#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fbk h GLN 32 N 0.00 0.14 -4.76 1.45 7.50 -1.98 -3.41 115.11 114.06 3fbk h GLN 32 Ca 0.00 -0.24 -0.69 0.00 0.50 0.00 0.00 58.65 58.22 3fbk h GLN 32 Cb 0.00 0.09 -0.31 0.00 0.05 0.00 0.00 27.48 27.31 3fbk h GLN 32 CO 0.00 1.11 -0.68 0.20 -1.50 0.00 0.00 178.83 177.96 3fbk s GLY 33 N -4.31 1.77 -0.14 3.46 0.00 -1.26 -3.95 107.32 102.88 3fbk s GLY 33 Ca -0.16 -1.72 0.16 0.00 0.00 0.00 0.00 44.72 43.00 3fbk s GLY 33 CO 0.76 0.70 1.64 0.00 0.00 0.00 0.00 173.10 176.19 3fbk n ALA 34 N 4.69 3.31 0.00 3.20 0.00 -0.69 -4.91 120.51 126.10 3fbk n ALA 34 Ca -0.13 -1.62 0.00 0.00 0.00 0.00 0.00 53.44 51.68 3fbk n ALA 34 Cb 0.44 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.83 3fbk n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fbk n GLY 35 N 0.98 0.76 3.24 0.00 0.00 -1.26 -1.33 105.19 107.59 3fbk n GLY 35 Ca 0.26 -2.22 -0.23 0.00 0.00 0.00 0.00 46.02 43.83 3fbk n GLY 35 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fbk s GLN 36 N -0.86 1.16 -0.03 1.61 1.11 0.18 -0.54 119.66 122.29 3fbk s GLN 36 Ca 0.00 -0.99 0.05 0.00 0.01 0.00 0.00 55.36 54.43 3fbk s GLN 36 Cb 0.00 -1.30 -0.01 0.00 -1.01 0.00 0.00 33.01 30.69 3fbk s GLN 36 CO 0.00 0.32 -0.18 -1.17 0.01 0.00 0.00 175.29 174.27 3fbk s LEU 37 N -1.50 1.97 -0.24 2.90 2.96 0.14 0.22 118.68 125.12 3fbk s LEU 37 Ca 0.05 -0.35 -0.08 0.00 -0.22 0.00 0.00 54.13 53.53 3fbk s LEU 37 Cb -0.09 -0.98 -0.03 0.00 0.50 0.00 0.00 46.19 45.58 3fbk s LEU 37 CO 0.03 0.19 0.09 -0.60 -1.32 0.00 0.00 176.35 174.74 3fbk s ARG 38 N -0.17 3.77 0.26 1.98 3.52 0.68 -0.46 118.95 128.52 3fbk s ARG 38 Ca 0.01 -0.42 -0.08 0.00 -0.13 0.00 0.00 55.73 55.10 3fbk s ARG 38 Cb -0.10 -3.37 -0.01 0.00 -1.56 0.00 0.00 34.95 29.91 3fbk s ARG 38 CO 0.01 -0.11 0.41 -0.48 -0.81 0.00 0.00 175.30 174.32 3fbk s LEU 39 N 1.44 0.64 -0.00 -0.88 0.05 -0.66 -1.41 118.68 117.86 3fbk s LEU 39 Ca 0.06 -1.15 -0.00 0.00 0.05 0.00 0.00 54.13 53.09 3fbk s LEU 39 Cb -0.15 1.42 -0.00 0.00 -2.05 0.00 0.00 46.19 45.41 3fbk s LEU 39 CO 0.05 -1.12 0.00 -0.55 -0.55 0.00 0.00 176.35 174.18 3fbk s SER 40 N -3.10 0.01 -0.03 1.48 0.15 -0.51 -1.63 113.70 110.07 3fbk s SER 40 Ca 0.28 -0.02 -0.00 0.00 0.70 0.00 0.00 55.95 56.91 3fbk s SER 40 Cb 0.01 0.01 0.03 0.00 -1.71 0.00 0.00 66.02 64.36 3fbk s SER 40 CO 0.12 -0.02 0.01 -0.63 1.20 0.00 0.00 173.24 173.92 3fbk s ILE 41 N -0.08 0.15 0.02 6.45 1.01 -0.20 -0.26 121.20 128.29 3fbk s ILE 41 Ca -0.01 0.13 0.01 0.00 0.00 0.00 0.00 60.65 60.78 3fbk s ILE 41 Cb -0.01 -0.27 -0.02 0.00 0.01 0.00 0.00 42.46 42.18 3fbk s ILE 41 CO -0.00 0.15 -0.05 -0.62 0.00 0.00 0.00 174.94 174.42 3fbk s ASP 42 N 1.22 0.53 -0.10 3.58 3.68 -0.59 -1.66 116.67 123.33 3fbk s ASP 42 Ca -0.07 -0.38 -0.01 0.00 2.13 0.00 0.00 52.55 54.22 3fbk s ASP 42 Cb -0.13 0.03 -0.03 0.00 -1.45 0.00 0.00 42.92 41.34 3fbk s ASP 42 CO -0.02 -0.15 -0.05 0.00 0.13 0.00 0.00 175.17 175.07 3fbk s ALA 43 N -0.99 3.03 -0.30 3.66 0.00 -1.26 0.10 121.76 125.99 3fbk s ALA 43 Ca -0.08 -0.85 -0.03 0.00 0.00 0.00 0.00 51.96 51.00 3fbk s ALA 43 Cb -0.07 -1.37 0.11 0.00 0.00 0.00 0.00 23.12 21.79 3fbk s ALA 43 CO -0.00 0.47 0.14 -1.14 0.00 0.00 0.00 175.76 175.22 3fbk s GLN 44 N -0.47 0.36 -0.98 0.00 -0.44 -0.20 -4.93 119.66 113.00 3fbk s GLN 44 Ca 0.07 -0.76 -0.11 0.00 -2.50 0.00 0.00 55.36 52.06 3fbk s GLN 44 Cb -0.12 -1.37 -0.01 0.00 -1.64 0.00 0.00 33.01 29.87 3fbk s GLN 44 CO 0.02 -1.04 0.76 -0.25 0.50 0.00 0.00 175.29 175.28 3fbk n ASP 45 N 5.00 -6.01 -2.70 6.67 9.92 -1.26 -2.29 116.55 125.88 3fbk n ASP 45 Ca -0.03 -0.75 -0.19 0.00 -0.53 0.00 0.00 54.79 53.29 3fbk n ASP 45 Cb 0.41 -3.77 0.00 0.00 -0.64 0.00 0.00 41.12 37.12 3fbk n ASP 45 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 3fbk n ARG 46 N -3.25 -2.85 -3.81 -1.24 1.74 -1.26 -4.97 116.66 101.03 3fbk n ARG 46 Ca -0.11 0.76 -0.27 0.00 -0.77 0.00 0.00 57.85 57.47 3fbk n ARG 46 Cb 0.59 -5.46 -0.17 0.00 -1.02 0.00 0.00 32.46 26.40 3fbk n ARG 46 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3fbk s VAL 47 N -2.91 0.74 -0.10 1.55 1.01 -0.97 -1.66 120.40 118.06 3fbk s VAL 47 Ca 0.13 -0.46 -0.28 0.00 0.00 0.00 0.00 61.98 61.37 3fbk s VAL 47 Cb -0.06 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.26 3fbk s VAL 47 CO 0.16 0.02 0.91 -0.76 0.00 0.00 0.00 175.10 175.43 3fbk s LEU 48 N 1.79 4.25 -0.38 3.92 1.43 0.04 -1.03 118.68 128.69 3fbk s LEU 48 Ca 0.01 1.41 -0.09 0.00 -1.03 0.00 0.00 54.13 54.43 3fbk s LEU 48 Cb -0.15 -3.41 0.05 0.00 0.03 0.00 0.00 46.19 42.71 3fbk s LEU 48 CO -0.07 -0.36 0.20 -0.22 0.23 0.00 0.00 176.35 176.12 3fbk s LEU 49 N 1.74 4.77 -0.10 1.79 2.96 0.11 -0.09 118.68 129.86 3fbk s LEU 49 Ca 0.45 -1.24 -0.03 0.00 -0.22 0.00 0.00 54.13 53.08 3fbk s LEU 49 Cb -0.18 -1.96 -0.03 0.00 0.50 0.00 0.00 46.19 44.51 3fbk s LEU 49 CO 0.18 -0.43 0.02 -0.76 -1.32 0.00 0.00 176.35 174.05 3fbk s LEU 50 N 1.46 3.70 -0.32 -0.68 1.02 -0.20 -1.54 118.68 122.11 3fbk s LEU 50 Ca 0.01 0.17 0.02 0.00 0.02 0.00 0.00 54.13 54.35 3fbk s LEU 50 Cb -0.21 -1.87 0.09 0.00 0.02 0.00 0.00 46.19 44.23 3fbk s LEU 50 CO 0.04 0.35 0.04 -2.28 0.02 0.00 0.00 176.35 174.52 3fbk s HIS 51 N -0.70 3.07 -0.52 0.29 2.46 0.64 0.27 115.29 120.79 3fbk s HIS 51 Ca 0.11 -2.51 -0.22 0.00 0.47 0.00 0.00 55.06 52.91 3fbk s HIS 51 Cb -0.12 -2.41 0.04 0.00 -0.13 0.00 0.00 32.58 29.96 3fbk s HIS 51 CO 0.02 -0.91 0.82 0.42 -2.47 0.00 0.00 174.74 172.63 3fbk s ILE 52 N 1.15 4.57 -0.01 0.89 1.09 -0.02 -1.42 121.20 127.45 3fbk s ILE 52 Ca 0.08 0.06 -0.00 0.00 -1.10 0.00 0.00 60.65 59.68 3fbk s ILE 52 Cb -0.19 -4.44 -0.00 0.00 -1.06 0.00 0.00 42.46 36.78 3fbk s ILE 52 CO -0.12 -0.97 -0.00 0.40 -0.10 0.00 0.00 174.94 174.15 3fbk h ILE 53 N 5.97 0.00 -3.27 2.92 2.04 -1.51 -1.22 117.51 122.44 3fbk h ILE 53 Ca -0.26 -0.08 0.01 0.00 1.00 0.00 0.00 64.86 65.52 3fbk h ILE 53 Cb 1.08 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 37.08 3fbk h ILE 53 CO 1.03 0.00 0.08 -1.83 0.00 0.00 0.00 178.15 177.43 3fbk s GLU 54 N -1.05 1.60 0.28 2.37 -1.05 -1.19 -0.46 118.70 119.21 3fbk s GLU 54 Ca -0.00 -1.02 0.09 0.00 -0.15 0.00 0.00 54.97 53.89 3fbk s GLU 54 Cb 0.00 0.55 -0.05 0.00 -0.44 0.00 0.00 34.13 34.18 3fbk s GLU 54 CO 0.00 -0.70 -0.13 0.20 0.95 0.00 0.00 175.26 175.58 3fbk s GLY 55 N -2.93 1.87 -0.09 -3.83 0.00 0.14 -0.23 107.32 102.24 3fbk s GLY 55 Ca 0.14 -1.90 -0.12 0.00 0.00 0.00 0.00 44.72 42.84 3fbk s GLY 55 CO 0.05 -1.92 0.31 1.25 0.00 0.00 0.00 173.10 172.78 3fbk s LYS 56 N -3.61 0.44 -1.41 2.90 2.20 0.13 -3.43 119.74 116.97 3fbk s LYS 56 Ca 0.29 0.26 -0.08 0.00 -0.36 0.00 0.00 55.97 56.08 3fbk s LYS 56 Cb -0.00 0.21 0.05 0.00 -1.51 0.00 0.00 37.83 36.57 3fbk s LYS 56 CO 0.13 -0.08 0.59 0.41 -0.36 0.00 0.00 175.35 176.04 3fbk n GLY 57 N 2.48 -0.50 3.72 5.54 0.00 -1.00 -0.64 105.19 114.78 3fbk n GLY 57 Ca -0.15 0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 3fbk n GLY 57 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3fbk n LEU 58 N -3.94 3.96 -4.15 0.99 4.77 -0.40 -4.01 117.00 114.23 3fbk n LEU 58 Ca -0.05 1.14 -0.33 0.00 -0.03 0.00 0.00 56.01 56.74 3fbk n LEU 58 Cb 0.57 -1.54 -0.15 0.00 -2.33 0.00 0.00 43.42 39.96 3fbk n LEU 58 CO 0.52 -0.03 -0.48 -0.63 -1.33 0.00 0.00 177.39 175.44 3fbk s ILE 59 N 0.09 2.38 -0.19 -0.08 -1.09 -0.44 -4.90 121.20 116.97 3fbk s ILE 59 Ca 0.66 -1.00 -0.00 0.00 -2.23 0.00 0.00 60.65 58.08 3fbk s ILE 59 Cb -0.54 -2.11 0.01 0.00 -1.58 0.00 0.00 42.46 38.24 3fbk s ILE 59 CO 0.47 0.38 -0.15 -0.94 -1.23 0.00 0.00 174.94 173.47 3fbk s SER 60 N 1.29 3.49 0.00 3.58 1.04 -1.26 -4.82 113.70 117.02 3fbk s SER 60 Ca 0.02 -0.62 0.16 0.00 0.48 0.00 0.00 55.95 55.99 3fbk s SER 60 Cb -0.15 -1.55 0.68 0.00 0.10 0.00 0.00 66.02 65.10 3fbk s SER 60 CO -0.09 -0.02 1.51 2.29 0.98 0.00 0.00 173.24 177.91 3fbk n LYS 61 N 4.66 0.00 -2.64 4.02 0.00 -1.26 -4.72 118.16 118.22 3fbk n LYS 61 Ca -0.20 0.23 -0.40 0.00 -0.00 0.00 0.00 58.31 57.94 3fbk n LYS 61 Cb 0.50 -1.51 -0.05 0.00 -0.00 0.00 0.00 35.03 33.97 3fbk n LYS 61 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 3fbk s GLN 62 N -3.00 4.75 -0.00 -1.58 -0.21 -1.26 -5.00 119.66 113.36 3fbk s GLN 62 Ca 0.08 1.61 -0.30 0.00 0.02 0.00 0.00 55.36 56.76 3fbk s GLN 62 Cb 0.10 -3.26 -0.04 0.00 1.00 0.00 0.00 33.01 30.81 3fbk s GLN 62 CO 0.29 0.35 1.19 -1.25 -2.12 0.00 0.00 175.29 173.76 3fbk s PRO 63 N -1.07 4.40 0.00 2.91 0.04 -1.26 -4.87 135.00 135.15 3fbk s PRO 63 Ca 0.43 1.71 0.00 0.00 0.04 0.00 0.00 61.00 63.18 3fbk s PRO 63 Cb -0.28 -3.46 0.00 0.00 0.04 0.00 0.00 34.50 30.80 3fbk s PRO 63 CO 0.35 -0.35 0.00 0.41 0.04 0.00 0.00 177.00 177.45 3fbk n GLY 64 N 3.28 0.64 3.75 0.56 0.00 -1.26 -5.09 105.19 107.08 3fbk n GLY 64 Ca 0.10 -2.10 -0.32 0.00 0.00 0.00 0.00 46.02 43.69 3fbk n GLY 64 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fbk s THR 65 N -1.12 3.00 -0.35 2.61 -4.23 -1.26 -5.00 115.64 109.29 3fbk s THR 65 Ca 0.00 0.40 -0.10 0.00 -1.18 0.00 0.00 61.69 60.81 3fbk s THR 65 Cb 0.00 -2.85 0.02 0.00 1.34 0.00 0.00 72.50 71.01 3fbk s THR 65 CO 0.00 -0.36 0.17 0.00 -0.54 0.00 0.00 174.62 173.90 3fbk s ASP 67 N 1.55 3.91 0.42 0.00 1.11 -1.26 -0.63 116.67 121.77 3fbk s ASP 67 Ca 0.02 -3.40 -0.12 0.00 0.18 0.00 0.00 52.55 49.23 3fbk s ASP 67 Cb -0.19 -1.30 -0.07 0.00 1.07 0.00 0.00 42.92 42.43 3fbk s ASP 67 CO 0.06 -0.15 0.80 -2.16 1.18 0.00 0.00 175.17 174.90 3fbk s PRO 68 N -0.73 3.81 0.09 8.23 0.04 -1.21 -0.67 135.00 144.55 3fbk s PRO 68 Ca 0.24 0.55 -0.12 0.00 0.04 0.00 0.00 61.00 61.71 3fbk s PRO 68 Cb -0.09 -2.35 0.01 0.00 0.04 0.00 0.00 34.50 32.12 3fbk s PRO 68 CO -0.13 -0.07 0.27 1.52 0.04 0.00 0.00 177.00 178.63 3fbk s TYR 69 N -2.41 -0.00 -0.09 0.56 -0.85 -0.71 -0.98 117.35 112.87 3fbk s TYR 69 Ca 0.52 -0.32 0.02 0.00 -0.52 0.00 0.00 57.07 56.78 3fbk s TYR 69 Cb -0.10 0.06 -0.02 0.00 0.38 0.00 0.00 41.96 42.28 3fbk s TYR 69 CO 0.31 -0.57 -0.17 0.08 -1.52 0.00 0.00 175.55 173.68 3fbk s VAL 70 N -3.49 2.77 -0.09 -3.49 1.01 -1.26 -0.97 120.40 114.88 3fbk s VAL 70 Ca 0.02 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 61.24 3fbk s VAL 70 Cb 0.03 -2.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.29 3fbk s VAL 70 CO -0.09 0.55 -0.21 -0.75 0.00 0.00 0.00 175.10 174.60 3fbk s LYS 71 N -0.03 2.95 -0.07 2.72 2.20 0.77 -1.22 119.74 127.07 3fbk s LYS 71 Ca -0.05 -0.82 0.02 0.00 -0.36 0.00 0.00 55.97 54.76 3fbk s LYS 71 Cb -0.14 -2.35 -0.03 0.00 -1.51 0.00 0.00 37.83 33.80 3fbk s LYS 71 CO 0.04 0.28 -0.11 0.42 -0.36 0.00 0.00 175.35 175.63 3fbk s ILE 72 N 0.11 3.36 0.35 5.43 1.09 0.19 -1.22 121.20 130.50 3fbk s ILE 72 Ca -0.10 -0.60 -0.17 0.00 -1.10 0.00 0.00 60.65 58.67 3fbk s ILE 72 Cb -0.16 -2.35 0.06 0.00 -1.06 0.00 0.00 42.46 38.94 3fbk s ILE 72 CO 0.06 0.59 0.82 -0.94 -0.10 0.00 0.00 174.94 175.37 3fbk s SER 73 N -0.63 -0.02 0.07 3.58 1.04 -0.75 -1.69 113.70 115.30 3fbk s SER 73 Ca 0.09 -1.03 0.08 0.00 0.48 0.00 0.00 55.95 55.58 3fbk s SER 73 Cb -0.11 0.79 -0.04 0.00 0.10 0.00 0.00 66.02 66.76 3fbk s SER 73 CO 0.01 -1.56 -0.19 -0.76 0.98 0.00 0.00 173.24 171.72 3fbk s LEU 74 N -3.10 2.59 0.01 2.42 1.43 -1.26 -0.25 118.68 120.52 3fbk s LEU 74 Ca 0.16 -0.50 0.00 0.00 -1.03 0.00 0.00 54.13 52.76 3fbk s LEU 74 Cb -0.05 -1.49 -0.01 0.00 0.03 0.00 0.00 46.19 44.67 3fbk s LEU 74 CO 0.10 0.22 -0.02 0.27 0.23 0.00 0.00 176.35 177.15 3fbk s ILE 75 N -1.00 0.11 0.25 -0.59 -4.36 -0.13 -4.01 121.20 111.47 3fbk s ILE 75 Ca 0.16 -0.47 -0.18 0.00 -0.26 0.00 0.00 60.65 59.89 3fbk s ILE 75 Cb -0.10 -0.18 -0.08 0.00 1.25 0.00 0.00 42.46 43.34 3fbk s ILE 75 CO 0.07 -0.23 0.73 -2.16 0.24 0.00 0.00 174.94 173.58 3fbk s PRO 76 N -0.74 4.17 -0.30 0.37 0.04 -1.26 -0.29 135.00 137.00 3fbk s PRO 76 Ca -0.07 0.80 -0.12 0.00 0.04 0.00 0.00 61.00 61.65 3fbk s PRO 76 Cb -0.05 -2.74 0.13 0.00 0.04 0.00 0.00 34.50 31.88 3fbk s PRO 76 CO -0.00 0.32 0.73 -2.00 0.04 0.00 0.00 177.00 176.08 3fbk s GLU 77 N -2.29 0.54 -1.36 4.56 2.12 -1.26 -4.99 118.70 116.03 3fbk s GLU 77 Ca 0.46 1.26 -0.09 0.00 0.36 0.00 0.00 54.97 56.96 3fbk s GLU 77 Cb -0.15 0.65 0.11 0.00 0.26 0.00 0.00 34.13 35.00 3fbk s GLU 77 CO 0.20 -0.17 2.16 -3.47 -0.54 0.00 0.00 175.26 173.44 3fbk n ASP 78 N 5.10 5.88 -3.63 -1.70 4.64 -1.26 -4.83 116.55 120.75 3fbk n ASP 78 Ca -0.13 -3.02 -0.05 0.00 -1.38 0.00 0.00 54.79 50.21 3fbk n ASP 78 Cb 0.52 -1.49 -0.05 0.00 -1.04 0.00 0.00 41.12 39.05 3fbk n ASP 78 CO 0.00 0.00 0.00 -0.55 -0.82 0.00 0.00 177.20 175.83 3fbk s SER 79 N 1.29 -0.15 0.00 1.67 0.15 -1.26 -5.05 113.70 110.35 3fbk s SER 79 Ca 0.47 0.21 0.08 0.00 0.70 0.00 0.00 55.95 57.41 3fbk s SER 79 Cb 0.13 0.19 0.09 0.00 -1.71 0.00 0.00 66.02 64.72 3fbk s SER 79 CO -0.04 -0.10 0.82 0.54 1.20 0.00 0.00 173.24 175.65 3fbk n ARG 80 N 1.01 0.56 -0.07 5.44 1.74 -1.26 -4.64 116.66 119.44 3fbk n ARG 80 Ca -0.06 -1.12 0.18 0.00 -0.77 0.00 0.00 57.85 56.08 3fbk n ARG 80 Cb 0.58 -1.16 0.61 0.00 -1.02 0.00 0.00 32.46 31.47 3fbk n ARG 80 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3fbk h LEU 81 N 1.52 0.16 -0.42 0.55 3.38 -2.00 -0.56 115.31 117.94 3fbk h LEU 81 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3fbk h LEU 81 Cb 0.38 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3fbk h LEU 81 CO 0.00 0.09 -0.27 0.54 0.09 0.00 0.00 178.44 178.89 3fbk n ARG 82 N -4.42 0.73 -2.03 1.13 1.74 -1.26 -4.94 116.66 107.61 3fbk n ARG 82 Ca 0.11 -0.42 -0.39 0.00 -0.77 0.00 0.00 57.85 56.39 3fbk n ARG 82 Cb 0.57 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.52 3fbk n ARG 82 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3fbk s HIS 83 N -2.56 2.72 0.02 -1.55 3.76 -0.22 -4.83 115.29 112.63 3fbk s HIS 83 Ca 0.23 1.42 0.00 0.00 -0.15 0.00 0.00 55.06 56.56 3fbk s HIS 83 Cb 0.19 -3.65 -0.02 0.00 1.11 0.00 0.00 32.58 30.22 3fbk s HIS 83 CO 0.54 -2.16 -0.03 -0.65 -0.85 0.00 0.00 174.74 171.59 3fbk s GLN 84 N -2.46 0.28 0.11 1.40 -0.21 -0.68 -4.98 119.66 113.12 3fbk s GLN 84 Ca 0.61 -0.54 -0.01 0.00 0.02 0.00 0.00 55.36 55.44 3fbk s GLN 84 Cb -0.37 0.08 -0.04 0.00 1.00 0.00 0.00 33.01 33.68 3fbk s GLN 84 CO 0.46 -0.04 0.04 -1.59 -2.12 0.00 0.00 175.29 172.04 3fbk s LYS 85 N -1.28 0.86 0.63 2.91 -2.85 -1.26 0.52 119.74 119.28 3fbk s LYS 85 Ca -0.14 -1.39 0.01 0.00 -1.00 0.00 0.00 55.97 53.46 3fbk s LYS 85 Cb -0.09 0.24 0.12 0.00 -2.06 0.00 0.00 37.83 36.04 3fbk s LYS 85 CO -0.01 -0.23 0.87 0.25 0.10 0.00 0.00 175.35 176.33 3fbk n THR 86 N -0.05 0.00 -1.40 3.79 -2.24 -0.36 -4.98 114.28 109.04 3fbk n THR 86 Ca -0.07 -1.46 -0.30 0.00 -2.27 0.00 0.00 64.05 59.95 3fbk n THR 86 Cb 0.63 -0.89 0.12 0.00 -2.10 0.00 0.00 70.33 68.09 3fbk n THR 86 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fbk s GLN 87 N -4.76 1.56 -0.26 -0.78 -2.07 -1.26 -4.63 119.66 107.47 3fbk s GLN 87 Ca 0.59 0.65 -0.11 0.00 -1.82 0.00 0.00 55.36 54.67 3fbk s GLN 87 Cb -0.04 -1.86 -0.05 0.00 -1.09 0.00 0.00 33.01 29.98 3fbk s GLN 87 CO 0.39 -1.99 0.17 0.99 -1.32 0.00 0.00 175.29 173.53 3fbk s THR 88 N -3.08 5.34 -0.48 3.63 2.01 -1.26 -4.47 115.64 117.33 3fbk s THR 88 Ca 0.62 0.18 -0.20 0.00 0.31 0.00 0.00 61.69 62.60 3fbk s THR 88 Cb -0.16 -3.51 0.04 0.00 0.01 0.00 0.00 72.50 68.88 3fbk s THR 88 CO 0.55 0.31 0.65 -0.69 -0.69 0.00 0.00 174.62 174.75 3fbk s VAL 89 N 1.35 4.82 0.22 3.82 1.01 -0.15 -4.97 120.40 126.50 3fbk s VAL 89 Ca 0.07 -0.14 -0.30 0.00 0.00 0.00 0.00 61.98 61.61 3fbk s VAL 89 Cb -0.15 -4.27 -0.09 0.00 0.00 0.00 0.00 36.38 31.87 3fbk s VAL 89 CO 0.07 -0.72 1.38 -2.16 0.00 0.00 0.00 175.10 173.67 3fbk s PRO 90 N 2.82 4.32 -1.11 2.72 0.04 -1.26 -3.36 135.00 139.17 3fbk s PRO 90 Ca 0.20 2.18 -0.22 0.00 0.04 0.00 0.00 61.00 63.20 3fbk s PRO 90 Cb -0.16 -3.15 0.01 0.00 0.04 0.00 0.00 34.50 31.24 3fbk s PRO 90 CO 0.16 -0.34 0.73 -3.47 0.04 0.00 0.00 177.00 174.12 3fbk n ASP 91 N 2.52 -5.02 -3.69 6.66 2.03 -0.86 -4.96 116.55 113.23 3fbk n ASP 91 Ca 0.07 -1.06 -0.10 0.00 0.52 0.00 0.00 54.79 54.22 3fbk n ASP 91 Cb 0.41 -2.70 -0.11 0.00 -0.72 0.00 0.00 41.12 38.01 3fbk n ASP 91 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3fbk n ARG 93 N 4.59 1.14 -3.18 0.00 1.74 -1.26 -4.25 116.66 115.43 3fbk n ARG 93 Ca -0.19 -0.75 -0.20 0.00 -0.77 0.00 0.00 57.85 55.94 3fbk n ARG 93 Cb 0.53 -1.48 -0.04 0.00 -1.02 0.00 0.00 32.46 30.45 3fbk n ARG 93 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3fbk n ASP 94 N -0.28 0.89 -4.77 0.55 9.92 -1.26 -1.27 116.55 120.33 3fbk n ASP 94 Ca 0.13 -2.97 -0.40 0.00 -0.53 0.00 0.00 54.79 51.02 3fbk n ASP 94 Cb 0.38 -0.62 -0.01 0.00 -0.64 0.00 0.00 41.12 40.24 3fbk n ASP 94 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 3fbk s PRO 95 N -2.15 4.10 -0.40 -0.24 0.04 -1.22 -4.67 135.00 130.46 3fbk s PRO 95 Ca 0.39 2.34 -0.10 0.00 0.04 0.00 0.00 61.00 63.68 3fbk s PRO 95 Cb 0.29 -2.91 0.06 0.00 0.04 0.00 0.00 34.50 31.98 3fbk s PRO 95 CO -0.09 -0.45 0.23 0.00 0.04 0.00 0.00 177.00 176.73 3fbk s ALA 96 N -1.17 3.27 -0.21 8.56 0.00 -1.26 0.26 121.76 131.21 3fbk s ALA 96 Ca 0.54 -1.98 -0.21 0.00 0.00 0.00 0.00 51.96 50.31 3fbk s ALA 96 Cb -0.42 -2.61 -0.18 0.00 0.00 0.00 0.00 23.12 19.91 3fbk s ALA 96 CO 0.56 -1.55 0.16 1.19 0.00 0.00 0.00 175.76 176.12 3fbk n PHE 97 N 4.94 0.96 -3.90 0.00 3.72 0.21 -4.98 117.46 118.41 3fbk n PHE 97 Ca -0.11 0.42 -0.28 0.00 -0.05 0.00 0.00 57.45 57.43 3fbk n PHE 97 Cb 0.44 -1.08 -0.01 0.00 -0.94 0.00 0.00 39.48 37.90 3fbk n PHE 97 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 3fbk n HIS 98 N -4.43 -1.69 -5.02 1.38 8.25 0.39 -4.97 115.22 109.13 3fbk n HIS 98 Ca -0.32 0.65 -0.27 0.00 -0.26 0.00 0.00 57.72 57.52 3fbk n HIS 98 Cb 0.67 -3.63 -0.16 0.00 1.12 0.00 0.00 29.99 28.00 3fbk n HIS 98 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 3fbk s GLU 99 N -6.47 1.71 -0.06 -0.41 2.02 -0.54 -5.00 118.70 109.94 3fbk s GLU 99 Ca 0.13 -0.74 -0.02 0.00 0.02 0.00 0.00 54.97 54.35 3fbk s GLU 99 Cb -0.05 -1.64 -0.04 0.00 0.10 0.00 0.00 34.13 32.51 3fbk s GLU 99 CO 0.89 0.44 0.05 -1.01 0.02 0.00 0.00 175.26 175.65 3fbk s HIS 100 N -0.46 3.28 0.08 1.61 3.76 -1.26 -0.84 115.29 121.46 3fbk s HIS 100 Ca 0.07 0.26 0.05 0.00 -0.15 0.00 0.00 55.06 55.29 3fbk s HIS 100 Cb -0.08 -1.80 -0.03 0.00 1.11 0.00 0.00 32.58 31.78 3fbk s HIS 100 CO -0.01 0.55 -0.14 -0.06 -0.85 0.00 0.00 174.74 174.23 3fbk s PHE 101 N -1.02 1.22 -0.26 1.40 0.08 0.14 -4.98 117.98 114.56 3fbk s PHE 101 Ca 0.17 -0.48 0.01 0.00 0.12 0.00 0.00 56.93 56.75 3fbk s PHE 101 Cb -0.12 -0.68 0.07 0.00 -0.57 0.00 0.00 43.02 41.73 3fbk s PHE 101 CO 0.07 0.06 -0.01 -0.06 -0.10 0.00 0.00 175.22 175.17 3fbk s PHE 102 N -1.40 2.46 -0.45 0.36 0.08 -1.26 -1.03 117.98 116.73 3fbk s PHE 102 Ca -0.01 -1.91 -0.03 0.00 0.12 0.00 0.00 56.93 55.10 3fbk s PHE 102 Cb -0.09 -1.78 0.12 0.00 -0.57 0.00 0.00 43.02 40.69 3fbk s PHE 102 CO 0.02 -0.81 0.25 0.12 -0.10 0.00 0.00 175.22 174.70 3fbk s PHE 103 N 1.37 3.55 0.21 0.36 2.19 0.88 -4.93 117.98 121.60 3fbk s PHE 103 Ca -0.01 -2.44 -0.30 0.00 0.33 0.00 0.00 56.93 54.52 3fbk s PHE 103 Cb -0.19 -3.24 -0.08 0.00 -1.31 0.00 0.00 43.02 38.20 3fbk s PHE 103 CO -0.09 -0.95 1.20 -1.25 1.83 0.00 0.00 175.22 175.95 3fbk s PRO 104 N 0.96 4.49 0.18 10.12 0.04 -1.26 -0.78 135.00 148.74 3fbk s PRO 104 Ca 0.09 1.90 0.07 0.00 0.04 0.00 0.00 61.00 63.11 3fbk s PRO 104 Cb -0.23 -3.22 -0.04 0.00 0.04 0.00 0.00 34.50 31.05 3fbk s PRO 104 CO -0.04 -0.07 -0.15 0.14 0.04 0.00 0.00 177.00 176.93 3fbk s VAL 105 N -0.25 1.62 0.33 -0.36 -7.23 -0.66 -4.92 120.40 108.93 3fbk s VAL 105 Ca 0.52 -2.06 0.05 0.00 -1.81 0.00 0.00 61.98 58.68 3fbk s VAL 105 Cb -0.33 -1.90 -0.06 0.00 0.56 0.00 0.00 36.38 34.64 3fbk s VAL 105 CO 0.38 -0.53 0.03 0.00 -0.31 0.00 0.00 175.10 174.68 3fbk s GLN 106 N -3.33 1.67 0.31 4.82 -2.07 -1.26 -4.68 119.66 115.12 3fbk s GLN 106 Ca 0.18 -1.91 0.08 0.00 -1.82 0.00 0.00 55.36 51.89 3fbk s GLN 106 Cb -0.02 -1.01 0.87 0.00 -1.09 0.00 0.00 33.01 31.76 3fbk s GLN 106 CO 0.05 -0.13 1.67 1.49 -1.32 0.00 0.00 175.29 177.05 3fbk h GLU 107 N 2.11 0.30 0.00 9.60 4.57 -2.02 0.33 114.58 129.47 3fbk h GLU 107 Ca -0.41 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.75 3fbk h GLU 107 Cb 1.24 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.76 3fbk h GLU 107 CO 0.71 0.20 0.00 0.39 -1.18 0.00 0.00 179.01 179.13 3fbk n GLU 108 N -5.11 0.10 0.00 1.92 4.71 -1.26 -2.10 120.64 118.90 3fbk n GLU 108 Ca 0.26 0.24 0.11 0.00 -0.01 0.00 0.00 57.16 57.75 3fbk n GLU 108 Cb 0.80 -1.50 -0.03 0.00 -1.01 0.00 0.00 31.44 29.70 3fbk n GLU 108 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 3fbk n ASP 109 N -1.35 1.48 -0.33 1.62 10.43 0.12 -4.58 116.55 123.94 3fbk n ASP 109 Ca 0.04 -1.22 0.19 0.00 2.57 0.00 0.00 54.79 56.37 3fbk n ASP 109 Cb 0.09 0.68 0.43 0.00 1.84 0.00 0.00 41.12 44.16 3fbk n ASP 109 CO 0.00 0.00 0.00 0.44 -1.07 0.00 0.00 177.20 176.57 3fbk h ASP 110 N 1.23 0.59 -0.12 -2.24 3.45 -1.48 0.17 116.42 118.03 3fbk h ASP 110 Ca 0.00 0.10 0.00 0.00 0.43 0.00 0.00 57.03 57.56 3fbk h ASP 110 Cb 0.63 -0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.39 3fbk h ASP 110 CO 0.00 0.15 0.00 0.00 -1.57 0.00 0.00 179.24 177.82 3fbk n GLN 111 N -4.72 1.52 -2.69 3.56 3.00 -1.26 -2.30 117.38 114.49 3fbk n GLN 111 Ca 0.25 -0.79 -0.22 0.00 -0.01 0.00 0.00 57.00 56.23 3fbk n GLN 111 Cb 0.75 -1.36 0.07 0.00 0.00 0.00 0.00 30.24 29.70 3fbk n GLN 111 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 3fbk s LYS 112 N -1.84 2.15 0.03 -1.09 1.02 0.05 -4.89 119.74 115.16 3fbk s LYS 112 Ca 0.30 -1.07 0.08 0.00 0.02 0.00 0.00 55.97 55.30 3fbk s LYS 112 Cb 0.16 -2.46 -0.02 0.00 -0.52 0.00 0.00 37.83 34.99 3fbk s LYS 112 CO 0.24 -1.03 -0.23 1.03 -0.92 0.00 0.00 175.35 174.45 3fbk s ARG 113 N -4.89 1.64 -0.32 1.68 0.52 0.61 -1.59 118.95 116.60 3fbk s ARG 113 Ca 0.62 -0.95 -0.25 0.00 -0.52 0.00 0.00 55.73 54.62 3fbk s ARG 113 Cb -0.08 -1.72 0.01 0.00 0.52 0.00 0.00 34.95 33.68 3fbk s ARG 113 CO 0.41 0.45 0.88 -1.17 0.02 0.00 0.00 175.30 175.89 3fbk s LEU 114 N -1.00 4.04 -0.19 2.53 2.96 0.16 -0.95 118.68 126.23 3fbk s LEU 114 Ca 0.09 0.73 -0.09 0.00 -0.22 0.00 0.00 54.13 54.64 3fbk s LEU 114 Cb -0.09 -3.21 -0.05 0.00 0.50 0.00 0.00 46.19 43.34 3fbk s LEU 114 CO 0.01 -0.72 0.13 -0.22 -1.32 0.00 0.00 176.35 174.23 3fbk s LEU 115 N 3.20 4.23 -0.22 -0.68 2.96 0.66 -0.95 118.68 127.86 3fbk s LEU 115 Ca 0.36 0.26 0.01 0.00 -0.22 0.00 0.00 54.13 54.54 3fbk s LEU 115 Cb -0.13 -2.08 0.03 0.00 0.50 0.00 0.00 46.19 44.51 3fbk s LEU 115 CO 0.14 0.22 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.57 3fbk s VAL 116 N 0.13 2.36 -0.05 1.68 1.01 -1.26 -1.81 120.40 122.46 3fbk s VAL 116 Ca 0.09 -1.12 0.05 0.00 0.00 0.00 0.00 61.98 60.99 3fbk s VAL 116 Cb -0.11 -2.16 -0.01 0.00 0.00 0.00 0.00 36.38 34.11 3fbk s VAL 116 CO -0.01 0.30 -0.20 -0.89 0.00 0.00 0.00 175.10 174.30 3fbk s THR 117 N 1.26 1.64 -0.22 3.92 2.01 -0.36 -4.35 115.64 119.55 3fbk s THR 117 Ca 0.00 -0.83 -0.10 0.00 0.31 0.00 0.00 61.69 61.07 3fbk s THR 117 Cb -0.16 -1.41 -0.05 0.00 0.01 0.00 0.00 72.50 70.90 3fbk s THR 117 CO -0.08 0.47 0.13 -0.69 -0.69 0.00 0.00 174.62 173.75 3fbk s VAL 118 N -0.00 5.23 0.14 3.82 1.01 0.01 -0.16 120.40 130.44 3fbk s VAL 118 Ca -0.04 0.13 0.09 0.00 0.00 0.00 0.00 61.98 62.16 3fbk s VAL 118 Cb -0.13 -3.41 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 3fbk s VAL 118 CO 0.03 0.39 -0.18 0.26 0.00 0.00 0.00 175.10 175.60 3fbk s TRP 119 N 0.77 2.51 -0.43 5.22 0.52 -0.14 -0.97 118.94 126.41 3fbk s TRP 119 Ca 0.07 -0.28 -0.11 0.00 0.02 0.00 0.00 56.10 55.80 3fbk s TRP 119 Cb -0.13 -1.31 0.07 0.00 -1.15 0.00 0.00 33.47 30.96 3fbk s TRP 119 CO 0.02 0.41 0.29 1.21 0.02 0.00 0.00 176.95 178.91 3fbk s ASN 120 N -2.29 5.78 0.32 2.95 2.47 0.78 -1.73 114.94 123.22 3fbk s ASN 120 Ca 0.19 -1.43 -0.29 0.00 0.42 0.00 0.00 52.86 51.75 3fbk s ASN 120 Cb -0.10 -2.04 -0.11 0.00 -1.45 0.00 0.00 41.25 37.55 3fbk s ASN 120 CO 0.11 -0.56 1.49 -0.60 -3.72 0.00 0.00 177.10 173.82 3fbk s ARG 121 N 1.49 4.17 0.24 0.43 3.52 0.16 -1.99 118.95 126.97 3fbk s ARG 121 Ca 0.03 2.49 0.10 0.00 -0.13 0.00 0.00 55.73 58.22 3fbk s ARG 121 Cb -0.23 -3.02 -0.05 0.00 -1.56 0.00 0.00 34.95 30.09 3fbk s ARG 121 CO 0.04 -0.50 -0.18 0.00 -0.81 0.00 0.00 175.30 173.84 3fbk s ALA 122 N -0.60 2.44 0.41 6.12 0.00 -1.26 -4.79 121.76 124.09 3fbk s ALA 122 Ca 0.57 -1.77 0.16 0.00 0.00 0.00 0.00 51.96 50.92 3fbk s ALA 122 Cb -0.45 -0.20 1.04 0.00 0.00 0.00 0.00 23.12 23.50 3fbk s ALA 122 CO 0.54 0.22 1.88 0.66 0.00 0.00 0.00 175.76 179.06 3fbk h SER 123 N 2.49 0.43 -3.28 0.00 4.64 -1.96 -3.36 113.55 112.51 3fbk h SER 123 Ca -0.40 0.03 -0.67 0.00 -0.47 0.00 0.00 61.79 60.29 3fbk h SER 123 Cb 1.24 -0.05 -0.30 0.00 -0.31 0.00 0.00 62.40 62.98 3fbk h SER 123 CO 0.59 0.20 -0.81 -1.58 -0.87 0.00 0.00 176.83 174.36 3fbk s GLN 124 N -5.45 3.21 0.29 4.77 0.74 -1.26 -5.03 119.66 116.92 3fbk s GLN 124 Ca -0.08 -0.76 0.00 0.00 0.05 0.00 0.00 55.36 54.57 3fbk s GLN 124 Cb 0.22 -2.59 0.69 0.00 1.10 0.00 0.00 33.01 32.43 3fbk s GLN 124 CO 0.78 0.04 1.60 0.77 -0.55 0.00 0.00 175.29 177.93 3fbk h SER 125 N 7.22 -0.32 0.00 6.67 0.02 -1.99 0.84 113.55 126.00 3fbk h SER 125 Ca -0.31 0.24 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 3fbk h SER 125 Cb 1.19 0.40 0.00 0.00 0.14 0.00 0.00 62.40 64.13 3fbk h SER 125 CO 0.56 -0.27 0.12 0.08 -1.14 0.00 0.00 176.83 176.18 3fbk h ARG 126 N 0.08 0.00 -0.00 3.45 0.11 -1.96 0.51 114.38 116.56 3fbk h ARG 126 Ca 0.55 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.63 3fbk h ARG 126 Cb 1.12 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.20 3fbk h ARG 126 CO -0.80 0.00 -0.45 1.04 0.10 0.00 0.00 179.97 179.86 3fbk n GLN 127 N -2.98 0.42 -2.09 0.08 3.00 0.29 -4.91 117.38 111.18 3fbk n GLN 127 Ca -0.03 -0.27 -0.42 0.00 -0.01 0.00 0.00 57.00 56.28 3fbk n GLN 127 Cb 0.18 -1.49 -0.03 0.00 0.00 0.00 0.00 30.24 28.90 3fbk n GLN 127 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 3fbk s SER 128 N -2.77 6.74 0.20 1.08 0.01 0.17 -4.69 113.70 114.45 3fbk s SER 128 Ca 0.16 2.42 -0.05 0.00 1.31 0.00 0.00 55.95 59.80 3fbk s SER 128 Cb 0.18 -2.59 -0.06 0.00 0.21 0.00 0.00 66.02 63.77 3fbk s SER 128 CO 0.64 -0.71 0.45 -0.83 0.41 0.00 0.00 173.24 173.20 3fbk s GLY 129 N 1.12 2.09 -0.15 3.44 0.00 -0.84 -4.87 107.32 108.11 3fbk s GLY 129 Ca 0.66 -0.55 -0.22 0.00 0.00 0.00 0.00 44.72 44.61 3fbk s GLY 129 CO 0.30 -0.46 0.68 -2.27 0.00 0.00 0.00 173.10 171.36 3fbk s LEU 130 N -2.98 4.20 -0.18 0.66 0.20 -1.26 -0.16 118.68 119.16 3fbk s LEU 130 Ca 0.42 0.99 -0.22 0.00 0.69 0.00 0.00 54.13 56.02 3fbk s LEU 130 Cb -0.11 -3.00 -0.19 0.00 -0.43 0.00 0.00 46.19 42.45 3fbk s LEU 130 CO 0.26 -0.25 0.36 0.40 -0.29 0.00 0.00 176.35 176.84 3fbk h ILE 131 N 5.05 1.11 -1.60 6.68 2.04 -1.37 -3.47 117.51 125.94 3fbk h ILE 131 Ca -0.34 -2.10 0.29 0.00 1.00 0.00 0.00 64.86 63.71 3fbk h ILE 131 Cb 1.16 2.36 -0.13 0.00 -0.74 0.00 0.00 36.82 39.47 3fbk h ILE 131 CO 0.78 0.37 0.77 -0.83 0.00 0.00 0.00 178.15 179.24 3fbk s GLY 132 N -4.54 -0.37 0.01 5.37 0.00 -1.18 -4.71 107.32 101.90 3fbk s GLY 132 Ca -0.23 0.77 -0.00 0.00 0.00 0.00 0.00 44.72 45.26 3fbk s GLY 132 CO 0.57 0.18 0.01 0.00 0.00 0.00 0.00 173.10 173.86 3fbk s SER 135 N -1.03 -0.43 -0.02 0.00 1.04 -0.65 -0.52 113.70 112.09 3fbk s SER 135 Ca 0.00 -0.03 0.01 0.00 0.48 0.00 0.00 55.95 56.42 3fbk s SER 135 Cb -0.00 0.47 0.01 0.00 0.10 0.00 0.00 66.02 66.60 3fbk s SER 135 CO 0.00 -0.77 -0.04 -0.36 0.98 0.00 0.00 173.24 173.05 3fbk s PHE 136 N -3.37 0.53 0.25 5.02 0.08 -0.13 -3.53 117.98 116.84 3fbk s PHE 136 Ca 0.04 -0.11 -0.30 0.00 0.12 0.00 0.00 56.93 56.68 3fbk s PHE 136 Cb -0.01 -0.45 -0.10 0.00 -0.57 0.00 0.00 43.02 41.89 3fbk s PHE 136 CO -0.10 -0.10 1.43 0.20 -0.10 0.00 0.00 175.22 176.56 3fbk s GLY 137 N 0.49 2.36 0.12 4.36 0.00 -1.26 0.36 107.32 113.75 3fbk s GLY 137 Ca -0.06 1.33 -0.17 0.00 0.00 0.00 0.00 44.72 45.82 3fbk s GLY 137 CO -0.00 2.26 1.68 -2.08 0.00 0.00 0.00 173.10 174.95 3fbk h VAL 138 N 3.51 1.18 -0.58 1.40 2.07 -1.46 -2.54 116.25 119.83 3fbk h VAL 138 Ca -0.46 -0.52 0.01 0.00 0.82 0.00 0.00 66.70 66.54 3fbk h VAL 138 Cb 1.22 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 3fbk h VAL 138 CO 0.77 0.19 0.38 0.50 0.02 0.00 0.00 177.57 179.42 3fbk h LYS 139 N 0.39 0.76 0.00 1.57 3.64 -1.70 -1.91 116.57 119.31 3fbk h LYS 139 Ca 0.11 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 3fbk h LYS 139 Cb 0.16 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 31.81 3fbk h LYS 139 CO -0.01 0.51 -0.11 1.03 -2.27 0.00 0.00 179.45 178.60 3fbk h SER 140 N 0.78 0.00 1.22 4.20 0.87 -1.84 -1.86 113.55 116.92 3fbk h SER 140 Ca 0.21 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.77 3fbk h SER 140 Cb -0.09 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.87 3fbk h SER 140 CO -0.05 0.11 0.00 -0.07 -0.53 0.00 0.00 176.83 176.29 3fbk h LEU 141 N 0.00 0.00 -0.61 2.23 3.38 -0.91 -2.92 115.31 116.48 3fbk h LEU 141 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3fbk h LEU 141 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3fbk h LEU 141 CO 0.01 0.00 -0.29 0.18 0.09 0.00 0.00 178.44 178.43 3fbk n LEU 142 N -2.67 1.24 -0.02 1.67 4.77 -0.70 -4.43 117.00 116.85 3fbk n LEU 142 Ca 0.03 -0.37 0.06 0.00 -0.03 0.00 0.00 56.01 55.70 3fbk n LEU 142 Cb 0.35 -0.09 -0.14 0.00 -2.33 0.00 0.00 43.42 41.21 3fbk n LEU 142 CO 0.27 0.23 -0.78 1.07 -1.33 0.00 0.00 177.39 176.85 3fbk n THR 143 N -0.50 0.22 -3.67 -5.08 5.66 -1.11 -5.06 114.28 104.75 3fbk n THR 143 Ca 0.12 -0.47 -0.10 0.00 -3.05 0.00 0.00 64.05 60.55 3fbk n THR 143 Cb 0.37 -0.03 -0.09 0.00 -1.55 0.00 0.00 70.33 69.03 3fbk n THR 143 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 3fbk s GLU 147 N -3.09 0.61 -0.05 1.09 -6.30 -1.26 -5.14 118.70 104.55 3fbk s GLU 147 Ca -0.07 0.97 0.03 0.00 -2.50 0.00 0.00 54.97 53.40 3fbk s GLU 147 Cb 0.10 0.16 -0.02 0.00 0.00 0.00 0.00 34.13 34.36 3fbk s GLU 147 CO 0.74 -0.13 -0.15 0.42 0.02 0.00 0.00 175.26 176.16 3fbk s ILE 148 N 1.14 3.03 -0.30 -3.70 1.09 -0.66 -5.00 121.20 116.80 3fbk s ILE 148 Ca -0.07 -0.73 -0.15 0.00 -1.10 0.00 0.00 60.65 58.60 3fbk s ILE 148 Cb -0.06 -2.19 0.16 0.00 -1.06 0.00 0.00 42.46 39.31 3fbk s ILE 148 CO -0.11 0.59 0.98 -0.55 -0.10 0.00 0.00 174.94 175.75 3fbk s SER 149 N -0.65 -0.55 0.00 3.58 0.15 -1.26 -1.03 113.70 113.94 3fbk s SER 149 Ca 0.10 0.80 0.00 0.00 0.70 0.00 0.00 55.95 57.55 3fbk s SER 149 Cb -0.11 1.46 0.00 0.00 -1.71 0.00 0.00 66.02 65.66 3fbk s SER 149 CO 0.01 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 174.94 3fbk n GLY 150 N 4.41 0.94 3.77 9.45 0.00 -0.65 -5.01 105.19 118.09 3fbk n GLY 150 Ca -0.13 -1.93 -0.39 0.00 0.00 0.00 0.00 46.02 43.57 3fbk n GLY 150 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3fbk s TRP 151 N -2.41 3.71 0.11 1.61 0.52 -1.26 -1.65 118.94 119.57 3fbk s TRP 151 Ca 0.00 1.24 0.06 0.00 0.02 0.00 0.00 56.10 57.42 3fbk s TRP 151 Cb 0.00 -2.61 -0.03 0.00 -1.15 0.00 0.00 33.47 29.68 3fbk s TRP 151 CO 0.00 0.39 -0.14 0.71 0.02 0.00 0.00 176.95 177.93 3fbk s TYR 152 N -0.36 1.37 0.27 -1.98 2.02 0.39 -0.21 117.35 118.84 3fbk s TYR 152 Ca 0.31 -0.52 -0.22 0.00 -0.37 0.00 0.00 57.07 56.27 3fbk s TYR 152 Cb -0.19 -0.73 -0.09 0.00 -0.40 0.00 0.00 41.96 40.55 3fbk s TYR 152 CO 0.18 0.12 0.81 0.71 -1.57 0.00 0.00 175.55 175.80 3fbk s TYR 153 N -1.84 3.64 -0.33 2.71 2.02 0.43 -0.69 117.35 123.29 3fbk s TYR 153 Ca 0.06 1.53 -0.20 0.00 -0.37 0.00 0.00 57.07 58.08 3fbk s TYR 153 Cb -0.07 -2.73 -0.00 0.00 -0.40 0.00 0.00 41.96 38.76 3fbk s TYR 153 CO 0.03 0.26 0.63 -0.51 -1.57 0.00 0.00 175.55 174.39 3fbk s LEU 154 N -2.09 4.20 0.61 -1.29 1.43 0.29 -4.62 118.68 117.22 3fbk s LEU 154 Ca 0.47 0.28 0.04 0.00 -1.03 0.00 0.00 54.13 53.88 3fbk s LEU 154 Cb -0.17 -2.80 0.08 0.00 0.03 0.00 0.00 46.19 43.34 3fbk s LEU 154 CO 0.21 -0.54 0.85 -0.76 0.23 0.00 0.00 176.35 176.34 3fbk s LEU 155 N 2.66 3.15 0.87 1.79 1.43 0.33 -1.71 118.68 127.19 3fbk s LEU 155 Ca 0.25 -0.45 -0.11 0.00 -1.03 0.00 0.00 54.13 52.78 3fbk s LEU 155 Cb -0.15 -2.11 0.11 0.00 0.03 0.00 0.00 46.19 44.07 3fbk s LEU 155 CO 0.13 -1.45 1.09 -0.83 0.23 0.00 0.00 176.35 175.53 3fbk s GLY 156 N -4.62 1.64 0.62 -3.19 0.00 -1.25 -0.78 107.32 99.73 3fbk s GLY 156 Ca 0.62 0.12 0.28 0.00 0.00 0.00 0.00 44.72 45.74 3fbk s GLY 156 CO 0.40 0.56 1.87 1.05 0.00 0.00 0.00 173.10 176.99 3fbk h GLU 157 N -1.50 0.00 0.00 2.90 4.11 -1.92 0.92 114.58 119.10 3fbk h GLU 157 Ca -0.47 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 58.77 3fbk h GLU 157 Cb 1.27 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.49 3fbk h GLU 157 CO 0.52 0.00 -1.58 0.72 0.07 0.00 0.00 179.01 178.74 3fbk n HIS 158 N -3.42 0.00 -0.32 2.06 8.25 -1.26 -4.53 115.22 116.00 3fbk n HIS 158 Ca 0.05 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.55 3fbk n HIS 158 Cb 0.60 -0.67 0.19 0.00 1.12 0.00 0.00 29.99 31.22 3fbk n HIS 158 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3fbk h LEU 159 N -0.95 0.76 -2.91 2.41 5.85 -1.90 -2.27 115.31 116.30 3fbk h LEU 159 Ca -0.28 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 3fbk h LEU 159 Cb 1.21 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.14 3fbk h LEU 159 CO -0.17 0.42 -0.00 1.23 -0.34 0.00 0.00 178.44 179.59 3fbk h GLY 160 N 0.86 0.00 0.88 3.75 0.00 -1.02 -0.77 103.07 106.77 3fbk h GLY 160 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.76 3fbk h GLY 160 CO -0.25 0.00 -0.08 0.54 0.00 0.00 0.00 176.54 176.75 3fbk n ARG 161 N -3.16 0.78 -0.00 4.80 1.74 -0.85 -1.77 116.66 118.20 3fbk n ARG 161 Ca -0.03 -0.23 0.04 0.00 -0.77 0.00 0.00 57.85 56.86 3fbk n ARG 161 Cb 0.08 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 29.96 3fbk n ARG 161 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3fbk n THR 162 N -0.91 0.00 -3.46 0.55 -2.24 -0.30 -4.89 114.28 103.03 3fbk n THR 162 Ca 0.16 -0.22 -0.01 0.00 -2.27 0.00 0.00 64.05 61.71 3fbk n THR 162 Cb 0.26 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.97 3fbk n THR 162 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 3fbk n LYS 163 N -1.64 0.16 -4.00 -0.78 2.85 -1.17 -4.99 118.16 108.59 3fbk n LYS 163 Ca -0.01 -0.35 -0.08 0.00 -1.05 0.00 0.00 58.31 56.82 3fbk n LYS 163 Cb 0.20 0.47 -0.09 0.00 -0.65 0.00 0.00 35.03 34.96 3fbk n LYS 163 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 177.40 173.97 3fbk s HIS 164 N -5.60 0.36 -0.10 5.58 -3.43 -1.23 -1.64 115.29 109.23 3fbk s HIS 164 Ca 0.05 -0.82 -0.03 0.00 -0.80 0.00 0.00 55.06 53.45 3fbk s HIS 164 Cb -0.01 -0.25 0.05 0.00 -1.43 0.00 0.00 32.58 30.94 3fbk s HIS 164 CO 0.01 -0.41 0.11 -0.51 -2.00 0.00 0.00 174.74 171.94 3fbk s LEU 165 N -2.72 0.09 0.57 5.38 1.43 -1.26 -5.03 118.68 117.14 3fbk s LEU 165 Ca 0.04 -0.01 -0.15 0.00 -1.03 0.00 0.00 54.13 52.98 3fbk s LEU 165 Cb 0.05 0.02 -0.05 0.00 0.03 0.00 0.00 46.19 46.24 3fbk s LEU 165 CO -0.09 -0.28 1.02 -1.59 0.23 0.00 0.00 176.35 175.64 3fbk s LYS 166 N 2.22 3.67 -0.39 1.70 -2.85 -1.26 -0.43 119.74 122.39 3fbk s LYS 166 Ca 0.04 0.96 -0.24 0.00 -1.00 0.00 0.00 55.97 55.73 3fbk s LYS 166 Cb -0.13 -2.09 0.02 0.00 -2.06 0.00 0.00 37.83 33.56 3fbk s LYS 166 CO -0.06 -0.51 0.84 0.08 0.10 0.00 0.00 175.35 175.79 3fbk s VAL 167 N -2.75 4.65 0.24 1.79 1.01 0.70 -4.73 120.40 121.32 3fbk s VAL 167 Ca 0.59 0.88 -0.31 0.00 0.00 0.00 0.00 61.98 63.14 3fbk s VAL 167 Cb -0.12 -4.28 -0.14 0.00 0.00 0.00 0.00 36.38 31.84 3fbk s VAL 167 CO 0.39 -0.55 1.31 0.00 0.00 0.00 0.00 175.10 176.25 3fbk n ALA 168 N 6.64 0.58 0.08 5.51 0.00 -1.26 -4.75 120.51 127.31 3fbk n ALA 168 Ca 0.04 0.42 -0.13 0.00 0.00 0.00 0.00 53.44 53.77 3fbk n ALA 168 Cb 0.48 -2.19 -0.13 0.00 0.00 0.00 0.00 19.45 17.60 3fbk n ALA 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fbk h ARG 169 N 3.69 0.16 -5.45 0.00 3.08 -1.97 -3.47 114.38 110.41 3fbk h ARG 169 Ca -0.44 -0.28 -0.39 0.00 0.07 0.00 0.00 59.98 58.94 3fbk h ARG 169 Cb 1.30 0.10 -0.07 0.00 0.08 0.00 0.00 29.97 31.38 3fbk h ARG 169 CO 0.72 1.10 -0.58 0.54 -1.07 0.00 0.00 179.97 180.68 3fbk n ARG 170 N -3.44 -3.58 0.00 0.04 1.74 -1.26 -5.27 116.66 104.88 3fbk n ARG 170 Ca -0.07 0.51 0.14 0.00 -0.77 0.00 0.00 57.85 57.66 3fbk n ARG 170 Cb 1.00 -5.24 0.53 0.00 -1.02 0.00 0.00 32.46 27.73 3fbk n ARG 170 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65