#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fkt s VAL 2 N 0.00 3.54 0.10 1.61 0.11 -1.26 -3.92 120.40 120.59 1fkt s VAL 2 Ca 0.00 0.92 0.06 0.00 -2.93 0.00 0.00 61.98 60.03 1fkt s VAL 2 Cb 0.00 -3.37 -0.03 0.00 -1.53 0.00 0.00 36.38 31.45 1fkt s VAL 2 CO 0.00 -0.25 -0.15 -1.10 -3.33 0.00 0.00 175.10 170.28 1fkt s GLN 3 N -3.39 0.95 -0.26 1.54 -0.21 0.12 -4.97 119.66 113.44 1fkt s GLN 3 Ca 0.69 -1.12 0.02 0.00 0.02 0.00 0.00 55.36 54.97 1fkt s GLN 3 Cb -0.19 -0.91 0.07 0.00 1.00 0.00 0.00 33.01 32.97 1fkt s GLN 3 CO 0.25 0.19 -0.06 0.08 -2.12 0.00 0.00 175.29 173.63 1fkt s VAL 4 N -1.71 1.86 -0.69 1.09 1.01 -1.26 -2.23 120.40 118.46 1fkt s VAL 4 Ca 0.04 -1.52 -0.05 0.00 0.00 0.00 0.00 61.98 60.46 1fkt s VAL 4 Cb -0.07 -2.09 0.18 0.00 0.00 0.00 0.00 36.38 34.40 1fkt s VAL 4 CO 0.03 -0.14 0.53 -1.61 0.00 0.00 0.00 175.10 173.90 1fkt s GLU 5 N 1.23 2.82 0.66 2.72 2.02 -0.56 -4.98 118.70 122.60 1fkt s GLU 5 Ca -0.05 -2.60 -0.15 0.00 0.02 0.00 0.00 54.97 52.19 1fkt s GLU 5 Cb -0.19 -3.87 0.00 0.00 0.10 0.00 0.00 34.13 30.17 1fkt s GLU 5 CO -0.06 -1.20 1.12 0.99 0.02 0.00 0.00 175.26 176.12 1fkt s THR 6 N -0.17 3.19 0.05 3.63 2.01 -1.26 -0.36 115.64 122.73 1fkt s THR 6 Ca 0.18 0.55 -0.01 0.00 0.31 0.00 0.00 61.69 62.72 1fkt s THR 6 Cb -0.17 -3.08 -0.01 0.00 0.01 0.00 0.00 72.50 69.25 1fkt s THR 6 CO -0.05 -0.34 -0.03 -0.38 -0.69 0.00 0.00 174.62 173.13 1fkt n ILE 7 N -2.44 1.01 -3.90 1.82 5.41 -0.11 -4.84 119.36 116.32 1fkt n ILE 7 Ca 0.10 0.30 -0.35 0.00 1.00 0.00 0.00 62.75 63.80 1fkt n ILE 7 Cb 0.52 -1.63 -0.14 0.00 -0.71 0.00 0.00 39.64 37.68 1fkt n ILE 7 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1fkt s SER 8 N -5.82 4.64 1.12 4.38 0.15 -0.96 -5.00 113.70 112.22 1fkt s SER 8 Ca -0.03 -0.91 -0.14 0.00 0.70 0.00 0.00 55.95 55.57 1fkt s SER 8 Cb 0.01 -1.73 0.21 0.00 -1.71 0.00 0.00 66.02 62.79 1fkt s SER 8 CO 0.04 -0.17 0.68 -2.65 1.20 0.00 0.00 173.24 172.33 1fkt n PRO 9 N 4.71 -1.89 -3.10 5.44 -0.02 -1.26 -0.39 135.00 138.48 1fkt n PRO 9 Ca -0.15 -0.52 -0.16 0.00 -2.02 0.00 0.00 63.50 60.65 1fkt n PRO 9 Cb 0.46 -2.02 -0.02 0.00 -0.02 0.00 0.00 33.50 31.90 1fkt n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fkt n GLY 10 N 1.29 3.41 0.33 -1.23 0.00 -1.26 -4.33 105.19 103.40 1fkt n GLY 10 Ca 0.03 -2.27 0.18 0.00 0.00 0.00 0.00 46.02 43.96 1fkt n GLY 10 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1fkt n ASP 11 N -1.52 -0.02 0.00 1.61 5.75 -1.19 -4.80 116.55 116.40 1fkt n ASP 11 Ca -0.07 1.66 0.00 0.00 -0.01 0.00 0.00 54.79 56.37 1fkt n ASP 11 Cb 0.34 -0.65 0.00 0.00 -1.03 0.00 0.00 41.12 39.78 1fkt n ASP 11 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1fkt n GLY 12 N -1.44 0.62 0.00 6.12 0.00 -1.26 -4.90 105.19 104.33 1fkt n GLY 12 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1fkt n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fkt n ARG 13 N -1.18 1.98 -3.52 1.61 1.74 -1.26 -4.99 116.66 111.04 1fkt n ARG 13 Ca 0.00 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.67 1fkt n ARG 13 Cb 0.00 -0.84 -0.11 0.00 -1.02 0.00 0.00 32.46 30.50 1fkt n ARG 13 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1fkt s THR 14 N -1.35 5.06 0.31 0.55 2.01 -1.26 -5.04 115.64 115.92 1fkt s THR 14 Ca 0.00 -0.59 0.05 0.00 0.31 0.00 0.00 61.69 61.46 1fkt s THR 14 Cb 0.00 -3.75 -0.06 0.00 0.01 0.00 0.00 72.50 68.70 1fkt s THR 14 CO 0.00 -0.20 0.02 -0.36 -0.69 0.00 0.00 174.62 173.39 1fkt s PHE 15 N 1.66 1.97 0.93 4.92 0.40 -1.26 -0.09 117.98 126.51 1fkt s PHE 15 Ca 0.05 -0.86 -0.10 0.00 -0.60 0.00 0.00 56.93 55.41 1fkt s PHE 15 Cb -0.19 -1.24 0.16 0.00 0.51 0.00 0.00 43.02 42.26 1fkt s PHE 15 CO 0.09 0.11 1.13 -2.14 0.70 0.00 0.00 175.22 175.11 1fkt s PRO 16 N -3.83 0.87 0.20 0.24 0.02 -1.26 -4.94 135.00 126.29 1fkt s PRO 16 Ca 0.34 1.45 0.04 0.00 0.02 0.00 0.00 61.00 62.85 1fkt s PRO 16 Cb 0.07 -1.72 -0.05 0.00 0.02 0.00 0.00 34.50 32.83 1fkt s PRO 16 CO 0.14 -2.70 -0.04 0.15 -0.33 0.00 0.00 177.00 174.22 1fkt s LYS 17 N -4.64 1.23 -0.43 5.54 1.02 -1.26 -5.05 119.74 116.14 1fkt s LYS 17 Ca 0.67 -1.59 -0.28 0.00 0.02 0.00 0.00 55.97 54.79 1fkt s LYS 17 Cb -0.23 -0.62 -0.02 0.00 -0.52 0.00 0.00 37.83 36.44 1fkt s LYS 17 CO 0.59 -0.03 1.84 1.03 -0.92 0.00 0.00 175.35 177.86 1fkt s ARG 18 N -3.82 3.05 0.00 1.68 0.52 -1.26 -1.28 118.95 117.84 1fkt s ARG 18 Ca 0.24 1.16 0.00 0.00 -0.52 0.00 0.00 55.73 56.60 1fkt s ARG 18 Cb 0.04 -4.27 0.00 0.00 0.52 0.00 0.00 34.95 31.24 1fkt s ARG 18 CO 0.05 -2.20 0.00 0.41 0.02 0.00 0.00 175.30 173.58 1fkt n GLY 19 N 5.53 1.28 3.94 -3.53 0.00 -1.26 -5.09 105.19 106.07 1fkt n GLY 19 Ca 0.23 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.05 1fkt n GLY 19 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fkt s GLN 20 N 0.00 2.92 0.23 1.61 -1.52 -0.41 -5.03 119.66 117.47 1fkt s GLN 20 Ca 0.00 -1.16 0.07 0.00 -1.95 0.00 0.00 55.36 52.32 1fkt s GLN 20 Cb 0.00 -2.67 -0.04 0.00 -0.22 0.00 0.00 33.01 30.08 1fkt s GLN 20 CO 0.00 0.02 0.11 0.99 -0.25 0.00 0.00 175.29 176.16 1fkt s THR 21 N -2.25 4.12 0.10 -0.19 2.01 -1.26 -3.60 115.64 114.57 1fkt s THR 21 Ca 0.45 -1.47 0.08 0.00 0.31 0.00 0.00 61.69 61.06 1fkt s THR 21 Cb -0.08 -3.18 -0.04 0.00 0.01 0.00 0.00 72.50 69.22 1fkt s THR 21 CO 0.30 -0.28 -0.17 0.00 -0.69 0.00 0.00 174.62 173.78 1fkt s VAL 23 N -1.11 1.60 0.11 0.00 1.01 0.12 -2.23 120.40 119.91 1fkt s VAL 23 Ca 0.18 -1.18 0.08 0.00 0.00 0.00 0.00 61.98 61.05 1fkt s VAL 23 Cb -0.11 -1.80 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 1fkt s VAL 23 CO 0.10 -0.01 -0.19 0.68 0.00 0.00 0.00 175.10 175.68 1fkt s VAL 24 N 1.38 1.62 -0.12 2.92 -7.23 0.19 -0.17 120.40 118.99 1fkt s VAL 24 Ca -0.05 -1.62 0.03 0.00 -1.81 0.00 0.00 61.98 58.53 1fkt s VAL 24 Cb -0.18 -1.56 0.01 0.00 0.56 0.00 0.00 36.38 35.21 1fkt s VAL 24 CO -0.07 -0.18 -0.20 -2.28 -0.31 0.00 0.00 175.10 172.06 1fkt s HIS 25 N -1.49 2.35 0.22 2.82 2.46 -0.65 -2.40 115.29 118.60 1fkt s HIS 25 Ca 0.08 -1.09 -0.07 0.00 0.47 0.00 0.00 55.06 54.44 1fkt s HIS 25 Cb -0.08 -1.62 -0.02 0.00 -0.13 0.00 0.00 32.58 30.73 1fkt s HIS 25 CO 0.04 -0.50 0.31 1.52 -2.47 0.00 0.00 174.74 173.64 1fkt s TYR 26 N 0.73 0.71 -0.07 3.88 1.13 -1.26 -0.55 117.35 121.92 1fkt s TYR 26 Ca -0.11 -1.01 0.03 0.00 -1.41 0.00 0.00 57.07 54.57 1fkt s TYR 26 Cb -0.16 -0.16 0.01 0.00 -1.10 0.00 0.00 41.96 40.55 1fkt s TYR 26 CO 0.01 -0.81 -0.14 0.99 -2.51 0.00 0.00 175.55 173.09 1fkt s THR 27 N -4.07 1.29 -0.28 -3.49 2.01 0.14 -1.27 115.64 109.96 1fkt s THR 27 Ca 0.29 -0.57 0.01 0.00 0.31 0.00 0.00 61.69 61.73 1fkt s THR 27 Cb 0.03 -1.16 0.06 0.00 0.01 0.00 0.00 72.50 71.43 1fkt s THR 27 CO 0.09 0.39 -0.05 -0.83 -0.69 0.00 0.00 174.62 173.54 1fkt s GLY 28 N 0.62 1.72 0.34 4.40 0.00 0.68 -0.08 107.32 115.00 1fkt s GLY 28 Ca -0.15 -1.80 0.08 0.00 0.00 0.00 0.00 44.72 42.85 1fkt s GLY 28 CO 0.04 0.67 -0.06 -0.29 0.00 0.00 0.00 173.10 173.46 1fkt s MET 29 N 1.17 1.77 0.04 2.90 1.75 0.45 -1.19 119.30 126.19 1fkt s MET 29 Ca -0.06 -1.93 0.04 0.00 -1.25 0.00 0.00 55.69 52.49 1fkt s MET 29 Cb -0.20 -1.51 -0.04 0.00 2.84 0.00 0.00 34.83 35.92 1fkt s MET 29 CO -0.03 0.06 -0.05 -0.51 -0.65 0.00 0.00 175.02 173.84 1fkt s LEU 30 N -3.58 3.26 0.00 4.11 1.43 0.90 -0.40 118.68 124.40 1fkt s LEU 30 Ca 0.32 -0.17 0.00 0.00 -1.03 0.00 0.00 54.13 53.25 1fkt s LEU 30 Cb 0.04 -1.93 0.00 0.00 0.03 0.00 0.00 46.19 44.34 1fkt s LEU 30 CO 0.16 0.24 0.00 -0.62 0.23 0.00 0.00 176.35 176.36 1fkt n GLU 31 N 1.19 0.00 -0.55 1.70 1.02 -1.26 -2.34 120.64 120.40 1fkt n GLU 31 Ca -0.14 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 1fkt n GLU 31 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.94 1fkt n GLU 31 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1fkt n ASP 32 N -3.80 0.05 0.00 1.62 5.75 -1.26 -5.02 116.55 113.89 1fkt n ASP 32 Ca 0.00 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.78 1fkt n ASP 32 Cb 0.00 -0.20 0.00 0.00 -1.03 0.00 0.00 41.12 39.89 1fkt n ASP 32 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1fkt n GLY 33 N 0.03 0.13 0.00 6.12 0.00 -0.99 -5.15 105.19 105.32 1fkt n GLY 33 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1fkt n GLY 33 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1fkt n LYS 34 N -1.74 0.00 -3.34 1.61 0.00 -1.26 -4.93 118.16 108.50 1fkt n LYS 34 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 58.31 57.93 1fkt n LYS 34 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 35.03 34.97 1fkt n LYS 34 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 1fkt s LYS 35 N -1.48 4.14 0.00 -1.58 -2.85 -1.26 -0.07 119.74 116.64 1fkt s LYS 35 Ca 0.00 0.60 0.00 0.00 -1.00 0.00 0.00 55.97 55.57 1fkt s LYS 35 Cb 0.00 -3.27 0.00 0.00 -2.06 0.00 0.00 37.83 32.50 1fkt s LYS 35 CO 0.00 0.57 0.00 1.97 0.10 0.00 0.00 175.35 177.99 1fkt n PHE 36 N 2.08 0.00 -3.77 1.78 -1.74 -0.33 -4.96 117.46 110.52 1fkt n PHE 36 Ca -0.11 0.00 -0.35 0.00 -0.56 0.00 0.00 57.45 56.43 1fkt n PHE 36 Cb 0.51 0.00 -0.11 0.00 1.52 0.00 0.00 39.48 41.41 1fkt n PHE 36 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1fkt s ASP 37 N -3.51 5.08 0.08 5.98 1.01 -0.96 -5.00 116.67 119.35 1fkt s ASP 37 Ca 0.00 -2.76 0.08 0.00 0.71 0.00 0.00 52.55 50.58 1fkt s ASP 37 Cb 0.00 -1.81 -0.03 0.00 1.01 0.00 0.00 42.92 42.09 1fkt s ASP 37 CO 0.00 -0.37 -0.21 -0.44 0.21 0.00 0.00 175.17 174.36 1fkt s SER 38 N 0.68 2.55 -0.96 0.27 0.01 -1.26 0.25 113.70 115.23 1fkt s SER 38 Ca 0.16 -0.62 -0.02 0.00 1.31 0.00 0.00 55.95 56.78 1fkt s SER 38 Cb -0.21 -0.17 0.27 0.00 0.21 0.00 0.00 66.02 66.12 1fkt s SER 38 CO -0.03 0.11 1.14 -1.54 0.41 0.00 0.00 173.24 173.33 1fkt n SER 39 N 1.41 5.31 -2.93 2.44 3.41 -0.39 -4.81 113.62 118.06 1fkt n SER 39 Ca -0.18 -3.30 -0.39 0.00 -0.26 0.00 0.00 58.87 54.73 1fkt n SER 39 Cb 0.53 -1.13 0.04 0.00 -0.26 0.00 0.00 64.21 63.39 1fkt n SER 39 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1fkt n ARG 40 N 1.64 2.96 -2.31 4.33 1.85 -1.26 -4.66 116.66 119.21 1fkt n ARG 40 Ca 0.26 -3.67 -0.40 0.00 -1.00 0.00 0.00 57.85 53.04 1fkt n ARG 40 Cb 0.36 -2.28 -0.03 0.00 -1.05 0.00 0.00 32.46 29.46 1fkt n ARG 40 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1fkt s ASP 41 N -1.30 5.74 0.00 2.89 1.11 -1.26 -4.91 116.67 118.93 1fkt s ASP 41 Ca 0.51 -0.11 0.00 0.00 0.18 0.00 0.00 52.55 53.13 1fkt s ASP 41 Cb 0.42 -2.55 0.00 0.00 1.07 0.00 0.00 42.92 41.87 1fkt s ASP 41 CO -0.38 -2.10 0.00 0.54 1.18 0.00 0.00 175.17 174.41 1fkt n ARG 42 N 9.28 0.00 -0.22 8.23 3.00 -1.26 -1.97 116.66 133.72 1fkt n ARG 42 Ca 0.12 0.00 0.06 0.00 -0.01 0.00 0.00 57.85 58.02 1fkt n ARG 42 Cb 0.50 0.00 0.16 0.00 0.00 0.00 0.00 32.46 33.12 1fkt n ARG 42 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1fkt n ASN 43 N -0.87 3.03 -2.84 0.55 3.02 -1.26 -4.93 115.26 111.96 1fkt n ASN 43 Ca 0.00 -2.30 -0.07 0.00 -0.03 0.00 0.00 54.58 52.18 1fkt n ASN 43 Cb 0.00 -0.29 -0.00 0.00 -0.61 0.00 0.00 39.78 38.88 1fkt n ASN 43 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1fkt n LYS 44 N 0.05 0.51 -0.88 3.52 5.02 -0.83 -5.15 118.16 120.40 1fkt n LYS 44 Ca 0.13 -2.18 -0.31 0.00 -2.02 0.00 0.00 58.31 53.93 1fkt n LYS 44 Cb 0.53 -1.49 0.03 0.00 -0.02 0.00 0.00 35.03 34.07 1fkt n LYS 44 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1fkt n PRO 45 N 2.85 0.00 -1.68 1.97 -0.02 -1.26 -4.85 135.00 132.01 1fkt n PRO 45 Ca 0.19 0.00 -0.37 0.00 -2.02 0.00 0.00 63.50 61.30 1fkt n PRO 45 Cb 0.55 -0.83 0.06 0.00 -0.02 0.00 0.00 33.50 33.26 1fkt n PRO 45 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1fkt n PHE 46 N -1.88 1.42 -3.87 6.00 7.35 -1.01 -4.73 117.46 120.75 1fkt n PHE 46 Ca 0.00 0.43 -0.10 0.00 -0.76 0.00 0.00 57.45 57.02 1fkt n PHE 46 Cb 0.45 -2.21 -0.09 0.00 0.35 0.00 0.00 39.48 37.98 1fkt n PHE 46 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 1fkt s LYS 47 N -3.09 0.64 0.37 -4.13 1.02 -1.26 -0.64 119.74 112.65 1fkt s LYS 47 Ca 0.80 -0.63 -0.16 0.00 0.02 0.00 0.00 55.97 55.99 1fkt s LYS 47 Cb -0.40 0.26 0.05 0.00 -0.52 0.00 0.00 37.83 37.23 1fkt s LYS 47 CO 0.43 -0.18 0.80 -0.59 -0.92 0.00 0.00 175.35 174.89 1fkt s PHE 48 N -2.42 0.10 0.15 3.18 -0.71 -0.95 -4.93 117.98 112.40 1fkt s PHE 48 Ca -0.06 -0.75 0.10 0.00 -1.04 0.00 0.00 56.93 55.18 1fkt s PHE 48 Cb -0.02 0.83 -0.04 0.00 -1.21 0.00 0.00 43.02 42.58 1fkt s PHE 48 CO -0.03 -1.52 -0.22 1.41 -1.34 0.00 0.00 175.22 173.52 1fkt s MET 49 N -2.41 1.61 -0.19 1.99 1.75 -1.26 -0.33 119.30 120.47 1fkt s MET 49 Ca 0.15 -1.36 -0.19 0.00 -1.25 0.00 0.00 55.69 53.04 1fkt s MET 49 Cb -0.05 -1.96 -0.03 0.00 2.84 0.00 0.00 34.83 35.63 1fkt s MET 49 CO 0.11 0.44 0.55 -1.17 -0.65 0.00 0.00 175.02 174.30 1fkt s LEU 50 N -2.37 4.16 0.00 4.11 2.96 -1.24 -3.84 118.68 122.47 1fkt s LEU 50 Ca 0.18 0.75 0.00 0.00 -0.22 0.00 0.00 54.13 54.84 1fkt s LEU 50 Cb -0.09 -2.77 0.00 0.00 0.50 0.00 0.00 46.19 43.83 1fkt s LEU 50 CO 0.09 -0.19 0.00 0.61 -1.32 0.00 0.00 176.35 175.54 1fkt n GLY 51 N 3.78 0.86 0.00 7.98 0.00 -1.26 -4.25 105.19 112.31 1fkt n GLY 51 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1fkt n GLY 51 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1fkt n LYS 52 N -1.83 1.40 -4.13 1.61 4.81 -1.25 -5.02 118.16 113.75 1fkt n LYS 52 Ca 0.00 -1.06 -0.37 0.00 -0.87 0.00 0.00 58.31 56.01 1fkt n LYS 52 Cb 0.00 -0.96 -0.04 0.00 0.02 0.00 0.00 35.03 34.06 1fkt n LYS 52 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1fkt n GLN 53 N -0.29 -0.60 0.00 1.64 6.02 -1.26 -4.81 117.38 118.09 1fkt n GLN 53 Ca 0.00 0.05 0.13 0.00 -0.01 0.00 0.00 57.00 57.17 1fkt n GLN 53 Cb 0.18 -2.77 0.39 0.00 1.02 0.00 0.00 30.24 29.07 1fkt n GLN 53 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1fkt n GLU 54 N -4.58 0.79 -4.34 -1.09 1.02 -1.26 -4.87 120.64 106.31 1fkt n GLU 54 Ca -0.21 -0.45 -0.25 0.00 -0.02 0.00 0.00 57.16 56.23 1fkt n GLU 54 Cb 0.59 -1.49 -0.07 0.00 -0.02 0.00 0.00 31.44 30.45 1fkt n GLU 54 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 1fkt n VAL 55 N -0.71 0.00 -1.99 2.62 0.24 -1.26 -5.06 118.33 112.17 1fkt n VAL 55 Ca 0.12 -2.28 -0.29 0.00 -2.04 0.00 0.00 64.34 59.85 1fkt n VAL 55 Cb 0.34 0.76 0.06 0.00 -1.47 0.00 0.00 33.84 33.53 1fkt n VAL 55 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1fkt s ILE 56 N -2.97 2.90 0.10 1.34 -4.36 -1.26 -4.77 121.20 112.17 1fkt s ILE 56 Ca 0.17 0.19 -0.35 0.00 -0.26 0.00 0.00 60.65 60.40 1fkt s ILE 56 Cb 0.01 -3.27 -0.15 0.00 1.25 0.00 0.00 42.46 40.30 1fkt s ILE 56 CO 0.12 -0.34 1.56 -0.09 0.24 0.00 0.00 174.94 176.43 1fkt h ARG 57 N -0.72 -0.79 -0.93 0.37 2.43 -1.78 -0.38 114.38 112.59 1fkt h ARG 57 Ca -0.45 0.05 0.32 0.00 -0.81 0.00 0.00 59.98 59.09 1fkt h ARG 57 Cb 1.29 0.18 -0.09 0.00 -0.42 0.00 0.00 29.97 30.92 1fkt h ARG 57 CO 0.64 -0.53 0.60 0.41 -1.51 0.00 0.00 179.97 179.58 1fkt n GLY 58 N -1.51 -0.56 0.08 2.80 0.00 0.36 -0.13 105.19 106.22 1fkt n GLY 58 Ca -0.09 0.50 -0.10 0.00 0.00 0.00 0.00 46.02 46.32 1fkt n GLY 58 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1fkt h TRP 59 N 0.00 0.00 -0.75 1.61 4.06 -1.37 0.19 115.95 119.69 1fkt h TRP 59 Ca 0.59 0.00 0.16 0.00 2.06 0.00 0.00 58.89 61.69 1fkt h TRP 59 Cb 1.90 0.00 -0.10 0.00 -1.00 0.00 0.00 29.16 29.96 1fkt h TRP 59 CO -0.00 0.60 0.24 1.49 -3.56 0.00 0.00 178.44 177.21 1fkt h GLU 60 N -1.00 0.34 0.12 0.49 4.81 0.19 0.60 114.58 120.12 1fkt h GLU 60 Ca -0.11 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.09 1fkt h GLU 60 Cb 0.73 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.04 1fkt h GLU 60 CO -0.07 0.22 -0.06 1.49 -0.73 0.00 0.00 179.01 179.87 1fkt h GLU 61 N 0.35 -0.16 -0.63 1.92 4.57 -0.68 -2.22 114.58 117.73 1fkt h GLU 61 Ca 0.42 0.01 0.06 0.00 -1.18 0.00 0.00 59.36 58.68 1fkt h GLU 61 Cb 0.70 0.04 -0.09 0.00 -0.16 0.00 0.00 28.75 29.24 1fkt h GLU 61 CO -0.47 -0.10 -0.53 0.78 -1.18 0.00 0.00 179.01 177.51 1fkt h GLY 62 N -0.27 -1.04 1.18 1.92 0.00 -0.17 0.23 103.07 104.92 1fkt h GLY 62 Ca -0.02 0.78 -0.07 0.00 0.00 0.00 0.00 47.33 48.02 1fkt h GLY 62 CO 0.03 -0.11 0.12 -2.08 0.00 0.00 0.00 176.54 174.51 1fkt h VAL 63 N -0.20 1.25 0.00 4.60 2.07 0.04 -1.49 116.25 122.52 1fkt h VAL 63 Ca 0.10 -0.96 -0.02 0.00 0.82 0.00 0.00 66.70 66.65 1fkt h VAL 63 Cb 0.47 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1fkt h VAL 63 CO -0.70 0.36 -0.10 0.00 0.02 0.00 0.00 177.57 177.16 1fkt h ALA 64 N 1.18 1.82 -0.12 1.67 0.00 -0.49 0.94 119.26 124.26 1fkt h ALA 64 Ca 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1fkt h ALA 64 Cb 0.38 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1fkt h ALA 64 CO 0.01 0.12 0.00 0.94 0.00 0.00 0.00 179.25 180.32 1fkt n GLN 65 N -4.39 1.31 -4.41 0.00 7.27 0.65 -4.63 117.38 113.18 1fkt n GLN 65 Ca -0.03 -0.45 -0.27 0.00 0.07 0.00 0.00 57.00 56.33 1fkt n GLN 65 Cb 0.17 -1.12 -0.12 0.00 2.41 0.00 0.00 30.24 31.58 1fkt n GLN 65 CO 0.00 0.00 0.00 -1.64 0.07 0.00 0.00 177.06 175.49 1fkt s MET 66 N -1.81 1.49 0.33 3.69 -1.94 0.32 -5.03 119.30 116.36 1fkt s MET 66 Ca 0.08 -1.51 0.07 0.00 -1.71 0.00 0.00 55.69 52.63 1fkt s MET 66 Cb 0.04 -1.80 -0.03 0.00 2.01 0.00 0.00 34.83 35.05 1fkt s MET 66 CO 0.05 0.39 0.27 -1.54 -0.01 0.00 0.00 175.02 174.19 1fkt s SER 67 N -2.64 5.27 -0.26 3.03 1.04 -1.26 -4.47 113.70 114.41 1fkt s SER 67 Ca 0.20 -0.49 -0.33 0.00 0.48 0.00 0.00 55.95 55.81 1fkt s SER 67 Cb -0.08 -1.00 -0.09 0.00 0.10 0.00 0.00 66.02 64.95 1fkt s SER 67 CO 0.09 -0.32 2.14 0.52 0.98 0.00 0.00 173.24 176.66 1fkt n VAL 68 N -1.34 0.31 -0.28 5.02 0.31 0.88 0.03 118.33 123.27 1fkt n VAL 68 Ca -0.03 -0.29 0.00 0.00 -0.01 0.00 0.00 64.34 64.01 1fkt n VAL 68 Cb 0.60 -1.98 0.00 0.00 -0.91 0.00 0.00 33.84 31.54 1fkt n VAL 68 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1fkt n GLY 69 N 5.87 0.85 3.75 2.92 0.00 -0.31 -3.14 105.19 115.13 1fkt n GLY 69 Ca 0.34 -0.11 -0.33 0.00 0.00 0.00 0.00 46.02 45.91 1fkt n GLY 69 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1fkt s GLN 70 N -0.66 3.00 -0.01 1.61 0.74 0.10 -4.09 119.66 120.36 1fkt s GLN 70 Ca 0.00 -0.49 0.04 0.00 0.05 0.00 0.00 55.36 54.97 1fkt s GLN 70 Cb 0.00 -2.82 -0.01 0.00 1.10 0.00 0.00 33.01 31.28 1fkt s GLN 70 CO 0.00 0.66 -0.14 0.50 -0.55 0.00 0.00 175.29 175.75 1fkt s ARG 71 N -1.55 1.17 0.18 1.67 3.52 0.47 -1.05 118.95 123.36 1fkt s ARG 71 Ca 0.20 -0.52 -0.09 0.00 -0.13 0.00 0.00 55.73 55.19 1fkt s ARG 71 Cb -0.12 -1.13 -0.01 0.00 -1.56 0.00 0.00 34.95 32.13 1fkt s ARG 71 CO 0.11 0.31 0.31 0.00 -0.81 0.00 0.00 175.30 175.22 1fkt s ALA 72 N -0.34 0.01 -0.27 6.12 0.00 -0.03 -0.93 121.76 126.31 1fkt s ALA 72 Ca 0.06 -0.91 -0.00 0.00 0.00 0.00 0.00 51.96 51.10 1fkt s ALA 72 Cb -0.06 0.92 0.05 0.00 0.00 0.00 0.00 23.12 24.03 1fkt s ALA 72 CO -0.01 -0.68 -0.06 0.21 0.00 0.00 0.00 175.76 175.23 1fkt s LYS 73 N -3.98 2.48 0.02 0.00 2.20 0.51 -0.38 119.74 120.58 1fkt s LYS 73 Ca 0.19 -1.21 -0.01 0.00 -0.36 0.00 0.00 55.97 54.58 1fkt s LYS 73 Cb 0.03 -3.02 -0.04 0.00 -1.51 0.00 0.00 37.83 33.29 1fkt s LYS 73 CO 0.02 -0.54 0.15 -0.51 -0.36 0.00 0.00 175.35 174.11 1fkt s LEU 74 N 1.22 4.19 -0.10 5.43 1.43 0.68 -1.50 118.68 130.02 1fkt s LEU 74 Ca -0.05 0.24 0.03 0.00 -1.03 0.00 0.00 54.13 53.32 1fkt s LEU 74 Cb -0.19 -2.60 -0.00 0.00 0.03 0.00 0.00 46.19 43.43 1fkt s LEU 74 CO -0.03 0.23 -0.22 -0.89 0.23 0.00 0.00 176.35 175.67 1fkt s THR 75 N -1.35 2.28 0.16 5.49 2.01 -0.95 -0.15 115.64 123.14 1fkt s THR 75 Ca 0.28 -0.95 0.11 0.00 0.31 0.00 0.00 61.69 61.44 1fkt s THR 75 Cb -0.13 -1.88 -0.04 0.00 0.01 0.00 0.00 72.50 70.46 1fkt s THR 75 CO 0.20 0.55 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.81 1fkt s ILE 76 N 0.28 2.39 0.34 1.82 1.01 0.83 -0.70 121.20 127.17 1fkt s ILE 76 Ca -0.16 -1.85 0.09 0.00 0.00 0.00 0.00 60.65 58.73 1fkt s ILE 76 Cb -0.17 -2.11 -0.05 0.00 0.01 0.00 0.00 42.46 40.14 1fkt s ILE 76 CO 0.08 -0.01 0.04 -0.94 0.00 0.00 0.00 174.94 174.11 1fkt s SER 77 N -2.37 4.29 0.21 3.58 1.04 -1.25 -1.98 113.70 117.21 1fkt s SER 77 Ca 0.18 -0.95 -0.20 0.00 0.48 0.00 0.00 55.95 55.46 1fkt s SER 77 Cb -0.09 -0.57 0.17 0.00 0.10 0.00 0.00 66.02 65.63 1fkt s SER 77 CO 0.08 -0.26 1.56 1.55 0.98 0.00 0.00 173.24 177.15 1fkt h PRO 78 N 1.75 -0.05 -0.91 4.02 0.13 -1.82 0.38 132.00 135.49 1fkt h PRO 78 Ca -0.43 0.00 0.26 0.00 -0.87 0.00 0.00 66.00 64.97 1fkt h PRO 78 Cb 1.25 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.36 1fkt h PRO 78 CO 0.66 -0.03 0.68 0.38 -0.23 0.00 0.00 178.00 179.46 1fkt h ASP 79 N -0.05 0.00 -0.11 1.44 2.03 -1.94 0.17 116.42 117.96 1fkt h ASP 79 Ca 0.29 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.59 1fkt h ASP 79 Cb 0.57 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.07 1fkt h ASP 79 CO -0.90 0.00 0.00 -1.22 -1.03 0.00 0.00 179.24 176.09 1fkt n TYR 80 N -4.17 0.13 0.00 4.15 4.02 0.69 -4.85 117.16 117.13 1fkt n TYR 80 Ca 0.19 -0.19 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1fkt n TYR 80 Cb 1.00 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 40.31 1fkt n TYR 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1fkt n ALA 81 N 0.40 0.00 -2.78 -0.72 0.00 0.99 -0.49 120.51 117.91 1fkt n ALA 81 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.19 1fkt n ALA 81 Cb 0.28 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.71 1fkt n ALA 81 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1fkt n TYR 82 N 0.00 3.64 0.00 0.00 4.01 -1.23 -4.66 117.16 118.92 1fkt n TYR 82 Ca 0.00 -3.49 0.00 0.00 -0.16 0.00 0.00 57.90 54.25 1fkt n TYR 82 Cb 0.00 -0.66 0.00 0.00 -0.31 0.00 0.00 39.34 38.37 1fkt n TYR 82 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fkt n GLY 83 N -0.23 0.00 0.00 2.72 0.00 -0.26 -3.46 105.19 103.95 1fkt n GLY 83 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.39 1fkt n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fkt n ALA 84 N 0.00 1.95 -2.92 4.61 0.00 -1.26 -4.05 120.51 118.83 1fkt n ALA 84 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.00 1fkt n ALA 84 Cb 0.00 0.33 -0.03 0.00 0.00 0.00 0.00 19.45 19.76 1fkt n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1fkt s THR 85 N -1.74 4.65 0.00 0.00 2.01 -1.22 -4.01 115.64 115.32 1fkt s THR 85 Ca 0.00 -1.30 0.00 0.00 0.31 0.00 0.00 61.69 60.70 1fkt s THR 85 Cb 0.00 -4.75 0.00 0.00 0.01 0.00 0.00 72.50 67.76 1fkt s THR 85 CO 0.00 -1.48 0.00 0.61 -0.69 0.00 0.00 174.62 173.06 1fkt n GLY 86 N 5.46 1.88 3.20 4.40 0.00 -1.26 -4.93 105.19 113.94 1fkt n GLY 86 Ca 0.17 -2.03 -0.34 0.00 0.00 0.00 0.00 46.02 43.81 1fkt n GLY 86 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1fkt s HIS 87 N 2.01 3.04 -0.84 1.61 2.46 0.41 -4.90 115.29 119.07 1fkt s HIS 87 Ca 0.00 -1.53 -0.23 0.00 0.47 0.00 0.00 55.06 53.77 1fkt s HIS 87 Cb 0.00 -2.05 -0.18 0.00 -0.13 0.00 0.00 32.58 30.22 1fkt s HIS 87 CO 0.00 -0.72 2.29 -0.35 -2.47 0.00 0.00 174.74 173.49 1fkt n PRO 88 N 4.67 0.39 0.00 2.88 -0.04 -1.25 -0.76 135.00 140.89 1fkt n PRO 88 Ca -0.17 -0.89 0.00 0.00 -0.04 0.00 0.00 63.50 62.40 1fkt n PRO 88 Cb 0.47 -3.36 0.00 0.00 -0.04 0.00 0.00 33.50 30.57 1fkt n PRO 88 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1fkt n GLY 89 N 6.47 3.52 0.09 0.55 0.00 -1.26 -4.92 105.19 109.65 1fkt n GLY 89 Ca 0.47 -0.50 -0.11 0.00 0.00 0.00 0.00 46.02 45.88 1fkt n GLY 89 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1fkt n ILE 90 N 0.00 1.48 -3.77 -0.61 5.41 0.06 -4.77 119.36 117.16 1fkt n ILE 90 Ca 0.00 0.09 -0.30 0.00 1.00 0.00 0.00 62.75 63.55 1fkt n ILE 90 Cb 0.00 -2.29 -0.14 0.00 -0.71 0.00 0.00 39.64 36.50 1fkt n ILE 90 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1fkt s ILE 91 N -2.61 1.43 1.18 1.39 1.01 -0.15 -4.92 121.20 118.54 1fkt s ILE 91 Ca -0.26 -2.25 -0.16 0.00 0.00 0.00 0.00 60.65 57.99 1fkt s ILE 91 Cb 0.05 -2.03 0.23 0.00 0.01 0.00 0.00 42.46 40.72 1fkt s ILE 91 CO 0.38 -0.79 0.57 -2.65 0.00 0.00 0.00 174.94 172.45 1fkt n PRO 92 N 3.98 -2.36 -0.48 2.79 -0.02 -1.24 0.15 135.00 137.82 1fkt n PRO 92 Ca 0.05 -0.67 -0.29 0.00 -2.02 0.00 0.00 63.50 60.57 1fkt n PRO 92 Cb 0.37 -1.94 0.25 0.00 -0.02 0.00 0.00 33.50 32.16 1fkt n PRO 92 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1fkt n PRO 93 N -3.82 -2.63 -3.18 0.52 -0.04 -1.26 -4.01 135.00 120.60 1fkt n PRO 93 Ca 0.02 -0.74 0.00 0.00 -0.04 0.00 0.00 63.50 62.73 1fkt n PRO 93 Cb 0.57 -2.06 0.00 0.00 -0.04 0.00 0.00 33.50 31.98 1fkt n PRO 93 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1fkt n HIS 94 N -5.01 0.00 -4.58 0.54 8.25 -1.26 -4.89 115.22 108.28 1fkt n HIS 94 Ca 0.02 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.16 1fkt n HIS 94 Cb 0.56 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.55 1fkt n HIS 94 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1fkt s ALA 95 N -4.18 2.92 0.17 -1.41 0.00 -1.26 -4.99 121.76 113.00 1fkt s ALA 95 Ca 0.00 -1.00 -0.13 0.00 0.00 0.00 0.00 51.96 50.83 1fkt s ALA 95 Cb 0.00 -1.09 -0.07 0.00 0.00 0.00 0.00 23.12 21.96 1fkt s ALA 95 CO 0.00 0.59 0.54 0.99 0.00 0.00 0.00 175.76 177.88 1fkt s THR 96 N -0.91 4.89 0.07 0.00 2.01 -1.26 -4.37 115.64 116.08 1fkt s THR 96 Ca 0.15 0.70 0.06 0.00 0.31 0.00 0.00 61.69 62.91 1fkt s THR 96 Cb -0.11 -3.69 -0.04 0.00 0.01 0.00 0.00 72.50 68.67 1fkt s THR 96 CO 0.05 0.15 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.27 1fkt s LEU 97 N -2.22 3.04 -0.07 4.42 1.43 -0.84 -4.00 118.68 120.44 1fkt s LEU 97 Ca 0.40 -0.32 0.03 0.00 -1.03 0.00 0.00 54.13 53.21 1fkt s LEU 97 Cb -0.14 -1.81 0.00 0.00 0.03 0.00 0.00 46.19 44.27 1fkt s LEU 97 CO 0.20 0.21 -0.18 -0.69 0.23 0.00 0.00 176.35 176.12 1fkt s VAL 98 N -1.14 1.57 -0.22 -1.59 1.01 0.46 -0.12 120.40 120.37 1fkt s VAL 98 Ca 0.20 -0.75 -0.00 0.00 0.00 0.00 0.00 61.98 61.43 1fkt s VAL 98 Cb -0.11 -1.37 0.06 0.00 0.00 0.00 0.00 36.38 34.95 1fkt s VAL 98 CO 0.12 0.45 -0.03 -0.36 0.00 0.00 0.00 175.10 175.27 1fkt s PHE 99 N 0.39 2.05 -0.70 5.22 0.40 0.79 -0.41 117.98 125.73 1fkt s PHE 99 Ca -0.14 -1.52 -0.22 0.00 -0.60 0.00 0.00 56.93 54.45 1fkt s PHE 99 Cb -0.16 -1.44 0.07 0.00 0.51 0.00 0.00 43.02 42.01 1fkt s PHE 99 CO 0.05 -0.73 1.00 -0.51 0.70 0.00 0.00 175.22 175.74 1fkt s ASP 100 N 1.51 6.22 0.04 1.36 1.11 0.89 -0.23 116.67 127.57 1fkt s ASP 100 Ca -0.05 -1.08 0.05 0.00 0.18 0.00 0.00 52.55 51.66 1fkt s ASP 100 Cb -0.18 -2.43 -0.04 0.00 1.07 0.00 0.00 42.92 41.34 1fkt s ASP 100 CO -0.07 -1.43 -0.08 -0.69 1.18 0.00 0.00 175.17 174.09 1fkt s VAL 101 N 4.03 3.52 -0.11 -1.27 1.01 0.48 -0.68 120.40 127.39 1fkt s VAL 101 Ca 0.24 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 61.29 1fkt s VAL 101 Cb -0.15 -2.57 0.01 0.00 0.00 0.00 0.00 36.38 33.67 1fkt s VAL 101 CO 0.08 0.30 -0.19 -0.70 0.00 0.00 0.00 175.10 174.58 1fkt s GLU 102 N -1.69 2.64 -0.38 2.72 2.12 0.29 -0.85 118.70 123.54 1fkt s GLU 102 Ca 0.19 -0.72 -0.18 0.00 0.36 0.00 0.00 54.97 54.61 1fkt s GLU 102 Cb -0.11 -2.11 0.01 0.00 0.26 0.00 0.00 34.13 32.17 1fkt s GLU 102 CO 0.10 0.03 0.49 -1.17 -0.54 0.00 0.00 175.26 174.17 1fkt s LEU 103 N 0.71 4.51 -0.12 2.70 2.96 -0.21 -1.64 118.68 127.59 1fkt s LEU 103 Ca -0.11 -0.27 -0.13 0.00 -0.22 0.00 0.00 54.13 53.40 1fkt s LEU 103 Cb -0.16 -2.53 -0.12 0.00 0.50 0.00 0.00 46.19 43.88 1fkt s LEU 103 CO 0.02 -0.53 0.36 -0.07 -1.32 0.00 0.00 176.35 174.81 1fkt h LEU 104 N 9.13 -0.00 -7.99 -0.68 3.38 -0.87 -0.81 115.31 117.47 1fkt h LEU 104 Ca -0.27 -0.46 0.22 0.00 0.09 0.00 0.00 57.88 57.46 1fkt h LEU 104 Cb 1.12 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.83 1fkt h LEU 104 CO 0.79 0.72 0.70 -0.75 0.09 0.00 0.00 178.44 179.98 1fkt s LYS 105 N -1.89 1.01 0.20 1.13 2.20 -1.07 -4.24 119.74 117.09 1fkt s LYS 105 Ca -0.09 -0.66 0.06 0.00 -0.36 0.00 0.00 55.97 54.93 1fkt s LYS 105 Cb -0.01 0.28 -0.04 0.00 -1.51 0.00 0.00 37.83 36.55 1fkt s LYS 105 CO 0.32 -0.48 0.11 -0.51 -0.36 0.00 0.00 175.35 174.43 1fkt s LEU 106 N -3.58 3.64 0.00 5.43 1.43 -1.26 0.15 118.68 124.49 1fkt s LEU 106 Ca 0.25 -0.27 0.00 0.00 -1.03 0.00 0.00 54.13 53.08 1fkt s LEU 106 Cb -0.02 -2.23 0.00 0.00 0.03 0.00 0.00 46.19 43.97 1fkt s LEU 106 CO 0.04 0.04 0.39 1.21 0.23 0.00 0.00 176.35 178.26