#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 4.48 0.23 1.61 0.11 -1.26 -3.93 120.40 121.63 1fkr s VAL 2 Ca 0.00 -0.65 0.10 0.00 -2.93 0.00 0.00 61.98 58.51 1fkr s VAL 2 Cb 0.00 -3.09 -0.05 0.00 -1.53 0.00 0.00 36.38 31.71 1fkr s VAL 2 CO 0.00 0.24 -0.19 -1.58 -3.33 0.00 0.00 175.10 170.24 1fkr s GLN 3 N -2.03 1.50 -0.21 1.54 0.74 -1.00 -4.99 119.66 115.21 1fkr s GLN 3 Ca 0.25 -1.62 0.01 0.00 0.05 0.00 0.00 55.36 54.05 1fkr s GLN 3 Cb -0.12 -1.55 0.05 0.00 1.10 0.00 0.00 33.01 32.48 1fkr s GLN 3 CO 0.17 0.30 -0.09 0.08 -0.55 0.00 0.00 175.29 175.20 1fkr s VAL 4 N -2.38 1.64 -0.62 1.34 1.01 -1.26 -2.51 120.40 117.60 1fkr s VAL 4 Ca 0.24 -1.10 -0.02 0.00 0.00 0.00 0.00 61.98 61.10 1fkr s VAL 4 Cb -0.05 -1.77 0.16 0.00 0.00 0.00 0.00 36.38 34.73 1fkr s VAL 4 CO 0.11 0.09 0.43 -1.61 0.00 0.00 0.00 175.10 174.12 1fkr s GLU 5 N 1.38 2.54 0.69 2.72 2.02 -0.49 -4.99 118.70 122.56 1fkr s GLU 5 Ca -0.03 -2.55 -0.14 0.00 0.02 0.00 0.00 54.97 52.27 1fkr s GLU 5 Cb -0.17 -3.71 0.01 0.00 0.10 0.00 0.00 34.13 30.37 1fkr s GLU 5 CO -0.07 -1.17 1.11 0.99 0.02 0.00 0.00 175.26 176.13 1fkr s THR 6 N -0.11 3.27 0.01 3.63 2.01 -1.26 -1.00 115.64 122.19 1fkr s THR 6 Ca 0.17 0.54 0.00 0.00 0.31 0.00 0.00 61.69 62.71 1fkr s THR 6 Cb -0.20 -3.06 0.00 0.00 0.01 0.00 0.00 72.50 69.25 1fkr s THR 6 CO -0.03 -0.41 0.00 -0.38 -0.69 0.00 0.00 174.62 173.11 1fkr n ILE 7 N -2.70 0.13 -3.82 1.82 5.41 -0.89 -4.85 119.36 114.46 1fkr n ILE 7 Ca 0.10 0.04 -0.28 0.00 1.00 0.00 0.00 62.75 63.62 1fkr n ILE 7 Cb 0.52 -1.42 -0.12 0.00 -0.71 0.00 0.00 39.64 37.92 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 -5.11 4.33 1.00 4.38 0.01 -1.06 -5.02 113.70 112.23 1fkr s SER 8 Ca 0.00 -3.74 -0.17 0.00 1.31 0.00 0.00 55.95 53.34 1fkr s SER 8 Cb 0.00 -1.46 -0.15 0.00 0.21 0.00 0.00 66.02 64.62 1fkr s SER 8 CO 0.00 -0.10 -0.83 -2.65 0.41 0.00 0.00 173.24 170.07 1fkr n PRO 9 N 2.09 -0.00 -3.40 12.44 -0.02 -1.26 -2.32 135.00 142.53 1fkr n PRO 9 Ca 0.21 -0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.53 1fkr n PRO 9 Cb 0.37 -1.00 -0.04 0.00 -0.02 0.00 0.00 33.50 32.81 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 3.49 3.74 0.37 -1.23 0.00 -1.26 -4.57 105.19 105.73 1fkr n GLY 10 Ca -0.02 -2.16 0.01 0.00 0.00 0.00 0.00 46.02 43.85 1fkr n GLY 10 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1fkr n ASP 11 N -1.47 -0.55 0.00 1.61 5.68 -1.26 -4.78 116.55 115.78 1fkr n ASP 11 Ca -0.07 1.72 0.00 0.00 -0.50 0.00 0.00 54.79 55.93 1fkr n ASP 11 Cb 0.35 -0.43 0.00 0.00 -1.14 0.00 0.00 41.12 39.89 1fkr n ASP 11 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1fkr n GLY 12 N -1.52 0.74 0.00 6.12 0.00 -1.26 -4.89 105.19 104.39 1fkr n GLY 12 Ca 0.12 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.46 1.90 -4.09 1.61 1.74 -1.26 -5.03 116.66 109.06 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 -0.88 -0.12 0.00 -1.02 0.00 0.00 32.46 30.44 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 -1.77 4.07 0.43 0.55 2.01 -1.26 -5.07 115.64 114.60 1fkr s THR 14 Ca 0.00 -0.28 0.03 0.00 0.31 0.00 0.00 61.69 61.76 1fkr s THR 14 Cb 0.00 -2.84 -0.04 0.00 0.01 0.00 0.00 72.50 69.64 1fkr s THR 14 CO 0.00 0.43 0.06 -0.36 -0.69 0.00 0.00 174.62 174.06 1fkr s PHE 15 N 0.90 1.95 0.69 4.92 0.40 -1.26 -0.58 117.98 125.00 1fkr s PHE 15 Ca 0.01 -1.03 -0.15 0.00 -0.60 0.00 0.00 56.93 55.17 1fkr s PHE 15 Cb -0.14 -1.42 0.02 0.00 0.51 0.00 0.00 43.02 41.99 1fkr s PHE 15 CO 0.02 0.04 1.15 -2.14 0.70 0.00 0.00 175.22 174.98 1fkr s PRO 16 N -3.80 2.50 0.40 0.24 0.02 -1.26 -4.85 135.00 128.24 1fkr s PRO 16 Ca 0.22 1.54 0.07 0.00 0.02 0.00 0.00 61.00 62.85 1fkr s PRO 16 Cb 0.04 -1.90 -0.07 0.00 0.02 0.00 0.00 34.50 32.59 1fkr s PRO 16 CO 0.11 -1.51 0.01 0.15 -0.33 0.00 0.00 177.00 175.43 1fkr s LYS 17 N -4.04 1.97 -0.51 5.54 1.02 -1.26 -5.07 119.74 117.39 1fkr s LYS 17 Ca 0.70 -2.04 -0.28 0.00 0.02 0.00 0.00 55.97 54.36 1fkr s LYS 17 Cb -0.24 -1.70 0.02 0.00 -0.52 0.00 0.00 37.83 35.39 1fkr s LYS 17 CO 0.43 -0.02 1.33 1.03 -0.92 0.00 0.00 175.35 177.20 1fkr s ARG 18 N -3.72 3.48 0.00 1.68 0.52 -1.26 -2.55 118.95 117.11 1fkr s ARG 18 Ca 0.35 0.57 0.00 0.00 -0.52 0.00 0.00 55.73 56.14 1fkr s ARG 18 Cb 0.08 -4.04 0.00 0.00 0.52 0.00 0.00 34.95 31.51 1fkr s ARG 18 CO 0.18 -1.70 0.00 0.41 0.02 0.00 0.00 175.30 174.21 1fkr n GLY 19 N 5.11 1.49 3.82 -3.53 0.00 -1.26 -5.11 105.19 105.71 1fkr n GLY 19 Ca 0.13 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 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 0.00 2.56 -0.18 1.61 -0.21 -1.06 -5.05 119.66 117.33 1fkr s GLN 20 Ca 0.00 -1.45 -0.03 0.00 0.02 0.00 0.00 55.36 53.90 1fkr s GLN 20 Cb 0.00 -2.35 -0.02 0.00 1.00 0.00 0.00 33.01 31.64 1fkr s GLN 20 CO 0.00 0.02 -0.05 0.99 -2.12 0.00 0.00 175.29 174.13 1fkr s THR 21 N -2.39 3.59 0.33 -0.19 2.01 -1.19 -3.92 115.64 113.88 1fkr s THR 21 Ca 0.42 -0.44 -0.27 0.00 0.31 0.00 0.00 61.69 61.70 1fkr s THR 21 Cb -0.04 -2.59 -0.09 0.00 0.01 0.00 0.00 72.50 69.79 1fkr s THR 21 CO 0.26 0.46 1.08 0.00 -0.69 0.00 0.00 174.62 175.73 1fkr s VAL 23 N -1.36 2.86 0.10 0.00 1.01 0.75 -1.98 120.40 121.79 1fkr s VAL 23 Ca 0.50 -2.53 0.10 0.00 0.00 0.00 0.00 61.98 60.04 1fkr s VAL 23 Cb -0.28 -2.99 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 1fkr s VAL 23 CO 0.36 -0.71 -0.23 0.68 0.00 0.00 0.00 175.10 175.20 1fkr s VAL 24 N 0.61 2.51 -0.14 2.92 -7.23 -0.74 -0.82 120.40 117.51 1fkr s VAL 24 Ca 0.12 -1.54 -0.00 0.00 -1.81 0.00 0.00 61.98 58.75 1fkr s VAL 24 Cb -0.22 -2.10 0.03 0.00 0.56 0.00 0.00 36.38 34.66 1fkr s VAL 24 CO -0.05 0.17 -0.07 -2.28 -0.31 0.00 0.00 175.10 172.56 1fkr s HIS 25 N -1.03 1.66 0.34 2.82 2.46 -1.06 -2.16 115.29 118.31 1fkr s HIS 25 Ca 0.15 -0.94 0.04 0.00 0.47 0.00 0.00 55.06 54.78 1fkr s HIS 25 Cb -0.10 -1.31 -0.03 0.00 -0.13 0.00 0.00 32.58 31.00 1fkr s HIS 25 CO 0.07 -0.58 0.17 1.52 -2.47 0.00 0.00 174.74 173.45 1fkr s TYR 26 N 1.65 1.68 -0.15 3.88 1.13 -1.26 -1.93 117.35 122.34 1fkr s TYR 26 Ca 0.03 -1.39 -0.00 0.00 -1.41 0.00 0.00 57.07 54.30 1fkr s TYR 26 Cb -0.14 -0.92 0.04 0.00 -1.10 0.00 0.00 41.96 39.84 1fkr s TYR 26 CO -0.08 -0.51 -0.06 0.99 -2.51 0.00 0.00 175.55 173.37 1fkr s THR 27 N -3.47 1.13 -0.14 -3.49 2.01 -1.01 -2.84 115.64 107.83 1fkr s THR 27 Ca 0.33 -0.56 -0.14 0.00 0.31 0.00 0.00 61.69 61.63 1fkr s THR 27 Cb 0.04 -1.25 -0.05 0.00 0.01 0.00 0.00 72.50 71.25 1fkr s THR 27 CO 0.18 0.20 0.32 -0.83 -0.69 0.00 0.00 174.62 173.81 1fkr s GLY 28 N 1.64 2.25 0.26 4.40 0.00 -1.26 -2.07 107.32 112.53 1fkr s GLY 28 Ca 0.02 -0.41 0.01 0.00 0.00 0.00 0.00 44.72 44.34 1fkr s GLY 28 CO -0.08 0.43 0.10 -0.29 0.00 0.00 0.00 173.10 173.26 1fkr s MET 29 N 0.34 1.42 0.30 2.90 1.75 -0.84 -3.31 119.30 121.87 1fkr s MET 29 Ca 0.18 -1.77 0.02 0.00 -1.25 0.00 0.00 55.69 52.88 1fkr s MET 29 Cb -0.13 -0.26 0.02 0.00 2.84 0.00 0.00 34.83 37.30 1fkr s MET 29 CO 0.05 -0.30 0.18 1.28 -0.65 0.00 0.00 175.02 175.59 1fkr n LEU 30 N -0.47 0.00 -0.24 4.11 4.77 -1.07 -2.52 117.00 121.59 1fkr n LEU 30 Ca 0.00 -1.63 -0.06 0.00 -0.03 0.00 0.00 56.01 54.28 1fkr n LEU 30 Cb 0.66 0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.71 1fkr n LEU 30 CO 0.37 -0.40 0.38 -0.62 -1.33 0.00 0.00 177.39 175.79 1fkr n GLU 31 N -1.12 -0.25 -2.64 3.23 1.02 -1.25 -4.13 120.64 115.49 1fkr n GLU 31 Ca -0.03 1.07 -0.04 0.00 -0.02 0.00 0.00 57.16 58.14 1fkr n GLU 31 Cb 0.35 -1.58 0.12 0.00 -0.02 0.00 0.00 31.44 30.31 1fkr n GLU 31 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1fkr n ASP 32 N -4.39 -1.57 0.00 1.62 5.75 -1.26 -5.05 116.55 111.65 1fkr n ASP 32 Ca 0.01 -2.25 0.00 0.00 -0.01 0.00 0.00 54.79 52.54 1fkr n ASP 32 Cb 0.15 0.80 0.00 0.00 -1.03 0.00 0.00 41.12 41.04 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 -1.12 0.12 0.00 6.12 0.00 -1.26 -5.17 105.19 103.88 1fkr n GLY 33 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.71 0.00 -3.33 1.61 0.00 -1.26 -4.99 118.16 108.48 1fkr n LYS 34 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 58.31 57.94 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 0.85 4.06 0.00 -1.58 1.02 -1.26 -2.58 119.74 120.25 1fkr s LYS 35 Ca 0.00 0.58 0.00 0.00 0.02 0.00 0.00 55.97 56.57 1fkr s LYS 35 Cb 0.00 -3.05 0.00 0.00 -0.52 0.00 0.00 37.83 34.26 1fkr s LYS 35 CO 0.00 0.54 0.00 1.97 -0.92 0.00 0.00 175.35 176.94 1fkr n PHE 36 N 1.17 0.00 -2.16 3.18 -1.74 -1.21 -4.93 117.46 111.77 1fkr n PHE 36 Ca -0.07 0.00 0.03 0.00 -0.56 0.00 0.00 57.45 56.85 1fkr n PHE 36 Cb 0.51 0.00 0.04 0.00 1.52 0.00 0.00 39.48 41.56 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 -1.05 0.87 -4.08 5.98 8.00 -1.26 -5.07 116.55 119.95 1fkr n ASP 37 Ca 0.00 -2.29 -0.37 0.00 0.71 0.00 0.00 54.79 52.85 1fkr n ASP 37 Cb 0.12 -0.30 0.07 0.00 -0.02 0.00 0.00 41.12 40.98 1fkr n ASP 37 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1fkr n SER 38 N 0.04 -3.21 -2.74 -2.24 7.64 -1.26 -4.38 113.62 107.47 1fkr n SER 38 Ca 0.06 0.01 -0.36 0.00 1.01 0.00 0.00 58.87 59.59 1fkr n SER 38 Cb 0.93 -0.67 0.03 0.00 -1.01 0.00 0.00 64.21 63.50 1fkr n SER 38 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1fkr n SER 39 N 2.10 6.83 -2.73 6.43 3.41 -1.13 -4.70 113.62 123.83 1fkr n SER 39 Ca -0.01 -3.81 -0.22 0.00 -0.26 0.00 0.00 58.87 54.57 1fkr n SER 39 Cb 0.69 -0.90 -0.01 0.00 -0.26 0.00 0.00 64.21 63.73 1fkr n SER 39 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1fkr n ARG 40 N -0.56 2.60 -0.01 4.33 1.85 -1.26 -4.32 116.66 119.29 1fkr n ARG 40 Ca 0.51 -4.20 -0.01 0.00 -1.00 0.00 0.00 57.85 53.15 1fkr n ARG 40 Cb 0.39 -1.97 -0.00 0.00 -1.05 0.00 0.00 32.46 29.82 1fkr n ARG 40 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1fkr n ASP 41 N -0.24 0.26 0.00 2.89 8.00 -1.26 -5.01 116.55 121.20 1fkr n ASP 41 Ca 0.29 0.29 0.00 0.00 0.71 0.00 0.00 54.79 56.08 1fkr n ASP 41 Cb 0.62 -0.55 0.00 0.00 -0.02 0.00 0.00 41.12 41.17 1fkr n ASP 41 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 1fkr n ARG 42 N -2.60 0.00 -0.06 -1.24 1.85 -1.26 -5.04 116.66 108.30 1fkr n ARG 42 Ca -0.01 0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.73 1fkr n ARG 42 Cb 0.04 0.00 -0.05 0.00 -1.05 0.00 0.00 32.46 31.40 1fkr n ARG 42 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 1fkr n ASN 43 N 0.00 2.12 -4.81 2.89 2.85 -1.26 -5.06 115.26 111.99 1fkr n ASN 43 Ca 0.00 0.03 -0.22 0.00 -0.11 0.00 0.00 54.58 54.28 1fkr n ASN 43 Cb 0.00 -0.28 -0.05 0.00 1.24 0.00 0.00 39.78 40.69 1fkr n ASN 43 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 1fkr s LYS 44 N -2.25 2.84 0.00 1.20 -0.14 -1.26 -5.12 119.74 115.01 1fkr s LYS 44 Ca -0.18 -1.12 0.00 0.00 -1.36 0.00 0.00 55.97 53.32 1fkr s LYS 44 Cb 0.06 -2.51 0.00 0.00 -1.68 0.00 0.00 37.83 33.69 1fkr s LYS 44 CO 0.26 0.36 0.00 -0.35 -0.76 0.00 0.00 175.35 174.87 1fkr n PRO 45 N -1.17 1.90 -3.53 -1.68 -0.04 -1.26 -4.72 135.00 124.49 1fkr n PRO 45 Ca -0.07 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.02 1fkr n PRO 45 Cb 0.58 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.98 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 3.60 -0.08 0.54 5.36 -0.92 -4.97 117.98 121.51 1fkr s PHE 46 Ca 0.00 0.80 -0.01 0.00 -0.96 0.00 0.00 56.93 56.76 1fkr s PHE 46 Cb 0.00 -2.30 0.03 0.00 -0.34 0.00 0.00 43.02 40.41 1fkr s PHE 46 CO 0.00 0.46 -0.04 0.15 -1.46 0.00 0.00 175.22 174.34 1fkr s LYS 47 N -0.34 0.98 0.26 10.12 1.02 -1.26 -1.78 119.74 128.73 1fkr s LYS 47 Ca 0.21 -0.06 0.02 0.00 0.02 0.00 0.00 55.97 56.15 1fkr s LYS 47 Cb -0.15 -1.16 -0.04 0.00 -0.52 0.00 0.00 37.83 35.96 1fkr s LYS 47 CO 0.09 -0.24 0.15 -0.59 -0.92 0.00 0.00 175.35 173.84 1fkr s PHE 48 N 1.67 1.43 0.11 3.18 -0.71 -0.84 -4.95 117.98 117.87 1fkr s PHE 48 Ca 0.02 -1.38 0.07 0.00 -1.04 0.00 0.00 56.93 54.60 1fkr s PHE 48 Cb -0.13 -0.72 -0.04 0.00 -1.21 0.00 0.00 43.02 40.92 1fkr s PHE 48 CO -0.05 -0.58 -0.10 1.41 -1.34 0.00 0.00 175.22 174.56 1fkr s MET 49 N -3.95 2.13 -0.24 1.99 1.75 -1.26 0.08 119.30 119.79 1fkr s MET 49 Ca 0.38 -1.03 -0.19 0.00 -1.25 0.00 0.00 55.69 53.60 1fkr s MET 49 Cb 0.06 -2.30 -0.02 0.00 2.84 0.00 0.00 34.83 35.40 1fkr s MET 49 CO 0.16 0.51 0.58 -1.17 -0.65 0.00 0.00 175.02 174.45 1fkr s LEU 50 N -2.23 4.08 0.00 4.11 2.96 -1.25 -3.89 118.68 122.45 1fkr s LEU 50 Ca 0.22 0.67 0.00 0.00 -0.22 0.00 0.00 54.13 54.80 1fkr s LEU 50 Cb -0.11 -2.79 0.00 0.00 0.50 0.00 0.00 46.19 43.79 1fkr s LEU 50 CO 0.14 -0.31 0.00 0.61 -1.32 0.00 0.00 176.35 175.47 1fkr n GLY 51 N 4.14 0.56 2.20 7.98 0.00 -1.26 -4.29 105.19 114.52 1fkr n GLY 51 Ca -0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.44 3.39 -0.12 1.61 4.81 -1.25 -4.98 118.16 120.17 1fkr n LYS 52 Ca 0.00 -4.07 0.00 0.00 -0.87 0.00 0.00 58.31 53.37 1fkr n LYS 52 Cb 0.00 -2.28 0.00 0.00 0.02 0.00 0.00 35.03 32.77 1fkr n LYS 52 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1fkr n GLN 53 N -0.69 -0.03 -0.04 1.64 6.02 -1.26 -4.61 117.38 118.41 1fkr n GLN 53 Ca 0.47 -0.01 0.03 0.00 -0.01 0.00 0.00 57.00 57.47 1fkr n GLN 53 Cb 0.82 0.02 -0.15 0.00 1.02 0.00 0.00 30.24 31.95 1fkr n GLN 53 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1fkr n GLU 54 N -0.03 0.73 -4.28 -1.09 0.00 -1.26 -4.96 120.64 109.75 1fkr n GLU 54 Ca 0.00 -0.12 -0.24 0.00 0.00 0.00 0.00 57.16 56.81 1fkr n GLU 54 Cb 0.00 -1.48 -0.07 0.00 0.00 0.00 0.00 31.44 29.88 1fkr n GLU 54 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.13 177.27 1fkr s VAL 55 N -3.04 3.48 1.30 6.31 -7.23 -1.26 -5.12 120.40 114.85 1fkr s VAL 55 Ca -0.08 -1.81 -0.18 0.00 -1.81 0.00 0.00 61.98 58.10 1fkr s VAL 55 Cb 0.10 -2.83 0.32 0.00 0.56 0.00 0.00 36.38 34.53 1fkr s VAL 55 CO 0.82 -0.31 0.87 2.30 -0.31 0.00 0.00 175.10 178.47 1fkr n ILE 56 N -0.71 0.00 0.33 -0.62 -5.35 -1.26 -4.73 119.36 107.02 1fkr n ILE 56 Ca -0.07 -0.29 -0.13 0.00 -0.27 0.00 0.00 62.75 61.98 1fkr n ILE 56 Cb 0.58 -0.96 -0.06 0.00 -1.74 0.00 0.00 39.64 37.46 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 -3.07 -0.84 -0.25 6.28 9.65 -1.93 -2.83 114.38 121.39 1fkr h ARG 57 Ca -0.53 0.06 0.10 0.00 -1.10 0.00 0.00 59.98 58.51 1fkr h ARG 57 Cb 1.32 0.19 -0.04 0.00 -1.39 0.00 0.00 29.97 30.05 1fkr h ARG 57 CO 0.39 -0.56 0.15 0.41 2.80 0.00 0.00 179.97 183.15 1fkr n GLY 58 N -0.46 -0.18 0.00 2.80 0.00 -1.23 -0.28 105.19 105.84 1fkr n GLY 58 Ca -0.11 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 -3.40 0.00 -0.08 1.61 7.02 -1.20 -1.66 117.44 119.73 1fkr n TRP 59 Ca 0.09 0.00 -0.00 0.00 -1.02 0.00 0.00 57.50 56.57 1fkr n TRP 59 Cb 0.32 -0.23 0.01 0.00 -2.42 0.00 0.00 31.31 28.99 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 -1.36 -0.05 -0.03 -0.99 2.13 0.61 0.27 120.64 121.22 1fkr n GLU 60 Ca 0.00 0.33 -0.09 0.00 0.66 0.00 0.00 57.16 58.06 1fkr n GLU 60 Cb 0.00 -0.49 -0.08 0.00 0.27 0.00 0.00 31.44 31.14 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 -0.06 0.00 5.31 4.57 -1.53 -2.66 114.58 120.21 1fkr h GLU 61 Ca 0.07 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.26 1fkr h GLU 61 Cb 0.13 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.73 1fkr h GLU 61 CO -0.21 0.48 0.00 0.41 -1.18 0.00 0.00 179.01 178.51 1fkr n GLY 62 N 1.36 -3.07 0.31 1.92 0.00 0.76 -1.49 105.19 104.98 1fkr n GLY 62 Ca -0.06 0.34 0.07 0.00 0.00 0.00 0.00 46.02 46.37 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 0.19 -0.49 1.61 2.07 0.35 -0.17 116.25 119.80 1fkr h VAL 63 Ca 0.00 -0.02 0.06 0.00 0.82 0.00 0.00 66.70 67.57 1fkr h VAL 63 Cb 0.00 0.13 -0.09 0.00 -1.52 0.00 0.00 31.29 29.81 1fkr h VAL 63 CO 0.00 0.01 -0.52 0.00 0.02 0.00 0.00 177.57 177.08 1fkr h ALA 64 N 1.84 -0.61 0.00 1.67 0.00 -1.14 0.50 119.26 121.51 1fkr h ALA 64 Ca 0.47 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.42 1fkr h ALA 64 Cb 0.84 1.08 0.00 0.00 0.00 0.00 0.00 17.79 19.71 1fkr h ALA 64 CO -0.81 -0.97 0.22 0.94 0.00 0.00 0.00 179.25 178.63 1fkr n GLN 65 N -5.38 0.00 -4.02 0.00 7.27 -0.09 -4.50 117.38 110.66 1fkr n GLN 65 Ca -0.01 0.24 -0.30 0.00 0.07 0.00 0.00 57.00 56.99 1fkr n GLN 65 Cb 0.34 -1.72 -0.06 0.00 2.41 0.00 0.00 30.24 31.22 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 -2.42 3.04 0.08 3.69 -1.94 0.17 -5.09 119.30 116.84 1fkr s MET 66 Ca 0.00 -0.66 0.08 0.00 -1.71 0.00 0.00 55.69 53.40 1fkr s MET 66 Cb 0.00 -2.80 -0.04 0.00 2.01 0.00 0.00 34.83 34.00 1fkr s MET 66 CO 0.00 0.56 -0.17 -1.54 -0.01 0.00 0.00 175.02 173.87 1fkr s SER 67 N -2.57 3.95 -0.48 3.03 1.04 -1.26 -4.58 113.70 112.83 1fkr s SER 67 Ca 0.31 -0.47 -0.42 0.00 0.48 0.00 0.00 55.95 55.85 1fkr s SER 67 Cb -0.12 -0.63 -0.18 0.00 0.10 0.00 0.00 66.02 65.19 1fkr s SER 67 CO 0.24 0.21 2.03 0.52 0.98 0.00 0.00 173.24 177.22 1fkr n VAL 68 N 1.07 0.00 0.00 5.02 0.31 0.25 -0.38 118.33 124.60 1fkr n VAL 68 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1fkr n VAL 68 Cb 0.52 -0.47 0.00 0.00 -0.91 0.00 0.00 33.84 32.98 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 7.09 0.62 3.94 2.92 0.00 -1.05 -4.25 105.19 114.47 1fkr n GLY 69 Ca 0.52 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.27 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 -0.68 3.44 0.02 1.61 0.74 0.49 -4.48 119.66 120.80 1fkr s GLN 70 Ca 0.00 -0.55 0.04 0.00 0.05 0.00 0.00 55.36 54.89 1fkr s GLN 70 Cb 0.00 -2.98 -0.02 0.00 1.10 0.00 0.00 33.01 31.11 1fkr s GLN 70 CO 0.00 0.54 -0.12 0.50 -0.55 0.00 0.00 175.29 175.67 1fkr s ARG 71 N -3.04 0.83 0.33 1.67 3.52 -0.98 -2.14 118.95 119.15 1fkr s ARG 71 Ca 0.35 -0.59 -0.08 0.00 -0.13 0.00 0.00 55.73 55.28 1fkr s ARG 71 Cb -0.12 -0.80 0.01 0.00 -1.56 0.00 0.00 34.95 32.49 1fkr s ARG 71 CO 0.28 0.20 0.56 0.00 -0.81 0.00 0.00 175.30 175.54 1fkr s ALA 72 N -0.65 0.16 -0.29 6.12 0.00 0.48 -2.11 121.76 125.48 1fkr s ALA 72 Ca 0.01 -1.18 0.02 0.00 0.00 0.00 0.00 51.96 50.81 1fkr s ALA 72 Cb -0.06 1.01 0.08 0.00 0.00 0.00 0.00 23.12 24.15 1fkr s ALA 72 CO 0.00 -0.86 0.01 0.21 0.00 0.00 0.00 175.76 175.13 1fkr s LYS 73 N -3.06 1.42 0.12 0.00 2.20 -0.17 -0.71 119.74 119.53 1fkr s LYS 73 Ca 0.25 -1.32 -0.03 0.00 -0.36 0.00 0.00 55.97 54.50 1fkr s LYS 73 Cb -0.02 -2.68 -0.05 0.00 -1.51 0.00 0.00 37.83 33.57 1fkr s LYS 73 CO 0.16 -0.79 0.33 -0.51 -0.36 0.00 0.00 175.35 174.17 1fkr s LEU 74 N 1.26 4.29 -0.31 5.43 1.43 -0.42 -1.40 118.68 128.97 1fkr s LEU 74 Ca 0.03 0.49 0.03 0.00 -1.03 0.00 0.00 54.13 53.65 1fkr s LEU 74 Cb -0.19 -3.21 0.09 0.00 0.03 0.00 0.00 46.19 42.91 1fkr s LEU 74 CO -0.11 0.08 0.00 -0.89 0.23 0.00 0.00 176.35 175.67 1fkr s THR 75 N -1.62 2.12 -0.18 5.49 2.01 -1.05 -2.04 115.64 120.38 1fkr s THR 75 Ca 0.39 -2.02 -0.10 0.00 0.31 0.00 0.00 61.69 60.27 1fkr s THR 75 Cb -0.12 -2.46 -0.05 0.00 0.01 0.00 0.00 72.50 69.88 1fkr s THR 75 CO 0.26 -0.42 0.16 -0.63 -0.69 0.00 0.00 174.62 173.30 1fkr s ILE 76 N 1.03 5.41 0.21 1.82 1.01 -0.00 -2.37 121.20 128.31 1fkr s ILE 76 Ca 0.04 0.25 0.09 0.00 0.00 0.00 0.00 60.65 61.03 1fkr s ILE 76 Cb -0.19 -3.48 -0.04 0.00 0.01 0.00 0.00 42.46 38.75 1fkr s ILE 76 CO -0.08 0.47 -0.04 -0.94 0.00 0.00 0.00 174.94 174.35 1fkr s SER 77 N 0.08 4.48 0.20 3.58 1.04 -1.25 -0.34 113.70 121.49 1fkr s SER 77 Ca 0.11 -0.56 -0.06 0.00 0.48 0.00 0.00 55.95 55.92 1fkr s SER 77 Cb -0.12 -0.84 0.31 0.00 0.10 0.00 0.00 66.02 65.48 1fkr s SER 77 CO 0.00 0.06 1.12 -0.81 0.98 0.00 0.00 173.24 174.59 1fkr n PRO 78 N -0.32 -0.07 -0.31 4.02 -0.04 -1.25 0.21 135.00 137.23 1fkr n PRO 78 Ca -0.09 1.12 0.28 0.00 -0.04 0.00 0.00 63.50 64.76 1fkr n PRO 78 Cb 0.57 -1.66 0.51 0.00 -0.04 0.00 0.00 33.50 32.87 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 -5.16 0.26 -0.10 3.54 5.68 -1.26 -2.34 116.55 117.17 1fkr n ASP 79 Ca 0.11 1.58 -0.16 0.00 -0.50 0.00 0.00 54.79 55.81 1fkr n ASP 79 Cb 0.35 -0.74 -0.08 0.00 -1.14 0.00 0.00 41.12 39.52 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 -5.18 0.00 -1.55 2.11 4.02 0.13 -4.71 117.16 111.98 1fkr n TYR 80 Ca 0.34 0.00 -0.31 0.00 -0.01 0.00 0.00 57.90 57.92 1fkr n TYR 80 Cb 1.14 -0.71 0.07 0.00 -0.02 0.00 0.00 39.34 39.81 1fkr n TYR 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1fkr s ALA 81 N -2.37 2.50 0.00 -0.72 0.00 0.03 -3.28 121.76 117.92 1fkr s ALA 81 Ca -0.26 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 51.68 1fkr s ALA 81 Cb 0.08 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 20.05 1fkr s ALA 81 CO 0.39 -1.44 0.00 0.66 0.00 0.00 0.00 175.76 175.38 1fkr n TYR 82 N -3.26 0.00 0.00 0.00 4.01 -1.26 -4.50 117.16 112.14 1fkr n TYR 82 Ca 0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.81 1fkr n TYR 82 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.58 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 0.00 0.00 1.46 2.72 0.00 -1.24 -3.44 105.19 104.69 1fkr n GLY 83 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 3.00 -2.52 4.61 0.00 -1.26 -4.39 120.51 119.95 1fkr n ALA 84 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 1fkr n ALA 84 Cb 0.00 0.10 -0.11 0.00 0.00 0.00 0.00 19.45 19.44 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 -1.70 3.00 0.00 0.00 2.01 -1.22 -3.64 115.64 114.09 1fkr s THR 85 Ca 0.00 -1.52 0.00 0.00 0.31 0.00 0.00 61.69 60.48 1fkr s THR 85 Cb 0.00 -2.41 0.00 0.00 0.01 0.00 0.00 72.50 70.10 1fkr s THR 85 CO 0.00 0.04 0.00 0.61 -0.69 0.00 0.00 174.62 174.58 1fkr n GLY 86 N 0.58 1.90 2.66 4.40 0.00 -1.26 -4.95 105.19 108.52 1fkr n GLY 86 Ca -0.14 -0.21 -0.27 0.00 0.00 0.00 0.00 46.02 45.39 1fkr n GLY 86 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1fkr n HIS 87 N 0.00 1.72 -0.72 1.61 -0.00 -1.26 -5.03 115.22 111.54 1fkr n HIS 87 Ca 0.00 -3.93 -0.32 0.00 -0.00 0.00 0.00 57.72 53.47 1fkr n HIS 87 Cb 0.00 -0.31 -0.06 0.00 -0.00 0.00 0.00 29.99 29.62 1fkr n HIS 87 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.34 174.04 1fkr n PRO 88 N 2.14 0.00 0.00 1.57 -0.02 -1.26 -1.37 135.00 136.05 1fkr n PRO 88 Ca 0.24 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 1fkr n PRO 88 Cb 0.41 -0.78 0.00 0.00 -0.02 0.00 0.00 33.50 33.10 1fkr n PRO 88 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fkr n GLY 89 N 3.49 1.23 0.62 -1.23 0.00 -1.26 -4.86 105.19 103.17 1fkr n GLY 89 Ca 0.26 -0.13 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 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 0.67 -3.82 -0.61 5.41 -0.47 -4.88 119.36 115.66 1fkr n ILE 90 Ca 0.00 -0.17 -0.32 0.00 1.00 0.00 0.00 62.75 63.26 1fkr n ILE 90 Cb 0.00 -1.66 -0.11 0.00 -0.71 0.00 0.00 39.64 37.17 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 -2.22 3.31 0.90 1.39 -1.09 -1.19 -5.03 121.20 117.28 1fkr s ILE 91 Ca -0.17 -3.70 -0.15 0.00 -2.23 0.00 0.00 60.65 54.40 1fkr s ILE 91 Cb 0.07 -3.16 -0.04 0.00 -1.58 0.00 0.00 42.46 37.74 1fkr s ILE 91 CO 0.21 -0.95 0.06 -2.65 -1.23 0.00 0.00 174.94 170.38 1fkr n PRO 92 N 2.62 -0.08 -1.68 2.79 -0.02 -1.26 -4.17 135.00 133.20 1fkr n PRO 92 Ca 0.14 0.01 -0.17 0.00 -2.02 0.00 0.00 63.50 61.46 1fkr n PRO 92 Cb 0.35 -1.57 -0.10 0.00 -0.02 0.00 0.00 33.50 32.17 1fkr n PRO 92 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1fkr s PRO 93 N -2.88 1.46 0.00 0.52 0.04 -1.26 -3.55 135.00 129.34 1fkr s PRO 93 Ca 0.54 -0.38 0.00 0.00 0.04 0.00 0.00 61.00 61.20 1fkr s PRO 93 Cb -0.24 -4.99 0.00 0.00 0.04 0.00 0.00 34.50 29.31 1fkr s PRO 93 CO 0.70 -5.08 0.00 0.72 0.04 0.00 0.00 177.00 173.38 1fkr n HIS 94 N 18.66 0.00 -4.80 0.56 8.25 -1.24 -5.05 115.22 131.61 1fkr n HIS 94 Ca 0.43 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.59 1fkr n HIS 94 Cb 0.46 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.43 1fkr n HIS 94 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1fkr s ALA 95 N -1.03 2.27 -0.17 -1.41 0.00 -1.23 -4.93 121.76 115.25 1fkr s ALA 95 Ca 0.00 -1.31 -0.19 0.00 0.00 0.00 0.00 51.96 50.46 1fkr s ALA 95 Cb 0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 1fkr s ALA 95 CO 0.00 0.53 0.53 0.99 0.00 0.00 0.00 175.76 177.81 1fkr s THR 96 N -0.86 5.12 0.11 0.00 2.01 -1.26 -3.94 115.64 116.82 1fkr s THR 96 Ca 0.12 1.00 0.02 0.00 0.31 0.00 0.00 61.69 63.14 1fkr s THR 96 Cb -0.10 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.52 1fkr s THR 96 CO 0.03 0.22 0.21 -0.76 -0.69 0.00 0.00 174.62 173.63 1fkr s LEU 97 N 1.32 4.20 -0.12 4.42 1.43 0.54 -3.90 118.68 126.57 1fkr s LEU 97 Ca 0.26 0.14 -0.01 0.00 -1.03 0.00 0.00 54.13 53.48 1fkr s LEU 97 Cb -0.15 -2.80 0.03 0.00 0.03 0.00 0.00 46.19 43.30 1fkr s LEU 97 CO 0.10 0.11 -0.03 -0.69 0.23 0.00 0.00 176.35 176.07 1fkr s VAL 98 N -1.62 0.74 0.26 -1.59 1.01 -1.05 -0.82 120.40 117.33 1fkr s VAL 98 Ca 0.33 -0.24 0.08 0.00 0.00 0.00 0.00 61.98 62.16 1fkr s VAL 98 Cb -0.12 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 1fkr s VAL 98 CO 0.27 0.21 0.10 -0.36 0.00 0.00 0.00 175.10 175.32 1fkr s PHE 99 N 1.81 2.91 -0.47 5.22 0.40 -0.86 -1.98 117.98 125.01 1fkr s PHE 99 Ca 0.03 -0.17 0.03 0.00 -0.60 0.00 0.00 56.93 56.22 1fkr s PHE 99 Cb -0.14 -1.30 0.14 0.00 0.51 0.00 0.00 43.02 42.23 1fkr s PHE 99 CO -0.07 0.57 0.27 -0.51 0.70 0.00 0.00 175.22 176.18 1fkr s ASP 100 N -3.76 3.66 0.11 1.36 1.01 -0.88 -1.30 116.67 116.87 1fkr s ASP 100 Ca 0.32 -2.81 0.02 0.00 0.71 0.00 0.00 52.55 50.79 1fkr s ASP 100 Cb -0.07 -1.10 -0.04 0.00 1.01 0.00 0.00 42.92 42.72 1fkr s ASP 100 CO 0.22 -0.24 0.20 -0.69 0.21 0.00 0.00 175.17 174.87 1fkr s VAL 101 N 0.10 5.06 -0.27 -1.27 1.01 0.11 -2.40 120.40 122.74 1fkr s VAL 101 Ca 0.19 -0.68 -0.00 0.00 0.00 0.00 0.00 61.98 61.49 1fkr s VAL 101 Cb -0.21 -3.53 0.08 0.00 0.00 0.00 0.00 36.38 32.73 1fkr s VAL 101 CO -0.03 0.02 0.04 -0.70 0.00 0.00 0.00 175.10 174.42 1fkr s GLU 102 N -2.83 1.05 -0.29 2.72 2.12 -0.82 -0.39 118.70 120.27 1fkr s GLU 102 Ca 0.33 -1.01 -0.29 0.00 0.36 0.00 0.00 54.97 54.36 1fkr s GLU 102 Cb -0.12 -2.33 0.00 0.00 0.26 0.00 0.00 34.13 31.95 1fkr s GLU 102 CO 0.26 -0.80 1.23 -1.17 -0.54 0.00 0.00 175.26 174.24 1fkr s LEU 103 N 1.52 3.93 -0.10 2.70 2.96 -0.91 -2.56 118.68 126.22 1fkr s LEU 103 Ca 0.03 1.22 -0.04 0.00 -0.22 0.00 0.00 54.13 55.11 1fkr s LEU 103 Cb -0.18 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 42.96 1fkr s LEU 103 CO -0.14 -0.98 -0.09 -0.07 -1.32 0.00 0.00 176.35 173.75 1fkr h LEU 104 N 10.49 0.00 0.00 -0.68 3.38 -1.30 -2.78 115.31 124.42 1fkr h LEU 104 Ca -0.24 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 1fkr h LEU 104 Cb 1.09 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.83 1fkr h LEU 104 CO 1.03 0.52 0.03 0.29 0.09 0.00 0.00 178.44 180.40 1fkr n LYS 105 N -4.18 0.19 -4.45 1.13 4.76 -1.05 -4.39 118.16 110.17 1fkr n LYS 105 Ca -0.03 -0.45 -0.24 0.00 -2.87 0.00 0.00 58.31 54.72 1fkr n LYS 105 Cb 0.13 0.52 -0.10 0.00 -1.84 0.00 0.00 35.03 33.74 1fkr n LYS 105 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1fkr s LEU 106 N 0.00 2.66 0.00 -0.35 1.43 -1.26 -0.18 118.68 120.98 1fkr s LEU 106 Ca 0.04 -0.98 0.00 0.00 -1.03 0.00 0.00 54.13 52.15 1fkr s LEU 106 Cb -0.01 -1.18 0.00 0.00 0.03 0.00 0.00 46.19 45.04 1fkr s LEU 106 CO 0.03 0.04 0.24 1.21 0.23 0.00 0.00 176.35 178.10