#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 3.27 0.17 1.61 0.11 -1.26 -2.68 120.40 121.63 1fkr s VAL 2 Ca 0.00 -1.00 0.10 0.00 -2.93 0.00 0.00 61.98 58.15 1fkr s VAL 2 Cb 0.00 -2.42 -0.04 0.00 -1.53 0.00 0.00 36.38 32.39 1fkr s VAL 2 CO 0.00 0.34 -0.22 -1.58 -3.33 0.00 0.00 175.10 170.30 1fkr s GLN 3 N -1.53 1.40 -0.19 1.54 0.74 -0.71 -4.97 119.66 115.95 1fkr s GLN 3 Ca 0.17 -1.45 0.00 0.00 0.05 0.00 0.00 55.36 54.13 1fkr s GLN 3 Cb -0.11 -1.65 0.05 0.00 1.10 0.00 0.00 33.01 32.40 1fkr s GLN 3 CO 0.07 0.35 -0.07 0.08 -0.55 0.00 0.00 175.29 175.18 1fkr s VAL 4 N -1.72 1.40 -0.30 1.34 1.01 -1.26 -2.42 120.40 118.45 1fkr s VAL 4 Ca 0.18 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.25 1fkr s VAL 4 Cb -0.07 -1.55 0.05 0.00 0.00 0.00 0.00 36.38 34.80 1fkr s VAL 4 CO 0.08 0.10 0.00 -1.61 0.00 0.00 0.00 175.10 173.68 1fkr s GLU 5 N 1.49 2.40 0.43 2.72 0.41 -0.87 -4.99 118.70 120.29 1fkr s GLU 5 Ca -0.01 -1.29 -0.14 0.00 -0.41 0.00 0.00 54.97 53.12 1fkr s GLU 5 Cb -0.16 -3.19 -0.08 0.00 -1.78 0.00 0.00 34.13 28.93 1fkr s GLU 5 CO -0.08 -0.64 0.85 0.99 -0.49 0.00 0.00 175.26 175.89 1fkr s THR 6 N 1.24 4.66 0.01 3.63 2.01 -1.26 -0.17 115.64 125.77 1fkr s THR 6 Ca -0.05 0.91 0.00 0.00 0.31 0.00 0.00 61.69 62.87 1fkr s THR 6 Cb -0.20 -3.70 0.00 0.00 0.01 0.00 0.00 72.50 68.61 1fkr s THR 6 CO -0.01 -0.52 0.00 -0.38 -0.69 0.00 0.00 174.62 173.02 1fkr n ILE 7 N -1.22 0.06 -3.83 1.82 5.41 -0.53 -4.90 119.36 116.18 1fkr n ILE 7 Ca 0.04 0.02 -0.28 0.00 1.00 0.00 0.00 62.75 63.53 1fkr n ILE 7 Cb 0.54 -1.33 -0.12 0.00 -0.71 0.00 0.00 39.64 38.03 1fkr n ILE 7 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1fkr n SER 8 N -2.95 2.66 -3.51 4.38 2.88 -1.07 -5.02 113.62 111.00 1fkr n SER 8 Ca 0.00 -3.13 -0.33 0.00 -1.33 0.00 0.00 58.87 54.08 1fkr n SER 8 Cb 0.39 -0.73 0.03 0.00 -0.75 0.00 0.00 64.21 63.14 1fkr n SER 8 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1fkr n PRO 9 N 2.01 0.00 -1.48 -1.46 -0.02 -1.26 -2.34 135.00 130.44 1fkr n PRO 9 Ca 0.21 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1fkr n PRO 9 Cb 0.37 -0.88 0.00 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 3.07 5.03 0.44 -1.23 0.00 -1.26 -4.42 105.19 106.83 1fkr n GLY 10 Ca -0.02 -2.08 -0.13 0.00 0.00 0.00 0.00 46.02 43.79 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 0.00 -1.70 0.00 1.61 2.03 -1.88 -3.46 116.42 113.03 1fkr h ASP 11 Ca 0.00 0.23 0.00 0.00 -0.73 0.00 0.00 57.03 56.53 1fkr h ASP 11 Cb 0.00 0.70 0.00 0.00 -0.83 0.00 0.00 39.33 39.20 1fkr h ASP 11 CO 0.00 -0.42 0.00 0.61 -1.03 0.00 0.00 179.24 178.40 1fkr n GLY 12 N -1.40 1.85 0.00 7.15 0.00 -1.26 -4.99 105.19 106.53 1fkr n GLY 12 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.80 0.61 -4.56 1.61 1.74 -1.26 -5.09 116.66 108.91 1fkr n ARG 13 Ca 0.00 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.74 1fkr n ARG 13 Cb 0.00 -0.65 -0.11 0.00 -1.02 0.00 0.00 32.46 30.68 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 -1.31 3.85 0.38 0.55 2.01 -1.26 -5.07 115.64 114.80 1fkr s THR 14 Ca 0.00 -0.42 0.04 0.00 0.31 0.00 0.00 61.69 61.62 1fkr s THR 14 Cb 0.00 -2.59 -0.03 0.00 0.01 0.00 0.00 72.50 69.89 1fkr s THR 14 CO 0.00 0.60 0.15 -0.36 -0.69 0.00 0.00 174.62 174.31 1fkr s PHE 15 N -0.77 1.77 0.31 4.92 0.40 -1.26 -1.56 117.98 121.79 1fkr s PHE 15 Ca 0.12 -1.33 -0.29 0.00 -0.60 0.00 0.00 56.93 54.83 1fkr s PHE 15 Cb -0.11 -1.08 -0.10 0.00 0.51 0.00 0.00 43.02 42.24 1fkr s PHE 15 CO 0.02 -0.38 1.32 -2.14 0.70 0.00 0.00 175.22 174.74 1fkr s PRO 16 N -3.70 4.35 0.31 0.24 0.02 -1.26 -4.86 135.00 130.10 1fkr s PRO 16 Ca 0.28 2.20 0.11 0.00 0.02 0.00 0.00 61.00 63.61 1fkr s PRO 16 Cb 0.03 -3.09 -0.06 0.00 0.02 0.00 0.00 34.50 31.40 1fkr s PRO 16 CO 0.16 -0.22 -0.15 0.15 -0.33 0.00 0.00 177.00 176.62 1fkr s LYS 17 N -1.42 1.75 0.03 5.54 -0.14 -1.26 -5.01 119.74 119.22 1fkr s LYS 17 Ca 0.51 -1.84 -0.30 0.00 -1.36 0.00 0.00 55.97 52.97 1fkr s LYS 17 Cb -0.40 -1.74 -0.06 0.00 -1.68 0.00 0.00 37.83 33.95 1fkr s LYS 17 CO 0.50 0.24 1.36 1.03 -0.76 0.00 0.00 175.35 177.73 1fkr s ARG 18 N -3.56 4.31 0.00 1.68 0.52 -1.26 -2.61 118.95 118.04 1fkr s ARG 18 Ca 0.31 1.95 0.00 0.00 -0.52 0.00 0.00 55.73 57.47 1fkr s ARG 18 Cb -0.02 -3.48 0.00 0.00 0.52 0.00 0.00 34.95 31.97 1fkr s ARG 18 CO 0.16 -0.50 0.00 0.41 0.02 0.00 0.00 175.30 175.38 1fkr n GLY 19 N 3.55 1.78 3.87 -3.53 0.00 -1.26 -5.08 105.19 104.51 1fkr n GLY 19 Ca 0.12 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.10 2.27 0.37 1.61 -0.21 -1.07 -5.09 119.66 117.43 1fkr s GLN 20 Ca 0.00 -1.99 0.08 0.00 0.02 0.00 0.00 55.36 53.47 1fkr s GLN 20 Cb 0.00 -2.06 -0.03 0.00 1.00 0.00 0.00 33.01 31.91 1fkr s GLN 20 CO 0.00 -0.51 0.27 0.99 -2.12 0.00 0.00 175.29 173.92 1fkr s THR 21 N -2.74 3.03 0.10 -0.19 2.01 -1.26 -4.13 115.64 112.46 1fkr s THR 21 Ca 0.34 -1.47 0.07 0.00 0.31 0.00 0.00 61.69 60.93 1fkr s THR 21 Cb -0.01 -3.06 -0.04 0.00 0.01 0.00 0.00 72.50 69.40 1fkr s THR 21 CO 0.20 -0.11 -0.11 0.00 -0.69 0.00 0.00 174.62 173.92 1fkr s VAL 23 N -1.19 1.85 0.12 0.00 1.01 0.14 -1.90 120.40 120.44 1fkr s VAL 23 Ca 0.21 -1.94 0.10 0.00 0.00 0.00 0.00 61.98 60.35 1fkr s VAL 23 Cb -0.11 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 1fkr s VAL 23 CO 0.13 -0.52 -0.26 0.68 0.00 0.00 0.00 175.10 175.13 1fkr s VAL 24 N 1.14 2.18 -0.18 2.92 -7.23 0.29 0.20 120.40 119.72 1fkr s VAL 24 Ca 0.07 -1.70 -0.00 0.00 -1.81 0.00 0.00 61.98 58.54 1fkr s VAL 24 Cb -0.19 -1.93 0.04 0.00 0.56 0.00 0.00 36.38 34.87 1fkr s VAL 24 CO -0.12 0.09 -0.06 -2.28 -0.31 0.00 0.00 175.10 172.42 1fkr s HIS 25 N -1.05 1.90 0.36 2.82 5.04 -1.06 -1.54 115.29 121.77 1fkr s HIS 25 Ca 0.13 -1.24 0.04 0.00 -1.54 0.00 0.00 55.06 52.44 1fkr s HIS 25 Cb -0.10 -1.40 -0.03 0.00 0.04 0.00 0.00 32.58 31.08 1fkr s HIS 25 CO 0.05 -0.66 0.13 1.52 -2.34 0.00 0.00 174.74 173.45 1fkr s TYR 26 N 1.57 1.75 -0.11 3.88 1.13 -1.26 -1.90 117.35 122.40 1fkr s TYR 26 Ca -0.00 -1.28 -0.02 0.00 -1.41 0.00 0.00 57.07 54.36 1fkr s TYR 26 Cb -0.16 -1.06 0.04 0.00 -1.10 0.00 0.00 41.96 39.68 1fkr s TYR 26 CO -0.08 -0.35 0.00 0.99 -2.51 0.00 0.00 175.55 173.61 1fkr s THR 27 N -3.36 0.48 -0.20 -3.49 2.01 -1.00 -1.81 115.64 108.27 1fkr s THR 27 Ca 0.30 -0.13 -0.08 0.00 0.31 0.00 0.00 61.69 62.09 1fkr s THR 27 Cb 0.04 -0.74 -0.04 0.00 0.01 0.00 0.00 72.50 71.77 1fkr s THR 27 CO 0.16 0.12 0.09 -0.83 -0.69 0.00 0.00 174.62 173.47 1fkr s GLY 28 N 1.91 1.94 0.35 4.40 0.00 0.40 -2.29 107.32 114.03 1fkr s GLY 28 Ca 0.03 -0.78 0.04 0.00 0.00 0.00 0.00 44.72 44.01 1fkr s GLY 28 CO -0.06 0.15 0.14 -0.29 0.00 0.00 0.00 173.10 173.04 1fkr s MET 29 N 0.53 1.74 0.42 2.90 1.75 -0.89 -2.02 119.30 123.74 1fkr s MET 29 Ca 0.05 -2.02 0.07 0.00 -1.25 0.00 0.00 55.69 52.54 1fkr s MET 29 Cb -0.12 -0.37 -0.06 0.00 2.84 0.00 0.00 34.83 37.12 1fkr s MET 29 CO 0.01 -0.44 0.13 -0.51 -0.65 0.00 0.00 175.02 173.55 1fkr s LEU 30 N -3.48 3.02 0.12 4.11 1.43 -0.97 -2.49 118.68 120.41 1fkr s LEU 30 Ca 0.31 -1.19 -0.20 0.00 -1.03 0.00 0.00 54.13 52.02 1fkr s LEU 30 Cb 0.04 -1.25 -0.02 0.00 0.03 0.00 0.00 46.19 44.99 1fkr s LEU 30 CO 0.17 -0.53 1.06 1.21 0.23 0.00 0.00 176.35 178.48 1fkr n GLU 31 N -1.17 -0.29 -2.69 1.70 0.00 -1.13 -3.81 120.64 113.25 1fkr n GLU 31 Ca -0.03 1.04 -0.05 0.00 0.00 0.00 0.00 57.16 58.12 1fkr n GLU 31 Cb 0.65 -1.53 0.11 0.00 0.00 0.00 0.00 31.44 30.67 1fkr n GLU 31 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 1fkr n ASP 32 N -4.88 -1.45 0.00 4.31 5.75 -1.26 -5.05 116.55 113.97 1fkr n ASP 32 Ca 0.02 -2.39 0.00 0.00 -0.01 0.00 0.00 54.79 52.41 1fkr n ASP 32 Cb 0.19 0.78 0.00 0.00 -1.03 0.00 0.00 41.12 41.05 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 -0.84 0.19 0.00 6.12 0.00 -1.25 -5.17 105.19 104.24 1fkr n GLY 33 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1fkr n GLY 33 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1fkr n LYS 34 N -1.16 0.00 -3.11 1.61 0.00 -1.26 -4.98 118.16 109.26 1fkr n LYS 34 Ca 0.00 0.00 -0.40 0.00 -0.00 0.00 0.00 58.31 57.91 1fkr n LYS 34 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 35.03 34.97 1fkr n LYS 34 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1fkr s LYS 35 N 0.10 4.24 -0.12 -1.58 1.02 -1.26 -2.29 119.74 119.84 1fkr s LYS 35 Ca 0.00 0.65 0.17 0.00 0.02 0.00 0.00 55.97 56.81 1fkr s LYS 35 Cb 0.00 -3.56 0.27 0.00 -0.52 0.00 0.00 37.83 34.01 1fkr s LYS 35 CO 0.00 -0.21 1.14 1.97 -0.92 0.00 0.00 175.35 177.33 1fkr n PHE 36 N 4.92 0.00 0.00 3.18 -1.74 -0.85 -4.97 117.46 118.00 1fkr n PHE 36 Ca -0.01 -0.91 0.00 0.00 -0.56 0.00 0.00 57.45 55.96 1fkr n PHE 36 Cb 0.50 -0.14 0.00 0.00 1.52 0.00 0.00 39.48 41.36 1fkr n PHE 36 CO 0.00 0.00 0.00 -0.25 -0.56 0.00 0.00 176.76 175.95 1fkr n ASP 37 N -1.31 0.00 -4.64 5.98 9.92 -1.21 -4.96 116.55 120.33 1fkr n ASP 37 Ca 0.15 0.00 -0.27 0.00 -0.53 0.00 0.00 54.79 54.14 1fkr n ASP 37 Cb 0.65 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 41.03 1fkr n ASP 37 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1fkr s SER 38 N 0.00 4.00 -0.48 -2.24 0.01 -1.26 0.15 113.70 113.88 1fkr s SER 38 Ca 0.00 -1.28 0.04 0.00 1.31 0.00 0.00 55.95 56.02 1fkr s SER 38 Cb 0.00 -0.42 0.43 0.00 0.21 0.00 0.00 66.02 66.24 1fkr s SER 38 CO 0.00 -0.44 1.37 -1.54 0.41 0.00 0.00 173.24 173.04 1fkr n SER 39 N -1.02 5.52 -3.18 2.44 3.41 -0.75 -4.79 113.62 115.25 1fkr n SER 39 Ca -0.04 -3.75 -0.25 0.00 -0.26 0.00 0.00 58.87 54.56 1fkr n SER 39 Cb 0.66 -0.57 -0.06 0.00 -0.26 0.00 0.00 64.21 63.98 1fkr n SER 39 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1fkr n ARG 40 N -0.61 2.25 0.00 4.33 3.00 -1.26 -4.74 116.66 119.64 1fkr n ARG 40 Ca 0.45 -4.31 0.00 0.00 -0.00 0.00 0.00 57.85 53.99 1fkr n ARG 40 Cb 0.69 -2.00 0.00 0.00 0.00 0.00 0.00 32.46 31.15 1fkr n ARG 40 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 1fkr n ASP 41 N 0.47 0.00 0.00 6.15 2.03 -1.26 -5.04 116.55 118.89 1fkr n ASP 41 Ca 0.28 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.59 1fkr n ASP 41 Cb 0.46 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.86 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 -0.13 0.00 -0.06 -0.67 0.63 -1.26 -5.04 116.66 110.14 1fkr n ARG 42 Ca 0.00 0.00 -0.08 0.00 -0.92 0.00 0.00 57.85 56.85 1fkr n ARG 42 Cb 0.00 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 32.86 1fkr n ARG 42 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1fkr n ASN 43 N 0.00 3.10 -4.93 6.15 5.03 -1.26 -5.05 115.26 118.29 1fkr n ASN 43 Ca 0.00 -0.06 -0.27 0.00 0.87 0.00 0.00 54.58 55.12 1fkr n ASN 43 Cb 0.00 -0.17 -0.03 0.00 -1.02 0.00 0.00 39.78 38.56 1fkr n ASN 43 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1fkr s LYS 44 N -2.23 3.39 0.00 3.52 1.02 -1.26 -5.13 119.74 119.06 1fkr s LYS 44 Ca -0.15 -0.60 0.00 0.00 0.02 0.00 0.00 55.97 55.24 1fkr s LYS 44 Cb 0.04 -2.95 0.00 0.00 -0.52 0.00 0.00 37.83 34.40 1fkr s LYS 44 CO 0.27 0.53 0.00 -0.35 -0.92 0.00 0.00 175.35 174.88 1fkr n PRO 45 N -0.42 1.27 -3.76 -1.68 -0.04 -1.26 -4.78 135.00 124.34 1fkr n PRO 45 Ca -0.07 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.08 1fkr n PRO 45 Cb 0.54 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.95 1fkr n PRO 45 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1fkr s PHE 46 N 0.00 3.49 -0.06 0.54 5.36 -0.59 -4.99 117.98 121.74 1fkr s PHE 46 Ca 0.00 0.44 -0.02 0.00 -0.96 0.00 0.00 56.93 56.38 1fkr s PHE 46 Cb 0.00 -1.91 0.03 0.00 -0.34 0.00 0.00 43.02 40.80 1fkr s PHE 46 CO 0.00 0.48 0.13 0.15 -1.46 0.00 0.00 175.22 174.52 1fkr s LYS 47 N -2.66 0.08 0.17 10.12 3.01 -1.26 -0.55 119.74 128.64 1fkr s LYS 47 Ca 0.39 0.33 -0.04 0.00 -1.01 0.00 0.00 55.97 55.63 1fkr s LYS 47 Cb -0.12 -0.17 -0.03 0.00 -1.01 0.00 0.00 37.83 36.50 1fkr s LYS 47 CO 0.26 -0.15 0.18 -0.59 0.51 0.00 0.00 175.35 175.55 1fkr s PHE 48 N 1.06 0.74 0.10 3.18 -0.12 -0.80 -4.91 117.98 117.24 1fkr s PHE 48 Ca -0.08 -1.08 0.08 0.00 -0.05 0.00 0.00 56.93 55.80 1fkr s PHE 48 Cb -0.11 -0.31 -0.04 0.00 -0.63 0.00 0.00 43.02 41.93 1fkr s PHE 48 CO -0.05 -0.65 -0.15 1.41 -0.05 0.00 0.00 175.22 175.73 1fkr s MET 49 N -4.05 1.95 -0.24 1.99 -2.45 -1.26 0.32 119.30 115.56 1fkr s MET 49 Ca 0.25 -1.09 -0.19 0.00 -1.25 0.00 0.00 55.69 53.41 1fkr s MET 49 Cb 0.05 -2.19 -0.02 0.00 1.25 0.00 0.00 34.83 33.92 1fkr s MET 49 CO 0.04 0.50 0.58 -1.17 1.05 0.00 0.00 175.02 176.02 1fkr s LEU 50 N -2.03 4.08 0.00 4.11 2.96 -1.26 -3.99 118.68 122.55 1fkr s LEU 50 Ca 0.18 0.67 0.00 0.00 -0.22 0.00 0.00 54.13 54.76 1fkr s LEU 50 Cb -0.11 -2.79 0.00 0.00 0.50 0.00 0.00 46.19 43.80 1fkr s LEU 50 CO 0.10 -0.31 0.00 0.61 -1.32 0.00 0.00 176.35 175.43 1fkr n GLY 51 N 4.14 1.36 1.81 7.98 0.00 -1.26 -4.39 105.19 114.82 1fkr n GLY 51 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 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 0.00 2.84 -1.28 1.61 3.00 -1.26 -4.99 118.16 118.08 1fkr n LYS 52 Ca 0.00 -3.67 0.00 0.00 -0.00 0.00 0.00 58.31 54.64 1fkr n LYS 52 Cb 0.00 -2.13 0.00 0.00 0.00 0.00 0.00 35.03 32.90 1fkr n LYS 52 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1fkr n GLN 53 N -0.89 -0.27 0.04 1.64 6.02 -1.26 -4.68 117.38 117.97 1fkr n GLN 53 Ca 0.45 -0.13 -0.08 0.00 -0.01 0.00 0.00 57.00 57.23 1fkr n GLN 53 Cb 0.92 0.24 -0.13 0.00 1.02 0.00 0.00 30.24 32.29 1fkr n GLN 53 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1fkr h GLU 54 N 0.93 0.01 -6.78 -1.09 5.08 -1.95 -3.45 114.58 107.34 1fkr h GLU 54 Ca 0.00 -0.02 -0.68 0.00 -1.00 0.00 0.00 59.36 57.67 1fkr h GLU 54 Cb 0.00 0.01 -0.20 0.00 0.50 0.00 0.00 28.75 29.06 1fkr h GLU 54 CO 0.00 0.87 -0.84 0.14 -1.00 0.00 0.00 179.01 178.18 1fkr s VAL 55 N -2.68 2.47 0.59 3.13 -7.23 -1.26 -5.08 120.40 110.35 1fkr s VAL 55 Ca -0.01 -1.75 -0.06 0.00 -1.81 0.00 0.00 61.98 58.35 1fkr s VAL 55 Cb 0.09 -2.13 0.09 0.00 0.56 0.00 0.00 36.38 34.99 1fkr s VAL 55 CO 0.82 0.04 0.21 2.30 -0.31 0.00 0.00 175.10 178.16 1fkr n ILE 56 N 0.70 0.00 -0.05 -0.62 -5.35 -1.26 -4.54 119.36 108.24 1fkr n ILE 56 Ca -0.16 0.00 -0.00 0.00 -0.27 0.00 0.00 62.75 62.32 1fkr n ILE 56 Cb 0.54 -0.24 -0.00 0.00 -1.74 0.00 0.00 39.64 38.19 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 0.00 0.00 -1.08 6.28 9.65 -1.90 -2.10 114.38 125.23 1fkr h ARG 57 Ca -0.10 0.00 0.31 0.00 -1.10 0.00 0.00 59.98 59.10 1fkr h ARG 57 Cb 0.32 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 28.86 1fkr h ARG 57 CO 0.06 0.00 1.03 0.41 2.80 0.00 0.00 179.97 184.27 1fkr n GLY 58 N 1.78 -0.67 0.00 2.80 0.00 -1.25 0.26 105.19 108.11 1fkr n GLY 58 Ca -0.01 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.39 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 -3.07 0.00 -0.26 1.61 7.02 -1.25 -2.19 117.44 119.30 1fkr n TRP 59 Ca 0.24 0.00 0.02 0.00 -1.02 0.00 0.00 57.50 56.75 1fkr n TRP 59 Cb 1.35 -0.08 0.07 0.00 -2.42 0.00 0.00 31.31 30.24 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 -1.57 -0.10 0.05 -0.99 2.13 -0.46 0.27 120.64 119.98 1fkr n GLU 60 Ca 0.00 1.08 -0.11 0.00 0.66 0.00 0.00 57.16 58.80 1fkr n GLU 60 Cb 0.00 -1.61 -0.08 0.00 0.27 0.00 0.00 31.44 30.02 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 -0.20 0.00 5.31 4.57 -0.42 -2.47 114.58 121.36 1fkr h GLU 61 Ca 0.30 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.50 1fkr h GLU 61 Cb 0.48 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.11 1fkr h GLU 61 CO -0.71 0.22 0.00 0.41 -1.18 0.00 0.00 179.01 177.76 1fkr n GLY 62 N 0.63 -3.07 0.22 1.92 0.00 0.33 -2.55 105.19 102.67 1fkr n GLY 62 Ca -0.08 0.18 0.06 0.00 0.00 0.00 0.00 46.02 46.19 1fkr n GLY 62 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1fkr n VAL 63 N -0.59 -0.26 -0.11 1.61 0.31 0.77 0.21 118.33 120.27 1fkr n VAL 63 Ca 0.00 1.38 -0.13 0.00 -0.01 0.00 0.00 64.34 65.58 1fkr n VAL 63 Cb 0.00 -1.96 -0.09 0.00 -0.91 0.00 0.00 33.84 30.87 1fkr n VAL 63 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1fkr h ALA 64 N 1.23 -0.79 0.00 3.52 0.00 -1.33 0.52 119.26 122.42 1fkr h ALA 64 Ca 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1fkr h ALA 64 Cb 0.59 1.09 0.00 0.00 0.00 0.00 0.00 17.79 19.47 1fkr h ALA 64 CO -0.61 -1.03 0.37 0.94 0.00 0.00 0.00 179.25 178.92 1fkr n GLN 65 N -5.25 0.03 -3.73 0.00 7.27 0.13 -4.40 117.38 111.44 1fkr n GLN 65 Ca -0.04 0.35 -0.22 0.00 0.07 0.00 0.00 57.00 57.16 1fkr n GLN 65 Cb 0.33 -1.96 -0.02 0.00 2.41 0.00 0.00 30.24 31.00 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 -2.76 3.46 0.23 3.69 -1.94 0.18 -5.11 119.30 117.05 1fkr s MET 66 Ca -0.00 -0.57 0.10 0.00 -1.71 0.00 0.00 55.69 53.51 1fkr s MET 66 Cb 0.01 -2.80 -0.04 0.00 2.01 0.00 0.00 34.83 34.00 1fkr s MET 66 CO 0.04 0.32 -0.14 -1.54 -0.01 0.00 0.00 175.02 173.69 1fkr s SER 67 N -3.95 3.92 -0.80 3.03 1.04 -1.26 -4.50 113.70 111.18 1fkr s SER 67 Ca 0.36 -0.79 -0.25 0.00 0.48 0.00 0.00 55.95 55.76 1fkr s SER 67 Cb -0.09 -0.51 -0.18 0.00 0.10 0.00 0.00 66.02 65.34 1fkr s SER 67 CO 0.32 0.07 2.48 0.52 0.98 0.00 0.00 173.24 177.61 1fkr n VAL 68 N -0.25 -0.03 0.00 5.02 0.31 -0.60 0.35 118.33 123.13 1fkr n VAL 68 Ca -0.09 -0.42 0.00 0.00 -0.01 0.00 0.00 64.34 63.82 1fkr n VAL 68 Cb 0.57 -1.42 0.00 0.00 -0.91 0.00 0.00 33.84 32.08 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 6.23 1.06 3.73 2.92 0.00 -0.98 -4.21 105.19 113.95 1fkr n GLY 69 Ca 0.54 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.25 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 -0.39 2.79 -0.01 1.61 -0.44 0.16 -4.18 119.66 119.19 1fkr s GLN 70 Ca 0.00 -0.70 0.05 0.00 -2.50 0.00 0.00 55.36 52.21 1fkr s GLN 70 Cb 0.00 -2.68 -0.01 0.00 -1.64 0.00 0.00 33.01 28.68 1fkr s GLN 70 CO 0.00 0.58 -0.16 0.50 0.50 0.00 0.00 175.29 176.70 1fkr s ARG 71 N -2.15 1.29 0.34 1.67 3.52 -0.99 -2.13 118.95 120.49 1fkr s ARG 71 Ca 0.26 -0.61 0.02 0.00 -0.13 0.00 0.00 55.73 55.26 1fkr s ARG 71 Cb -0.12 -1.26 -0.01 0.00 -1.56 0.00 0.00 34.95 32.00 1fkr s ARG 71 CO 0.18 0.34 0.40 0.00 -0.81 0.00 0.00 175.30 175.41 1fkr s ALA 72 N -0.43 1.21 -0.28 6.12 0.00 -0.13 -1.45 121.76 126.80 1fkr s ALA 72 Ca 0.06 -1.75 0.01 0.00 0.00 0.00 0.00 51.96 50.28 1fkr s ALA 72 Cb -0.06 1.29 0.08 0.00 0.00 0.00 0.00 23.12 24.42 1fkr s ALA 72 CO -0.00 -0.74 0.02 0.21 0.00 0.00 0.00 175.76 175.24 1fkr s LYS 73 N -3.20 1.27 0.12 0.00 2.20 0.76 -1.36 119.74 119.53 1fkr s LYS 73 Ca 0.35 -1.17 -0.04 0.00 -0.36 0.00 0.00 55.97 54.75 1fkr s LYS 73 Cb 0.01 -2.52 -0.05 0.00 -1.51 0.00 0.00 37.83 33.75 1fkr s LYS 73 CO 0.23 -0.79 0.33 -0.51 -0.36 0.00 0.00 175.35 174.26 1fkr s LEU 74 N 1.38 4.30 -0.21 5.43 1.43 0.01 -2.06 118.68 128.96 1fkr s LEU 74 Ca 0.03 0.51 0.01 0.00 -1.03 0.00 0.00 54.13 53.64 1fkr s LEU 74 Cb -0.18 -3.19 0.05 0.00 0.03 0.00 0.00 46.19 42.90 1fkr s LEU 74 CO -0.12 0.09 -0.08 -0.89 0.23 0.00 0.00 176.35 175.58 1fkr s THR 75 N -1.60 1.63 -0.03 5.49 2.01 -1.01 -1.92 115.64 120.20 1fkr s THR 75 Ca 0.39 -1.12 -0.01 0.00 0.31 0.00 0.00 61.69 61.26 1fkr s THR 75 Cb -0.12 -1.77 -0.04 0.00 0.01 0.00 0.00 72.50 70.58 1fkr s THR 75 CO 0.25 0.06 0.06 -0.63 -0.69 0.00 0.00 174.62 173.67 1fkr s ILE 76 N 1.38 4.60 0.11 1.82 1.01 -0.70 -1.73 121.20 127.68 1fkr s ILE 76 Ca -0.03 -0.37 0.06 0.00 0.00 0.00 0.00 60.65 60.31 1fkr s ILE 76 Cb -0.17 -3.05 -0.04 0.00 0.01 0.00 0.00 42.46 39.20 1fkr s ILE 76 CO -0.07 0.42 -0.02 -0.94 0.00 0.00 0.00 174.94 174.33 1fkr s SER 77 N -1.48 4.85 0.18 3.58 1.04 -1.09 -2.28 113.70 118.49 1fkr s SER 77 Ca 0.20 -0.26 -0.23 0.00 0.48 0.00 0.00 55.95 56.13 1fkr s SER 77 Cb -0.12 -1.09 0.08 0.00 0.10 0.00 0.00 66.02 65.00 1fkr s SER 77 CO 0.10 0.16 1.57 1.55 0.98 0.00 0.00 173.24 177.60 1fkr h PRO 78 N 3.34 -0.16 0.00 4.02 0.13 -1.94 -0.65 132.00 136.73 1fkr h PRO 78 Ca -0.48 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1fkr h PRO 78 Cb 1.17 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1fkr h PRO 78 CO 0.58 -0.11 0.80 -0.40 -0.23 0.00 0.00 178.00 178.64 1fkr n ASP 79 N -5.42 0.00 -0.07 1.44 5.75 -1.26 -0.41 116.55 116.59 1fkr n ASP 79 Ca 0.04 0.33 -0.08 0.00 -0.01 0.00 0.00 54.79 55.07 1fkr n ASP 79 Cb 0.35 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 40.34 1fkr n ASP 79 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1fkr n TYR 80 N -1.96 0.00 0.00 2.11 4.02 -0.25 -4.96 117.16 116.12 1fkr n TYR 80 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1fkr n TYR 80 Cb 0.80 -0.68 0.00 0.00 -0.02 0.00 0.00 39.34 39.45 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 -2.60 1.49 -1.60 -0.72 0.00 0.46 -3.25 120.51 114.29 1fkr n ALA 81 Ca -0.24 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1fkr n ALA 81 Cb 0.93 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.38 1fkr n ALA 81 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1fkr n TYR 82 N -2.11 0.00 -1.00 0.00 4.01 -1.20 -4.91 117.16 111.96 1fkr n TYR 82 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1fkr n TYR 82 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 1fkr n TYR 82 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fkr n GLY 83 N 3.60 0.19 3.28 2.72 0.00 -1.25 -4.55 105.19 109.18 1fkr n GLY 83 Ca 0.00 -0.39 -0.18 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.71 -2.18 -0.02 4.61 0.00 -1.26 -4.90 120.51 116.05 1fkr n ALA 84 Ca 0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 53.44 53.27 1fkr n ALA 84 Cb 0.33 -0.62 -0.02 0.00 0.00 0.00 0.00 19.45 19.14 1fkr n ALA 84 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1fkr n THR 85 N -1.68 0.27 -0.04 0.00 -1.04 -1.26 -4.96 114.28 105.57 1fkr n THR 85 Ca -0.20 -0.09 -0.10 0.00 -2.04 0.00 0.00 64.05 61.63 1fkr n THR 85 Cb 0.47 -1.10 -0.03 0.00 -1.82 0.00 0.00 70.33 67.85 1fkr n THR 85 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1fkr n GLY 86 N 2.99 -0.25 2.29 3.41 0.00 -1.26 -5.04 105.19 107.33 1fkr n GLY 86 Ca -0.09 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1fkr n GLY 86 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1fkr n HIS 87 N -3.79 0.00 0.56 1.61 1.44 -1.26 -4.77 115.22 109.02 1fkr n HIS 87 Ca -0.17 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.53 1fkr n HIS 87 Cb 0.47 0.00 0.07 0.00 0.12 0.00 0.00 29.99 30.66 1fkr n HIS 87 CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 1fkr n PRO 88 N -0.44 1.66 0.00 -1.40 -0.04 -1.26 -4.69 135.00 128.83 1fkr n PRO 88 Ca 0.00 -0.68 0.00 0.00 -0.04 0.00 0.00 63.50 62.78 1fkr n PRO 88 Cb 0.00 -1.53 0.00 0.00 -0.04 0.00 0.00 33.50 31.93 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 0.14 0.86 1.83 0.55 0.00 -1.26 -5.03 105.19 102.28 1fkr n GLY 89 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 0.00 0.01 -2.81 -0.61 5.41 -1.26 -4.92 119.36 115.17 1fkr n ILE 90 Ca 0.00 0.00 -0.32 0.00 1.00 0.00 0.00 62.75 63.43 1fkr n ILE 90 Cb 0.00 -0.67 -0.02 0.00 -0.71 0.00 0.00 39.64 38.24 1fkr n ILE 90 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 1fkr n ILE 91 N -2.62 4.15 -0.67 1.39 2.08 -1.26 -5.05 119.36 117.37 1fkr n ILE 91 Ca 0.00 -5.70 -0.32 0.00 0.56 0.00 0.00 62.75 57.29 1fkr n ILE 91 Cb 0.08 -1.45 0.17 0.00 -0.75 0.00 0.00 39.64 37.70 1fkr n ILE 91 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 1fkr n PRO 92 N -0.19 -1.58 -1.06 0.38 -0.04 -1.26 -4.46 135.00 126.80 1fkr n PRO 92 Ca 0.37 -0.44 -0.35 0.00 -0.04 0.00 0.00 63.50 63.03 1fkr n PRO 92 Cb 0.35 -1.71 0.02 0.00 -0.04 0.00 0.00 33.50 32.13 1fkr n PRO 92 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 1fkr n PRO 93 N -2.08 0.00 -1.07 0.54 -0.02 -1.26 -3.38 135.00 127.73 1fkr n PRO 93 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 1fkr n PRO 93 Cb 0.62 -0.95 0.00 0.00 -0.02 0.00 0.00 33.50 33.15 1fkr n PRO 93 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09 1fkr n HIS 94 N -1.93 0.00 -3.55 6.00 1.44 -1.26 -4.83 115.22 111.09 1fkr n HIS 94 Ca 0.02 0.00 -0.32 0.00 -2.01 0.00 0.00 57.72 55.41 1fkr n HIS 94 Cb 0.49 0.00 -0.07 0.00 0.12 0.00 0.00 29.99 30.53 1fkr n HIS 94 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1fkr n ALA 95 N -0.20 3.99 -0.65 1.59 0.00 -1.22 -5.07 120.51 118.95 1fkr n ALA 95 Ca 0.00 -4.67 -0.23 0.00 0.00 0.00 0.00 53.44 48.54 1fkr n ALA 95 Cb 0.00 -1.37 -0.02 0.00 0.00 0.00 0.00 19.45 18.07 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 1.61 0.85 -4.13 0.00 -1.04 -1.26 -4.72 114.28 105.58 1fkr n THR 96 Ca 0.25 -0.21 -0.28 0.00 -2.04 0.00 0.00 64.05 61.77 1fkr n THR 96 Cb 0.37 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.81 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 1.28 3.55 -0.08 -4.42 1.43 -0.97 -2.85 118.68 116.62 1fkr s LEU 97 Ca 0.31 -0.22 -0.01 0.00 -1.03 0.00 0.00 54.13 53.18 1fkr s LEU 97 Cb -0.44 -2.21 0.03 0.00 0.03 0.00 0.00 46.19 43.59 1fkr s LEU 97 CO 0.26 0.11 -0.03 -0.69 0.23 0.00 0.00 176.35 176.23 1fkr s VAL 98 N -1.59 0.62 0.13 -1.59 1.01 -1.04 -1.73 120.40 116.21 1fkr s VAL 98 Ca 0.28 -0.05 0.08 0.00 0.00 0.00 0.00 61.98 62.30 1fkr s VAL 98 Cb -0.10 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 1fkr s VAL 98 CO 0.20 0.29 -0.12 -0.36 0.00 0.00 0.00 175.10 175.12 1fkr s PHE 99 N 1.76 2.65 -0.43 5.22 0.40 -0.81 -2.08 117.98 124.69 1fkr s PHE 99 Ca 0.03 -0.20 0.03 0.00 -0.60 0.00 0.00 56.93 56.19 1fkr s PHE 99 Cb -0.13 -1.36 0.12 0.00 0.51 0.00 0.00 43.02 42.16 1fkr s PHE 99 CO -0.05 0.44 0.17 -0.51 0.70 0.00 0.00 175.22 175.97 1fkr s ASP 100 N -2.38 4.32 0.10 1.36 1.01 -0.97 -0.81 116.67 119.30 1fkr s ASP 100 Ca 0.22 -2.55 0.04 0.00 0.71 0.00 0.00 52.55 50.97 1fkr s ASP 100 Cb -0.10 -1.46 -0.04 0.00 1.01 0.00 0.00 42.92 42.32 1fkr s ASP 100 CO 0.13 -0.30 0.03 -0.69 0.21 0.00 0.00 175.17 174.55 1fkr s VAL 101 N 0.37 4.17 -0.30 -1.27 1.01 -0.46 -2.39 120.40 121.53 1fkr s VAL 101 Ca 0.15 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.18 1fkr s VAL 101 Cb -0.23 -3.01 0.09 0.00 0.00 0.00 0.00 36.38 33.23 1fkr s VAL 101 CO -0.05 0.10 0.05 -0.70 0.00 0.00 0.00 175.10 174.49 1fkr s GLU 102 N -2.41 1.16 -0.00 2.72 2.12 -0.80 -0.96 118.70 120.53 1fkr s GLU 102 Ca 0.27 -1.30 -0.30 0.00 0.36 0.00 0.00 54.97 53.99 1fkr s GLU 102 Cb -0.12 -2.53 -0.05 0.00 0.26 0.00 0.00 34.13 31.70 1fkr s GLU 102 CO 0.20 -0.88 1.27 -1.17 -0.54 0.00 0.00 175.26 174.14 1fkr s LEU 103 N 1.34 4.32 -0.20 2.70 2.96 -0.91 -2.55 118.68 126.33 1fkr s LEU 103 Ca 0.06 1.98 -0.16 0.00 -0.22 0.00 0.00 54.13 55.79 1fkr s LEU 103 Cb -0.18 -3.56 -0.11 0.00 0.50 0.00 0.00 46.19 42.83 1fkr s LEU 103 CO -0.15 -0.61 -0.09 0.18 -1.32 0.00 0.00 176.35 174.36 1fkr n LEU 104 N 4.91 1.88 0.00 -0.68 4.77 0.13 -2.31 117.00 125.70 1fkr n LEU 104 Ca 0.11 0.45 -0.00 0.00 -0.03 0.00 0.00 56.01 56.54 1fkr n LEU 104 Cb 0.45 -0.88 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 1fkr n LEU 104 CO 0.56 0.06 0.20 0.29 -1.33 0.00 0.00 177.39 177.18 1fkr n LYS 105 N -4.45 0.09 -4.37 3.23 5.02 -1.06 -4.24 118.16 112.38 1fkr n LYS 105 Ca -0.28 -0.25 -0.28 0.00 -2.02 0.00 0.00 58.31 55.49 1fkr n LYS 105 Cb 0.59 0.36 -0.11 0.00 -0.02 0.00 0.00 35.03 35.85 1fkr n LYS 105 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1fkr s LEU 106 N 0.00 2.57 0.00 -0.35 1.43 -1.26 0.26 118.68 121.33 1fkr s LEU 106 Ca 0.06 -0.74 0.00 0.00 -1.03 0.00 0.00 54.13 52.42 1fkr s LEU 106 Cb -0.00 -1.34 0.00 0.00 0.03 0.00 0.00 46.19 44.88 1fkr s LEU 106 CO 0.01 0.13 0.18 1.21 0.23 0.00 0.00 176.35 178.11