#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cfb s VAL 2 N 0.00 4.99 0.11 3.84 1.01 -1.26 -4.71 120.40 124.38 3cfb s VAL 2 Ca 0.00 1.34 -0.25 0.00 0.00 0.00 0.00 61.98 63.07 3cfb s VAL 2 Cb 0.00 -4.01 0.08 0.00 0.00 0.00 0.00 36.38 32.45 3cfb s VAL 2 CO 0.00 0.11 0.70 -1.59 0.00 0.00 0.00 175.10 174.32 3cfb s LYS 3 N 1.78 1.15 0.03 2.72 -2.85 -0.94 -5.00 119.74 116.62 3cfb s LYS 3 Ca 0.32 -0.43 0.05 0.00 -1.00 0.00 0.00 55.97 54.91 3cfb s LYS 3 Cb -0.16 0.52 -0.03 0.00 -2.06 0.00 0.00 37.83 36.09 3cfb s LYS 3 CO 0.12 -0.50 -0.09 -0.51 0.10 0.00 0.00 175.35 174.47 3cfb s LEU 4 N -2.67 3.07 -0.12 2.77 1.43 -1.26 -1.26 118.68 120.64 3cfb s LEU 4 Ca 0.03 -0.24 -0.02 0.00 -1.03 0.00 0.00 54.13 52.87 3cfb s LEU 4 Cb -0.01 -1.79 0.04 0.00 0.03 0.00 0.00 46.19 44.46 3cfb s LEU 4 CO -0.11 0.25 0.03 -0.69 0.23 0.00 0.00 176.35 176.06 3cfb s VAL 5 N -1.04 0.33 0.25 -1.59 1.01 -0.34 -4.16 120.40 114.87 3cfb s VAL 5 Ca 0.18 -0.09 -0.11 0.00 0.00 0.00 0.00 61.98 61.96 3cfb s VAL 5 Cb -0.11 -0.66 -0.08 0.00 0.00 0.00 0.00 36.38 35.54 3cfb s VAL 5 CO 0.09 0.06 0.59 -1.61 0.00 0.00 0.00 175.10 174.22 3cfb s GLU 6 N 1.97 3.84 0.21 2.72 8.01 -1.26 -1.79 118.70 132.40 3cfb s GLU 6 Ca 0.03 0.36 -0.11 0.00 0.01 0.00 0.00 54.97 55.26 3cfb s GLU 6 Cb -0.14 -2.60 -0.01 0.00 -4.31 0.00 0.00 34.13 27.08 3cfb s GLU 6 CO -0.06 0.28 0.39 -1.54 0.01 0.00 0.00 175.26 174.33 3cfb s SER 7 N -2.34 -0.04 0.00 -0.19 1.04 0.43 -4.74 113.70 107.85 3cfb s SER 7 Ca 0.49 -0.89 0.00 0.00 0.48 0.00 0.00 55.95 56.02 3cfb s SER 7 Cb -0.11 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.53 3cfb s SER 7 CO 0.20 -1.02 0.00 0.61 0.98 0.00 0.00 173.24 174.02 3cfb n GLY 8 N -0.31 0.79 3.70 7.32 0.00 -1.26 -1.07 105.19 114.36 3cfb n GLY 8 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 3cfb n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3cfb s GLY 9 N -1.53 1.64 0.00 -0.02 0.00 -1.26 -4.75 107.32 101.39 3cfb s GLY 9 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 44.72 44.89 3cfb s GLY 9 CO 0.00 0.63 0.00 0.61 0.00 0.00 0.00 173.10 174.34 3cfb n GLY 10 N -0.65 -1.41 3.76 0.20 0.00 -0.29 -4.89 105.19 101.91 3cfb n GLY 10 Ca 0.08 -1.02 -0.40 0.00 0.00 0.00 0.00 46.02 44.68 3cfb n GLY 10 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cfb s LEU 11 N 0.00 4.58 -0.06 0.99 1.43 -1.26 -1.49 118.68 122.87 3cfb s LEU 11 Ca 0.00 1.69 -0.08 0.00 -1.03 0.00 0.00 54.13 54.71 3cfb s LEU 11 Cb 0.00 -3.37 0.02 0.00 0.03 0.00 0.00 46.19 42.87 3cfb s LEU 11 CO 0.00 0.16 0.21 0.54 0.23 0.00 0.00 176.35 177.49 3cfb s VAL 12 N -0.93 0.02 0.51 -1.59 0.11 -0.45 -4.95 120.40 113.12 3cfb s VAL 12 Ca 0.38 -0.17 -0.20 0.00 -2.93 0.00 0.00 61.98 59.05 3cfb s VAL 12 Cb -0.23 -0.36 -0.07 0.00 -1.53 0.00 0.00 36.38 34.18 3cfb s VAL 12 CO 0.27 -0.10 1.10 -0.54 -3.33 0.00 0.00 175.10 172.51 3cfb s LYS 13 N -0.29 3.56 0.42 1.54 -0.14 -1.25 -1.22 119.74 122.36 3cfb s LYS 13 Ca -0.04 1.55 -0.25 0.00 -1.36 0.00 0.00 55.97 55.88 3cfb s LYS 13 Cb -0.03 -2.10 -0.10 0.00 -1.68 0.00 0.00 37.83 33.92 3cfb s LYS 13 CO 0.01 -0.67 1.14 -2.30 -0.76 0.00 0.00 175.35 172.77 3cfb n PRO 14 N -1.06 1.62 -0.50 -1.68 -0.02 -1.26 -1.27 135.00 130.81 3cfb n PRO 14 Ca 0.10 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 3cfb n PRO 14 Cb 0.51 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 3cfb n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3cfb n GLY 15 N 1.00 1.95 2.45 -1.23 0.00 0.74 -4.93 105.19 105.17 3cfb n GLY 15 Ca 0.08 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.93 3cfb n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfb n GLY 16 N -2.00 -0.64 3.21 -0.02 0.00 -0.40 -3.89 105.19 101.45 3cfb n GLY 16 Ca 0.00 -1.80 -0.20 0.00 0.00 0.00 0.00 46.02 44.01 3cfb n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3cfb s SER 17 N -3.90 1.98 -0.18 1.61 0.01 -1.26 -1.69 113.70 110.26 3cfb s SER 17 Ca 0.46 -0.66 -0.20 0.00 1.31 0.00 0.00 55.95 56.86 3cfb s SER 17 Cb -0.02 -0.08 0.05 0.00 0.21 0.00 0.00 66.02 66.19 3cfb s SER 17 CO 0.31 -0.04 0.55 -0.22 0.41 0.00 0.00 173.24 174.25 3cfb s LEU 18 N -1.86 -0.09 -0.19 2.44 2.96 -0.61 -5.00 118.68 116.33 3cfb s LEU 18 Ca 0.02 1.01 -0.01 0.00 -0.22 0.00 0.00 54.13 54.92 3cfb s LEU 18 Cb -0.10 1.90 0.00 0.00 0.50 0.00 0.00 46.19 48.50 3cfb s LEU 18 CO 0.03 -0.24 -0.12 -0.75 -1.32 0.00 0.00 176.35 173.95 3cfb s LYS 19 N 0.06 3.24 0.22 1.98 2.20 -1.26 -0.27 119.74 125.90 3cfb s LYS 19 Ca -0.02 -0.71 -0.06 0.00 -0.36 0.00 0.00 55.97 54.82 3cfb s LYS 19 Cb -0.04 -2.78 -0.06 0.00 -1.51 0.00 0.00 37.83 33.45 3cfb s LYS 19 CO 0.02 -0.12 0.48 -0.51 -0.36 0.00 0.00 175.35 174.86 3cfb s LEU 20 N 1.20 4.17 0.15 5.43 1.43 0.03 -4.67 118.68 126.42 3cfb s LEU 20 Ca 0.02 0.72 0.06 0.00 -1.03 0.00 0.00 54.13 53.90 3cfb s LEU 20 Cb -0.14 -3.49 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 3cfb s LEU 20 CO -0.05 -0.06 -0.14 -0.44 0.23 0.00 0.00 176.35 175.89 3cfb s SER 21 N -2.66 2.16 -0.06 2.29 0.01 -0.23 -1.30 113.70 113.91 3cfb s SER 21 Ca 0.44 -0.91 -0.03 0.00 1.31 0.00 0.00 55.95 56.76 3cfb s SER 21 Cb -0.11 -0.08 0.04 0.00 0.21 0.00 0.00 66.02 66.07 3cfb s SER 21 CO 0.25 -0.18 0.14 0.00 0.41 0.00 0.00 173.24 173.86 3cfb s THR 23 N 1.22 3.05 0.05 0.00 -4.23 -0.74 -1.54 115.64 113.45 3cfb s THR 23 Ca -0.09 -1.84 0.01 0.00 -1.18 0.00 0.00 61.69 58.60 3cfb s THR 23 Cb -0.12 -2.89 -0.03 0.00 1.34 0.00 0.00 72.50 70.81 3cfb s THR 23 CO -0.06 -0.25 -0.06 0.00 -0.54 0.00 0.00 174.62 173.71 3cfb s ALA 24 N -2.42 0.55 -0.17 3.99 0.00 -1.26 -1.19 121.76 121.26 3cfb s ALA 24 Ca 0.35 -0.89 -0.02 0.00 0.00 0.00 0.00 51.96 51.39 3cfb s ALA 24 Cb -0.03 0.11 -0.02 0.00 0.00 0.00 0.00 23.12 23.19 3cfb s ALA 24 CO 0.21 -0.13 -0.07 0.45 0.00 0.00 0.00 175.76 176.22 3cfb s SER 25 N -1.99 4.35 0.00 0.00 0.15 -0.39 -4.76 113.70 111.06 3cfb s SER 25 Ca -0.05 -0.28 0.00 0.00 0.70 0.00 0.00 55.95 56.32 3cfb s SER 25 Cb -0.05 -1.70 0.00 0.00 -1.71 0.00 0.00 66.02 62.56 3cfb s SER 25 CO -0.02 0.11 0.00 0.61 1.20 0.00 0.00 173.24 175.14 3cfb n GLY 26 N 3.91 0.82 3.04 9.45 0.00 -1.26 -2.23 105.19 118.93 3cfb n GLY 26 Ca -0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 3cfb n GLY 26 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cfb s ILE 27 N -3.29 1.40 -0.54 -0.61 1.01 -1.26 -4.99 121.20 112.91 3cfb s ILE 27 Ca 0.00 -0.59 -0.16 0.00 0.00 0.00 0.00 60.65 59.90 3cfb s ILE 27 Cb 0.00 -1.28 0.12 0.00 0.01 0.00 0.00 42.46 41.31 3cfb s ILE 27 CO 0.00 0.42 0.52 -0.89 0.00 0.00 0.00 174.94 174.99 3cfb s THR 28 N 0.96 5.16 0.37 2.92 2.01 -1.26 -4.78 115.64 121.02 3cfb s THR 28 Ca -0.08 -1.41 0.11 0.00 0.31 0.00 0.00 61.69 60.63 3cfb s THR 28 Cb -0.15 -4.34 0.34 0.00 0.01 0.00 0.00 72.50 68.35 3cfb s THR 28 CO -0.01 -0.88 1.86 -0.26 -0.69 0.00 0.00 174.62 174.65 3cfb h PHE 29 N 8.92 0.73 0.00 4.92 0.04 -1.93 -2.02 116.94 127.60 3cfb h PHE 29 Ca -0.30 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.49 3cfb h PHE 29 Cb 1.10 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 39.02 3cfb h PHE 29 CO 0.74 0.25 0.06 0.66 -0.60 0.00 0.00 178.31 179.41 3cfb h SER 30 N 0.60 0.00 0.68 2.17 4.64 -1.93 -2.67 113.55 117.05 3cfb h SER 30 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 3cfb h SER 30 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 3cfb h SER 30 CO -0.20 0.00 -0.43 0.54 -0.87 0.00 0.00 176.83 175.87 3cfb n ARG 31 N -2.91 0.07 -4.39 4.77 1.74 -0.76 -4.63 116.66 110.55 3cfb n ARG 31 Ca -0.03 0.02 -0.20 0.00 -0.77 0.00 0.00 57.85 56.88 3cfb n ARG 31 Cb 0.12 -1.54 -0.10 0.00 -1.02 0.00 0.00 32.46 29.92 3cfb n ARG 31 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3cfb s TYR 32 N -3.04 1.83 -0.28 -1.55 2.02 -1.01 -4.84 117.35 110.49 3cfb s TYR 32 Ca 0.11 -0.66 -0.29 0.00 -0.37 0.00 0.00 57.07 55.86 3cfb s TYR 32 Cb 0.17 -0.97 -0.00 0.00 -0.40 0.00 0.00 41.96 40.76 3cfb s TYR 32 CO 0.67 0.30 1.35 0.42 -1.57 0.00 0.00 175.55 176.73 3cfb s ILE 33 N -3.01 4.07 -0.00 2.71 1.01 -1.26 -3.50 121.20 121.22 3cfb s ILE 33 Ca 0.27 1.21 0.00 0.00 0.00 0.00 0.00 60.65 62.12 3cfb s ILE 33 Cb 0.02 -4.07 -0.04 0.00 0.01 0.00 0.00 42.46 38.38 3cfb s ILE 33 CO 0.10 -0.43 0.05 -0.04 0.00 0.00 0.00 174.94 174.62 3cfb s MET 34 N 4.23 2.97 0.10 2.79 -1.94 -0.43 -4.14 119.30 122.88 3cfb s MET 34 Ca 0.59 -0.53 0.02 0.00 -1.71 0.00 0.00 55.69 54.06 3cfb s MET 34 Cb -0.18 -2.80 -0.04 0.00 2.01 0.00 0.00 34.83 33.82 3cfb s MET 34 CO 0.24 0.64 -0.07 -1.12 -0.01 0.00 0.00 175.02 174.69 3cfb s SER 35 N -1.68 1.22 -0.01 3.03 0.01 -0.37 -0.81 113.70 115.09 3cfb s SER 35 Ca 0.22 -0.95 0.06 0.00 1.31 0.00 0.00 55.95 56.59 3cfb s SER 35 Cb -0.12 0.07 -0.03 0.00 0.21 0.00 0.00 66.02 66.16 3cfb s SER 35 CO 0.13 -0.41 -0.19 0.26 0.41 0.00 0.00 173.24 173.44 3cfb s TRP 36 N -3.30 2.56 -0.00 2.43 0.52 0.26 -0.87 118.94 120.53 3cfb s TRP 36 Ca 0.10 -0.26 -0.05 0.00 0.02 0.00 0.00 56.10 55.90 3cfb s TRP 36 Cb 0.03 -1.53 -0.00 0.00 -1.15 0.00 0.00 33.47 30.82 3cfb s TRP 36 CO -0.03 0.16 0.10 0.08 0.02 0.00 0.00 176.95 177.28 3cfb s VAL 37 N -0.78 0.07 0.06 4.03 1.01 -0.53 -0.90 120.40 123.36 3cfb s VAL 37 Ca 0.12 -0.60 0.05 0.00 0.00 0.00 0.00 61.98 61.55 3cfb s VAL 37 Cb -0.10 -0.35 -0.03 0.00 0.00 0.00 0.00 36.38 35.90 3cfb s VAL 37 CO 0.02 -0.33 -0.14 0.00 0.00 0.00 0.00 175.10 174.65 3cfb s ARG 38 N -1.12 0.84 -0.25 2.72 1.70 0.21 -0.13 118.95 122.92 3cfb s ARG 38 Ca -0.12 -0.86 -0.03 0.00 -0.47 0.00 0.00 55.73 54.25 3cfb s ARG 38 Cb -0.07 -0.83 0.02 0.00 -0.57 0.00 0.00 34.95 33.50 3cfb s ARG 38 CO 0.01 0.19 -0.03 -1.14 -1.08 0.00 0.00 175.30 173.25 3cfb s GLN 39 N -1.48 2.99 -0.00 3.89 2.00 0.39 -0.47 119.66 126.98 3cfb s GLN 39 Ca -0.01 -0.88 -0.16 0.00 -2.00 0.00 0.00 55.36 52.31 3cfb s GLN 39 Cb -0.09 -3.05 -0.06 0.00 0.80 0.00 0.00 33.01 30.61 3cfb s GLN 39 CO 0.02 -0.36 0.43 0.42 -0.50 0.00 0.00 175.29 175.30 3cfb s ILE 40 N 1.39 5.01 0.20 -2.34 1.01 -1.25 -1.04 121.20 124.18 3cfb s ILE 40 Ca 0.02 0.90 -0.13 0.00 0.00 0.00 0.00 60.65 61.44 3cfb s ILE 40 Cb -0.16 -3.74 0.19 0.00 0.01 0.00 0.00 42.46 38.75 3cfb s ILE 40 CO -0.03 0.55 1.65 1.55 0.00 0.00 0.00 174.94 178.66 3cfb h PRO 41 N 4.89 0.06 0.00 2.79 0.13 -1.95 -1.09 132.00 136.83 3cfb h PRO 41 Ca -0.50 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3cfb h PRO 41 Cb 1.21 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3cfb h PRO 41 CO 0.63 0.04 -0.35 -0.85 -0.23 0.00 0.00 178.00 177.25 3cfb n GLU 42 N -5.32 0.27 0.00 0.86 0.28 -1.26 -5.00 120.64 110.47 3cfb n GLU 42 Ca 0.07 0.14 0.00 0.00 -0.16 0.00 0.00 57.16 57.21 3cfb n GLU 42 Cb 0.32 -1.73 0.00 0.00 1.43 0.00 0.00 31.44 31.46 3cfb n GLU 42 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3cfb n LYS 43 N -2.16 2.88 -3.19 3.44 5.02 -0.41 -5.15 118.16 118.58 3cfb n LYS 43 Ca 0.04 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.15 3cfb n LYS 43 Cb 0.43 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.45 3cfb n LYS 43 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3cfb s ARG 44 N 1.40 2.95 0.35 1.97 0.52 -1.26 -4.62 118.95 120.27 3cfb s ARG 44 Ca 0.00 -1.09 -0.28 0.00 -0.52 0.00 0.00 55.73 53.84 3cfb s ARG 44 Cb 0.00 -2.77 -0.09 0.00 0.52 0.00 0.00 34.95 32.61 3cfb s ARG 44 CO 0.00 -0.14 1.25 -1.17 0.02 0.00 0.00 175.30 175.26 3cfb s LEU 45 N -4.30 4.35 -0.03 2.53 2.96 -1.26 -3.91 118.68 119.01 3cfb s LEU 45 Ca 0.51 2.56 0.01 0.00 -0.22 0.00 0.00 54.13 56.99 3cfb s LEU 45 Cb -0.10 -3.77 0.02 0.00 0.50 0.00 0.00 46.19 42.84 3cfb s LEU 45 CO 0.33 -0.58 -0.03 -0.70 -1.32 0.00 0.00 176.35 174.05 3cfb s GLU 46 N -1.94 0.63 0.39 1.98 2.12 0.38 -4.97 118.70 117.29 3cfb s GLU 46 Ca 0.52 -0.06 -0.26 0.00 0.36 0.00 0.00 54.97 55.52 3cfb s GLU 46 Cb -0.37 -0.68 -0.09 0.00 0.26 0.00 0.00 34.13 33.25 3cfb s GLU 46 CO 0.48 -0.07 1.28 -0.46 -0.54 0.00 0.00 175.26 175.95 3cfb s TRP 47 N 0.82 2.90 -0.06 5.30 -0.00 -1.26 -0.62 118.94 126.02 3cfb s TRP 47 Ca -0.10 1.43 -0.01 0.00 -0.00 0.00 0.00 56.10 57.42 3cfb s TRP 47 Cb -0.13 -3.63 -0.03 0.00 -0.00 0.00 0.00 33.47 29.67 3cfb s TRP 47 CO -0.00 -1.94 -0.06 0.28 -0.00 0.00 0.00 176.95 175.23 3cfb n VAL 48 N 0.26 0.32 -3.59 5.86 0.31 -0.08 -4.78 118.33 116.63 3cfb n VAL 48 Ca 0.03 -0.10 -0.10 0.00 -0.01 0.00 0.00 64.34 64.16 3cfb n VAL 48 Cb 0.44 -1.08 -0.05 0.00 -0.91 0.00 0.00 33.84 32.24 3cfb n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3cfb s ALA 49 N -2.11 -1.95 0.05 3.52 0.00 -0.92 -4.24 121.76 116.11 3cfb s ALA 49 Ca -0.08 1.63 0.01 0.00 0.00 0.00 0.00 51.96 53.52 3cfb s ALA 49 Cb 0.02 -0.83 -0.03 0.00 0.00 0.00 0.00 23.12 22.29 3cfb s ALA 49 CO 0.12 -0.30 -0.05 -1.12 0.00 0.00 0.00 175.76 174.41 3cfb s SER 50 N -1.03 0.64 -0.05 0.00 0.01 -0.50 -0.58 113.70 112.19 3cfb s SER 50 Ca -0.00 -0.74 0.01 0.00 1.31 0.00 0.00 55.95 56.52 3cfb s SER 50 Cb -0.01 0.11 0.02 0.00 0.21 0.00 0.00 66.02 66.35 3cfb s SER 50 CO 0.00 -0.38 -0.04 -0.51 0.41 0.00 0.00 173.24 172.72 3cfb s ILE 51 N -2.48 0.56 0.84 1.44 2.07 0.01 -1.07 121.20 122.57 3cfb s ILE 51 Ca -0.03 -0.10 -0.12 0.00 -1.41 0.00 0.00 60.65 58.99 3cfb s ILE 51 Cb -0.03 -0.60 0.09 0.00 0.13 0.00 0.00 42.46 42.05 3cfb s ILE 51 CO -0.04 0.25 1.13 -0.94 -1.91 0.00 0.00 174.94 173.43 3cfb s SER 52 N 1.15 4.18 0.42 4.50 1.04 0.14 -1.32 113.70 123.81 3cfb s SER 52 Ca -0.07 1.05 0.08 0.00 0.48 0.00 0.00 55.95 57.49 3cfb s SER 52 Cb -0.14 -1.68 0.90 0.00 0.10 0.00 0.00 66.02 65.21 3cfb s SER 52 CO -0.01 -2.14 2.05 -1.28 0.98 0.00 0.00 173.24 172.85 3cfb h SER 53 N -1.21 0.43 0.06 7.02 0.87 -1.82 -0.45 113.55 118.46 3cfb h SER 53 Ca -0.48 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.07 3cfb h SER 53 Cb 1.30 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 3cfb h SER 53 CO 0.62 0.31 -0.01 0.61 -0.53 0.00 0.00 176.83 177.83 3cfb n GLY 54 N -1.48 -0.89 0.92 5.77 0.00 -1.26 -4.93 105.19 103.32 3cfb n GLY 54 Ca 0.04 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.83 3cfb n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfb n GLY 55 N 1.06 0.76 3.72 -0.02 0.00 -0.18 -5.06 105.19 105.47 3cfb n GLY 55 Ca 0.22 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3cfb n GLY 55 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cfb s ILE 56 N -2.00 4.10 0.09 -0.61 1.01 -1.26 -4.78 121.20 117.75 3cfb s ILE 56 Ca 0.00 1.58 0.01 0.00 0.00 0.00 0.00 60.65 62.24 3cfb s ILE 56 Cb 0.00 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 38.42 3cfb s ILE 56 CO 0.00 0.16 0.20 0.42 0.00 0.00 0.00 174.94 175.73 3cfb s THR 57 N 0.69 5.21 -0.02 2.92 -4.23 -1.26 -0.69 115.64 118.26 3cfb s THR 57 Ca 0.55 -0.54 0.00 0.00 -1.18 0.00 0.00 61.69 60.52 3cfb s THR 57 Cb -0.28 -3.57 0.03 0.00 1.34 0.00 0.00 72.50 70.01 3cfb s THR 57 CO 0.31 0.07 0.01 -0.31 -0.54 0.00 0.00 174.62 174.17 3cfb s TYR 58 N -1.56 0.15 0.01 3.99 2.02 -0.23 -5.01 117.35 116.73 3cfb s TYR 58 Ca 0.34 0.06 -0.03 0.00 -0.37 0.00 0.00 57.07 57.08 3cfb s TYR 58 Cb -0.12 -0.29 -0.01 0.00 -0.40 0.00 0.00 41.96 41.14 3cfb s TYR 58 CO 0.27 -0.10 0.03 0.71 -1.57 0.00 0.00 175.55 174.90 3cfb s TYR 59 N 0.93 0.16 0.73 2.71 2.02 -1.26 -1.41 117.35 121.23 3cfb s TYR 59 Ca -0.08 -0.34 -0.11 0.00 -0.37 0.00 0.00 57.07 56.17 3cfb s TYR 59 Cb -0.12 -0.12 0.03 0.00 -0.40 0.00 0.00 41.96 41.35 3cfb s TYR 59 CO -0.02 -0.21 1.08 -1.25 -1.57 0.00 0.00 175.55 173.58 3cfb s PRO 60 N -1.29 2.62 0.53 -1.71 0.04 -1.26 -4.84 135.00 129.09 3cfb s PRO 60 Ca -0.14 0.71 0.23 0.00 0.04 0.00 0.00 61.00 61.84 3cfb s PRO 60 Cb -0.08 -1.97 1.45 0.00 0.04 0.00 0.00 34.50 33.93 3cfb s PRO 60 CO -0.00 -1.26 2.13 -0.44 0.04 0.00 0.00 177.00 177.48 3cfb h ASP 61 N -0.83 0.00 -0.01 6.66 3.32 -1.97 -1.87 116.42 121.73 3cfb h ASP 61 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 3cfb h ASP 61 Cb 1.24 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.79 3cfb h ASP 61 CO 0.60 0.07 0.01 0.77 -1.72 0.00 0.00 179.24 178.96 3cfb h SER 62 N 0.00 0.00 0.00 6.45 4.64 -1.97 -3.22 113.55 119.45 3cfb h SER 62 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3cfb h SER 62 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 3cfb h SER 62 CO 0.01 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.30 3cfb n VAL 63 N -4.33 0.00 -1.73 0.95 0.24 -1.00 -5.02 118.33 107.44 3cfb n VAL 63 Ca -0.03 -0.40 -0.42 0.00 -2.04 0.00 0.00 64.34 61.45 3cfb n VAL 63 Cb 0.09 1.03 -0.02 0.00 -1.47 0.00 0.00 33.84 33.47 3cfb n VAL 63 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 3cfb n LYS 64 N -0.67 2.67 0.00 7.34 4.81 -0.74 -1.31 118.16 130.26 3cfb n LYS 64 Ca 0.00 0.95 0.00 0.00 -0.87 0.00 0.00 58.31 58.39 3cfb n LYS 64 Cb 0.01 -2.75 0.00 0.00 0.02 0.00 0.00 35.03 32.30 3cfb n LYS 64 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3cfb n GLY 65 N 2.90 1.77 0.01 3.14 0.00 -1.26 -4.80 105.19 106.94 3cfb n GLY 65 Ca 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.13 3cfb n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cfb n ARG 66 N -2.00 2.14 -4.22 1.61 1.74 -0.43 -5.06 116.66 110.44 3cfb n ARG 66 Ca 0.00 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.77 3cfb n ARG 66 Cb 0.00 -1.03 -0.09 0.00 -1.02 0.00 0.00 32.46 30.33 3cfb n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3cfb s PHE 67 N -2.03 3.02 -0.07 -1.55 0.40 -0.73 -4.54 117.98 112.48 3cfb s PHE 67 Ca -0.01 0.02 -0.00 0.00 -0.60 0.00 0.00 56.93 56.33 3cfb s PHE 67 Cb 0.00 -1.60 0.02 0.00 0.51 0.00 0.00 43.02 41.96 3cfb s PHE 67 CO 0.04 0.46 -0.03 0.99 0.70 0.00 0.00 175.22 177.38 3cfb s THR 68 N -1.19 0.58 0.01 0.64 2.01 0.33 -4.85 115.64 113.17 3cfb s THR 68 Ca 0.22 -0.06 -0.16 0.00 0.31 0.00 0.00 61.69 62.01 3cfb s THR 68 Cb -0.12 -0.66 -0.06 0.00 0.01 0.00 0.00 72.50 71.67 3cfb s THR 68 CO 0.14 0.27 0.44 -0.51 -0.69 0.00 0.00 174.62 174.28 3cfb s ILE 69 N 1.53 4.98 0.19 1.82 2.07 -1.26 -0.57 121.20 129.96 3cfb s ILE 69 Ca -0.01 0.92 -0.14 0.00 -1.41 0.00 0.00 60.65 60.01 3cfb s ILE 69 Cb -0.13 -3.76 0.01 0.00 0.13 0.00 0.00 42.46 38.71 3cfb s ILE 69 CO -0.04 0.56 0.44 -0.94 -1.91 0.00 0.00 174.94 173.05 3cfb s SER 70 N -0.99 -0.14 -0.01 4.50 1.04 -1.01 -5.00 113.70 112.09 3cfb s SER 70 Ca 0.25 -0.68 0.01 0.00 0.48 0.00 0.00 55.95 56.01 3cfb s SER 70 Cb -0.17 0.54 0.01 0.00 0.10 0.00 0.00 66.02 66.49 3cfb s SER 70 CO 0.14 -1.02 -0.02 -0.60 0.98 0.00 0.00 173.24 172.72 3cfb s ARG 71 N -3.93 0.32 -0.50 4.02 3.52 -1.26 -0.94 118.95 120.18 3cfb s ARG 71 Ca 0.14 -0.05 -0.17 0.00 -0.13 0.00 0.00 55.73 55.51 3cfb s ARG 71 Cb 0.00 -0.38 0.07 0.00 -1.56 0.00 0.00 34.95 33.09 3cfb s ARG 71 CO 0.00 -0.01 0.53 0.34 -0.81 0.00 0.00 175.30 175.36 3cfb s ASP 72 N 0.36 6.19 0.18 -2.12 -1.08 0.41 -4.96 116.67 115.66 3cfb s ASP 72 Ca -0.04 -1.16 -0.07 0.00 -0.52 0.00 0.00 52.55 50.76 3cfb s ASP 72 Cb -0.07 -2.24 0.07 0.00 -1.46 0.00 0.00 42.92 39.22 3cfb s ASP 72 CO -0.01 -0.81 1.55 0.78 0.52 0.00 0.00 175.17 177.21 3cfb h ASN 73 N 8.91 0.89 0.11 -0.34 4.21 -1.97 0.55 115.58 127.94 3cfb h ASN 73 Ca -0.28 -0.37 -0.01 0.00 1.21 0.00 0.00 56.30 56.86 3cfb h ASN 73 Cb 1.10 -0.25 0.00 0.00 -1.12 0.00 0.00 38.32 38.05 3cfb h ASN 73 CO 0.95 1.12 -0.05 0.58 -1.29 0.00 0.00 177.43 178.74 3cfb h VAL 74 N 0.72 1.01 0.00 2.81 2.07 -1.97 -3.19 116.25 117.70 3cfb h VAL 74 Ca 0.08 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.17 3cfb h VAL 74 Cb 0.86 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 3cfb h VAL 74 CO 0.08 0.11 -0.12 0.54 0.02 0.00 0.00 177.57 178.19 3cfb n ARG 75 N -5.06 0.26 -2.96 1.57 1.74 -1.21 -4.96 116.66 106.04 3cfb n ARG 75 Ca -0.08 0.19 -0.13 0.00 -0.77 0.00 0.00 57.85 57.06 3cfb n ARG 75 Cb 0.16 -1.78 0.06 0.00 -1.02 0.00 0.00 32.46 29.88 3cfb n ARG 75 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3cfb n ASN 76 N -2.22 -5.65 -4.03 0.55 5.15 0.14 -5.02 115.26 104.17 3cfb n ASN 76 Ca 0.05 -0.58 -0.22 0.00 -0.60 0.00 0.00 54.58 53.22 3cfb n ASN 76 Cb 0.43 -4.41 -0.16 0.00 -0.53 0.00 0.00 39.78 35.11 3cfb n ASN 76 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3cfb s ILE 77 N -3.32 0.99 -0.07 -1.44 1.01 -0.91 -4.31 121.20 113.15 3cfb s ILE 77 Ca 0.36 -0.45 -0.02 0.00 0.00 0.00 0.00 60.65 60.54 3cfb s ILE 77 Cb -0.05 -0.88 -0.03 0.00 0.01 0.00 0.00 42.46 41.51 3cfb s ILE 77 CO 0.61 0.31 0.02 -0.22 0.00 0.00 0.00 174.94 175.66 3cfb s LEU 78 N 0.28 3.67 0.13 2.97 2.96 -0.59 -0.44 118.68 127.66 3cfb s LEU 78 Ca -0.06 0.15 0.07 0.00 -0.22 0.00 0.00 54.13 54.08 3cfb s LEU 78 Cb -0.11 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.64 3cfb s LEU 78 CO 0.01 0.36 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.93 3cfb s TYR 79 N -0.95 1.59 -0.25 5.38 2.02 -0.12 -0.71 117.35 124.32 3cfb s TYR 79 Ca 0.15 -0.50 -0.02 0.00 -0.37 0.00 0.00 57.07 56.34 3cfb s TYR 79 Cb -0.11 -0.83 0.08 0.00 -0.40 0.00 0.00 41.96 40.70 3cfb s TYR 79 CO 0.04 0.21 0.05 -1.17 -1.57 0.00 0.00 175.55 173.11 3cfb s LEU 80 N -2.39 1.80 -0.23 -1.29 2.96 -0.42 -2.40 118.68 116.72 3cfb s LEU 80 Ca 0.10 -1.21 -0.21 0.00 -0.22 0.00 0.00 54.13 52.58 3cfb s LEU 80 Cb -0.06 -0.78 -0.02 0.00 0.50 0.00 0.00 46.19 45.82 3cfb s LEU 80 CO 0.04 -0.34 0.67 -1.58 -1.32 0.00 0.00 176.35 173.82 3cfb s GLN 81 N 1.70 4.17 0.35 1.98 2.00 0.27 -0.79 119.66 129.34 3cfb s GLN 81 Ca 0.03 0.66 0.08 0.00 -2.00 0.00 0.00 55.36 54.13 3cfb s GLN 81 Cb -0.17 -3.62 -0.04 0.00 0.80 0.00 0.00 33.01 29.98 3cfb s GLN 81 CO -0.15 -0.36 0.20 -1.64 -0.50 0.00 0.00 175.29 172.84 3cfb s MET 82 N 2.30 2.45 -0.26 1.67 -1.94 0.62 -0.52 119.30 123.63 3cfb s MET 82 Ca 0.29 -1.51 -0.00 0.00 -1.71 0.00 0.00 55.69 52.75 3cfb s MET 82 Cb -0.16 -2.24 0.00 0.00 2.01 0.00 0.00 34.83 34.45 3cfb s MET 82 CO 0.09 0.07 0.01 0.43 -0.01 0.00 0.00 175.02 175.61 3cfb n SER 82 N -1.24 0.10 -4.77 3.03 7.64 -1.00 -1.58 113.62 115.81 3cfb n SER 82 Ca -0.02 -0.20 -0.39 0.00 1.01 0.00 0.00 58.87 59.26 3cfb n SER 82 Cb 0.61 -0.26 -0.00 0.00 -1.01 0.00 0.00 64.21 63.55 3cfb n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3cfb s LEU 82 N -3.50 4.19 0.32 -3.43 1.43 -0.68 -4.67 118.68 112.33 3cfb s LEU 82 Ca 0.02 2.61 0.09 0.00 -1.03 0.00 0.00 54.13 55.82 3cfb s LEU 82 Cb -0.01 -3.95 -0.06 0.00 0.03 0.00 0.00 46.19 42.20 3cfb s LEU 82 CO 0.16 -0.86 -0.11 -0.13 0.23 0.00 0.00 176.35 175.64 3cfb s ARG 83 N -2.29 1.73 0.47 1.70 0.52 -1.26 -0.19 118.95 119.64 3cfb s ARG 83 Ca 0.58 -1.87 0.14 0.00 -0.52 0.00 0.00 55.73 54.05 3cfb s ARG 83 Cb -0.37 -1.60 1.12 0.00 0.52 0.00 0.00 34.95 34.62 3cfb s ARG 83 CO 0.47 0.15 2.08 1.03 0.02 0.00 0.00 175.30 179.06 3cfb h SER 84 N 2.12 0.20 0.55 0.23 0.87 -1.97 -0.16 113.55 115.40 3cfb h SER 84 Ca -0.41 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 3cfb h SER 84 Cb 1.25 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 3cfb h SER 84 CO 0.68 0.14 0.00 -1.84 -0.53 0.00 0.00 176.83 175.28 3cfb n GLU 85 N -4.49 0.14 0.00 2.24 0.28 -1.26 -2.22 120.64 115.32 3cfb n GLU 85 Ca 0.02 0.13 0.14 0.00 -0.16 0.00 0.00 57.16 57.28 3cfb n GLU 85 Cb 0.17 -1.50 0.62 0.00 1.43 0.00 0.00 31.44 32.15 3cfb n GLU 85 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 3cfb n ASP 86 N -1.40 0.37 -4.69 -1.84 8.00 -0.07 -4.87 116.55 112.04 3cfb n ASP 86 Ca 0.07 -0.43 -0.42 0.00 0.71 0.00 0.00 54.79 54.72 3cfb n ASP 86 Cb 0.20 -0.11 -0.03 0.00 -0.02 0.00 0.00 41.12 41.16 3cfb n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3cfb s THR 87 N -2.54 3.13 -0.11 -3.53 2.01 -0.94 -4.88 115.64 108.78 3cfb s THR 87 Ca 0.27 0.57 -0.33 0.00 0.31 0.00 0.00 61.69 62.51 3cfb s THR 87 Cb 0.20 -3.37 0.14 0.00 0.01 0.00 0.00 72.50 69.48 3cfb s THR 87 CO 0.49 -0.00 1.35 0.00 -0.69 0.00 0.00 174.62 175.77 3cfb s ALA 88 N 2.60 -2.32 -0.23 7.40 0.00 -0.58 -4.47 121.76 124.16 3cfb s ALA 88 Ca 0.72 1.08 -0.19 0.00 0.00 0.00 0.00 51.96 53.58 3cfb s ALA 88 Cb -0.39 0.14 -0.03 0.00 0.00 0.00 0.00 23.12 22.85 3cfb s ALA 88 CO 0.31 -0.93 0.56 -1.17 0.00 0.00 0.00 175.76 174.53 3cfb s LEU 89 N -2.75 4.09 -0.21 0.00 2.96 -0.20 -1.30 118.68 121.28 3cfb s LEU 89 Ca 0.14 0.65 -0.10 0.00 -0.22 0.00 0.00 54.13 54.60 3cfb s LEU 89 Cb 0.04 -2.75 -0.05 0.00 0.50 0.00 0.00 46.19 43.94 3cfb s LEU 89 CO -0.05 -0.27 0.12 -0.31 -1.32 0.00 0.00 176.35 174.52 3cfb s TYR 90 N 2.10 3.36 0.08 5.38 1.51 -0.16 -0.46 117.35 129.16 3cfb s TYR 90 Ca 0.24 0.25 0.09 0.00 -1.01 0.00 0.00 57.07 56.64 3cfb s TYR 90 Cb -0.16 -2.17 -0.04 0.00 -0.11 0.00 0.00 41.96 39.49 3cfb s TYR 90 CO 0.09 0.21 -0.21 0.71 -1.11 0.00 0.00 175.55 175.24 3cfb s TYR 91 N 0.53 2.47 -0.14 2.71 1.51 0.81 -0.87 117.35 124.37 3cfb s TYR 91 Ca 0.07 -0.31 -0.07 0.00 -1.01 0.00 0.00 57.07 55.76 3cfb s TYR 91 Cb -0.12 -1.37 -0.04 0.00 -0.11 0.00 0.00 41.96 40.32 3cfb s TYR 91 CO -0.00 0.29 0.11 0.00 -1.11 0.00 0.00 175.55 174.84 3cfb s ALA 93 N -0.55 0.04 -0.89 0.00 0.00 -0.05 -2.69 121.76 117.63 3cfb s ALA 93 Ca 0.12 0.26 -0.17 0.00 0.00 0.00 0.00 51.96 52.17 3cfb s ALA 93 Cb -0.12 -0.20 0.17 0.00 0.00 0.00 0.00 23.12 22.96 3cfb s ALA 93 CO 0.02 -0.09 0.98 0.50 0.00 0.00 0.00 175.76 177.17 3cfb s ARG 94 N 0.83 3.60 0.33 0.00 3.00 -0.21 -1.24 118.95 125.26 3cfb s ARG 94 Ca -0.07 -2.05 0.26 0.00 -1.00 0.00 0.00 55.73 52.87 3cfb s ARG 94 Cb -0.10 -4.72 0.76 0.00 0.00 0.00 0.00 34.95 30.90 3cfb s ARG 94 CO -0.02 -1.58 1.74 0.78 0.00 0.00 0.00 175.30 176.22 3cfb h GLY 95 N 9.33 0.00 -3.34 8.12 0.00 -1.79 -1.47 103.07 113.93 3cfb h GLY 95 Ca 0.14 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.98 3cfb h GLY 95 CO 0.96 0.00 0.42 1.20 0.00 0.00 0.00 176.54 179.12 3cfb s GLN 96 N -3.23 4.51 6.49 4.80 -0.21 -1.26 -4.25 119.66 126.50 3cfb s GLN 96 Ca 0.07 1.59 0.00 0.00 0.02 0.00 0.00 55.36 57.05 3cfb s GLN 96 Cb 0.09 -2.93 0.00 0.00 1.00 0.00 0.00 33.01 31.17 3cfb s GLN 96 CO 0.58 0.15 0.00 0.41 -2.12 0.00 0.00 175.29 174.31 3cfb n GLY 97 N 0.87 1.89 3.46 3.09 0.00 -1.26 -4.00 105.19 109.24 3cfb n GLY 97 Ca 0.01 -0.13 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 3cfb n GLY 97 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3cfb s ARG 98 N 0.00 3.17 0.41 1.61 3.00 -1.26 -5.03 118.95 120.84 3cfb s ARG 98 Ca 0.00 -0.76 -0.26 0.00 -1.00 0.00 0.00 55.73 53.71 3cfb s ARG 98 Cb 0.00 -4.14 -0.08 0.00 0.00 0.00 0.00 34.95 30.72 3cfb s ARG 98 CO 0.00 -1.49 1.27 -2.14 0.00 0.00 0.00 175.30 172.94 3cfb s PRO 101 N 3.37 3.95 0.03 5.12 0.02 -1.26 -4.90 135.00 141.33 3cfb s PRO 101 Ca 0.21 2.09 0.08 0.00 0.02 0.00 0.00 61.00 63.40 3cfb s PRO 101 Cb -0.17 -2.72 -0.03 0.00 0.02 0.00 0.00 34.50 31.60 3cfb s PRO 101 CO 0.13 -0.48 -0.24 0.71 -0.33 0.00 0.00 177.00 176.78 3cfb s TYR 102 N -1.30 2.14 0.07 6.54 2.02 -0.55 -5.01 117.35 121.27 3cfb s TYR 102 Ca 0.57 -0.40 -0.07 0.00 -0.37 0.00 0.00 57.07 56.81 3cfb s TYR 102 Cb -0.36 -1.30 -0.01 0.00 -0.40 0.00 0.00 41.96 39.89 3cfb s TYR 102 CO 0.47 0.09 0.13 1.67 -1.57 0.00 0.00 175.55 176.34 3cfb s TRP 103 N -0.76 0.23 0.26 2.71 -2.14 -1.26 -1.04 118.94 116.94 3cfb s TRP 103 Ca 0.10 -0.66 -0.03 0.00 2.66 0.00 0.00 56.10 58.17 3cfb s TRP 103 Cb -0.09 -0.14 0.06 0.00 -3.10 0.00 0.00 33.47 30.19 3cfb s TRP 103 CO 0.01 -0.49 0.35 0.41 -2.66 0.00 0.00 176.95 174.58 3cfb n GLY 104 N 0.10 -0.24 0.09 3.67 0.00 -1.10 -4.53 105.19 103.18 3cfb n GLY 104 Ca -0.15 -1.83 0.13 0.00 0.00 0.00 0.00 46.02 44.16 3cfb n GLY 104 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3cfb n GLN 105 N -1.71 0.20 0.00 1.61 1.13 -1.26 -4.92 117.38 112.43 3cfb n GLN 105 Ca 0.05 0.25 0.00 0.00 -1.94 0.00 0.00 57.00 55.36 3cfb n GLN 105 Cb 0.18 -1.77 0.00 0.00 0.11 0.00 0.00 30.24 28.76 3cfb n GLN 105 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3cfb n GLY 106 N 0.92 0.71 2.91 1.08 0.00 -1.26 -5.04 105.19 104.51 3cfb n GLY 106 Ca 0.05 -1.74 -0.20 0.00 0.00 0.00 0.00 46.02 44.13 3cfb n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3cfb s THR 107 N -2.96 0.56 0.04 2.61 -1.32 -0.05 -4.81 115.64 109.71 3cfb s THR 107 Ca 0.00 -0.16 -0.22 0.00 -1.21 0.00 0.00 61.69 60.10 3cfb s THR 107 Cb 0.00 -0.56 -0.06 0.00 -1.51 0.00 0.00 72.50 70.37 3cfb s THR 107 CO 0.00 0.22 0.65 -0.22 -2.21 0.00 0.00 174.62 173.06 3cfb s LEU 108 N 0.73 4.46 -0.16 9.08 2.96 -1.26 -0.99 118.68 133.50 3cfb s LEU 108 Ca -0.10 1.29 0.01 0.00 -0.22 0.00 0.00 54.13 55.10 3cfb s LEU 108 Cb -0.13 -3.02 0.02 0.00 0.50 0.00 0.00 46.19 43.56 3cfb s LEU 108 CO 0.00 0.12 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.31 3cfb s VAL 109 N -0.40 1.71 -0.25 1.68 1.01 -0.42 -1.14 120.40 122.59 3cfb s VAL 109 Ca 0.33 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.60 3cfb s VAL 109 Cb -0.19 -1.58 0.04 0.00 0.00 0.00 0.00 36.38 34.65 3cfb s VAL 109 CO 0.20 0.48 -0.10 -0.89 0.00 0.00 0.00 175.10 174.79 3cfb s THR 110 N 1.43 2.41 -0.36 3.92 2.01 -0.55 -1.52 115.64 122.97 3cfb s THR 110 Ca 0.05 -1.34 -0.15 0.00 0.31 0.00 0.00 61.69 60.56 3cfb s THR 110 Cb -0.13 -2.29 -0.01 0.00 0.01 0.00 0.00 72.50 70.08 3cfb s THR 110 CO -0.11 0.12 0.34 -0.69 -0.69 0.00 0.00 174.62 173.59 3cfb s VAL 111 N 1.21 5.19 -0.05 3.82 1.01 -1.26 -1.35 120.40 128.97 3cfb s VAL 111 Ca -0.04 -0.12 -0.30 0.00 0.00 0.00 0.00 61.98 61.52 3cfb s VAL 111 Cb -0.18 -3.84 0.08 0.00 0.00 0.00 0.00 36.38 32.45 3cfb s VAL 111 CO -0.06 -0.14 0.75 -0.55 0.00 0.00 0.00 175.10 175.10 3cfb s SER 112 N 1.74 -0.58 -0.13 3.32 0.15 -0.36 -4.55 113.70 113.30 3cfb s SER 112 Ca 0.10 0.56 0.15 0.00 0.70 0.00 0.00 55.95 57.46 3cfb s SER 112 Cb -0.17 0.49 0.47 0.00 -1.71 0.00 0.00 66.02 65.10 3cfb s SER 112 CO 0.12 -0.58 1.38 -0.24 1.20 0.00 0.00 173.24 175.12 3cfb n SER 113 N 0.71 3.66 -4.80 5.45 2.88 -1.26 -3.91 113.62 116.35 3cfb n SER 113 Ca -0.16 -2.72 -0.34 0.00 -1.33 0.00 0.00 58.87 54.32 3cfb n SER 113 Cb 0.58 -0.46 -0.04 0.00 -0.75 0.00 0.00 64.21 63.55 3cfb n SER 113 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3cfb s ALA 114 N -2.29 2.88 0.09 -1.46 0.00 -1.26 -5.01 121.76 114.72 3cfb s ALA 114 Ca 0.37 0.57 -0.24 0.00 0.00 0.00 0.00 51.96 52.66 3cfb s ALA 114 Cb 0.28 -3.24 -0.07 0.00 0.00 0.00 0.00 23.12 20.09 3cfb s ALA 114 CO 0.11 -0.29 0.74 0.15 0.00 0.00 0.00 175.76 176.46 3cfb s LYS 115 N -3.28 4.48 0.21 0.00 1.02 -1.26 -5.00 119.74 115.91 3cfb s LYS 115 Ca 0.66 1.04 -0.32 0.00 0.02 0.00 0.00 55.97 57.38 3cfb s LYS 115 Cb -0.15 -3.31 -0.11 0.00 -0.52 0.00 0.00 37.83 33.73 3cfb s LYS 115 CO 0.20 0.45 1.67 0.99 -0.92 0.00 0.00 175.35 177.74 3cfb s THR 116 N -0.63 2.15 -0.06 2.17 2.01 -1.26 -4.77 115.64 115.25 3cfb s THR 116 Ca 0.36 0.11 0.00 0.00 0.31 0.00 0.00 61.69 62.47 3cfb s THR 116 Cb -0.21 -3.07 0.02 0.00 0.01 0.00 0.00 72.50 69.25 3cfb s THR 116 CO 0.23 0.01 -0.04 -0.89 -0.69 0.00 0.00 174.62 173.25 3cfb s THR 117 N 0.98 0.57 0.62 -0.82 2.01 0.26 -4.95 115.64 114.31 3cfb s THR 117 Ca 0.72 -0.09 -0.14 0.00 0.31 0.00 0.00 61.69 62.49 3cfb s THR 117 Cb -0.48 -0.63 -0.02 0.00 0.01 0.00 0.00 72.50 71.37 3cfb s THR 117 CO 0.34 0.26 1.05 -2.16 -0.69 0.00 0.00 174.62 173.42 3cfb s PRO 118 N 1.29 3.25 0.35 4.92 0.04 -1.26 -1.54 135.00 142.05 3cfb s PRO 118 Ca -0.05 1.09 -0.25 0.00 0.04 0.00 0.00 61.00 61.82 3cfb s PRO 118 Cb -0.14 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.28 3cfb s PRO 118 CO -0.02 -0.86 1.01 -1.25 0.04 0.00 0.00 177.00 175.92 3cfb s PRO 119 N -4.43 4.40 -0.03 0.56 0.04 -1.26 -4.38 135.00 129.90 3cfb s PRO 119 Ca 0.61 1.46 -0.26 0.00 0.04 0.00 0.00 61.00 62.85 3cfb s PRO 119 Cb -0.15 -2.72 -0.04 0.00 0.04 0.00 0.00 34.50 31.64 3cfb s PRO 119 CO 0.43 0.08 0.80 -1.12 0.04 0.00 0.00 177.00 177.23 3cfb s SER 120 N -1.52 7.14 -0.22 6.66 0.01 -0.03 -4.90 113.70 120.84 3cfb s SER 120 Ca 0.53 1.38 -0.04 0.00 1.31 0.00 0.00 55.95 59.13 3cfb s SER 120 Cb -0.21 -2.47 -0.01 0.00 0.21 0.00 0.00 66.02 63.54 3cfb s SER 120 CO 0.27 -0.14 -0.04 -0.69 0.41 0.00 0.00 173.24 173.04 3cfb s VAL 121 N 0.75 3.38 -0.11 3.43 1.01 -1.26 -0.92 120.40 126.69 3cfb s VAL 121 Ca 0.42 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 61.94 3cfb s VAL 121 Cb -0.19 -2.54 -0.01 0.00 0.00 0.00 0.00 36.38 33.64 3cfb s VAL 121 CO 0.22 0.42 -0.20 -0.31 0.00 0.00 0.00 175.10 175.24 3cfb s TYR 122 N 1.48 2.65 0.29 5.22 2.02 0.67 -4.96 117.35 124.72 3cfb s TYR 122 Ca 0.06 -0.84 -0.29 0.00 -0.37 0.00 0.00 57.07 55.63 3cfb s TYR 122 Cb -0.14 -1.75 -0.09 0.00 -0.40 0.00 0.00 41.96 39.58 3cfb s TYR 122 CO -0.03 -0.31 1.05 -1.25 -1.57 0.00 0.00 175.55 173.44 3cfb s PRO 123 N 0.27 4.62 -0.51 -1.71 0.04 -1.26 -0.74 135.00 135.71 3cfb s PRO 123 Ca -0.14 1.68 -0.01 0.00 0.04 0.00 0.00 61.00 62.57 3cfb s PRO 123 Cb -0.17 -3.11 0.13 0.00 0.04 0.00 0.00 34.50 31.40 3cfb s PRO 123 CO 0.07 0.24 0.29 -0.51 0.04 0.00 0.00 177.00 177.13 3cfb s LEU 124 N -1.57 5.03 0.11 -3.56 1.43 0.11 -4.90 118.68 115.34 3cfb s LEU 124 Ca 0.46 -2.54 0.10 0.00 -1.03 0.00 0.00 54.13 51.12 3cfb s LEU 124 Cb -0.29 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.11 3cfb s LEU 124 CO 0.37 -0.40 -0.26 0.00 0.23 0.00 0.00 176.35 176.28 3cfb s ALA 125 N 0.39 2.29 0.51 4.21 0.00 -1.26 -0.91 121.76 126.98 3cfb s ALA 125 Ca 0.14 -1.41 -0.23 0.00 0.00 0.00 0.00 51.96 50.46 3cfb s ALA 125 Cb -0.22 -0.38 -0.06 0.00 0.00 0.00 0.00 23.12 22.46 3cfb s ALA 125 CO -0.04 0.52 1.32 -1.25 0.00 0.00 0.00 175.76 176.32 3cfb s PRO 126 N -1.89 3.40 -0.27 0.00 0.04 -1.26 -4.99 135.00 130.02 3cfb s PRO 126 Ca 0.13 2.16 -0.03 0.00 0.04 0.00 0.00 61.00 63.29 3cfb s PRO 126 Cb -0.10 -2.38 0.09 0.00 0.04 0.00 0.00 34.50 32.16 3cfb s PRO 126 CO 0.05 -0.96 0.11 0.20 0.04 0.00 0.00 177.00 176.44 3cfb s GLY 127 N -0.96 0.60 -1.22 0.56 0.00 -1.26 -4.82 107.32 100.22 3cfb s GLY 127 Ca 0.67 -1.08 0.00 0.00 0.00 0.00 0.00 44.72 44.31 3cfb s GLY 127 CO 0.46 1.90 0.00 0.00 0.00 0.00 0.00 173.10 175.47 3cfb s GLY 129 N -2.15 1.55 0.00 0.00 0.00 -1.26 -4.84 107.32 100.62 3cfb s GLY 129 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 44.72 44.29 3cfb s GLY 129 CO 0.00 0.26 0.41 1.22 0.00 0.00 0.00 173.10 175.00 3cfb n ASP 130 N -4.47 0.29 0.00 1.64 8.00 -1.26 -4.77 116.55 115.98 3cfb n ASP 130 Ca 0.06 -1.12 0.00 0.00 0.71 0.00 0.00 54.79 54.44 3cfb n ASP 130 Cb 0.57 -0.14 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 3cfb n ASP 130 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3cfb n THR 133 N -0.13 0.00 -0.03 -3.53 -1.04 -1.26 -5.03 114.28 103.26 3cfb n THR 133 Ca 0.00 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.87 3cfb n THR 133 Cb 0.07 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 68.47 3cfb n THR 133 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 3cfb h THR 134 N 3.98 1.54 0.00 12.58 1.35 -1.95 -3.51 112.91 126.89 3cfb h THR 134 Ca 0.00 -1.77 0.00 0.00 -0.55 0.00 0.00 66.41 64.09 3cfb h THR 134 Cb 0.00 2.66 0.00 0.00 -1.73 0.00 0.00 68.15 69.08 3cfb h THR 134 CO 0.00 0.48 0.00 0.61 -0.25 0.00 0.00 175.52 176.36 3cfb n GLY 135 N 0.88 -0.25 0.10 5.82 0.00 -1.26 -4.33 105.19 106.15 3cfb n GLY 135 Ca -0.09 -1.72 0.11 0.00 0.00 0.00 0.00 46.02 44.32 3cfb n GLY 135 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3cfb n SER 136 N -1.13 0.55 -4.02 1.61 3.41 -1.26 -4.34 113.62 108.44 3cfb n SER 136 Ca 0.00 0.62 -0.29 0.00 -0.26 0.00 0.00 58.87 58.94 3cfb n SER 136 Cb 0.00 -0.74 -0.17 0.00 -0.26 0.00 0.00 64.21 63.04 3cfb n SER 136 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3cfb s SER 137 N -4.03 2.52 -0.07 4.04 0.15 -1.26 -1.49 113.70 113.56 3cfb s SER 137 Ca 0.06 -0.44 0.03 0.00 0.70 0.00 0.00 55.95 56.30 3cfb s SER 137 Cb 0.10 -1.10 -0.02 0.00 -1.71 0.00 0.00 66.02 63.29 3cfb s SER 137 CO 0.40 -0.03 -0.17 0.54 1.20 0.00 0.00 173.24 175.18 3cfb s VAL 138 N 1.28 2.76 -0.20 4.45 0.11 0.64 -4.88 120.40 124.56 3cfb s VAL 138 Ca -0.00 -0.81 -0.06 0.00 -2.93 0.00 0.00 61.98 58.18 3cfb s VAL 138 Cb -0.14 -2.08 -0.03 0.00 -1.53 0.00 0.00 36.38 32.60 3cfb s VAL 138 CO -0.06 0.57 0.02 -0.89 -3.33 0.00 0.00 175.10 171.40 3cfb s THR 139 N -0.29 4.12 0.39 5.04 2.01 -1.26 -0.76 115.64 124.88 3cfb s THR 139 Ca 0.02 -0.26 0.07 0.00 0.31 0.00 0.00 61.69 61.83 3cfb s THR 139 Cb -0.13 -2.87 -0.07 0.00 0.01 0.00 0.00 72.50 69.44 3cfb s THR 139 CO 0.03 0.42 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.60 3cfb s LEU 140 N 0.97 2.79 0.31 4.42 1.43 0.12 -4.67 118.68 124.06 3cfb s LEU 140 Ca 0.02 -1.32 -0.19 0.00 -1.03 0.00 0.00 54.13 51.61 3cfb s LEU 140 Cb -0.14 -0.89 0.03 0.00 0.03 0.00 0.00 46.19 45.22 3cfb s LEU 140 CO 0.02 -0.40 0.72 -0.83 0.23 0.00 0.00 176.35 176.10 3cfb s GLY 141 N -3.66 0.10 -0.06 -3.19 0.00 -0.09 -0.89 107.32 99.53 3cfb s GLY 141 Ca 0.34 -0.49 0.02 0.00 0.00 0.00 0.00 44.72 44.59 3cfb s GLY 141 CO 0.17 -0.20 -0.10 0.00 0.00 0.00 0.00 173.10 172.98 3cfb s LEU 143 N 0.81 4.15 -0.29 0.00 2.96 0.08 -1.10 118.68 125.29 3cfb s LEU 143 Ca -0.12 0.25 0.01 0.00 -0.22 0.00 0.00 54.13 54.05 3cfb s LEU 143 Cb -0.15 -2.23 0.06 0.00 0.50 0.00 0.00 46.19 44.37 3cfb s LEU 143 CO 0.02 0.05 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.36 3cfb s VAL 144 N 1.00 2.53 0.07 1.68 1.01 0.41 -0.24 120.40 126.86 3cfb s VAL 144 Ca 0.11 -1.60 0.06 0.00 0.00 0.00 0.00 61.98 60.55 3cfb s VAL 144 Cb -0.13 -2.51 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 3cfb s VAL 144 CO 0.05 -0.12 -0.16 -0.75 0.00 0.00 0.00 175.10 174.12 3cfb s LYS 145 N 1.15 0.93 -0.34 2.72 2.20 -0.09 -0.88 119.74 125.43 3cfb s LYS 145 Ca -0.06 -0.93 -0.00 0.00 -0.36 0.00 0.00 55.97 54.62 3cfb s LYS 145 Cb -0.20 -0.99 0.00 0.00 -1.51 0.00 0.00 37.83 35.14 3cfb s LYS 145 CO -0.04 0.23 0.03 0.41 -0.36 0.00 0.00 175.35 175.63 3cfb n GLY 146 N 1.44 0.27 3.70 5.54 0.00 -0.41 -0.85 105.19 114.87 3cfb n GLY 146 Ca -0.20 -0.68 -0.26 0.00 0.00 0.00 0.00 46.02 44.88 3cfb n GLY 146 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3cfb s TYR 147 N -2.33 2.91 -0.24 1.61 1.13 -0.98 -4.60 117.35 114.86 3cfb s TYR 147 Ca 0.02 -0.11 -0.21 0.00 -1.41 0.00 0.00 57.07 55.36 3cfb s TYR 147 Cb -0.01 -1.40 0.06 0.00 -1.10 0.00 0.00 41.96 39.51 3cfb s TYR 147 CO 0.02 0.52 0.63 0.12 -2.51 0.00 0.00 175.55 174.33 3cfb s PHE 148 N -1.76 -0.73 0.14 -3.49 5.36 -0.59 0.78 117.98 117.69 3cfb s PHE 148 Ca 0.28 1.72 -0.02 0.00 -0.96 0.00 0.00 56.93 57.95 3cfb s PHE 148 Cb -0.09 0.28 0.03 0.00 -0.34 0.00 0.00 43.02 42.90 3cfb s PHE 148 CO 0.20 -0.35 0.19 -0.35 -1.46 0.00 0.00 175.22 173.44 3cfb n PRO 149 N 2.98 -0.14 -2.76 10.12 -0.04 -1.26 -0.57 135.00 143.33 3cfb n PRO 149 Ca -0.15 -0.31 -0.35 0.00 -0.04 0.00 0.00 63.50 62.66 3cfb n PRO 149 Cb 0.56 -0.19 -0.06 0.00 -0.04 0.00 0.00 33.50 33.77 3cfb n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3cfb s GLU 150 N -3.38 4.30 0.44 0.54 2.02 -1.26 -4.76 118.70 116.60 3cfb s GLU 150 Ca 0.11 1.24 0.06 0.00 0.02 0.00 0.00 54.97 56.40 3cfb s GLU 150 Cb -0.00 -2.40 -0.04 0.00 0.10 0.00 0.00 34.13 31.78 3cfb s GLU 150 CO 0.08 0.02 0.15 -1.54 0.02 0.00 0.00 175.26 173.99 3cfb s SER 151 N -1.93 4.30 0.23 -0.19 1.04 -1.26 -5.02 113.70 110.87 3cfb s SER 151 Ca 0.58 -1.23 0.10 0.00 0.48 0.00 0.00 55.95 55.89 3cfb s SER 151 Cb -0.14 -0.25 -0.05 0.00 0.10 0.00 0.00 66.02 65.68 3cfb s SER 151 CO 0.18 -0.62 -0.18 0.68 0.98 0.00 0.00 173.24 174.28 3cfb s VAL 152 N -2.67 2.14 -0.06 5.02 -7.23 -1.26 -4.40 120.40 111.94 3cfb s VAL 152 Ca 0.35 -2.26 0.04 0.00 -1.81 0.00 0.00 61.98 58.31 3cfb s VAL 152 Cb 0.04 -2.15 -0.00 0.00 0.56 0.00 0.00 36.38 34.83 3cfb s VAL 152 CO 0.19 -0.44 -0.20 -0.89 -0.31 0.00 0.00 175.10 173.46 3cfb s THR 153 N -2.55 1.68 -0.19 5.32 2.01 -0.21 -4.97 115.64 116.74 3cfb s THR 153 Ca 0.25 -0.84 -0.02 0.00 0.31 0.00 0.00 61.69 61.39 3cfb s THR 153 Cb -0.04 -1.45 -0.01 0.00 0.01 0.00 0.00 72.50 71.02 3cfb s THR 153 CO 0.11 0.48 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.73 3cfb s VAL 154 N 0.13 3.06 -0.12 3.82 1.01 -1.26 -0.34 120.40 126.70 3cfb s VAL 154 Ca -0.08 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.31 3cfb s VAL 154 Cb -0.14 -2.35 0.00 0.00 0.00 0.00 0.00 36.38 33.89 3cfb s VAL 154 CO 0.04 0.47 -0.22 -0.89 0.00 0.00 0.00 175.10 174.51 3cfb s THR 156 N 1.11 2.21 -0.20 3.92 2.01 -0.15 -4.96 115.64 119.58 3cfb s THR 156 Ca 0.01 -0.96 -0.10 0.00 0.31 0.00 0.00 61.69 60.95 3cfb s THR 156 Cb -0.14 -1.87 -0.05 0.00 0.01 0.00 0.00 72.50 70.45 3cfb s THR 156 CO -0.02 0.55 0.13 0.26 -0.69 0.00 0.00 174.62 174.84 3cfb s TRP 157 N 0.48 3.38 -1.12 4.92 0.52 -1.26 -0.05 118.94 125.80 3cfb s TRP 157 Ca -0.14 0.28 -0.05 0.00 0.02 0.00 0.00 56.10 56.20 3cfb s TRP 157 Cb -0.17 -2.17 0.01 0.00 -1.15 0.00 0.00 33.47 29.99 3cfb s TRP 157 CO 0.06 0.24 0.10 0.09 0.02 0.00 0.00 176.95 177.46 3cfb n ASN 162 N 3.64 -0.04 -1.98 2.95 4.13 -0.40 -0.59 115.26 122.97 3cfb n ASN 162 Ca -0.16 -0.98 -0.18 0.00 1.68 0.00 0.00 54.58 54.94 3cfb n ASN 162 Cb 0.52 -1.20 -0.02 0.00 -1.54 0.00 0.00 39.78 37.54 3cfb n ASN 162 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 3cfb n SER 163 N -1.97 -5.30 0.00 6.41 7.64 -1.26 -2.13 113.62 117.01 3cfb n SER 163 Ca -0.22 0.06 0.00 0.00 1.01 0.00 0.00 58.87 59.72 3cfb n SER 163 Cb 0.51 -4.38 0.00 0.00 -1.01 0.00 0.00 64.21 59.33 3cfb n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3cfb n GLY 164 N -0.97 0.69 0.12 0.23 0.00 0.24 -4.92 105.19 100.57 3cfb n GLY 164 Ca -0.21 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.80 3cfb n GLY 164 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3cfb h SER 165 N 0.00 0.00 -0.48 1.61 4.64 -1.40 -3.25 113.55 114.67 3cfb h SER 165 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3cfb h SER 165 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3cfb h SER 165 CO 0.00 0.69 0.00 0.18 -0.87 0.00 0.00 176.83 176.83 3cfb n LEU 166 N -3.39 4.10 -0.32 5.97 4.77 -1.23 -4.64 117.00 122.26 3cfb n LEU 166 Ca 0.01 -2.07 0.13 0.00 -0.03 0.00 0.00 56.01 54.04 3cfb n LEU 166 Cb 0.76 -0.56 0.26 0.00 -2.33 0.00 0.00 43.42 41.56 3cfb n LEU 166 CO 0.43 0.61 0.72 -1.20 -1.33 0.00 0.00 177.39 176.61 3cfb n SER 167 N 0.70 -0.12 -4.74 -1.43 7.64 -1.23 -3.93 113.62 110.52 3cfb n SER 167 Ca 0.20 1.55 -0.41 0.00 1.01 0.00 0.00 58.87 61.22 3cfb n SER 167 Cb 0.81 -0.56 -0.03 0.00 -1.01 0.00 0.00 64.21 63.43 3cfb n SER 167 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3cfb s SER 168 N -5.02 6.70 -1.34 6.43 0.01 -1.26 -1.66 113.70 117.56 3cfb s SER 168 Ca -0.12 2.59 -0.00 0.00 1.31 0.00 0.00 55.95 59.73 3cfb s SER 168 Cb 0.27 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.88 3cfb s SER 168 CO 0.71 -0.68 0.04 -0.24 0.41 0.00 0.00 173.24 173.48 3cfb n SER 169 N 2.64 -4.69 -4.82 2.44 2.88 -1.26 -4.80 113.62 106.00 3cfb n SER 169 Ca 0.08 0.08 -0.38 0.00 -1.33 0.00 0.00 58.87 57.32 3cfb n SER 169 Cb 0.41 -3.94 -0.06 0.00 -0.75 0.00 0.00 64.21 59.87 3cfb n SER 169 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 3cfb s VAL 171 N -2.80 4.78 -0.10 2.46 1.01 -0.66 -2.45 120.40 122.64 3cfb s VAL 171 Ca 0.02 1.10 0.02 0.00 0.00 0.00 0.00 61.98 63.13 3cfb s VAL 171 Cb -0.01 -3.84 0.01 0.00 0.00 0.00 0.00 36.38 32.54 3cfb s VAL 171 CO 0.03 0.45 -0.17 -1.00 0.00 0.00 0.00 175.10 174.42 3cfb s HIS 172 N -1.23 2.03 -0.34 5.22 3.76 -0.51 -5.00 115.29 119.23 3cfb s HIS 172 Ca 0.32 -0.90 -0.09 0.00 -0.15 0.00 0.00 55.06 54.24 3cfb s HIS 172 Cb -0.18 -1.43 0.01 0.00 1.11 0.00 0.00 32.58 32.09 3cfb s HIS 172 CO 0.19 -0.43 0.16 0.99 -0.85 0.00 0.00 174.74 174.80 3cfb s THR 173 N 0.76 4.41 -0.09 1.30 2.01 -1.26 -1.38 115.64 121.39 3cfb s THR 173 Ca -0.11 -0.71 -0.18 0.00 0.31 0.00 0.00 61.69 61.00 3cfb s THR 173 Cb -0.16 -3.36 -0.04 0.00 0.01 0.00 0.00 72.50 68.95 3cfb s THR 173 CO 0.02 -0.07 0.48 -0.36 -0.69 0.00 0.00 174.62 174.00 3cfb s PHE 174 N 1.55 3.55 0.31 4.92 0.08 -0.73 -5.04 117.98 122.62 3cfb s PHE 174 Ca 0.03 0.94 -0.29 0.00 0.12 0.00 0.00 56.93 57.73 3cfb s PHE 174 Cb -0.18 -2.53 -0.13 0.00 -0.57 0.00 0.00 43.02 39.61 3cfb s PHE 174 CO 0.05 0.24 1.22 -2.30 -0.10 0.00 0.00 175.22 174.33 3cfb n PRO 175 N 3.37 1.86 -2.03 0.24 -0.02 -1.26 -4.20 135.00 132.96 3cfb n PRO 175 Ca -0.08 0.65 -0.33 0.00 -2.02 0.00 0.00 63.50 61.72 3cfb n PRO 175 Cb 0.52 -2.18 0.02 0.00 -0.02 0.00 0.00 33.50 31.83 3cfb n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3cfb s ALA 176 N -0.91 2.64 -0.01 3.55 0.00 -1.26 -4.82 121.76 120.95 3cfb s ALA 176 Ca 0.59 0.57 0.08 0.00 0.00 0.00 0.00 51.96 53.20 3cfb s ALA 176 Cb -0.63 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.17 3cfb s ALA 176 CO 0.59 -0.93 -0.25 -0.51 0.00 0.00 0.00 175.76 174.66 3cfb s LEU 177 N -4.38 2.11 -0.30 0.00 1.43 0.10 -4.93 118.68 112.71 3cfb s LEU 177 Ca 0.67 -0.48 -0.17 0.00 -1.03 0.00 0.00 54.13 53.12 3cfb s LEU 177 Cb -0.20 -1.34 -0.02 0.00 0.03 0.00 0.00 46.19 44.66 3cfb s LEU 177 CO 0.35 0.31 0.49 -0.22 0.23 0.00 0.00 176.35 177.50 3cfb s LEU 178 N -0.74 4.17 -0.14 1.79 2.96 -1.26 -1.47 118.68 123.99 3cfb s LEU 178 Ca 0.10 0.25 -0.00 0.00 -0.22 0.00 0.00 54.13 54.26 3cfb s LEU 178 Cb -0.10 -2.59 0.03 0.00 0.50 0.00 0.00 46.19 44.04 3cfb s LEU 178 CO -0.00 -0.35 -0.07 0.00 -1.32 0.00 0.00 176.35 174.61 3cfb s GLN 179 N 2.30 1.56 -1.30 1.98 -2.07 -0.27 -4.88 119.66 116.99 3cfb s GLN 179 Ca 0.19 -0.40 -0.03 0.00 -1.82 0.00 0.00 55.36 53.30 3cfb s GLN 179 Cb -0.16 -1.83 0.01 0.00 -1.09 0.00 0.00 33.01 29.95 3cfb s GLN 179 CO 0.11 -0.34 0.95 0.43 -1.32 0.00 0.00 175.29 175.12 3cfb n SER 180 N 4.89 -2.88 0.00 12.60 7.64 -1.26 -2.46 113.62 132.16 3cfb n SER 180 Ca -0.13 -0.68 0.00 0.00 1.01 0.00 0.00 58.87 59.07 3cfb n SER 180 Cb 0.49 -4.67 0.00 0.00 -1.01 0.00 0.00 64.21 59.02 3cfb n SER 180 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3cfb n GLY 183 N -1.48 2.25 3.42 0.23 0.00 -1.26 -5.00 105.19 103.35 3cfb n GLY 183 Ca -0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 3cfb n GLY 183 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cfb s LEU 184 N 0.00 2.44 0.16 0.99 1.43 -1.03 -4.79 118.68 117.88 3cfb s LEU 184 Ca 0.00 -0.76 0.03 0.00 -1.03 0.00 0.00 54.13 52.37 3cfb s LEU 184 Cb 0.00 -1.26 -0.03 0.00 0.03 0.00 0.00 46.19 44.92 3cfb s LEU 184 CO 0.00 0.15 0.28 -0.31 0.23 0.00 0.00 176.35 176.70 3cfb s TYR 185 N -1.33 3.46 -0.02 0.29 2.02 0.23 -1.11 117.35 120.89 3cfb s TYR 185 Ca 0.17 0.10 -0.01 0.00 -0.37 0.00 0.00 57.07 56.96 3cfb s TYR 185 Cb -0.09 -1.65 0.01 0.00 -0.40 0.00 0.00 41.96 39.83 3cfb s TYR 185 CO 0.08 0.51 0.06 -0.08 -1.57 0.00 0.00 175.55 174.55 3cfb s THR 186 N -1.76 -0.02 0.15 -0.71 -1.32 -0.54 -1.29 115.64 110.15 3cfb s THR 186 Ca 0.34 0.07 -0.03 0.00 -1.21 0.00 0.00 61.69 60.86 3cfb s THR 186 Cb -0.11 -0.10 -0.03 0.00 -1.51 0.00 0.00 72.50 70.75 3cfb s THR 186 CO 0.28 0.03 0.13 0.00 -2.21 0.00 0.00 174.62 172.85 3cfb s MET 187 N 0.41 1.03 0.10 7.08 0.23 -0.06 -0.72 119.30 127.36 3cfb s MET 187 Ca -0.03 -1.40 0.02 0.00 -1.03 0.00 0.00 55.69 53.25 3cfb s MET 187 Cb -0.05 0.28 -0.04 0.00 -1.53 0.00 0.00 34.83 33.50 3cfb s MET 187 CO -0.01 -0.32 -0.07 -1.54 -2.03 0.00 0.00 175.02 171.04 3cfb s SER 188 N -3.04 1.18 -0.02 -1.18 1.04 -1.26 -0.44 113.70 109.98 3cfb s SER 188 Ca 0.24 -0.97 0.01 0.00 0.48 0.00 0.00 55.95 55.72 3cfb s SER 188 Cb 0.06 0.08 0.01 0.00 0.10 0.00 0.00 66.02 66.27 3cfb s SER 188 CO 0.03 -0.43 -0.04 -0.55 0.98 0.00 0.00 173.24 173.23 3cfb s SER 189 N -2.93 0.57 0.18 7.02 0.15 -0.26 -1.78 113.70 116.66 3cfb s SER 189 Ca 0.10 -0.08 0.10 0.00 0.70 0.00 0.00 55.95 56.77 3cfb s SER 189 Cb 0.04 -0.16 -0.04 0.00 -1.71 0.00 0.00 66.02 64.14 3cfb s SER 189 CO -0.04 0.00 -0.15 -0.94 1.20 0.00 0.00 173.24 173.32 3cfb s SER 190 N 0.31 3.95 0.01 5.45 1.04 -0.48 -1.27 113.70 122.71 3cfb s SER 190 Ca -0.03 -0.67 0.00 0.00 0.48 0.00 0.00 55.95 55.73 3cfb s SER 190 Cb -0.07 -0.55 -0.01 0.00 0.10 0.00 0.00 66.02 65.49 3cfb s SER 190 CO -0.00 0.12 -0.02 0.54 0.98 0.00 0.00 173.24 174.85 3cfb s VAL 191 N -1.65 0.10 -0.09 5.02 0.11 -0.07 -1.42 120.40 122.41 3cfb s VAL 191 Ca 0.23 -0.65 0.04 0.00 -2.93 0.00 0.00 61.98 58.67 3cfb s VAL 191 Cb -0.09 -0.21 0.00 0.00 -1.53 0.00 0.00 36.38 34.56 3cfb s VAL 191 CO 0.13 -0.34 -0.21 -0.89 -3.33 0.00 0.00 175.10 170.46 3cfb s THR 192 N -1.02 1.79 0.14 5.04 2.01 -1.03 -0.70 115.64 121.88 3cfb s THR 192 Ca -0.11 -0.87 0.05 0.00 0.31 0.00 0.00 61.69 61.07 3cfb s THR 192 Cb -0.07 -1.57 -0.04 0.00 0.01 0.00 0.00 72.50 70.83 3cfb s THR 192 CO -0.01 0.50 -0.11 0.68 -0.69 0.00 0.00 174.62 175.00 3cfb s VAL 193 N 0.42 1.21 0.43 3.82 -7.23 0.06 -4.88 120.40 114.23 3cfb s VAL 193 Ca -0.17 -1.99 -0.26 0.00 -1.81 0.00 0.00 61.98 57.75 3cfb s VAL 193 Cb -0.17 -1.77 -0.09 0.00 0.56 0.00 0.00 36.38 34.90 3cfb s VAL 193 CO 0.07 -0.68 1.44 -2.84 -0.31 0.00 0.00 175.10 172.78 3cfb s PRO 194 N -3.51 3.82 0.43 4.82 0.02 -1.26 -0.26 135.00 139.05 3cfb s PRO 194 Ca 0.15 2.45 0.11 0.00 0.02 0.00 0.00 61.00 63.72 3cfb s PRO 194 Cb 0.01 -2.75 0.92 0.00 0.02 0.00 0.00 34.50 32.71 3cfb s PRO 194 CO 0.01 -0.72 2.01 1.03 -0.33 0.00 0.00 177.00 179.00 3cfb h SER 195 N 2.53 0.22 -0.00 2.53 0.87 -1.46 -1.53 113.55 116.71 3cfb h SER 195 Ca -0.51 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.03 3cfb h SER 195 Cb 1.26 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 63.16 3cfb h SER 195 CO 0.62 0.28 0.20 0.77 -0.53 0.00 0.00 176.83 178.16 3cfb h SER 196 N 0.25 0.00 0.14 6.23 4.64 -1.91 -2.26 113.55 120.65 3cfb h SER 196 Ca 0.06 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.02 3cfb h SER 196 Cb 0.18 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.22 3cfb h SER 196 CO 0.00 0.00 -2.14 0.35 -0.87 0.00 0.00 176.83 174.17 3cfb n THR 198 N -2.98 1.60 -5.04 2.95 -2.24 -0.59 -4.71 114.28 103.27 3cfb n THR 198 Ca -0.02 -0.70 -0.29 0.00 -2.27 0.00 0.00 64.05 60.77 3cfb n THR 198 Cb 0.26 -1.27 -0.17 0.00 -2.10 0.00 0.00 70.33 67.05 3cfb n THR 198 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 3cfb s TRP 199 N -2.54 2.14 -1.96 4.78 -0.00 -0.85 0.23 118.94 120.73 3cfb s TRP 199 Ca -0.20 -0.73 0.06 0.00 -0.00 0.00 0.00 56.10 55.23 3cfb s TRP 199 Cb 0.07 -1.44 0.16 0.00 -0.00 0.00 0.00 33.47 32.27 3cfb s TRP 199 CO 0.74 -0.27 1.13 -0.35 -0.00 0.00 0.00 176.95 178.20 3cfb n PRO 200 N 3.28 1.45 0.27 5.86 -0.04 -1.26 -4.57 135.00 139.99 3cfb n PRO 200 Ca -0.19 -0.67 0.12 0.00 -0.04 0.00 0.00 63.50 62.73 3cfb n PRO 200 Cb 0.52 -1.16 0.77 0.00 -0.04 0.00 0.00 33.50 33.59 3cfb n PRO 200 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3cfb h SER 202 N 1.08 0.00 -3.27 3.54 4.64 -1.71 -3.42 113.55 114.41 3cfb h SER 202 Ca 0.00 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.88 3cfb h SER 202 Cb 0.27 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.21 3cfb h SER 202 CO 0.00 0.08 -0.72 -1.61 -0.87 0.00 0.00 176.83 173.71 3cfb s GLU 203 N -4.47 1.34 0.27 4.77 2.02 0.63 -5.05 118.70 118.20 3cfb s GLU 203 Ca -0.04 -1.61 -0.29 0.00 0.02 0.00 0.00 54.97 53.04 3cfb s GLU 203 Cb 0.14 -1.05 -0.10 0.00 0.10 0.00 0.00 34.13 33.23 3cfb s GLU 203 CO 0.59 0.13 1.27 0.95 0.02 0.00 0.00 175.26 178.22 3cfb s THR 204 N -3.04 3.07 -0.18 3.63 -4.23 -1.26 -4.57 115.64 109.05 3cfb s THR 204 Ca 0.23 0.98 -0.00 0.00 -1.18 0.00 0.00 61.69 61.72 3cfb s THR 204 Cb 0.01 -3.63 0.05 0.00 1.34 0.00 0.00 72.50 70.27 3cfb s THR 204 CO 0.07 0.20 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.61 3cfb s VAL 205 N -0.61 1.22 -0.00 2.29 1.01 -1.26 -5.00 120.40 118.04 3cfb s VAL 205 Ca 0.51 -0.78 0.08 0.00 0.00 0.00 0.00 61.98 61.79 3cfb s VAL 205 Cb -0.37 -1.42 -0.02 0.00 0.00 0.00 0.00 36.38 34.57 3cfb s VAL 205 CO 0.44 0.07 -0.26 -0.89 0.00 0.00 0.00 175.10 174.47 3cfb s THR 206 N 1.57 2.03 -0.15 3.92 2.01 -1.26 -0.77 115.64 122.99 3cfb s THR 206 Ca -0.01 -1.15 -0.04 0.00 0.31 0.00 0.00 61.69 60.79 3cfb s THR 206 Cb -0.16 -1.69 -0.03 0.00 0.01 0.00 0.00 72.50 70.62 3cfb s THR 206 CO -0.07 0.52 -0.01 0.00 -0.69 0.00 0.00 174.62 174.36 3cfb s SER 209 N 0.13 4.19 -0.26 0.00 0.15 0.93 -0.54 113.70 118.30 3cfb s SER 209 Ca 0.01 -1.13 -0.07 0.00 0.70 0.00 0.00 55.95 55.46 3cfb s SER 209 Cb -0.13 -1.57 -0.02 0.00 -1.71 0.00 0.00 66.02 62.59 3cfb s SER 209 CO 0.02 -0.15 0.07 -0.69 1.20 0.00 0.00 173.24 173.69 3cfb s VAL 210 N 1.20 4.17 -0.18 4.45 1.01 0.10 -0.98 120.40 130.18 3cfb s VAL 210 Ca -0.04 -0.32 -0.05 0.00 0.00 0.00 0.00 61.98 61.57 3cfb s VAL 210 Cb -0.18 -3.00 -0.03 0.00 0.00 0.00 0.00 36.38 33.17 3cfb s VAL 210 CO -0.06 0.28 -0.01 0.00 0.00 0.00 0.00 175.10 175.30 3cfb s ALA 211 N 1.58 3.06 -0.51 5.51 0.00 0.54 -0.73 121.76 131.21 3cfb s ALA 211 Ca 0.05 -0.88 0.03 0.00 0.00 0.00 0.00 51.96 51.17 3cfb s ALA 211 Cb -0.16 -1.68 0.14 0.00 0.00 0.00 0.00 23.12 21.42 3cfb s ALA 211 CO 0.03 0.06 0.29 -1.58 0.00 0.00 0.00 175.76 174.56 3cfb s HIS 212 N 0.62 2.71 0.26 0.00 2.46 -0.31 -1.04 115.29 119.99 3cfb s HIS 212 Ca -0.01 -2.89 -0.02 0.00 0.47 0.00 0.00 55.06 52.61 3cfb s HIS 212 Cb -0.14 -2.39 0.50 0.00 -0.13 0.00 0.00 32.58 30.42 3cfb s HIS 212 CO 0.02 -0.73 1.77 -1.35 -2.47 0.00 0.00 174.74 171.98 3cfb h PRO 213 N 6.41 0.65 0.00 2.88 0.11 -1.80 -2.16 132.00 138.09 3cfb h PRO 213 Ca -0.01 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 3cfb h PRO 213 Cb 0.89 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.85 3cfb h PRO 213 CO 0.61 0.43 -0.07 0.00 -0.21 0.00 0.00 178.00 178.75 3cfb h ALA 214 N 1.53 1.22 -0.40 -0.75 0.00 -1.94 -0.11 119.26 118.82 3cfb h ALA 214 Ca 0.45 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.29 3cfb h ALA 214 Cb 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3cfb h ALA 214 CO -0.33 0.09 0.00 -1.13 0.00 0.00 0.00 179.25 177.87 3cfb n SER 215 N -3.49 3.11 -3.88 0.00 3.41 -0.86 -4.96 113.62 106.95 3cfb n SER 215 Ca -0.02 -1.93 -0.28 0.00 -0.26 0.00 0.00 58.87 56.38 3cfb n SER 215 Cb 0.20 -0.26 0.02 0.00 -0.26 0.00 0.00 64.21 63.91 3cfb n SER 215 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3cfb n SER 216 N 0.91 -3.82 -4.07 4.04 7.64 -0.05 -4.95 113.62 113.32 3cfb n SER 216 Ca 0.15 -0.80 -0.23 0.00 1.01 0.00 0.00 58.87 59.00 3cfb n SER 216 Cb 0.48 -3.87 -0.16 0.00 -1.01 0.00 0.00 64.21 59.65 3cfb n SER 216 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3cfb s THR 217 N -3.41 1.07 -0.05 0.44 2.01 -1.10 -5.04 115.64 109.58 3cfb s THR 217 Ca 0.50 -0.54 0.05 0.00 0.31 0.00 0.00 61.69 62.01 3cfb s THR 217 Cb -0.25 -0.93 -0.01 0.00 0.01 0.00 0.00 72.50 71.33 3cfb s THR 217 CO 0.83 0.32 -0.19 -0.89 -0.69 0.00 0.00 174.62 174.00 3cfb s THR 218 N -0.00 1.57 -0.12 -0.82 2.01 -1.26 -1.16 115.64 115.85 3cfb s THR 218 Ca -0.01 -0.80 0.02 0.00 0.31 0.00 0.00 61.69 61.21 3cfb s THR 218 Cb -0.09 -1.34 0.01 0.00 0.01 0.00 0.00 72.50 71.10 3cfb s THR 218 CO 0.01 0.45 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.53 3cfb s VAL 219 N -0.03 1.64 -0.13 3.82 1.01 0.09 -4.96 120.40 121.84 3cfb s VAL 219 Ca -0.03 -0.72 -0.02 0.00 0.00 0.00 0.00 61.98 61.21 3cfb s VAL 219 Cb -0.12 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.75 3cfb s VAL 219 CO 0.02 0.47 -0.06 -1.81 0.00 0.00 0.00 175.10 173.72 3cfb s ASP 220 N 1.03 4.63 -0.14 3.32 1.01 -1.26 0.03 116.67 125.28 3cfb s ASP 220 Ca -0.05 -0.14 0.02 0.00 0.71 0.00 0.00 52.55 53.09 3cfb s ASP 220 Cb -0.15 -1.63 0.01 0.00 1.01 0.00 0.00 42.92 42.16 3cfb s ASP 220 CO -0.03 0.21 -0.19 -0.54 0.21 0.00 0.00 175.17 174.83 3cfb s LYS 221 N 0.13 2.72 -0.21 8.23 -0.14 0.30 -4.97 119.74 125.79 3cfb s LYS 221 Ca -0.02 -0.74 -0.23 0.00 -1.36 0.00 0.00 55.97 53.62 3cfb s LYS 221 Cb -0.14 -2.28 -0.02 0.00 -1.68 0.00 0.00 37.83 33.72 3cfb s LYS 221 CO 0.03 -0.09 0.74 0.15 -0.76 0.00 0.00 175.35 175.42 3cfb s LYS 222 N 1.03 4.21 0.14 1.68 -0.14 -1.26 -0.84 119.74 124.56 3cfb s LYS 222 Ca -0.03 0.80 -0.30 0.00 -1.36 0.00 0.00 55.97 55.07 3cfb s LYS 222 Cb -0.15 -3.61 -0.07 0.00 -1.68 0.00 0.00 37.83 32.33 3cfb s LYS 222 CO -0.05 -0.37 1.05 -0.51 -0.76 0.00 0.00 175.35 174.72 3cfb s LEU 223 N 2.33 4.48 0.07 3.17 1.02 0.05 -5.00 118.68 124.80 3cfb s LEU 223 Ca 0.32 1.97 0.02 0.00 0.02 0.00 0.00 54.13 56.46 3cfb s LEU 223 Cb -0.16 -3.60 -0.04 0.00 0.02 0.00 0.00 46.19 42.42 3cfb s LEU 223 CO 0.10 -0.18 -0.06 -1.61 0.02 0.00 0.00 176.35 174.61 3cfb s GLU 226 N -0.10 0.70 0.00 1.70 2.02 -1.26 -4.66 118.70 117.09 3cfb s GLU 226 Ca 0.49 -1.11 0.31 0.00 0.02 0.00 0.00 54.97 54.67 3cfb s GLU 226 Cb -0.27 -0.18 1.62 0.00 0.10 0.00 0.00 34.13 35.40 3cfb s GLU 226 CO 0.32 -0.01 2.07 -0.35 0.02 0.00 0.00 175.26 177.31