#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fkr s VAL 2 N 0.00 3.17 0.21 1.61 0.11 -1.26 -3.39 120.40 120.84 1fkr s VAL 2 Ca 0.00 -1.37 0.11 0.00 -2.93 0.00 0.00 61.98 57.79 1fkr s VAL 2 Cb 0.00 -2.48 -0.04 0.00 -1.53 0.00 0.00 36.38 32.33 1fkr s VAL 2 CO 0.00 0.10 -0.21 -1.10 -3.33 0.00 0.00 175.10 170.56 1fkr s GLN 3 N -2.20 1.49 -0.26 1.54 1.11 -0.68 -4.98 119.66 115.67 1fkr s GLN 3 Ca 0.20 -1.56 0.01 0.00 0.01 0.00 0.00 55.36 54.02 1fkr s GLN 3 Cb -0.11 -1.67 0.07 0.00 -1.01 0.00 0.00 33.01 30.30 1fkr s GLN 3 CO 0.12 0.34 -0.00 0.08 0.01 0.00 0.00 175.29 175.84 1fkr s VAL 4 N -2.02 1.46 -0.76 1.09 1.01 -1.26 -2.47 120.40 117.45 1fkr s VAL 4 Ca 0.22 -1.39 -0.06 0.00 0.00 0.00 0.00 61.98 60.75 1fkr s VAL 4 Cb -0.06 -1.87 0.20 0.00 0.00 0.00 0.00 36.38 34.65 1fkr s VAL 4 CO 0.10 -0.29 0.63 -1.61 0.00 0.00 0.00 175.10 173.93 1fkr s GLU 5 N 1.39 3.07 0.72 2.72 2.02 -0.44 -5.00 118.70 123.17 1fkr s GLU 5 Ca 0.00 -2.73 -0.12 0.00 0.02 0.00 0.00 54.97 52.14 1fkr s GLU 5 Cb -0.18 -4.00 0.03 0.00 0.10 0.00 0.00 34.13 30.08 1fkr s GLU 5 CO -0.10 -1.23 1.10 0.99 0.02 0.00 0.00 175.26 176.04 1fkr s THR 6 N -0.38 3.28 0.05 3.63 2.01 -1.26 -1.44 115.64 121.52 1fkr s THR 6 Ca 0.20 0.49 0.00 0.00 0.31 0.00 0.00 61.69 62.69 1fkr s THR 6 Cb -0.14 -2.99 0.00 0.00 0.01 0.00 0.00 72.50 69.38 1fkr s THR 6 CO -0.07 -0.47 0.00 -0.38 -0.69 0.00 0.00 174.62 173.01 1fkr n ILE 7 N -3.05 0.44 -3.82 1.82 5.41 -0.82 -4.85 119.36 114.49 1fkr n ILE 7 Ca 0.10 0.15 -0.28 0.00 1.00 0.00 0.00 62.75 63.71 1fkr n ILE 7 Cb 0.53 -1.44 -0.12 0.00 -0.71 0.00 0.00 39.64 37.90 1fkr n ILE 7 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 1fkr s SER 8 N -5.36 4.31 0.85 4.38 0.01 -1.05 -5.02 113.70 111.83 1fkr s SER 8 Ca 0.00 -3.74 -0.21 0.00 1.31 0.00 0.00 55.95 53.32 1fkr s SER 8 Cb 0.00 -1.45 -0.16 0.00 0.21 0.00 0.00 66.02 64.62 1fkr s SER 8 CO 0.00 -0.10 -1.12 -2.65 0.41 0.00 0.00 173.24 169.79 1fkr n PRO 9 N 2.10 0.00 -3.61 12.44 -0.02 -1.26 -2.26 135.00 142.40 1fkr n PRO 9 Ca 0.21 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.48 1fkr n PRO 9 Cb 0.37 -0.85 -0.03 0.00 -0.02 0.00 0.00 33.50 32.97 1fkr n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fkr n GLY 10 N 2.97 3.44 0.43 -1.23 0.00 -1.26 -4.35 105.19 105.19 1fkr n GLY 10 Ca -0.02 -2.30 -0.11 0.00 0.00 0.00 0.00 46.02 43.59 1fkr n GLY 10 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1fkr h ASP 11 N 0.71 -1.90 0.00 1.61 2.03 -1.85 -3.46 116.42 113.56 1fkr h ASP 11 Ca -0.28 0.28 0.00 0.00 -0.73 0.00 0.00 57.03 56.31 1fkr h ASP 11 Cb 0.89 0.83 0.00 0.00 -0.83 0.00 0.00 39.33 40.22 1fkr h ASP 11 CO 0.45 -0.32 0.00 0.61 -1.03 0.00 0.00 179.24 178.95 1fkr n GLY 12 N -1.34 1.62 0.00 7.15 0.00 -1.26 -4.98 105.19 106.38 1fkr n GLY 12 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1fkr n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fkr n ARG 13 N -0.88 1.09 -4.11 1.61 1.74 -1.26 -5.06 116.66 109.79 1fkr n ARG 13 Ca 0.00 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.73 1fkr n ARG 13 Cb 0.00 -0.66 -0.13 0.00 -1.02 0.00 0.00 32.46 30.65 1fkr n ARG 13 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1fkr s THR 14 N -1.32 3.86 0.41 0.55 2.01 -1.26 -5.07 115.64 114.82 1fkr s THR 14 Ca 0.00 -0.35 0.03 0.00 0.31 0.00 0.00 61.69 61.69 1fkr s THR 14 Cb 0.00 -2.74 -0.03 0.00 0.01 0.00 0.00 72.50 69.74 1fkr s THR 14 CO 0.00 0.44 0.09 -0.36 -0.69 0.00 0.00 174.62 174.09 1fkr s PHE 15 N 0.97 1.87 0.27 4.92 0.40 -1.26 -0.73 117.98 124.41 1fkr s PHE 15 Ca 0.01 -1.13 -0.29 0.00 -0.60 0.00 0.00 56.93 54.92 1fkr s PHE 15 Cb -0.14 -1.30 -0.09 0.00 0.51 0.00 0.00 43.02 42.00 1fkr s PHE 15 CO 0.01 -0.10 1.12 -2.14 0.70 0.00 0.00 175.22 174.81 1fkr s PRO 16 N -3.78 4.61 0.37 0.24 0.02 -1.26 -4.87 135.00 130.32 1fkr s PRO 16 Ca 0.23 1.83 0.08 0.00 0.02 0.00 0.00 61.00 63.17 1fkr s PRO 16 Cb 0.04 -3.19 -0.07 0.00 0.02 0.00 0.00 34.50 31.30 1fkr s PRO 16 CO 0.13 0.15 -0.05 0.15 -0.33 0.00 0.00 177.00 177.05 1fkr s LYS 17 N -1.30 1.85 0.05 5.54 1.02 -1.26 -4.96 119.74 120.69 1fkr s LYS 17 Ca 0.46 -1.99 -0.31 0.00 0.02 0.00 0.00 55.97 54.15 1fkr s LYS 17 Cb -0.32 -1.62 -0.07 0.00 -0.52 0.00 0.00 37.83 35.30 1fkr s LYS 17 CO 0.41 0.05 1.38 1.03 -0.92 0.00 0.00 175.35 177.30 1fkr s ARG 18 N -3.67 4.31 0.00 1.68 0.52 -1.26 -2.54 118.95 117.99 1fkr s ARG 18 Ca 0.33 2.00 0.00 0.00 -0.52 0.00 0.00 55.73 57.54 1fkr s ARG 18 Cb 0.06 -3.42 0.00 0.00 0.52 0.00 0.00 34.95 32.11 1fkr s ARG 18 CO 0.17 -0.49 0.00 0.41 0.02 0.00 0.00 175.30 175.41 1fkr n GLY 19 N 3.55 1.57 3.88 -3.53 0.00 -1.25 -5.08 105.19 104.33 1fkr n GLY 19 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 1fkr n GLY 19 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fkr s GLN 20 N -0.08 2.31 0.32 1.61 -0.21 -1.05 -5.04 119.66 117.52 1fkr s GLN 20 Ca 0.00 -1.88 0.08 0.00 0.02 0.00 0.00 55.36 53.58 1fkr s GLN 20 Cb 0.00 -2.16 -0.03 0.00 1.00 0.00 0.00 33.01 31.82 1fkr s GLN 20 CO 0.00 -0.47 0.24 0.99 -2.12 0.00 0.00 175.29 173.93 1fkr s THR 21 N -2.68 3.63 0.04 -0.19 2.01 -1.26 -3.64 115.64 113.55 1fkr s THR 21 Ca 0.39 -1.45 0.06 0.00 0.31 0.00 0.00 61.69 61.00 1fkr s THR 21 Cb -0.02 -3.18 -0.03 0.00 0.01 0.00 0.00 72.50 69.28 1fkr s THR 21 CO 0.23 -0.22 -0.14 0.00 -0.69 0.00 0.00 174.62 173.80 1fkr s VAL 23 N -0.99 1.93 0.13 0.00 1.01 0.18 -1.99 120.40 120.68 1fkr s VAL 23 Ca 0.16 -2.05 0.09 0.00 0.00 0.00 0.00 61.98 60.18 1fkr s VAL 23 Cb -0.11 -2.40 -0.04 0.00 0.00 0.00 0.00 36.38 33.84 1fkr s VAL 23 CO 0.07 -0.56 -0.21 0.68 0.00 0.00 0.00 175.10 175.08 1fkr s VAL 24 N 1.09 1.85 -0.11 2.92 -7.23 -0.57 -0.07 120.40 118.27 1fkr s VAL 24 Ca 0.09 -1.69 -0.01 0.00 -1.81 0.00 0.00 61.98 58.56 1fkr s VAL 24 Cb -0.19 -1.72 0.03 0.00 0.56 0.00 0.00 36.38 35.06 1fkr s VAL 24 CO -0.11 -0.11 -0.06 -2.28 -0.31 0.00 0.00 175.10 172.22 1fkr s HIS 25 N -1.40 1.42 0.28 2.82 2.46 -1.04 -1.14 115.29 118.69 1fkr s HIS 25 Ca 0.11 -0.72 0.02 0.00 0.47 0.00 0.00 55.06 54.94 1fkr s HIS 25 Cb -0.09 -1.20 -0.04 0.00 -0.13 0.00 0.00 32.58 31.12 1fkr s HIS 25 CO 0.05 -0.51 0.13 1.52 -2.47 0.00 0.00 174.74 173.47 1fkr s TYR 26 N 1.73 1.56 -0.12 3.88 1.13 -1.26 -1.82 117.35 122.45 1fkr s TYR 26 Ca 0.05 -1.29 -0.02 0.00 -1.41 0.00 0.00 57.07 54.40 1fkr s TYR 26 Cb -0.13 -0.87 0.04 0.00 -1.10 0.00 0.00 41.96 39.90 1fkr s TYR 26 CO -0.08 -0.44 0.00 0.99 -2.51 0.00 0.00 175.55 173.51 1fkr s THR 27 N -3.68 0.52 -0.12 -3.49 2.01 -0.69 -0.75 115.64 109.44 1fkr s THR 27 Ca 0.36 -0.20 -0.04 0.00 0.31 0.00 0.00 61.69 62.12 1fkr s THR 27 Cb 0.06 -0.80 -0.04 0.00 0.01 0.00 0.00 72.50 71.74 1fkr s THR 27 CO 0.16 0.09 0.05 -0.83 -0.69 0.00 0.00 174.62 173.40 1fkr s GLY 28 N 1.89 1.93 0.33 4.40 0.00 -0.19 -1.80 107.32 113.89 1fkr s GLY 28 Ca 0.03 -0.75 0.04 0.00 0.00 0.00 0.00 44.72 44.03 1fkr s GLY 28 CO -0.07 -0.37 0.15 -0.29 0.00 0.00 0.00 173.10 172.53 1fkr s MET 29 N -0.60 1.69 0.18 2.90 1.75 -0.29 -3.99 119.30 120.94 1fkr s MET 29 Ca 0.11 -1.98 0.01 0.00 -1.25 0.00 0.00 55.69 52.57 1fkr s MET 29 Cb -0.12 -0.25 0.01 0.00 2.84 0.00 0.00 34.83 37.31 1fkr s MET 29 CO 0.02 -0.45 0.05 1.28 -0.65 0.00 0.00 175.02 175.27 1fkr n LEU 30 N -0.67 0.00 -1.27 4.11 4.77 -1.14 -1.83 117.00 120.96 1fkr n LEU 30 Ca -0.00 -1.06 0.01 0.00 -0.03 0.00 0.00 56.01 54.93 1fkr n LEU 30 Cb 0.65 0.07 0.19 0.00 -2.33 0.00 0.00 43.42 42.00 1fkr n LEU 30 CO 0.35 -0.24 0.62 -1.84 -1.33 0.00 0.00 177.39 174.95 1fkr n GLU 31 N -0.63 2.82 0.00 3.23 0.28 -1.26 -3.80 120.64 121.28 1fkr n GLU 31 Ca -0.05 -1.60 0.00 0.00 -0.16 0.00 0.00 57.16 55.35 1fkr n GLU 31 Cb 0.22 -1.86 0.00 0.00 1.43 0.00 0.00 31.44 31.23 1fkr n GLU 31 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1fkr n ASP 32 N 0.23 1.50 0.00 -1.84 5.75 -1.26 -5.07 116.55 115.86 1fkr n ASP 32 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.94 1fkr n ASP 32 Cb 0.79 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.88 1fkr n ASP 32 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1fkr n GLY 33 N 2.78 1.19 3.45 6.12 0.00 -1.25 -5.16 105.19 112.31 1fkr n GLY 33 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1fkr n GLY 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fkr s LYS 34 N 0.00 1.61 0.03 1.61 -0.14 -1.26 -4.92 119.74 116.67 1fkr s LYS 34 Ca 0.00 -1.41 -0.17 0.00 -1.36 0.00 0.00 55.97 53.03 1fkr s LYS 34 Cb 0.00 -1.94 -0.06 0.00 -1.68 0.00 0.00 37.83 34.15 1fkr s LYS 34 CO 0.00 0.43 0.49 -1.59 -0.76 0.00 0.00 175.35 173.91 1fkr s LYS 35 N -2.50 4.06 0.00 1.68 0.00 -1.26 -2.89 119.74 118.83 1fkr s LYS 35 Ca 0.20 0.57 0.00 0.00 0.00 0.00 0.00 55.97 56.73 1fkr s LYS 35 Cb -0.09 -3.24 0.00 0.00 0.00 0.00 0.00 37.83 34.51 1fkr s LYS 35 CO 0.10 0.65 0.00 1.97 0.00 0.00 0.00 175.35 178.07 1fkr n PHE 36 N 1.83 0.00 -3.48 1.78 -1.74 -1.26 -5.00 117.46 109.61 1fkr n PHE 36 Ca -0.12 0.00 -0.27 0.00 -0.56 0.00 0.00 57.45 56.50 1fkr n PHE 36 Cb 0.52 0.00 -0.13 0.00 1.52 0.00 0.00 39.48 41.39 1fkr n PHE 36 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1fkr s ASP 37 N -3.51 2.92 0.38 5.98 1.11 -1.26 -5.03 116.67 117.25 1fkr s ASP 37 Ca 0.00 -1.69 0.08 0.00 0.18 0.00 0.00 52.55 51.12 1fkr s ASP 37 Cb 0.00 -0.22 -0.05 0.00 1.07 0.00 0.00 42.92 43.71 1fkr s ASP 37 CO 0.00 -0.36 0.10 -0.44 1.18 0.00 0.00 175.17 175.65 1fkr s SER 38 N 1.58 4.32 -0.48 0.27 0.01 -1.26 -1.02 113.70 117.11 1fkr s SER 38 Ca 0.14 -1.03 0.05 0.00 1.31 0.00 0.00 55.95 56.42 1fkr s SER 38 Cb -0.19 -0.53 0.39 0.00 0.21 0.00 0.00 66.02 65.91 1fkr s SER 38 CO -0.16 -0.39 1.05 -1.54 0.41 0.00 0.00 173.24 172.61 1fkr n SER 39 N -1.10 4.51 0.00 2.44 3.41 0.07 -4.80 113.62 118.14 1fkr n SER 39 Ca -0.03 -3.68 0.00 0.00 -0.26 0.00 0.00 58.87 54.91 1fkr n SER 39 Cb 0.63 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 1fkr n SER 39 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1fkr n ARG 40 N -0.38 0.00 -0.48 4.33 1.74 -1.26 -4.63 116.66 115.97 1fkr n ARG 40 Ca 0.35 0.00 0.37 0.00 -0.77 0.00 0.00 57.85 57.80 1fkr n ARG 40 Cb 0.57 -0.04 0.57 0.00 -1.02 0.00 0.00 32.46 32.55 1fkr n ARG 40 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1fkr n ASP 41 N -2.14 0.02 -3.97 0.55 2.03 -1.26 -1.22 116.55 110.56 1fkr n ASP 41 Ca 0.00 0.74 -0.43 0.00 0.52 0.00 0.00 54.79 55.63 1fkr n ASP 41 Cb 0.00 -0.37 0.00 0.00 -0.72 0.00 0.00 41.12 40.03 1fkr n ASP 41 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 1fkr n ARG 42 N -3.47 3.67 0.00 -0.67 0.63 -1.26 -4.89 116.66 110.67 1fkr n ARG 42 Ca 0.31 -3.69 0.00 0.00 -0.92 0.00 0.00 57.85 53.56 1fkr n ARG 42 Cb 1.39 -2.90 0.00 0.00 0.45 0.00 0.00 32.46 31.41 1fkr n ARG 42 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1fkr n ASN 43 N 3.86 0.00 -4.81 6.15 5.15 -0.36 -3.82 115.26 121.44 1fkr n ASN 43 Ca 0.38 0.00 -0.37 0.00 -0.60 0.00 0.00 54.58 53.99 1fkr n ASN 43 Cb 0.37 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.56 1fkr n ASN 43 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1fkr s LYS 44 N -2.31 3.92 0.00 1.20 1.02 -1.26 -4.99 119.74 117.32 1fkr s LYS 44 Ca 0.00 0.16 0.00 0.00 0.02 0.00 0.00 55.97 56.15 1fkr s LYS 44 Cb 0.00 -3.29 0.00 0.00 -0.52 0.00 0.00 37.83 34.02 1fkr s LYS 44 CO 0.00 0.55 0.00 -2.30 -0.92 0.00 0.00 175.35 172.68 1fkr n PRO 45 N 2.50 2.31 -4.44 -1.68 -0.02 -1.25 -4.93 135.00 127.49 1fkr n PRO 45 Ca -0.15 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.03 1fkr n PRO 45 Cb 0.53 0.00 -0.11 0.00 -0.02 0.00 0.00 33.50 33.90 1fkr n PRO 45 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1fkr s PHE 46 N -0.04 2.70 -0.05 6.00 5.36 -0.30 -5.03 117.98 126.63 1fkr s PHE 46 Ca 0.00 -0.17 -0.01 0.00 -0.96 0.00 0.00 56.93 55.79 1fkr s PHE 46 Cb 0.00 -1.48 0.03 0.00 -0.34 0.00 0.00 43.02 41.22 1fkr s PHE 46 CO 0.00 0.35 0.02 0.15 -1.46 0.00 0.00 175.22 174.28 1fkr s LYS 47 N -1.73 0.29 0.20 10.12 1.02 -1.26 -1.52 119.74 126.87 1fkr s LYS 47 Ca 0.18 0.18 0.00 0.00 0.02 0.00 0.00 55.97 56.35 1fkr s LYS 47 Cb -0.11 -0.66 -0.05 0.00 -0.52 0.00 0.00 37.83 36.50 1fkr s LYS 47 CO 0.09 -0.25 0.08 -0.59 -0.92 0.00 0.00 175.35 173.76 1fkr s PHE 48 N 1.69 1.26 -0.15 3.18 -0.71 -0.84 -4.92 117.98 117.50 1fkr s PHE 48 Ca -0.00 -1.20 -0.04 0.00 -1.04 0.00 0.00 56.93 54.64 1fkr s PHE 48 Cb -0.13 -0.70 -0.03 0.00 -1.21 0.00 0.00 43.02 40.95 1fkr s PHE 48 CO -0.03 -0.41 -0.00 1.41 -1.34 0.00 0.00 175.22 174.84 1fkr s MET 49 N -4.04 3.59 -0.22 1.99 -2.45 -1.26 0.05 119.30 116.96 1fkr s MET 49 Ca 0.33 -0.44 -0.19 0.00 -1.25 0.00 0.00 55.69 54.13 1fkr s MET 49 Cb 0.07 -2.97 -0.03 0.00 1.25 0.00 0.00 34.83 33.16 1fkr s MET 49 CO 0.09 0.36 0.56 -1.17 1.05 0.00 0.00 175.02 175.92 1fkr s LEU 50 N 0.06 4.11 0.00 4.11 2.96 -1.24 -3.99 118.68 124.70 1fkr s LEU 50 Ca 0.02 0.69 0.00 0.00 -0.22 0.00 0.00 54.13 54.62 1fkr s LEU 50 Cb -0.13 -2.77 0.00 0.00 0.50 0.00 0.00 46.19 43.79 1fkr s LEU 50 CO 0.02 -0.26 0.00 0.61 -1.32 0.00 0.00 176.35 175.40 1fkr n GLY 51 N 4.02 1.31 0.96 7.98 0.00 -1.26 -3.79 105.19 114.40 1fkr n GLY 51 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.97 1fkr n GLY 51 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1fkr n LYS 52 N -1.33 0.04 0.00 1.61 0.00 -1.26 -5.04 118.16 112.18 1fkr n LYS 52 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 58.31 58.33 1fkr n LYS 52 Cb 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 35.03 34.47 1fkr n LYS 52 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 1fkr n GLN 53 N -3.23 0.00 -0.06 1.64 7.27 -1.26 -5.07 117.38 116.67 1fkr n GLN 53 Ca -0.03 0.00 -0.07 0.00 0.07 0.00 0.00 57.00 56.97 1fkr n GLN 53 Cb 0.37 0.00 -0.08 0.00 2.41 0.00 0.00 30.24 32.94 1fkr n GLN 53 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 1fkr n GLU 54 N 0.00 1.54 -4.30 3.69 2.13 -1.26 -5.01 120.64 117.42 1fkr n GLU 54 Ca 0.00 0.03 -0.28 0.00 0.66 0.00 0.00 57.16 57.57 1fkr n GLU 54 Cb 0.00 -1.28 -0.10 0.00 0.27 0.00 0.00 31.44 30.33 1fkr n GLU 54 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 1fkr s VAL 55 N -2.27 3.06 1.07 6.31 -7.23 -1.26 -5.12 120.40 114.97 1fkr s VAL 55 Ca -0.10 -1.62 -0.16 0.00 -1.81 0.00 0.00 61.98 58.29 1fkr s VAL 55 Cb 0.04 -2.48 0.18 0.00 0.56 0.00 0.00 36.38 34.67 1fkr s VAL 55 CO 0.40 -0.05 0.30 2.30 -0.31 0.00 0.00 175.10 177.74 1fkr n ILE 56 N 0.28 0.00 0.21 -0.62 -5.35 -1.26 -4.65 119.36 107.97 1fkr n ILE 56 Ca -0.12 -0.08 -0.09 0.00 -0.27 0.00 0.00 62.75 62.19 1fkr n ILE 56 Cb 0.55 -0.55 -0.04 0.00 -1.74 0.00 0.00 39.64 37.85 1fkr n ILE 56 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 1fkr h ARG 57 N -2.66 -0.58 -0.24 6.28 9.65 -1.83 -2.93 114.38 122.08 1fkr h ARG 57 Ca -0.31 0.04 0.09 0.00 -1.10 0.00 0.00 59.98 58.70 1fkr h ARG 57 Cb 0.93 0.13 -0.04 0.00 -1.39 0.00 0.00 29.97 29.61 1fkr h ARG 57 CO 0.20 -0.39 0.14 0.41 2.80 0.00 0.00 179.97 183.13 1fkr n GLY 58 N 0.17 -0.16 0.00 2.80 0.00 -1.25 0.76 105.19 107.51 1fkr n GLY 58 Ca -0.07 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1fkr n GLY 58 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1fkr n TRP 59 N -3.36 0.00 -0.17 1.61 7.02 -1.23 -1.01 117.44 120.30 1fkr n TRP 59 Ca 0.08 0.00 -0.01 0.00 -1.02 0.00 0.00 57.50 56.55 1fkr n TRP 59 Cb 0.29 -0.37 0.01 0.00 -2.42 0.00 0.00 31.31 28.82 1fkr n TRP 59 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 1fkr n GLU 60 N -1.87 -0.11 -0.02 -0.99 2.13 0.23 0.26 120.64 120.27 1fkr n GLU 60 Ca 0.00 0.67 -0.10 0.00 0.66 0.00 0.00 57.16 58.39 1fkr n GLU 60 Cb 0.00 -1.00 -0.08 0.00 0.27 0.00 0.00 31.44 30.63 1fkr n GLU 60 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1fkr h GLU 61 N 0.00 -0.08 0.00 5.31 4.57 -1.00 -2.56 114.58 120.82 1fkr h GLU 61 Ca 0.15 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 1fkr h GLU 61 Cb 0.26 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 1fkr h GLU 61 CO -0.43 0.49 0.00 0.41 -1.18 0.00 0.00 179.01 178.29 1fkr n GLY 62 N 1.18 -3.06 0.34 1.92 0.00 0.38 -1.39 105.19 104.55 1fkr n GLY 62 Ca -0.07 0.32 0.03 0.00 0.00 0.00 0.00 46.02 46.30 1fkr n GLY 62 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1fkr h VAL 63 N 0.00 0.09 -0.39 1.61 2.07 0.34 -0.82 116.25 119.15 1fkr h VAL 63 Ca 0.00 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.56 1fkr h VAL 63 Cb 0.00 0.09 -0.07 0.00 -1.52 0.00 0.00 31.29 29.79 1fkr h VAL 63 CO 0.00 0.00 -0.45 0.00 0.02 0.00 0.00 177.57 177.14 1fkr h ALA 64 N 1.78 -0.65 0.00 1.67 0.00 -1.20 0.59 119.26 121.45 1fkr h ALA 64 Ca 0.41 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1fkr h ALA 64 Cb 0.64 1.08 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1fkr h ALA 64 CO -0.92 -0.88 0.41 0.94 0.00 0.00 0.00 179.25 178.80 1fkr n GLN 65 N -4.83 0.04 -3.92 0.00 7.27 -0.34 -4.40 117.38 111.20 1fkr n GLN 65 Ca -0.02 0.39 -0.24 0.00 0.07 0.00 0.00 57.00 57.20 1fkr n GLN 65 Cb 0.26 -2.03 -0.03 0.00 2.41 0.00 0.00 30.24 30.86 1fkr n GLN 65 CO 0.00 0.00 0.00 -1.64 0.07 0.00 0.00 177.06 175.49 1fkr s MET 66 N -2.85 3.45 0.10 3.69 -1.94 0.21 -5.09 119.30 116.87 1fkr s MET 66 Ca -0.01 -0.64 0.10 0.00 -1.71 0.00 0.00 55.69 53.43 1fkr s MET 66 Cb 0.01 -2.92 -0.04 0.00 2.01 0.00 0.00 34.83 33.90 1fkr s MET 66 CO 0.04 0.46 -0.24 -1.54 -0.01 0.00 0.00 175.02 173.74 1fkr s SER 67 N -3.58 3.48 -0.97 3.03 1.04 -1.26 -4.51 113.70 110.93 1fkr s SER 67 Ca 0.35 -0.63 -0.31 0.00 0.48 0.00 0.00 55.95 55.83 1fkr s SER 67 Cb -0.10 -0.36 -0.21 0.00 0.10 0.00 0.00 66.02 65.45 1fkr s SER 67 CO 0.29 0.21 2.68 0.52 0.98 0.00 0.00 173.24 177.91 1fkr n VAL 68 N 1.14 -0.00 0.00 5.02 0.31 0.09 0.15 118.33 125.04 1fkr n VAL 68 Ca -0.17 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 1fkr n VAL 68 Cb 0.53 -0.59 0.00 0.00 -0.91 0.00 0.00 33.84 32.86 1fkr n VAL 68 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1fkr n GLY 69 N 6.50 1.39 3.71 2.92 0.00 -1.00 -4.20 105.19 114.51 1fkr n GLY 69 Ca 0.65 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.35 1fkr n GLY 69 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1fkr s GLN 70 N -0.26 2.80 -0.02 1.61 0.74 0.12 -4.03 119.66 120.62 1fkr s GLN 70 Ca 0.00 -0.64 0.05 0.00 0.05 0.00 0.00 55.36 54.82 1fkr s GLN 70 Cb 0.00 -2.68 -0.01 0.00 1.10 0.00 0.00 33.01 31.42 1fkr s GLN 70 CO 0.00 0.61 -0.18 1.03 -0.55 0.00 0.00 175.29 176.20 1fkr s ARG 71 N -1.83 1.48 0.33 1.67 0.52 -0.96 -2.03 118.95 118.14 1fkr s ARG 71 Ca 0.22 -0.63 -0.05 0.00 -0.52 0.00 0.00 55.73 54.75 1fkr s ARG 71 Cb -0.12 -1.41 0.01 0.00 0.52 0.00 0.00 34.95 33.95 1fkr s ARG 71 CO 0.14 0.37 0.49 0.00 0.02 0.00 0.00 175.30 176.32 1fkr s ALA 72 N -0.38 0.50 -0.25 2.13 0.00 0.41 -1.93 121.76 122.24 1fkr s ALA 72 Ca 0.06 -1.37 0.00 0.00 0.00 0.00 0.00 51.96 50.65 1fkr s ALA 72 Cb -0.07 1.11 0.07 0.00 0.00 0.00 0.00 23.12 24.23 1fkr s ALA 72 CO -0.00 -0.81 0.00 0.21 0.00 0.00 0.00 175.76 175.16 1fkr s LYS 73 N -3.15 1.26 0.13 0.00 2.20 -0.52 -1.23 119.74 118.43 1fkr s LYS 73 Ca 0.28 -0.99 0.04 0.00 -0.36 0.00 0.00 55.97 54.94 1fkr s LYS 73 Cb -0.01 -2.45 -0.04 0.00 -1.51 0.00 0.00 37.83 33.83 1fkr s LYS 73 CO 0.18 -0.71 0.15 -0.51 -0.36 0.00 0.00 175.35 174.09 1fkr s LEU 74 N 1.47 3.91 -0.12 5.43 1.43 0.30 -1.33 118.68 129.78 1fkr s LEU 74 Ca -0.00 -0.03 0.02 0.00 -1.03 0.00 0.00 54.13 53.08 1fkr s LEU 74 Cb -0.18 -2.54 0.01 0.00 0.03 0.00 0.00 46.19 43.52 1fkr s LEU 74 CO -0.10 0.10 -0.17 -0.89 0.23 0.00 0.00 176.35 175.52 1fkr s THR 75 N -1.64 1.63 -0.06 5.49 2.01 -1.03 -2.11 115.64 119.93 1fkr s THR 75 Ca 0.31 -0.72 0.04 0.00 0.31 0.00 0.00 61.69 61.64 1fkr s THR 75 Cb -0.11 -1.48 -0.02 0.00 0.01 0.00 0.00 72.50 70.90 1fkr s THR 75 CO 0.24 0.47 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.81 1fkr s ILE 76 N 0.98 2.57 0.17 1.82 1.01 -0.76 -1.69 121.20 125.30 1fkr s ILE 76 Ca -0.06 -0.88 0.08 0.00 0.00 0.00 0.00 60.65 59.79 1fkr s ILE 76 Cb -0.15 -1.99 -0.04 0.00 0.01 0.00 0.00 42.46 40.29 1fkr s ILE 76 CO -0.02 0.57 -0.03 -0.94 0.00 0.00 0.00 174.94 174.51 1fkr s SER 77 N -0.30 4.61 0.17 3.58 1.04 -1.22 -2.20 113.70 119.38 1fkr s SER 77 Ca 0.01 -0.44 -0.11 0.00 0.48 0.00 0.00 55.95 55.90 1fkr s SER 77 Cb -0.13 -0.93 0.21 0.00 0.10 0.00 0.00 66.02 65.28 1fkr s SER 77 CO 0.03 0.10 1.12 -0.81 0.98 0.00 0.00 173.24 174.65 1fkr n PRO 78 N 0.00 -0.14 -0.29 4.02 -0.04 -1.26 -0.04 135.00 137.25 1fkr n PRO 78 Ca -0.10 1.11 0.28 0.00 -0.04 0.00 0.00 63.50 64.75 1fkr n PRO 78 Cb 0.55 -1.65 0.52 0.00 -0.04 0.00 0.00 33.50 32.88 1fkr n PRO 78 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1fkr n ASP 79 N -5.09 0.29 -0.12 3.54 5.68 -1.26 -1.42 116.55 118.18 1fkr n ASP 79 Ca 0.08 1.42 -0.16 0.00 -0.50 0.00 0.00 54.79 55.63 1fkr n ASP 79 Cb 0.31 -0.69 -0.11 0.00 -1.14 0.00 0.00 41.12 39.49 1fkr n ASP 79 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 1fkr n TYR 80 N -4.91 0.00 0.00 2.11 4.02 0.94 -4.92 117.16 114.39 1fkr n TYR 80 Ca 0.33 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.22 1fkr n TYR 80 Cb 1.14 -0.89 0.00 0.00 -0.02 0.00 0.00 39.34 39.57 1fkr n TYR 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1fkr n ALA 81 N -3.16 0.00 -3.83 -0.72 0.00 -0.50 -2.78 120.51 109.51 1fkr n ALA 81 Ca -0.41 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.71 1fkr n ALA 81 Cb 0.94 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 20.28 1fkr n ALA 81 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1fkr s TYR 82 N 0.00 3.45 -0.59 0.00 2.02 -1.25 -4.79 117.35 116.20 1fkr s TYR 82 Ca 0.00 -3.09 0.01 0.00 -0.37 0.00 0.00 57.07 53.62 1fkr s TYR 82 Cb 0.00 -2.95 0.43 0.00 -0.40 0.00 0.00 41.96 39.04 1fkr s TYR 82 CO 0.00 -0.71 1.75 0.41 -1.57 0.00 0.00 175.55 175.43 1fkr n GLY 83 N 2.77 5.96 0.00 0.71 0.00 -1.17 -4.23 105.19 109.22 1fkr n GLY 83 Ca 0.12 -2.47 0.00 0.00 0.00 0.00 0.00 46.02 43.68 1fkr n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fkr n ALA 84 N -0.77 1.24 -3.74 4.61 0.00 -1.26 -4.73 120.51 115.86 1fkr n ALA 84 Ca 0.55 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.69 1fkr n ALA 84 Cb 0.66 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.98 1fkr n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1fkr s THR 85 N 0.00 1.48 0.00 0.00 2.01 -1.26 -4.79 115.64 113.07 1fkr s THR 85 Ca 0.00 -2.53 0.00 0.00 0.31 0.00 0.00 61.69 59.47 1fkr s THR 85 Cb 0.00 -2.04 0.00 0.00 0.01 0.00 0.00 72.50 70.47 1fkr s THR 85 CO 0.00 -0.87 0.00 0.61 -0.69 0.00 0.00 174.62 173.67 1fkr n GLY 86 N 3.61 3.01 3.80 4.40 0.00 -1.26 -5.08 105.19 113.68 1fkr n GLY 86 Ca 0.07 -1.76 -0.31 0.00 0.00 0.00 0.00 46.02 44.03 1fkr n GLY 86 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1fkr s HIS 87 N 3.98 3.27 -0.29 1.61 3.76 0.76 -4.91 115.29 123.46 1fkr s HIS 87 Ca 0.00 0.13 0.01 0.00 -0.15 0.00 0.00 55.06 55.05 1fkr s HIS 87 Cb 0.00 -1.67 0.29 0.00 1.11 0.00 0.00 32.58 32.32 1fkr s HIS 87 CO 0.00 0.54 1.75 -0.35 -0.85 0.00 0.00 174.74 175.83 1fkr n PRO 88 N 0.57 1.77 0.00 8.40 -0.04 -1.26 -0.69 135.00 143.75 1fkr n PRO 88 Ca -0.09 -1.65 0.00 0.00 -0.04 0.00 0.00 63.50 61.72 1fkr n PRO 88 Cb 0.52 -1.65 0.00 0.00 -0.04 0.00 0.00 33.50 32.33 1fkr n PRO 88 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1fkr n GLY 89 N -0.07 0.00 0.77 0.55 0.00 -1.26 -4.96 105.19 100.22 1fkr n GLY 89 Ca 0.32 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.29 1fkr n GLY 89 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1fkr n ILE 90 N -2.59 0.82 -3.65 -0.61 5.41 -1.26 -4.91 119.36 112.56 1fkr n ILE 90 Ca 0.00 0.09 -0.37 0.00 1.00 0.00 0.00 62.75 63.47 1fkr n ILE 90 Cb 0.13 -1.69 -0.07 0.00 -0.71 0.00 0.00 39.64 37.30 1fkr n ILE 90 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1fkr s ILE 91 N -2.19 4.17 0.48 1.39 -1.09 -1.23 -4.98 121.20 117.75 1fkr s ILE 91 Ca -0.10 -3.40 -0.07 0.00 -2.23 0.00 0.00 60.65 54.85 1fkr s ILE 91 Cb 0.03 -3.63 -0.04 0.00 -1.58 0.00 0.00 42.46 37.23 1fkr s ILE 91 CO 0.13 -1.00 0.81 -2.16 -1.23 0.00 0.00 174.94 171.49 1fkr s PRO 92 N -0.72 3.59 0.87 2.79 0.04 0.14 0.27 135.00 141.97 1fkr s PRO 92 Ca 0.22 0.30 -0.16 0.00 0.04 0.00 0.00 61.00 61.40 1fkr s PRO 92 Cb -0.13 -2.35 -0.05 0.00 0.04 0.00 0.00 34.50 32.01 1fkr s PRO 92 CO -0.08 -0.21 -0.64 -0.35 0.04 0.00 0.00 177.00 175.75 1fkr n PRO 93 N -2.15 -0.52 -1.74 0.56 -0.04 -1.26 -3.70 135.00 126.14 1fkr n PRO 93 Ca 0.01 -0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 1fkr n PRO 93 Cb 0.55 -1.15 0.00 0.00 -0.04 0.00 0.00 33.50 32.86 1fkr n PRO 93 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1fkr n HIS 94 N -3.59 0.00 -3.74 0.54 8.25 -1.26 -4.82 115.22 110.60 1fkr n HIS 94 Ca 0.00 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.18 1fkr n HIS 94 Cb 0.46 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.46 1fkr n HIS 94 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1fkr n ALA 95 N -0.42 3.37 -0.65 -1.41 0.00 -1.24 -5.04 120.51 115.12 1fkr n ALA 95 Ca 0.00 -4.28 -0.22 0.00 0.00 0.00 0.00 53.44 48.95 1fkr n ALA 95 Cb 0.00 -0.96 -0.01 0.00 0.00 0.00 0.00 19.45 18.48 1fkr n ALA 95 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1fkr n THR 96 N 1.97 0.77 -4.33 0.00 -1.04 -1.26 -4.96 114.28 105.42 1fkr n THR 96 Ca 0.23 -0.24 -0.26 0.00 -2.04 0.00 0.00 64.05 61.74 1fkr n THR 96 Cb 0.38 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.80 1fkr n THR 96 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1fkr s LEU 97 N 1.59 2.85 -0.05 -4.42 1.43 -0.94 -4.52 118.68 114.62 1fkr s LEU 97 Ca 0.30 -0.68 -0.00 0.00 -1.03 0.00 0.00 54.13 52.71 1fkr s LEU 97 Cb -0.40 -1.52 0.03 0.00 0.03 0.00 0.00 46.19 44.33 1fkr s LEU 97 CO 0.27 0.09 -0.00 -0.69 0.23 0.00 0.00 176.35 176.26 1fkr s VAL 98 N -1.80 0.30 0.14 -1.59 1.01 -0.76 -1.84 120.40 115.85 1fkr s VAL 98 Ca 0.25 0.10 0.10 0.00 0.00 0.00 0.00 61.98 62.43 1fkr s VAL 98 Cb -0.08 -0.42 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 1fkr s VAL 98 CO 0.14 0.21 -0.23 -0.36 0.00 0.00 0.00 175.10 174.87 1fkr s PHE 99 N 1.53 2.41 -0.43 5.22 0.40 -0.90 -1.14 117.98 125.07 1fkr s PHE 99 Ca -0.02 -0.33 0.03 0.00 -0.60 0.00 0.00 56.93 56.01 1fkr s PHE 99 Cb -0.13 -1.27 0.12 0.00 0.51 0.00 0.00 43.02 42.25 1fkr s PHE 99 CO -0.03 0.38 0.18 -0.51 0.70 0.00 0.00 175.22 175.95 1fkr s ASP 100 N -2.20 4.21 0.18 1.36 1.11 -0.75 -0.54 116.67 120.05 1fkr s ASP 100 Ca 0.17 -2.54 0.06 0.00 0.18 0.00 0.00 52.55 50.42 1fkr s ASP 100 Cb -0.10 -1.38 -0.04 0.00 1.07 0.00 0.00 42.92 42.47 1fkr s ASP 100 CO 0.08 -0.30 0.08 -0.69 1.18 0.00 0.00 175.17 175.53 1fkr s VAL 101 N 0.40 4.13 -0.28 -1.27 1.01 -0.36 -1.71 120.40 122.31 1fkr s VAL 101 Ca 0.15 -1.29 -0.00 0.00 0.00 0.00 0.00 61.98 60.84 1fkr s VAL 101 Cb -0.23 -3.11 0.09 0.00 0.00 0.00 0.00 36.38 33.12 1fkr s VAL 101 CO -0.05 -0.15 0.05 -0.70 0.00 0.00 0.00 175.10 174.26 1fkr s GLU 102 N -3.14 1.00 -0.24 2.72 2.12 -0.75 -0.45 118.70 119.96 1fkr s GLU 102 Ca 0.30 -1.09 -0.29 0.00 0.36 0.00 0.00 54.97 54.24 1fkr s GLU 102 Cb -0.09 -2.31 0.00 0.00 0.26 0.00 0.00 34.13 31.99 1fkr s GLU 102 CO 0.21 -0.86 1.16 -1.17 -0.54 0.00 0.00 175.26 174.07 1fkr s LEU 103 N 1.49 4.05 -0.16 2.70 2.96 -0.86 -2.51 118.68 126.37 1fkr s LEU 103 Ca 0.05 1.38 -0.14 0.00 -0.22 0.00 0.00 54.13 55.20 1fkr s LEU 103 Cb -0.18 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 42.87 1fkr s LEU 103 CO -0.17 -0.81 0.08 -0.07 -1.32 0.00 0.00 176.35 174.07 1fkr h LEU 104 N 9.90 0.00 0.00 -0.68 3.38 -0.80 -2.65 115.31 124.45 1fkr h LEU 104 Ca -0.23 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1fkr h LEU 104 Cb 1.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.83 1fkr h LEU 104 CO 1.00 0.98 0.01 2.29 0.09 0.00 0.00 178.44 182.80 1fkr n LYS 105 N -4.58 0.00 -4.38 1.13 2.85 -1.04 -4.39 118.16 107.75 1fkr n LYS 105 Ca -0.14 -0.01 -0.26 0.00 -1.05 0.00 0.00 58.31 56.85 1fkr n LYS 105 Cb 0.38 0.01 -0.10 0.00 -0.65 0.00 0.00 35.03 34.67 1fkr n LYS 105 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1fkr s LEU 106 N 0.00 2.71 0.00 -5.58 1.43 -1.26 0.49 118.68 116.47 1fkr s LEU 106 Ca 0.00 -0.80 0.00 0.00 -1.03 0.00 0.00 54.13 52.30 1fkr s LEU 106 Cb -0.00 -1.35 0.00 0.00 0.03 0.00 0.00 46.19 44.87 1fkr s LEU 106 CO 0.00 0.08 0.09 1.21 0.23 0.00 0.00 176.35 177.96