#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 0.73 0.14 2.12 1.70 -1.26 -5.13 118.95 117.25 2fnb s ARG 2 Ca 0.00 1.08 0.00 0.00 -0.47 0.00 0.00 55.73 56.34 2fnb s ARG 2 Cb 0.00 0.25 0.00 0.00 -0.57 0.00 0.00 34.95 34.63 2fnb s ARG 2 CO 0.00 -0.12 0.00 0.41 -1.08 0.00 0.00 175.30 174.51 2fnb n GLY 3 N 3.55 -3.32 1.25 3.88 0.00 -1.26 -5.07 105.19 104.21 2fnb n GLY 3 Ca -0.17 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.76 2fnb n GLY 3 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2fnb n SER 4 N -1.24 -6.93 -0.00 1.61 7.64 -1.26 -5.08 113.62 108.35 2fnb n SER 4 Ca 0.00 0.89 -0.01 0.00 1.01 0.00 0.00 58.87 60.77 2fnb n SER 4 Cb 0.04 -3.05 -0.00 0.00 -1.01 0.00 0.00 64.21 60.19 2fnb n SER 4 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2fnb n GLU 5 N 0.23 0.03 -4.34 1.43 4.07 -1.26 -4.94 120.64 115.86 2fnb n GLU 5 Ca 0.00 0.01 -0.19 0.00 -0.06 0.00 0.00 57.16 56.92 2fnb n GLU 5 Cb 0.00 -0.36 -0.15 0.00 -0.06 0.00 0.00 31.44 30.87 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 -1.17 0.70 0.24 6.31 1.01 -1.26 -5.11 120.40 121.11 2fnb s VAL 6 Ca -0.02 -0.33 -0.30 0.00 0.00 0.00 0.00 61.98 61.34 2fnb s VAL 6 Cb 0.00 -0.62 -0.09 0.00 0.00 0.00 0.00 36.38 35.67 2fnb s VAL 6 CO 0.03 0.22 1.28 -2.16 0.00 0.00 0.00 175.10 174.47 2fnb s PRO 7 N 0.14 4.42 0.48 2.72 0.04 -1.26 -4.33 135.00 137.20 2fnb s PRO 7 Ca -0.02 2.06 0.03 0.00 0.04 0.00 0.00 61.00 63.11 2fnb s PRO 7 Cb -0.07 -3.17 0.02 0.00 0.04 0.00 0.00 34.50 31.32 2fnb s PRO 7 CO 0.00 -0.17 0.67 1.14 0.04 0.00 0.00 177.00 178.68 2fnb s GLN 8 N -0.68 2.78 -1.25 4.56 -2.07 -1.26 -4.68 119.66 117.06 2fnb s GLN 8 Ca 0.53 -0.84 -0.20 0.00 -1.82 0.00 0.00 55.36 53.03 2fnb s GLN 8 Cb -0.37 -2.60 0.01 0.00 -1.09 0.00 0.00 33.01 28.96 2fnb s GLN 8 CO 0.42 -0.43 1.81 -0.51 -1.32 0.00 0.00 175.29 175.26 2fnb s LEU 9 N -4.56 3.52 0.58 2.60 1.43 -1.26 -4.74 118.68 116.25 2fnb s LEU 9 Ca 0.53 -2.12 0.36 0.00 -1.03 0.00 0.00 54.13 51.87 2fnb s LEU 9 Cb -0.10 -2.58 1.69 0.00 0.03 0.00 0.00 46.19 45.22 2fnb s LEU 9 CO 0.36 -1.94 2.11 0.74 0.23 0.00 0.00 176.35 177.85 2fnb h THR 10 N 5.83 0.12 -0.14 5.49 2.02 -1.95 -1.86 112.91 122.42 2fnb h THR 10 Ca 0.35 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 67.14 2fnb h THR 10 Cb 0.90 1.34 0.00 0.00 -1.74 0.00 0.00 68.15 68.65 2fnb h THR 10 CO 1.37 0.03 0.00 -0.67 0.37 0.00 0.00 175.52 176.62 2fnb n ASP 11 N -3.19 0.96 -4.66 4.18 2.03 -1.26 -4.92 116.55 109.69 2fnb n ASP 11 Ca -0.01 -1.80 -0.42 0.00 0.52 0.00 0.00 54.79 53.08 2fnb n ASP 11 Cb 0.23 -0.09 -0.03 0.00 -0.72 0.00 0.00 41.12 40.51 2fnb n ASP 11 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2fnb s LEU 12 N -1.27 4.38 0.16 -2.67 1.98 -0.70 -4.13 118.68 116.43 2fnb s LEU 12 Ca 0.21 2.48 0.01 0.00 -2.89 0.00 0.00 54.13 53.94 2fnb s LEU 12 Cb 0.11 -3.54 -0.04 0.00 0.66 0.00 0.00 46.19 43.38 2fnb s LEU 12 CO 0.16 -0.98 0.02 -0.94 -1.89 0.00 0.00 176.35 172.72 2fnb s SER 13 N 3.71 0.91 0.13 3.68 1.04 0.10 -5.00 113.70 118.27 2fnb s SER 13 Ca 0.80 -1.20 0.06 0.00 0.48 0.00 0.00 55.95 56.10 2fnb s SER 13 Cb -0.39 0.18 -0.04 0.00 0.10 0.00 0.00 66.02 65.87 2fnb s SER 13 CO 0.35 -0.63 0.01 -0.36 0.98 0.00 0.00 173.24 173.60 2fnb s PHE 14 N -3.79 2.96 0.20 5.02 0.08 -1.26 -0.54 117.98 120.64 2fnb s PHE 14 Ca 0.25 -0.06 -0.06 0.00 0.12 0.00 0.00 56.93 57.17 2fnb s PHE 14 Cb 0.07 -1.48 -0.02 0.00 -0.57 0.00 0.00 43.02 41.01 2fnb s PHE 14 CO 0.04 0.49 0.26 0.14 -0.10 0.00 0.00 175.22 176.05 2fnb s VAL 15 N -1.49 0.02 -1.14 -0.44 -7.23 -0.36 -4.88 120.40 104.88 2fnb s VAL 15 Ca 0.27 -1.70 -0.28 0.00 -1.81 0.00 0.00 61.98 58.46 2fnb s VAL 15 Cb -0.11 -2.24 0.03 0.00 0.56 0.00 0.00 36.38 34.63 2fnb s VAL 15 CO 0.19 -0.10 0.69 0.47 -0.31 0.00 0.00 175.10 176.04 2fnb n ASP 16 N -0.28 -4.47 -2.95 4.85 8.00 -1.26 -0.35 116.55 120.09 2fnb n ASP 16 Ca -0.02 -1.20 -0.32 0.00 0.71 0.00 0.00 54.79 53.97 2fnb n ASP 16 Cb 0.64 -1.96 -0.07 0.00 -0.02 0.00 0.00 41.12 39.71 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 -4.56 4.00 -2.17 0.53 2.08 -1.26 -3.45 119.36 114.53 2fnb n ILE 17 Ca -0.14 -2.39 -0.26 0.00 0.56 0.00 0.00 62.75 60.52 2fnb n ILE 17 Cb 0.58 -2.41 0.08 0.00 -0.75 0.00 0.00 39.64 37.15 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 1.60 2.22 -2.00 1.39 -1.32 -1.20 -4.98 115.64 111.36 2fnb s THR 18 Ca 0.68 -0.24 0.17 0.00 -1.21 0.00 0.00 61.69 61.09 2fnb s THR 18 Cb 0.22 -2.98 0.50 0.00 -1.51 0.00 0.00 72.50 68.73 2fnb s THR 18 CO -0.05 0.00 1.49 0.47 -2.21 0.00 0.00 174.62 174.32 2fnb n ASP 19 N -3.01 0.00 0.00 8.08 9.92 -1.26 -3.53 116.55 126.75 2fnb n ASP 19 Ca 0.09 -0.87 0.00 0.00 -0.53 0.00 0.00 54.79 53.47 2fnb n ASP 19 Cb 0.60 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.08 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 -0.88 2.19 -3.63 -2.24 3.41 -1.26 -4.74 113.62 106.46 2fnb n SER 20 Ca 0.13 -0.14 -0.03 0.00 -0.26 0.00 0.00 58.87 58.57 2fnb n SER 20 Cb 0.06 0.72 -0.03 0.00 -0.26 0.00 0.00 64.21 64.70 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 -1.16 -0.06 -0.14 4.04 1.04 -1.23 -4.03 113.70 112.16 2fnb s SER 21 Ca 0.00 0.04 -0.03 0.00 0.48 0.00 0.00 55.95 56.44 2fnb s SER 21 Cb 0.00 0.05 -0.03 0.00 0.10 0.00 0.00 66.02 66.14 2fnb s SER 21 CO 0.00 -0.07 -0.03 -0.51 0.98 0.00 0.00 173.24 173.61 2fnb s ILE 22 N -1.44 3.99 0.43 -1.02 2.07 -0.19 -3.21 121.20 121.84 2fnb s ILE 22 Ca 0.09 -0.33 -0.05 0.00 -1.41 0.00 0.00 60.65 58.94 2fnb s ILE 22 Cb -0.01 -2.73 -0.04 0.00 0.13 0.00 0.00 42.46 39.81 2fnb s ILE 22 CO -0.06 0.52 0.73 -0.83 -1.91 0.00 0.00 174.94 173.39 2fnb s GLY 23 N 0.07 1.61 0.08 1.50 0.00 0.52 -0.86 107.32 110.23 2fnb s GLY 23 Ca 0.00 -0.50 0.04 0.00 0.00 0.00 0.00 44.72 44.26 2fnb s GLY 23 CO 0.03 -0.35 -0.11 1.08 0.00 0.00 0.00 173.10 173.74 2fnb s LEU 24 N -4.37 2.32 0.01 0.66 1.02 0.67 -1.22 118.68 117.77 2fnb s LEU 24 Ca 0.47 -0.68 0.01 0.00 0.02 0.00 0.00 54.13 53.95 2fnb s LEU 24 Cb -0.10 -0.36 -0.01 0.00 0.02 0.00 0.00 46.19 45.74 2fnb s LEU 24 CO 0.39 -0.18 -0.03 -0.60 0.02 0.00 0.00 176.35 175.96 2fnb s ARG 25 N -2.12 0.25 0.15 1.70 3.52 0.30 -2.47 118.95 120.28 2fnb s ARG 25 Ca -0.01 -0.30 -0.04 0.00 -0.13 0.00 0.00 55.73 55.25 2fnb s ARG 25 Cb -0.07 -0.11 0.02 0.00 -1.56 0.00 0.00 34.95 33.23 2fnb s ARG 25 CO 0.01 0.02 0.27 -2.67 -0.81 0.00 0.00 175.30 172.12 2fnb n TRP 26 N 2.45 -1.31 -3.69 5.12 2.14 0.09 -0.72 117.44 121.51 2fnb n TRP 26 Ca -0.17 -0.79 -0.39 0.00 2.07 0.00 0.00 57.50 58.22 2fnb n TRP 26 Cb 0.58 0.32 -0.11 0.00 -0.81 0.00 0.00 31.31 31.28 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 -2.63 3.91 0.19 -1.67 2.01 -1.26 -4.68 115.64 111.50 2fnb s THR 27 Ca 0.08 -1.35 -0.31 0.00 0.31 0.00 0.00 61.69 60.42 2fnb s THR 27 Cb -0.01 -3.34 -0.10 0.00 0.01 0.00 0.00 72.50 69.06 2fnb s THR 27 CO 0.06 -0.37 1.53 -2.16 -0.69 0.00 0.00 174.62 172.99 2fnb s PRO 28 N 1.38 4.23 -0.54 4.92 0.04 -1.26 -4.96 135.00 138.81 2fnb s PRO 28 Ca 0.01 2.35 -0.27 0.00 0.04 0.00 0.00 61.00 63.13 2fnb s PRO 28 Cb -0.21 -3.14 0.03 0.00 0.04 0.00 0.00 34.50 31.22 2fnb s PRO 28 CO 0.02 -0.56 1.11 -0.51 0.04 0.00 0.00 177.00 177.10 2fnb s LEU 29 N 0.71 3.65 0.00 -3.56 1.02 -1.26 -4.91 118.68 114.33 2fnb s LEU 29 Ca 0.67 0.11 -0.01 0.00 0.02 0.00 0.00 54.13 54.92 2fnb s LEU 29 Cb -0.43 -3.20 -0.05 0.00 0.02 0.00 0.00 46.19 42.53 2fnb s LEU 29 CO 0.35 -1.35 1.64 0.59 0.02 0.00 0.00 176.35 177.60 2fnb n ASN 30 N 8.02 3.40 0.00 2.29 4.13 -1.26 -4.57 115.26 127.27 2fnb n ASN 30 Ca 0.08 -1.97 0.05 0.00 1.68 0.00 0.00 54.58 54.43 2fnb n ASN 30 Cb 0.49 -0.78 0.31 0.00 -1.54 0.00 0.00 39.78 38.26 2fnb n ASN 30 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2fnb n SER 31 N 1.97 0.00 0.00 6.41 7.64 -1.26 -4.93 113.62 123.45 2fnb n SER 31 Ca 0.08 -1.58 0.00 0.00 1.01 0.00 0.00 58.87 58.39 2fnb n SER 31 Cb 0.40 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 2fnb n SER 31 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2fnb n SER 32 N -0.67 0.00 0.00 6.43 3.41 -1.26 -2.14 113.62 119.39 2fnb n SER 32 Ca 0.08 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.73 2fnb n SER 32 Cb 0.04 0.00 0.22 0.00 -0.26 0.00 0.00 64.21 64.21 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 1.00 -1.40 6.66 -1.04 -1.26 -4.73 114.28 113.51 2fnb n THR 33 Ca 0.00 0.25 -0.41 0.00 -2.04 0.00 0.00 64.05 61.85 2fnb n THR 33 Cb 0.00 -1.09 0.01 0.00 -1.82 0.00 0.00 70.33 67.43 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 -1.36 1.38 -0.05 12.58 3.06 -0.91 -3.70 119.36 130.36 2fnb n ILE 34 Ca 0.04 -0.50 -0.02 0.00 -2.50 0.00 0.00 62.75 59.77 2fnb n ILE 34 Cb 0.09 -0.36 -0.01 0.00 0.54 0.00 0.00 39.64 39.91 2fnb n ILE 34 CO 0.00 0.00 0.00 0.40 -2.50 0.00 0.00 176.55 174.45 2fnb h ILE 35 N 0.55 0.00 0.00 9.51 2.04 -1.57 -3.47 117.51 124.57 2fnb h ILE 35 Ca -0.40 -0.81 0.00 0.00 1.00 0.00 0.00 64.86 64.66 2fnb h ILE 35 Cb 1.42 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.50 2fnb h ILE 35 CO 0.49 0.00 0.00 0.61 0.00 0.00 0.00 178.15 179.25 2fnb n GLY 36 N 1.74 -0.57 3.13 5.37 0.00 -1.13 -4.42 105.19 109.31 2fnb n GLY 36 Ca -0.03 -0.72 -0.21 0.00 0.00 0.00 0.00 46.02 45.06 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 -3.30 1.23 -0.08 1.61 2.02 -1.26 -2.48 117.35 115.09 2fnb s TYR 37 Ca 0.00 -0.31 0.03 0.00 -0.37 0.00 0.00 57.07 56.42 2fnb s TYR 37 Cb 0.00 -0.75 -0.02 0.00 -0.40 0.00 0.00 41.96 40.79 2fnb s TYR 37 CO 0.00 0.02 -0.17 0.50 -1.57 0.00 0.00 175.55 174.33 2fnb s ARG 38 N -0.85 2.78 -0.10 -0.62 3.00 0.20 -2.30 118.95 121.06 2fnb s ARG 38 Ca 0.03 -0.75 0.02 0.00 -1.00 0.00 0.00 55.73 54.03 2fnb s ARG 38 Cb -0.07 -2.40 0.01 0.00 0.00 0.00 0.00 34.95 32.50 2fnb s ARG 38 CO 0.01 0.44 -0.15 0.42 0.00 0.00 0.00 175.30 176.02 2fnb s ILE 39 N -0.27 1.45 -0.14 4.11 1.09 -0.44 -0.54 121.20 126.48 2fnb s ILE 39 Ca 0.01 -0.62 0.02 0.00 -1.10 0.00 0.00 60.65 58.97 2fnb s ILE 39 Cb -0.13 -1.33 0.01 0.00 -1.06 0.00 0.00 42.46 39.95 2fnb s ILE 39 CO 0.03 0.43 -0.21 -0.89 -0.10 0.00 0.00 174.94 174.20 2fnb s THR 40 N 0.97 2.18 -0.22 2.92 2.01 -0.19 -0.58 115.64 122.73 2fnb s THR 40 Ca -0.07 -0.94 -0.07 0.00 0.31 0.00 0.00 61.69 60.92 2fnb s THR 40 Cb -0.15 -1.87 -0.03 0.00 0.01 0.00 0.00 72.50 70.46 2fnb s THR 40 CO -0.01 0.54 0.05 0.68 -0.69 0.00 0.00 174.62 175.19 2fnb s VAL 41 N 0.73 4.31 0.31 3.82 -7.23 -0.47 -0.23 120.40 121.64 2fnb s VAL 41 Ca -0.09 -0.18 0.10 0.00 -1.81 0.00 0.00 61.98 60.00 2fnb s VAL 41 Cb -0.16 -2.98 -0.06 0.00 0.56 0.00 0.00 36.38 33.74 2fnb s VAL 41 CO 0.00 0.39 -0.12 0.68 -0.31 0.00 0.00 175.10 175.74 2fnb s VAL 42 N 1.15 2.21 -0.45 1.32 -7.23 -0.81 -1.58 120.40 115.01 2fnb s VAL 42 Ca 0.04 -2.25 -0.29 0.00 -1.81 0.00 0.00 61.98 57.67 2fnb s VAL 42 Cb -0.14 -2.51 0.03 0.00 0.56 0.00 0.00 36.38 34.32 2fnb s VAL 42 CO 0.03 -0.28 1.11 0.00 -0.31 0.00 0.00 175.10 175.64 2fnb s ALA 43 N -2.65 3.21 0.00 1.32 0.00 0.88 -1.14 121.76 123.38 2fnb s ALA 43 Ca 0.31 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 51.82 2fnb s ALA 43 Cb 0.01 -3.84 0.00 0.00 0.00 0.00 0.00 23.12 19.29 2fnb s ALA 43 CO 0.15 -2.13 0.00 0.00 0.00 0.00 0.00 175.76 173.78 2fnb n ALA 44 N 7.64 0.00 1.08 0.00 0.00 0.78 -2.41 120.51 127.60 2fnb n ALA 44 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2fnb n ALA 44 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 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 1.19 0.10 0.00 0.00 -1.26 -4.06 105.19 101.16 2fnb n GLY 45 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.04 0.50 0.00 1.61 4.07 -1.01 -4.92 120.64 120.84 2fnb n GLU 46 Ca 0.00 -0.21 0.00 0.00 -0.06 0.00 0.00 57.16 56.89 2fnb n GLU 46 Cb 0.22 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.10 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 1.36 2.16 3.41 8.31 0.00 -1.25 -4.95 105.19 114.24 2fnb n GLY 47 Ca 0.11 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.83 0.05 -1.20 -0.61 5.41 -1.26 -4.89 119.36 115.02 2fnb n ILE 48 Ca 0.00 -0.17 -0.29 0.00 1.00 0.00 0.00 62.75 63.29 2fnb n ILE 48 Cb 0.00 -1.11 0.15 0.00 -0.71 0.00 0.00 39.64 37.97 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 7.15 0.89 0.00 0.38 0.04 -1.26 -0.08 135.00 142.11 2fnb s PRO 49 Ca 1.19 0.66 0.00 0.00 0.04 0.00 0.00 61.00 62.89 2fnb s PRO 49 Cb -1.09 -1.78 0.00 0.00 0.04 0.00 0.00 34.50 31.68 2fnb s PRO 49 CO 0.52 -2.45 0.00 -0.89 0.04 0.00 0.00 177.00 174.21 2fnb n ILE 50 N -4.01 0.00 -3.83 0.56 2.08 -0.62 -4.52 119.36 109.02 2fnb n ILE 50 Ca 0.06 0.00 -0.08 0.00 0.56 0.00 0.00 62.75 63.29 2fnb n ILE 50 Cb 0.56 -0.64 0.01 0.00 -0.75 0.00 0.00 39.64 38.82 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 -0.30 0.02 0.07 1.39 -0.71 -1.06 -5.04 117.98 112.33 2fnb s PHE 51 Ca 0.00 -0.61 0.02 0.00 -1.04 0.00 0.00 56.93 55.30 2fnb s PHE 51 Cb 0.00 0.78 -0.03 0.00 -1.21 0.00 0.00 43.02 42.56 2fnb s PHE 51 CO 0.00 -1.44 -0.07 -1.83 -1.34 0.00 0.00 175.22 170.54 2fnb s GLU 52 N -2.93 0.66 0.19 1.99 -1.05 -1.26 -1.36 118.70 114.94 2fnb s GLU 52 Ca 0.14 -1.00 -0.12 0.00 -0.15 0.00 0.00 54.97 53.84 2fnb s GLU 52 Cb -0.05 -0.25 0.00 0.00 -0.44 0.00 0.00 34.13 33.39 2fnb s GLU 52 CO 0.10 0.02 0.39 0.34 0.95 0.00 0.00 175.26 177.06 2fnb s ASP 53 N -2.20 -0.07 0.37 0.83 2.15 0.25 -5.00 116.67 113.01 2fnb s ASP 53 Ca -0.01 -0.80 0.04 0.00 0.43 0.00 0.00 52.55 52.22 2fnb s ASP 53 Cb -0.03 0.51 -0.06 0.00 -0.30 0.00 0.00 42.92 43.04 2fnb s ASP 53 CO -0.02 -1.00 0.05 -0.36 -0.17 0.00 0.00 175.17 173.67 2fnb s PHE 54 N -3.96 2.07 0.31 -5.34 0.40 -1.26 -1.32 117.98 108.88 2fnb s PHE 54 Ca 0.17 -0.93 0.02 0.00 -0.60 0.00 0.00 56.93 55.59 2fnb s PHE 54 Cb 0.01 -1.42 -0.01 0.00 0.51 0.00 0.00 43.02 42.12 2fnb s PHE 54 CO 0.02 0.10 0.06 1.33 0.70 0.00 0.00 175.22 177.43 2fnb n VAL 55 N -0.83 0.00 0.04 -0.44 0.24 -0.97 -4.93 118.33 111.44 2fnb n VAL 55 Ca -0.05 -1.66 -0.02 0.00 -2.04 0.00 0.00 64.34 60.57 2fnb n VAL 55 Cb 0.67 0.49 -0.01 0.00 -1.47 0.00 0.00 33.84 33.52 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 1.02 -0.10 0.00 -1.34 1.82 -1.93 -3.41 116.42 112.48 2fnb h ASP 56 Ca -0.25 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.39 2fnb h ASP 56 Cb 0.86 0.03 0.00 0.00 0.68 0.00 0.00 39.33 40.90 2fnb h ASP 56 CO 0.41 -0.06 0.00 -1.54 -1.61 0.00 0.00 179.24 176.44 2fnb n SER 57 N -2.37 0.00 -0.63 2.28 3.41 -1.26 -4.68 113.62 110.36 2fnb n SER 57 Ca -0.01 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.64 2fnb n SER 57 Cb 0.05 0.00 0.08 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 1.12 -4.72 4.04 3.41 -1.26 -4.73 113.62 111.47 2fnb n SER 58 Ca 0.00 -2.60 -0.42 0.00 -0.26 0.00 0.00 58.87 55.59 2fnb n SER 58 Cb 0.00 -0.34 -0.03 0.00 -0.26 0.00 0.00 64.21 63.58 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 -1.28 3.85 -1.88 -3.33 1.01 -1.26 -4.75 120.40 112.76 2fnb s VAL 59 Ca 0.22 1.39 0.15 0.00 0.00 0.00 0.00 61.98 63.74 2fnb s VAL 59 Cb 0.22 -3.89 0.12 0.00 0.00 0.00 0.00 36.38 32.83 2fnb s VAL 59 CO -0.04 0.14 0.98 0.61 0.00 0.00 0.00 175.10 176.79 2fnb n GLY 60 N 2.93 0.08 3.04 4.51 0.00 -1.26 -4.54 105.19 109.94 2fnb n GLY 60 Ca 0.08 -0.44 -0.10 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.28 -0.73 0.05 1.61 6.14 -1.26 -0.74 117.35 121.14 2fnb s TYR 61 Ca 0.18 1.06 -0.02 0.00 0.64 0.00 0.00 57.07 58.92 2fnb s TYR 61 Cb 0.13 0.09 -0.03 0.00 0.42 0.00 0.00 41.96 42.56 2fnb s TYR 61 CO 0.19 -0.58 -0.00 -0.47 0.64 0.00 0.00 175.55 175.33 2fnb s TYR 62 N 2.54 0.45 -0.04 4.97 5.04 -1.03 -5.01 117.35 124.27 2fnb s TYR 62 Ca 0.06 -0.95 -0.01 0.00 -2.44 0.00 0.00 57.07 53.72 2fnb s TYR 62 Cb -0.14 -0.33 0.03 0.00 0.35 0.00 0.00 41.96 41.87 2fnb s TYR 62 CO -0.14 -0.38 0.07 0.99 -1.34 0.00 0.00 175.55 174.76 2fnb s THR 63 N -3.66 -0.04 0.07 4.34 2.01 -1.26 -0.23 115.64 116.86 2fnb s THR 63 Ca 0.04 0.16 0.04 0.00 0.31 0.00 0.00 61.69 62.25 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 -0.09 0.06 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.19 2fnb s VAL 64 N 0.88 3.87 0.19 3.82 1.01 -0.04 -4.99 120.40 125.14 2fnb s VAL 64 Ca -0.07 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 60.97 2fnb s VAL 64 Cb -0.10 -2.80 -0.00 0.00 0.00 0.00 0.00 36.38 33.48 2fnb s VAL 64 CO -0.03 0.20 0.01 0.41 0.00 0.00 0.00 175.10 175.68 2fnb n THR 65 N 0.87 0.00 -1.06 3.92 -1.04 -1.26 -1.02 114.28 114.69 2fnb n THR 65 Ca -0.12 -0.94 -0.02 0.00 -2.04 0.00 0.00 64.05 60.92 2fnb n THR 65 Cb 0.52 0.21 -0.01 0.00 -1.82 0.00 0.00 70.33 69.23 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 2.38 0.56 3.77 3.41 0.00 -1.26 -4.90 105.19 109.15 2fnb n GLY 66 Ca -0.07 -0.64 -0.34 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.48 3.63 -0.29 0.99 1.43 -1.26 -5.05 118.68 117.66 2fnb s LEU 67 Ca 0.00 2.11 -0.04 0.00 -1.03 0.00 0.00 54.13 55.17 2fnb s LEU 67 Cb 0.00 -4.57 0.10 0.00 0.03 0.00 0.00 46.19 41.75 2fnb s LEU 67 CO 0.00 -1.35 0.13 -0.70 0.23 0.00 0.00 176.35 174.66 2fnb s GLU 68 N -3.56 0.19 0.85 1.70 -6.30 -1.26 -4.81 118.70 105.51 2fnb s GLU 68 Ca 0.71 -0.51 -0.11 0.00 -2.50 0.00 0.00 54.97 52.56 2fnb s GLU 68 Cb -0.23 -1.17 0.10 0.00 0.00 0.00 0.00 34.13 32.84 2fnb s GLU 68 CO 0.32 -1.01 1.09 -1.25 0.02 0.00 0.00 175.26 174.43 2fnb s PRO 69 N 2.11 1.65 0.00 4.30 0.04 -1.26 -4.06 135.00 137.77 2fnb s PRO 69 Ca 0.09 0.98 0.00 0.00 0.04 0.00 0.00 61.00 62.11 2fnb s PRO 69 Cb -0.16 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.54 2fnb s PRO 69 CO -0.36 -2.02 0.00 0.41 0.04 0.00 0.00 177.00 175.07 2fnb n GLY 70 N -1.12 2.87 3.77 0.56 0.00 -0.97 -4.96 105.19 105.35 2fnb n GLY 70 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.02 4.50 0.54 -0.61 -1.09 -1.26 -5.01 121.20 117.26 2fnb s ILE 71 Ca 0.00 1.65 -0.10 0.00 -2.23 0.00 0.00 60.65 59.98 2fnb s ILE 71 Cb 0.00 -4.12 -0.05 0.00 -1.58 0.00 0.00 42.46 36.72 2fnb s ILE 71 CO 0.00 0.48 0.92 -0.62 -1.23 0.00 0.00 174.94 174.49 2fnb s ASP 72 N -0.82 6.32 -0.06 3.58 2.15 -1.25 -4.57 116.67 122.02 2fnb s ASP 72 Ca 0.36 1.25 -0.01 0.00 0.43 0.00 0.00 52.55 54.59 2fnb s ASP 72 Cb -0.22 -2.39 0.03 0.00 -0.30 0.00 0.00 42.92 40.04 2fnb s ASP 72 CO 0.25 -0.69 -0.01 -0.31 -0.17 0.00 0.00 175.17 174.24 2fnb s TYR 73 N -2.88 0.66 -0.43 -5.34 1.51 -1.02 -0.16 117.35 109.69 2fnb s TYR 73 Ca 0.53 -0.16 -0.17 0.00 -1.01 0.00 0.00 57.07 56.25 2fnb s TYR 73 Cb -0.11 -0.74 0.03 0.00 -0.11 0.00 0.00 41.96 41.03 2fnb s TYR 73 CO 0.46 -0.28 0.45 -0.51 -1.11 0.00 0.00 175.55 174.55 2fnb s ASP 74 N 1.65 6.19 -0.72 2.29 1.11 -0.29 -1.28 116.67 125.62 2fnb s ASP 74 Ca 0.00 -0.75 -0.09 0.00 0.18 0.00 0.00 52.55 51.89 2fnb s ASP 74 Cb -0.13 -2.22 0.19 0.00 1.07 0.00 0.00 42.92 41.82 2fnb s ASP 74 CO -0.04 -0.61 0.60 -0.63 1.18 0.00 0.00 175.17 175.67 2fnb s ILE 75 N 2.13 4.70 -0.59 0.77 1.09 -0.17 -1.92 121.20 127.21 2fnb s ILE 75 Ca 0.11 -2.64 -0.25 0.00 -1.10 0.00 0.00 60.65 56.78 2fnb s ILE 75 Cb -0.18 -3.97 0.04 0.00 -1.06 0.00 0.00 42.46 37.30 2fnb s ILE 75 CO 0.13 -0.95 1.02 -0.94 -0.10 0.00 0.00 174.94 174.11 2fnb s SER 76 N 1.56 6.32 -0.28 3.58 1.04 0.68 -3.05 113.70 123.55 2fnb s SER 76 Ca 0.17 -0.38 -0.13 0.00 0.48 0.00 0.00 55.95 56.09 2fnb s SER 76 Cb -0.16 -2.47 -0.04 0.00 0.10 0.00 0.00 66.02 63.46 2fnb s SER 76 CO -0.06 -1.37 0.29 -0.69 0.98 0.00 0.00 173.24 172.39 2fnb s VAL 77 N 4.33 5.24 -0.04 5.02 1.01 -0.58 -1.03 120.40 134.35 2fnb s VAL 77 Ca 0.32 0.32 0.05 0.00 0.00 0.00 0.00 61.98 62.68 2fnb s VAL 77 Cb -0.12 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 2fnb s VAL 77 CO 0.19 0.17 -0.19 -0.63 0.00 0.00 0.00 175.10 174.63 2fnb s ILE 78 N 1.92 2.61 -0.14 2.22 1.01 0.30 -2.09 121.20 127.04 2fnb s ILE 78 Ca 0.11 -0.89 -0.05 0.00 0.00 0.00 0.00 60.65 59.82 2fnb s ILE 78 Cb -0.16 -1.98 -0.04 0.00 0.01 0.00 0.00 42.46 40.29 2fnb s ILE 78 CO 0.11 0.58 0.03 -0.89 0.00 0.00 0.00 174.94 174.77 2fnb s THR 79 N -0.63 4.51 -0.16 2.92 2.01 -1.26 -0.62 115.64 122.40 2fnb s THR 79 Ca 0.10 -0.15 -0.01 0.00 0.31 0.00 0.00 61.69 61.94 2fnb s THR 79 Cb -0.11 -2.97 0.04 0.00 0.01 0.00 0.00 72.50 69.47 2fnb s THR 79 CO 0.00 0.53 -0.05 -1.48 -0.69 0.00 0.00 174.62 172.94 2fnb s LEU 80 N -0.17 1.52 0.00 4.42 2.34 -1.04 -1.46 118.68 124.29 2fnb s LEU 80 Ca 0.06 -0.63 0.00 0.00 0.06 0.00 0.00 54.13 53.62 2fnb s LEU 80 Cb -0.12 -0.87 0.00 0.00 -0.56 0.00 0.00 46.19 44.64 2fnb s LEU 80 CO 0.02 -0.19 0.00 2.30 -1.06 0.00 0.00 176.35 177.42 2fnb n ILE 81 N 4.90 0.00 -1.10 1.48 -5.35 -0.31 -1.97 119.36 117.01 2fnb n ILE 81 Ca -0.12 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.07 2fnb n ILE 81 Cb 0.48 -0.79 -0.11 0.00 -1.74 0.00 0.00 39.64 37.48 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 -1.18 0.19 -3.74 7.28 5.15 -1.24 -2.81 115.26 118.91 2fnb n ASN 82 Ca 0.00 0.12 -0.10 0.00 -0.60 0.00 0.00 54.58 54.00 2fnb n ASN 82 Cb 0.00 -0.67 0.00 0.00 -0.53 0.00 0.00 39.78 38.58 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 4.75 -0.18 3.63 8.20 0.00 -1.26 -4.83 105.19 115.49 2fnb n GLY 83 Ca 0.48 0.07 -0.02 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 -4.53 -0.35 0.05 -0.02 0.00 -1.12 -5.19 107.32 96.16 2fnb s GLY 84 Ca 0.10 0.83 0.05 0.00 0.00 0.00 0.00 44.72 45.70 2fnb s GLY 84 CO 0.21 0.22 -0.15 1.85 0.00 0.00 0.00 173.10 175.23 2fnb s GLU 85 N -2.72 0.93 0.21 2.90 2.12 -1.26 -1.16 118.70 119.71 2fnb s GLU 85 Ca 0.11 -0.83 -0.03 0.00 0.36 0.00 0.00 54.97 54.59 2fnb s GLU 85 Cb 0.01 -0.96 0.05 0.00 0.26 0.00 0.00 34.13 33.49 2fnb s GLU 85 CO -0.03 0.23 0.28 0.43 -0.54 0.00 0.00 175.26 175.63 2fnb n SER 86 N 1.71 0.12 -4.74 -1.70 7.64 -0.54 -4.63 113.62 111.48 2fnb n SER 86 Ca -0.19 -1.16 -0.41 0.00 1.01 0.00 0.00 58.87 58.12 2fnb n SER 86 Cb 0.54 -0.21 -0.04 0.00 -1.01 0.00 0.00 64.21 63.50 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 -3.62 3.37 0.67 -0.43 0.00 -1.26 -4.91 121.76 115.57 2fnb s ALA 87 Ca 0.17 0.80 -0.15 0.00 0.00 0.00 0.00 51.96 52.78 2fnb s ALA 87 Cb -0.01 -3.35 0.01 0.00 0.00 0.00 0.00 23.12 19.77 2fnb s ALA 87 CO 0.11 -0.20 1.11 -1.25 0.00 0.00 0.00 175.76 175.54 2fnb s PRO 88 N -0.36 2.71 -0.35 0.00 0.04 -1.26 -4.72 135.00 131.07 2fnb s PRO 88 Ca 0.49 1.40 0.01 0.00 0.04 0.00 0.00 61.00 62.94 2fnb s PRO 88 Cb -0.29 -1.94 0.11 0.00 0.04 0.00 0.00 34.50 32.42 2fnb s PRO 88 CO 0.35 -1.32 0.11 0.99 0.04 0.00 0.00 177.00 177.17 2fnb s THR 89 N -2.36 1.47 -0.45 1.26 2.01 -0.89 -5.04 115.64 111.64 2fnb s THR 89 Ca 0.67 -1.94 -0.19 0.00 0.31 0.00 0.00 61.69 60.53 2fnb s THR 89 Cb -0.21 -2.09 0.03 0.00 0.01 0.00 0.00 72.50 70.25 2fnb s THR 89 CO 0.43 -0.69 0.56 -0.89 -0.69 0.00 0.00 174.62 173.34 2fnb s THR 90 N 1.13 4.93 0.36 -0.82 2.01 -1.26 -1.52 115.64 120.48 2fnb s THR 90 Ca 0.12 -0.19 -0.08 0.00 0.31 0.00 0.00 61.69 61.85 2fnb s THR 90 Cb -0.19 -4.17 -0.06 0.00 0.01 0.00 0.00 72.50 68.09 2fnb s THR 90 CO -0.15 -0.58 0.68 -0.76 -0.69 0.00 0.00 174.62 173.12 2fnb s LEU 91 N 2.53 3.91 0.07 4.42 1.43 -1.17 -4.91 118.68 124.96 2fnb s LEU 91 Ca 0.17 0.95 0.06 0.00 -1.03 0.00 0.00 54.13 54.28 2fnb s LEU 91 Cb -0.16 -3.81 -0.03 0.00 0.03 0.00 0.00 46.19 42.22 2fnb s LEU 91 CO 0.15 -0.33 -0.17 -0.89 0.23 0.00 0.00 176.35 175.34 2fnb s THR 92 N -2.28 1.39 -0.24 5.49 2.01 -1.26 -1.00 115.64 119.76 2fnb s THR 92 Ca 0.48 -1.28 -0.10 0.00 0.31 0.00 0.00 61.69 61.10 2fnb s THR 92 Cb -0.10 -1.27 0.09 0.00 0.01 0.00 0.00 72.50 71.23 2fnb s THR 92 CO 0.32 -0.04 0.54 -1.58 -0.69 0.00 0.00 174.62 173.17 2fnb s GLN 93 N -1.53 0.49 0.43 4.92 2.00 -0.40 -4.99 119.66 120.58 2fnb s GLN 93 Ca 0.03 1.13 0.20 0.00 -2.00 0.00 0.00 55.36 54.72 2fnb s GLN 93 Cb -0.09 0.35 0.99 0.00 0.80 0.00 0.00 33.01 35.06 2fnb s GLN 93 CO 0.02 -0.19 1.90 0.37 -0.50 0.00 0.00 175.29 176.89 2fnb h GLN 94 N 7.63 0.00 0.00 1.67 -0.00 -1.88 -2.69 115.11 119.84 2fnb h GLN 94 Ca -0.24 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.41 2fnb h GLN 94 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.63 2fnb h GLN 94 CO 0.16 0.26 0.00 2.41 0.00 0.00 0.00 178.83 181.67