 0.03 3.03 -1.26 -5.08 118.95 115.95 2fnb s ARG 2 Ca 0.00 -0.37 0.00 0.00 2.03 0.00 0.00 55.73 57.39 2fnb s ARG 2 Cb 0.00 -0.09 0.00 0.00 -1.03 0.00 0.00 34.95 33.83 2fnb s ARG 2 CO 0.00 0.01 0.00 0.41 -1.13 0.00 0.00 175.30 174.59 2fnb n GLY 3 N 2.27 -1.45 2.95 3.88 0.00 -1.26 -5.17 105.19 106.41 2fnb n GLY 3 Ca -0.18 0.64 -0.14 0.00 0.00 0.00 0.00 46.02 46.33 2fnb n GLY 3 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fnb s SER 4 N 0.00 0.46 0.00 1.61 1.04 -1.26 -5.12 113.70 110.42 2fnb s SER 4 Ca 0.00 -0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.29 2fnb s SER 4 Cb 0.00 -0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.09 2fnb s SER 4 CO 0.00 -0.00 0.00 1.21 0.98 0.00 0.00 173.24 175.43 2fnb n GLU 5 N 2.75 0.00 -4.31 4.02 4.07 -1.26 -5.03 120.64 120.88 2fnb n GLU 5 Ca -0.14 0.00 -0.20 0.00 -0.06 0.00 0.00 57.16 56.76 2fnb n GLU 5 Cb 0.58 0.00 -0.16 0.00 -0.06 0.00 0.00 31.44 31.81 2fnb n GLU 5 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 2fnb s VAL 6 N 0.00 0.68 -0.03 6.31 1.01 -1.26 -5.11 120.40 122.00 2fnb s VAL 6 Ca 0.00 -0.29 -0.30 0.00 0.00 0.00 0.00 61.98 61.39 2fnb s VAL 6 Cb 0.00 -0.62 -0.06 0.00 0.00 0.00 0.00 36.38 35.70 2fnb s VAL 6 CO 0.00 0.22 1.64 -2.16 0.00 0.00 0.00 175.10 174.81 2fnb s PRO 7 N 0.31 4.19 0.90 2.72 0.04 -1.26 -4.45 135.00 137.45 2fnb s PRO 7 Ca -0.04 2.20 -0.13 0.00 0.04 0.00 0.00 61.00 63.07 2fnb s PRO 7 Cb -0.09 -3.90 0.14 0.00 0.04 0.00 0.00 34.50 30.68 2fnb s PRO 7 CO 0.00 -0.81 1.16 1.14 0.04 0.00 0.00 177.00 178.53 2fnb s GLN 8 N 3.73 1.19 -1.09 4.56 -2.07 -1.26 -4.73 119.66 119.99 2fnb s GLN 8 Ca 0.73 0.17 -0.22 0.00 -1.82 0.00 0.00 55.36 54.22 2fnb s GLN 8 Cb -0.34 -1.86 0.01 0.00 -1.09 0.00 0.00 33.01 29.74 2fnb s GLN 8 CO 0.30 -2.14 1.70 -0.51 -1.32 0.00 0.00 175.29 173.32 2fnb s LEU 9 N -5.95 3.45 0.66 2.60 1.43 -1.26 -4.81 118.68 114.79 2fnb s LEU 9 Ca 0.65 -1.56 0.43 0.00 -1.03 0.00 0.00 54.13 52.62 2fnb s LEU 9 Cb -0.13 -2.57 2.35 0.00 0.03 0.00 0.00 46.19 45.87 2fnb s LEU 9 CO 0.52 -1.91 2.35 0.74 0.23 0.00 0.00 176.35 178.28 2fnb h THR 10 N 6.50 0.03 -0.10 5.49 2.02 -1.94 -1.06 112.91 123.84 2fnb h THR 10 Ca 0.24 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.39 2fnb h THR 10 Cb 0.96 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.41 2fnb h THR 10 CO 1.36 0.00 0.00 0.47 0.37 0.00 0.00 175.52 177.72 2fnb n ASP 11 N -3.13 2.05 -4.62 4.18 8.00 -1.26 -4.96 116.55 116.81 2fnb n ASP 11 Ca -0.03 -1.71 -0.49 0.00 0.71 0.00 0.00 54.79 53.28 2fnb n ASP 11 Cb 0.08 -0.06 -0.05 0.00 -0.02 0.00 0.00 41.12 41.07 2fnb n ASP 11 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2fnb n LEU 12 N 0.58 3.04 -3.98 0.64 -0.00 -0.41 -4.30 117.00 112.58 2fnb n LEU 12 Ca 0.17 0.74 -0.08 0.00 -0.00 0.00 0.00 56.01 56.84 2fnb n LEU 12 Cb 0.42 -1.35 -0.09 0.00 -0.00 0.00 0.00 43.42 42.40 2fnb n LEU 12 CO 0.15 -0.33 -0.25 -0.44 -0.00 0.00 0.00 177.39 176.53 2fnb s SER 13 N 5.43 0.31 0.17 1.96 0.01 0.19 -5.01 113.70 116.77 2fnb s SER 13 Ca 0.98 -0.81 0.06 0.00 1.31 0.00 0.00 55.95 57.49 2fnb s SER 13 Cb -0.71 0.25 -0.04 0.00 0.21 0.00 0.00 66.02 65.74 2fnb s SER 13 CO 0.50 -0.63 0.11 -0.36 0.41 0.00 0.00 173.24 173.27 2fnb s PHE 14 N -3.71 3.08 0.25 2.43 0.08 -1.26 -0.80 117.98 118.05 2fnb s PHE 14 Ca 0.04 -0.05 0.01 0.00 0.12 0.00 0.00 56.93 57.06 2fnb s PHE 14 Cb 0.06 -1.48 -0.03 0.00 -0.57 0.00 0.00 43.02 41.00 2fnb s PHE 14 CO -0.10 0.52 0.20 0.14 -0.10 0.00 0.00 175.22 175.89 2fnb s VAL 15 N -1.77 0.00 -1.22 -0.44 -7.23 0.00 -4.81 120.40 104.93 2fnb s VAL 15 Ca 0.30 -1.96 -0.27 0.00 -1.81 0.00 0.00 61.98 58.24 2fnb s VAL 15 Cb -0.10 -2.49 0.02 0.00 0.56 0.00 0.00 36.38 34.37 2fnb s VAL 15 CO 0.22 0.00 0.67 -0.67 -0.31 0.00 0.00 175.10 175.01 2fnb n ASP 16 N -0.72 -4.03 -2.00 4.85 2.03 -1.26 -0.48 116.55 114.94 2fnb n ASP 16 Ca 0.04 -1.20 -0.08 0.00 0.52 0.00 0.00 54.79 54.07 2fnb n ASP 16 Cb 0.65 -2.29 -0.11 0.00 -0.72 0.00 0.00 41.12 38.65 2fnb n ASP 16 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2fnb n ILE 17 N -4.72 2.26 -1.19 5.18 2.08 -1.26 -3.14 119.36 118.57 2fnb n ILE 17 Ca -0.13 -1.05 -0.29 0.00 0.56 0.00 0.00 62.75 61.84 2fnb n ILE 17 Cb 0.59 -1.81 0.16 0.00 -0.75 0.00 0.00 39.64 37.82 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 1.20 2.40 -1.52 1.39 -1.32 -1.12 -4.92 115.64 111.74 2fnb s THR 18 Ca 0.44 0.13 0.21 0.00 -1.21 0.00 0.00 61.69 61.26 2fnb s THR 18 Cb 0.21 -2.62 0.41 0.00 -1.51 0.00 0.00 72.50 68.99 2fnb s THR 18 CO 0.00 -0.17 1.68 0.47 -2.21 0.00 0.00 174.62 174.39 2fnb n ASP 19 N -4.02 0.00 -0.00 8.08 9.92 -1.26 -3.36 116.55 125.91 2fnb n ASP 19 Ca 0.06 -0.13 0.00 0.00 -0.53 0.00 0.00 54.79 54.20 2fnb n ASP 19 Cb 0.56 -0.24 -0.00 0.00 -0.64 0.00 0.00 41.12 40.80 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 -1.24 0.41 -3.59 -2.24 3.41 -1.26 -4.42 113.62 104.69 2fnb n SER 20 Ca 0.11 -0.47 0.02 0.00 -0.26 0.00 0.00 58.87 58.27 2fnb n SER 20 Cb 0.15 1.00 -0.01 0.00 -0.26 0.00 0.00 64.21 65.10 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 -1.12 -0.03 -0.02 4.04 1.04 -1.21 -4.42 113.70 111.96 2fnb s SER 21 Ca 0.00 -0.06 0.01 0.00 0.48 0.00 0.00 55.95 56.39 2fnb s SER 21 Cb 0.00 0.08 0.01 0.00 0.10 0.00 0.00 66.02 66.21 2fnb s SER 21 CO 0.02 -0.14 -0.04 -0.51 0.98 0.00 0.00 173.24 173.55 2fnb s ILE 22 N -2.21 0.39 0.43 -1.02 2.07 -0.54 -2.81 121.20 117.51 2fnb s ILE 22 Ca 0.14 -0.13 -0.01 0.00 -1.41 0.00 0.00 60.65 59.25 2fnb s ILE 22 Cb 0.05 -0.38 -0.02 0.00 0.13 0.00 0.00 42.46 42.24 2fnb s ILE 22 CO -0.05 0.15 0.66 -0.83 -1.91 0.00 0.00 174.94 172.96 2fnb s GLY 23 N 0.40 1.49 0.04 1.50 0.00 0.36 -0.56 107.32 110.55 2fnb s GLY 23 Ca -0.04 -0.93 0.03 0.00 0.00 0.00 0.00 44.72 43.77 2fnb s GLY 23 CO -0.00 -0.79 -0.08 1.08 0.00 0.00 0.00 173.10 173.30 2fnb s LEU 24 N -4.52 2.22 0.04 0.66 1.02 0.61 -0.82 118.68 117.89 2fnb s LEU 24 Ca 0.46 -0.49 0.05 0.00 0.02 0.00 0.00 54.13 54.16 2fnb s LEU 24 Cb -0.10 -0.23 -0.02 0.00 0.02 0.00 0.00 46.19 45.86 2fnb s LEU 24 CO 0.38 -0.15 -0.14 -0.13 0.02 0.00 0.00 176.35 176.34 2fnb s ARG 25 N -1.39 0.92 0.38 1.70 0.52 0.02 -2.61 118.95 118.49 2fnb s ARG 25 Ca -0.07 -0.74 -0.08 0.00 -0.52 0.00 0.00 55.73 54.32 2fnb s ARG 25 Cb -0.09 -0.91 0.03 0.00 0.52 0.00 0.00 34.95 34.50 2fnb s ARG 25 CO 0.01 0.23 0.65 1.67 0.02 0.00 0.00 175.30 177.87 2fnb s TRP 26 N -0.83 0.66 -0.08 -0.53 -2.14 -0.58 -0.64 118.94 114.79 2fnb s TRP 26 Ca 0.01 -1.11 -0.05 0.00 2.66 0.00 0.00 56.10 57.60 2fnb s TRP 26 Cb -0.08 0.38 -0.04 0.00 -3.10 0.00 0.00 33.47 30.63 2fnb s TRP 26 CO 0.01 -1.40 0.14 0.99 -2.66 0.00 0.00 176.95 174.04 2fnb s THR 27 N -2.49 5.42 -0.09 0.66 2.01 -1.26 -4.57 115.64 115.32 2fnb s THR 27 Ca 0.24 0.07 -0.30 0.00 0.31 0.00 0.00 61.69 62.01 2fnb s THR 27 Cb -0.03 -3.41 -0.03 0.00 0.01 0.00 0.00 72.50 69.05 2fnb s THR 27 CO 0.17 0.53 1.19 -2.16 -0.69 0.00 0.00 174.62 173.66 2fnb s PRO 28 N -1.30 4.33 0.01 4.92 0.04 -1.26 -4.89 135.00 136.85 2fnb s PRO 28 Ca 0.19 1.64 -0.17 0.00 0.04 0.00 0.00 61.00 62.69 2fnb s PRO 28 Cb -0.12 -3.60 -0.35 0.00 0.04 0.00 0.00 34.50 30.47 2fnb s PRO 28 CO 0.08 -0.50 0.97 -0.07 0.04 0.00 0.00 177.00 177.52 2fnb h LEU 29 N 8.56 0.76 -1.96 -3.56 4.07 -1.89 -3.48 115.31 117.81 2fnb h LEU 29 Ca -0.32 -0.93 -0.55 0.00 0.08 0.00 0.00 57.88 56.16 2fnb h LEU 29 Cb 1.14 -0.25 -0.21 0.00 1.08 0.00 0.00 40.66 42.42 2fnb h LEU 29 CO 0.90 1.64 -0.86 -0.46 -1.08 0.00 0.00 178.44 178.59 2fnb n ASN 30 N -3.82 0.51 0.19 -0.43 0.23 -1.26 -4.89 115.26 105.79 2fnb n ASN 30 Ca -0.16 -1.14 -0.13 0.00 -0.53 0.00 0.00 54.58 52.62 2fnb n ASN 30 Cb 1.04 -1.42 -0.07 0.00 -2.08 0.00 0.00 39.78 37.25 2fnb n ASN 30 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 2fnb h SER 31 N -1.39 -1.04 0.00 0.53 0.02 -1.96 -3.49 113.55 106.22 2fnb h SER 31 Ca -0.58 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 2fnb h SER 31 Cb 1.25 0.35 0.00 0.00 0.14 0.00 0.00 62.40 64.14 2fnb h SER 31 CO 0.66 -0.47 0.00 -1.54 -1.14 0.00 0.00 176.83 174.34 2fnb n SER 32 N -4.63 0.00 0.00 3.07 3.41 -1.26 -4.98 113.62 109.23 2fnb n SER 32 Ca -0.08 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.66 2fnb n SER 32 Cb 0.33 0.00 0.69 0.00 -0.26 0.00 0.00 64.21 64.97 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 0.13 -1.10 6.66 -1.04 -1.26 -4.89 114.28 112.78 2fnb n THR 33 Ca 0.00 0.03 -0.43 0.00 -2.04 0.00 0.00 64.05 61.61 2fnb n THR 33 Cb 0.00 -0.60 -0.06 0.00 -1.82 0.00 0.00 70.33 67.85 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 -1.22 0.00 -0.05 12.58 0.00 -1.26 -4.33 119.36 125.08 2fnb n ILE 34 Ca 0.14 0.00 -0.02 0.00 0.00 0.00 0.00 62.75 62.87 2fnb n ILE 34 Cb 0.18 -0.06 -0.01 0.00 0.00 0.00 0.00 39.64 39.75 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 2.38 0.00 -0.15 9.51 5.03 -1.78 -3.48 117.51 129.02 2fnb h ILE 35 Ca -0.35 -0.83 0.00 0.00 -0.12 0.00 0.00 64.86 63.56 2fnb h ILE 35 Cb 1.01 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 34.80 2fnb h ILE 35 CO 0.50 0.00 0.00 0.61 -0.68 0.00 0.00 178.15 178.58 2fnb n GLY 36 N 1.74 0.82 3.08 5.37 0.00 -1.20 -4.11 105.19 110.88 2fnb n GLY 36 Ca -0.03 -0.62 -0.21 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 -2.10 1.12 -0.21 1.61 2.02 -1.26 -2.91 117.35 115.63 2fnb s TYR 37 Ca 0.00 -0.22 0.01 0.00 -0.37 0.00 0.00 57.07 56.49 2fnb s TYR 37 Cb 0.00 -0.73 0.04 0.00 -0.40 0.00 0.00 41.96 40.87 2fnb s TYR 37 CO 0.00 -0.03 -0.12 0.50 -1.57 0.00 0.00 175.55 174.33 2fnb s ARG 38 N -0.26 2.23 0.10 -0.62 3.00 -0.08 -2.79 118.95 120.53 2fnb s ARG 38 Ca 0.04 -0.95 -0.12 0.00 -1.00 0.00 0.00 55.73 53.70 2fnb s ARG 38 Cb -0.05 -2.54 -0.06 0.00 0.00 0.00 0.00 34.95 32.29 2fnb s ARG 38 CO -0.00 -0.42 0.45 0.42 0.00 0.00 0.00 175.30 175.75 2fnb s ILE 39 N 1.32 5.00 -0.03 4.11 1.09 -0.08 -0.85 121.20 131.76 2fnb s ILE 39 Ca -0.02 0.62 -0.00 0.00 -1.10 0.00 0.00 60.65 60.15 2fnb s ILE 39 Cb -0.16 -3.68 0.03 0.00 -1.06 0.00 0.00 42.46 37.58 2fnb s ILE 39 CO -0.08 0.30 0.01 -0.89 -0.10 0.00 0.00 174.94 174.18 2fnb s THR 40 N -1.39 0.10 -0.01 2.92 2.01 0.28 -1.17 115.64 118.38 2fnb s THR 40 Ca 0.34 0.16 -0.00 0.00 0.31 0.00 0.00 61.69 62.50 2fnb s THR 40 Cb -0.15 -0.23 -0.04 0.00 0.01 0.00 0.00 72.50 72.10 2fnb s THR 40 CO 0.18 0.15 0.06 0.68 -0.69 0.00 0.00 174.62 174.99 2fnb s VAL 41 N 1.25 4.58 0.16 3.82 -7.23 -1.25 -0.45 120.40 121.28 2fnb s VAL 41 Ca -0.07 -0.44 0.01 0.00 -1.81 0.00 0.00 61.98 59.67 2fnb s VAL 41 Cb -0.13 -3.07 -0.04 0.00 0.56 0.00 0.00 36.38 33.69 2fnb s VAL 41 CO -0.02 0.37 0.02 0.68 -0.31 0.00 0.00 175.10 175.84 2fnb s VAL 42 N -1.15 0.49 -0.09 1.32 -7.23 -0.59 -0.63 120.40 112.52 2fnb s VAL 42 Ca 0.21 -1.96 -0.30 0.00 -1.81 0.00 0.00 61.98 58.13 2fnb s VAL 42 Cb -0.12 -2.10 -0.02 0.00 0.56 0.00 0.00 36.38 34.70 2fnb s VAL 42 CO 0.12 -0.47 1.09 0.00 -0.31 0.00 0.00 175.10 175.54 2fnb s ALA 43 N -3.79 3.45 -0.72 1.32 0.00 -0.45 -1.60 121.76 119.98 2fnb s ALA 43 Ca 0.24 0.47 -0.26 0.00 0.00 0.00 0.00 51.96 52.42 2fnb s ALA 43 Cb 0.07 -3.48 -0.05 0.00 0.00 0.00 0.00 23.12 19.66 2fnb s ALA 43 CO 0.03 -0.69 2.03 0.00 0.00 0.00 0.00 175.76 177.13 2fnb s ALA 44 N 2.15 1.74 0.00 0.00 0.00 0.25 -3.27 121.76 122.64 2fnb s ALA 44 Ca 0.51 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.60 2fnb s ALA 44 Cb -0.21 -4.43 0.00 0.00 0.00 0.00 0.00 23.12 18.48 2fnb s ALA 44 CO 0.19 -4.54 0.00 0.41 0.00 0.00 0.00 175.76 171.82 2fnb n GLY 45 N 6.27 0.96 3.15 0.00 0.00 -1.26 -4.64 105.19 109.68 2fnb n GLY 45 Ca 0.33 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.25 2fnb n GLY 45 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2fnb s GLU 46 N 0.00 0.64 0.00 1.61 2.12 -1.20 -5.04 118.70 116.82 2fnb s GLU 46 Ca 0.00 -0.67 0.00 0.00 0.36 0.00 0.00 54.97 54.66 2fnb s GLU 46 Cb 0.00 0.26 0.00 0.00 0.26 0.00 0.00 34.13 34.65 2fnb s GLU 46 CO 0.00 -0.17 0.46 0.41 -0.54 0.00 0.00 175.26 175.42 2fnb n GLY 47 N 0.76 -0.20 3.43 -1.50 0.00 -1.26 -3.98 105.19 102.45 2fnb n GLY 47 Ca -0.19 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.35 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 -0.32 0.04 -3.02 -0.61 5.41 -1.26 -4.92 119.36 114.67 2fnb n ILE 48 Ca 0.00 -0.18 -0.28 0.00 1.00 0.00 0.00 62.75 63.30 2fnb n ILE 48 Cb 0.03 -1.11 -0.02 0.00 -0.71 0.00 0.00 39.64 37.84 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 7.42 3.60 -0.46 0.38 0.04 -1.26 -1.34 135.00 143.38 2fnb s PRO 49 Ca 1.20 0.09 0.08 0.00 0.04 0.00 0.00 61.00 62.41 2fnb s PRO 49 Cb -1.07 -2.51 0.29 0.00 0.04 0.00 0.00 34.50 31.25 2fnb s PRO 49 CO 0.50 0.01 0.68 -0.89 0.04 0.00 0.00 177.00 177.35 2fnb n ILE 50 N -1.61 0.56 -1.13 0.56 2.08 0.19 -4.95 119.36 115.07 2fnb n ILE 50 Ca -0.01 -4.63 0.14 0.00 0.56 0.00 0.00 62.75 58.82 2fnb n ILE 50 Cb 0.55 -1.42 -0.04 0.00 -0.75 0.00 0.00 39.64 37.97 2fnb n ILE 50 CO 0.00 0.00 0.00 2.22 0.56 0.00 0.00 176.55 179.33 2fnb n PHE 51 N 0.75 -2.73 -4.26 1.39 -1.74 -1.26 -4.02 117.46 105.58 2fnb n PHE 51 Ca 0.25 1.39 -0.26 0.00 -0.56 0.00 0.00 57.45 58.28 2fnb n PHE 51 Cb 0.52 -2.48 -0.17 0.00 1.52 0.00 0.00 39.48 38.87 2fnb n PHE 51 CO 0.00 0.00 0.00 -1.83 -0.56 0.00 0.00 176.76 174.37 2fnb s GLU 52 N -2.44 1.61 0.31 3.97 -1.05 -1.26 -3.79 118.70 116.06 2fnb s GLU 52 Ca 0.00 -0.34 0.07 0.00 -0.15 0.00 0.00 54.97 54.55 2fnb s GLU 52 Cb 0.00 -1.49 -0.03 0.00 -0.44 0.00 0.00 34.13 32.17 2fnb s GLU 52 CO 0.00 -0.11 0.28 0.34 0.95 0.00 0.00 175.26 176.72 2fnb s ASP 53 N 1.15 5.43 0.17 0.83 -1.08 -0.32 -4.97 116.67 117.89 2fnb s ASP 53 Ca -0.05 -0.39 0.03 0.00 -0.52 0.00 0.00 52.55 51.62 2fnb s ASP 53 Cb -0.14 -1.13 -0.05 0.00 -1.46 0.00 0.00 42.92 40.14 2fnb s ASP 53 CO -0.02 -0.27 -0.05 -0.36 0.52 0.00 0.00 175.17 174.99 2fnb s PHE 54 N -2.24 1.27 0.35 -5.34 0.08 -1.26 -0.90 117.98 109.94 2fnb s PHE 54 Ca 0.39 -0.88 0.02 0.00 0.12 0.00 0.00 56.93 56.57 2fnb s PHE 54 Cb -0.07 -0.70 -0.01 0.00 -0.57 0.00 0.00 43.02 41.68 2fnb s PHE 54 CO 0.27 -0.05 0.06 1.33 -0.10 0.00 0.00 175.22 176.72 2fnb n VAL 55 N -0.24 0.00 0.20 -0.44 0.24 -1.12 -4.98 118.33 111.99 2fnb n VAL 55 Ca -0.08 -1.84 -0.08 0.00 -2.04 0.00 0.00 64.34 60.30 2fnb n VAL 55 Cb 0.62 0.52 -0.04 0.00 -1.47 0.00 0.00 33.84 33.47 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 1.10 -0.42 0.00 -1.34 3.58 -1.92 -3.41 116.42 114.00 2fnb h ASP 56 Ca -0.28 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.18 2fnb h ASP 56 Cb 0.96 0.11 0.00 0.00 1.72 0.00 0.00 39.33 42.12 2fnb h ASP 56 CO 0.46 -0.29 0.00 -1.54 -2.88 0.00 0.00 179.24 174.99 2fnb n SER 57 N -3.42 0.00 -0.06 2.28 3.41 -1.26 -4.70 113.62 109.88 2fnb n SER 57 Ca -0.06 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.60 2fnb n SER 57 Cb 0.20 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.22 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 2.05 -4.76 4.04 3.41 -1.26 -4.75 113.62 112.35 2fnb n SER 58 Ca 0.00 -2.55 -0.39 0.00 -0.26 0.00 0.00 58.87 55.66 2fnb n SER 58 Cb 0.00 -0.24 -0.04 0.00 -0.26 0.00 0.00 64.21 63.67 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 -1.93 3.57 -0.08 -3.33 1.01 -1.26 -4.83 120.40 113.54 2fnb s VAL 59 Ca 0.17 1.50 0.01 0.00 0.00 0.00 0.00 61.98 63.65 2fnb s VAL 59 Cb 0.15 -3.92 0.01 0.00 0.00 0.00 0.00 36.38 32.62 2fnb s VAL 59 CO 0.02 0.29 0.54 0.61 0.00 0.00 0.00 175.10 176.56 2fnb n GLY 60 N 1.03 -1.22 3.00 4.51 0.00 -1.26 -4.25 105.19 107.00 2fnb n GLY 60 Ca 0.00 -0.02 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.10 -0.28 0.23 1.61 6.14 -1.26 -1.53 117.35 122.15 2fnb s TYR 61 Ca 0.01 0.71 -0.11 0.00 0.64 0.00 0.00 57.07 58.32 2fnb s TYR 61 Cb 0.01 -0.02 -0.01 0.00 0.42 0.00 0.00 41.96 42.36 2fnb s TYR 61 CO 0.01 -0.23 0.40 -0.47 0.64 0.00 0.00 175.55 175.90 2fnb s TYR 62 N 1.42 0.47 -0.15 4.97 5.04 -1.07 -5.02 117.35 123.00 2fnb s TYR 62 Ca -0.07 -0.81 -0.14 0.00 -2.44 0.00 0.00 57.07 53.60 2fnb s TYR 62 Cb -0.11 0.05 0.04 0.00 0.35 0.00 0.00 41.96 42.29 2fnb s TYR 62 CO -0.08 -0.90 0.41 0.99 -1.34 0.00 0.00 175.55 174.64 2fnb s THR 63 N -4.03 0.00 0.15 4.34 2.01 -1.26 -0.28 115.64 116.58 2fnb s THR 63 Ca 0.24 -0.01 0.09 0.00 0.31 0.00 0.00 61.69 62.31 2fnb s THR 63 Cb 0.01 -0.58 -0.04 0.00 0.01 0.00 0.00 72.50 71.90 2fnb s THR 63 CO 0.08 -0.01 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.19 2fnb s VAL 64 N 0.16 3.14 0.00 3.82 1.01 0.27 -4.98 120.40 123.83 2fnb s VAL 64 Ca -0.00 -1.56 0.00 0.00 0.00 0.00 0.00 61.98 60.42 2fnb s VAL 64 Cb -0.03 -2.52 -0.00 0.00 0.00 0.00 0.00 36.38 33.84 2fnb s VAL 64 CO 0.01 -0.02 0.00 0.41 0.00 0.00 0.00 175.10 175.50 2fnb n THR 65 N 0.33 0.00 -1.88 3.92 -1.04 -1.26 -1.47 114.28 112.88 2fnb n THR 65 Ca -0.12 -0.03 -0.13 0.00 -2.04 0.00 0.00 64.05 61.73 2fnb n THR 65 Cb 0.54 0.01 -0.03 0.00 -1.82 0.00 0.00 70.33 69.04 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 1.37 0.49 3.89 3.41 0.00 -1.26 -5.00 105.19 108.09 2fnb n GLY 66 Ca -0.00 -0.37 -0.29 0.00 0.00 0.00 0.00 46.02 45.36 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 -3.41 2.98 -0.25 0.99 1.43 -1.26 -5.05 118.68 114.11 2fnb s LEU 67 Ca 0.00 1.01 -0.02 0.00 -1.03 0.00 0.00 54.13 54.08 2fnb s LEU 67 Cb 0.00 -3.80 0.08 0.00 0.03 0.00 0.00 46.19 42.50 2fnb s LEU 67 CO 0.00 -1.28 0.08 -0.70 0.23 0.00 0.00 176.35 174.68 2fnb s GLU 68 N -5.26 0.55 0.32 1.70 -6.30 -1.26 -4.93 118.70 103.52 2fnb s GLU 68 Ca 0.57 -0.65 -0.29 0.00 -2.50 0.00 0.00 54.97 52.10 2fnb s GLU 68 Cb -0.11 -1.86 -0.10 0.00 0.00 0.00 0.00 34.13 32.06 2fnb s GLU 68 CO 0.50 -0.84 1.24 -1.25 0.02 0.00 0.00 175.26 174.93 2fnb s PRO 69 N 1.84 4.42 0.00 4.30 0.04 -1.26 -3.55 135.00 140.79 2fnb s PRO 69 Ca 0.05 2.08 0.00 0.00 0.04 0.00 0.00 61.00 63.17 2fnb s PRO 69 Cb -0.17 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.29 2fnb s PRO 69 CO -0.20 -0.08 0.00 0.41 0.04 0.00 0.00 177.00 177.17 2fnb n GLY 70 N 0.90 0.24 3.91 0.56 0.00 -1.26 -5.03 105.19 104.51 2fnb n GLY 70 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.00 4.93 -0.19 -0.61 1.09 -1.23 -4.92 121.20 118.26 2fnb s ILE 71 Ca 0.00 0.15 -0.11 0.00 -1.10 0.00 0.00 60.65 59.58 2fnb s ILE 71 Cb 0.00 -3.83 -0.05 0.00 -1.06 0.00 0.00 42.46 37.52 2fnb s ILE 71 CO 0.00 -0.69 0.19 -0.62 -0.10 0.00 0.00 174.94 173.72 2fnb s ASP 72 N -3.83 6.27 -0.07 3.58 2.15 -1.26 -3.33 116.67 120.18 2fnb s ASP 72 Ca 0.46 0.30 0.05 0.00 0.43 0.00 0.00 52.55 53.80 2fnb s ASP 72 Cb -0.10 -2.12 -0.01 0.00 -0.30 0.00 0.00 42.92 40.39 2fnb s ASP 72 CO 0.40 0.14 -0.24 -0.31 -0.17 0.00 0.00 175.17 174.98 2fnb s TYR 73 N 0.50 2.44 -0.32 -5.34 1.51 -0.18 -0.58 117.35 115.38 2fnb s TYR 73 Ca 0.11 -0.80 -0.25 0.00 -1.01 0.00 0.00 57.07 55.11 2fnb s TYR 73 Cb -0.12 -1.61 0.01 0.00 -0.11 0.00 0.00 41.96 40.13 2fnb s TYR 73 CO 0.01 -0.27 0.89 -0.51 -1.11 0.00 0.00 175.55 174.56 2fnb s ASP 74 N -0.02 6.74 -0.42 2.29 1.01 -0.63 -1.21 116.67 124.43 2fnb s ASP 74 Ca -0.08 0.76 -0.10 0.00 0.71 0.00 0.00 52.55 53.84 2fnb s ASP 74 Cb -0.15 -2.46 0.08 0.00 1.01 0.00 0.00 42.92 41.40 2fnb s ASP 74 CO 0.05 -0.73 0.28 -0.63 0.21 0.00 0.00 175.17 174.34 2fnb s ILE 75 N 3.24 4.36 0.10 0.77 1.09 -0.24 -1.54 121.20 128.98 2fnb s ILE 75 Ca 0.37 -1.35 -0.11 0.00 -1.10 0.00 0.00 60.65 58.46 2fnb s ILE 75 Cb -0.13 -3.66 -0.06 0.00 -1.06 0.00 0.00 42.46 37.55 2fnb s ILE 75 CO 0.14 -0.51 0.45 -0.44 -0.10 0.00 0.00 174.94 174.48 2fnb s SER 76 N 2.16 6.70 -0.31 3.58 0.01 0.40 -1.74 113.70 124.51 2fnb s SER 76 Ca 0.03 0.89 -0.01 0.00 1.31 0.00 0.00 55.95 58.18 2fnb s SER 76 Cb -0.23 -2.22 0.13 0.00 0.21 0.00 0.00 66.02 63.92 2fnb s SER 76 CO 0.03 0.15 0.27 -0.69 0.41 0.00 0.00 173.24 173.40 2fnb s VAL 77 N -1.42 -0.27 -0.20 3.43 1.01 -0.57 -0.56 120.40 121.82 2fnb s VAL 77 Ca 0.35 -0.74 -0.10 0.00 0.00 0.00 0.00 61.98 61.49 2fnb s VAL 77 Cb -0.14 -0.94 -0.05 0.00 0.00 0.00 0.00 36.38 35.25 2fnb s VAL 77 CO 0.18 -0.59 0.12 -0.63 0.00 0.00 0.00 175.10 174.18 2fnb s ILE 78 N 2.03 5.28 -0.18 2.22 1.01 -0.03 -3.33 121.20 128.20 2fnb s ILE 78 Ca 0.11 0.14 -0.17 0.00 0.00 0.00 0.00 60.65 60.74 2fnb s ILE 78 Cb -0.15 -3.41 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 2fnb s ILE 78 CO -0.26 0.44 0.45 -0.89 0.00 0.00 0.00 174.94 174.69 2fnb s THR 79 N 0.39 5.17 -0.13 2.92 2.01 -1.26 -0.90 115.64 123.84 2fnb s THR 79 Ca 0.07 0.84 0.01 0.00 0.31 0.00 0.00 61.69 62.92 2fnb s THR 79 Cb -0.11 -3.78 0.02 0.00 0.01 0.00 0.00 72.50 68.63 2fnb s THR 79 CO -0.01 0.24 -0.15 -1.48 -0.69 0.00 0.00 174.62 172.53 2fnb s LEU 80 N 1.26 1.75 0.00 4.42 2.34 -1.14 -1.13 118.68 126.17 2fnb s LEU 80 Ca 0.22 -0.47 0.00 0.00 0.06 0.00 0.00 54.13 53.94 2fnb s LEU 80 Cb -0.15 -1.16 0.00 0.00 -0.56 0.00 0.00 46.19 44.32 2fnb s LEU 80 CO 0.09 -0.00 0.00 2.30 -1.06 0.00 0.00 176.35 177.67 2fnb n ILE 81 N 4.40 0.00 -1.47 1.48 -5.35 0.36 -3.04 119.36 115.75 2fnb n ILE 81 Ca -0.18 0.00 -0.40 0.00 -0.27 0.00 0.00 62.75 61.90 2fnb n ILE 81 Cb 0.51 -0.21 -0.15 0.00 -1.74 0.00 0.00 39.64 38.05 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 -0.69 0.25 -2.71 7.28 5.15 -1.26 -3.25 115.26 120.03 2fnb n ASN 82 Ca 0.00 0.16 -0.11 0.00 -0.60 0.00 0.00 54.58 54.04 2fnb n ASN 82 Cb 0.00 -0.89 -0.01 0.00 -0.53 0.00 0.00 39.78 38.35 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 6.34 -0.49 3.30 8.20 0.00 -1.26 -4.89 105.19 116.40 2fnb n GLY 83 Ca 0.65 0.02 -0.14 0.00 0.00 0.00 0.00 46.02 46.55 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 -2.18 -0.28 -0.03 -0.02 0.00 -1.20 -5.16 107.32 98.44 2fnb s GLY 84 Ca 0.10 0.88 0.01 0.00 0.00 0.00 0.00 44.72 45.72 2fnb s GLY 84 CO 0.13 0.68 -0.03 -0.54 0.00 0.00 0.00 173.10 173.33 2fnb s GLU 85 N -0.48 2.75 0.62 2.90 2.02 -1.26 -0.48 118.70 124.77 2fnb s GLU 85 Ca -0.06 -0.59 -0.07 0.00 0.02 0.00 0.00 54.97 54.27 2fnb s GLU 85 Cb -0.03 -2.63 0.14 0.00 0.10 0.00 0.00 34.13 31.70 2fnb s GLU 85 CO 0.03 0.64 0.85 0.43 0.02 0.00 0.00 175.26 177.23 2fnb n SER 86 N 1.79 0.44 -4.75 -0.19 7.64 -0.28 -4.60 113.62 113.67 2fnb n SER 86 Ca -0.16 -1.54 -0.35 0.00 1.01 0.00 0.00 58.87 57.82 2fnb n SER 86 Cb 0.53 -0.62 0.05 0.00 -1.01 0.00 0.00 64.21 63.16 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 -3.60 2.43 -0.48 -0.43 0.00 -1.26 -4.79 121.76 113.63 2fnb s ALA 87 Ca 0.51 0.96 -0.27 0.00 0.00 0.00 0.00 51.96 53.16 2fnb s ALA 87 Cb -0.02 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 2fnb s ALA 87 CO 0.35 -1.36 1.91 -1.25 0.00 0.00 0.00 175.76 175.41 2fnb s PRO 88 N -3.52 2.84 -0.76 0.00 0.04 -1.26 -4.63 135.00 127.71 2fnb s PRO 88 Ca 0.76 1.05 -0.24 0.00 0.04 0.00 0.00 61.00 62.61 2fnb s PRO 88 Cb -0.30 -4.34 0.06 0.00 0.04 0.00 0.00 34.50 29.96 2fnb s PRO 88 CO 0.37 -2.45 1.16 0.99 0.04 0.00 0.00 177.00 177.11 2fnb s THR 89 N 8.61 4.07 -0.11 1.26 2.01 -1.21 -4.97 115.64 125.29 2fnb s THR 89 Ca 0.76 -0.21 0.02 0.00 0.31 0.00 0.00 61.69 62.57 2fnb s THR 89 Cb -0.17 -4.83 0.01 0.00 0.01 0.00 0.00 72.50 67.52 2fnb s THR 89 CO 0.27 -1.68 -0.19 -0.89 -0.69 0.00 0.00 174.62 171.44 2fnb s THR 90 N 4.71 1.75 0.03 -0.82 2.01 -1.26 -1.52 115.64 120.54 2fnb s THR 90 Ca 0.31 -0.81 0.09 0.00 0.31 0.00 0.00 61.69 61.59 2fnb s THR 90 Cb -0.10 -1.56 -0.03 0.00 0.01 0.00 0.00 72.50 70.82 2fnb s THR 90 CO 0.08 0.49 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.49 2fnb s LEU 91 N 0.80 2.21 -0.40 4.42 1.43 -0.71 -4.96 118.68 121.48 2fnb s LEU 91 Ca -0.09 -0.53 -0.14 0.00 -1.03 0.00 0.00 54.13 52.34 2fnb s LEU 91 Cb -0.16 -1.33 0.02 0.00 0.03 0.00 0.00 46.19 44.75 2fnb s LEU 91 CO 0.00 0.28 0.28 -0.89 0.23 0.00 0.00 176.35 176.25 2fnb s THR 92 N -0.77 5.13 -0.21 5.49 2.01 -1.26 -1.08 115.64 124.95 2fnb s THR 92 Ca 0.12 -0.67 -0.05 0.00 0.31 0.00 0.00 61.69 61.39 2fnb s THR 92 Cb -0.10 -3.85 -0.02 0.00 0.01 0.00 0.00 72.50 68.54 2fnb s THR 92 CO 0.02 -0.28 0.01 -1.58 -0.69 0.00 0.00 174.62 172.10 2fnb s GLN 93 N 1.66 3.61 0.14 4.92 2.00 -0.35 -4.94 119.66 126.69 2fnb s GLN 93 Ca 0.05 -0.52 -0.30 0.00 -2.00 0.00 0.00 55.36 52.58 2fnb s GLN 93 Cb -0.19 -3.12 -0.07 0.00 0.80 0.00 0.00 33.01 30.43 2fnb s GLN 93 CO 0.09 -0.04 1.11 -1.14 -0.50 0.00 0.00 175.29 174.82 2fnb s GLN 94 N 1.15 4.55 0.00 1.67 0.74 -1.26 -1.02 119.66 125.49 2fnb s GLN 94 Ca 0.03 1.71 0.11 0.00 0.05 0.00 0.00 55.36 57.26 2fnb s GLN 94 Cb -0.14 -3.30 0.09 0.00 1.10 0.00 0.00 33.01 30.75 2fnb s GLN 94 CO 0.02 -0.01 0.84 2.41 -0.55 0.00 0.00 175.29 178.00