#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b7f s VAL 2 N 0.00 5.15 -0.45 0.52 1.01 -1.26 -5.07 120.40 120.29 2b7f s VAL 2 Ca 0.00 -1.52 -0.24 0.00 0.00 0.00 0.00 61.98 60.21 2b7f s VAL 2 Cb 0.00 -4.42 0.03 0.00 0.00 0.00 0.00 36.38 31.98 2b7f s VAL 2 CO 0.00 -1.00 0.87 -0.63 0.00 0.00 0.00 175.10 174.34 2b7f s ILE 3 N 1.71 4.55 0.53 2.22 1.09 -1.26 -5.04 121.20 125.00 2b7f s ILE 3 Ca 0.09 0.64 -0.20 0.00 -1.10 0.00 0.00 60.65 60.08 2b7f s ILE 3 Cb -0.24 -4.38 -0.06 0.00 -1.06 0.00 0.00 42.46 36.72 2b7f s ILE 3 CO 0.01 -0.78 1.14 -2.84 -0.10 0.00 0.00 174.94 172.38 2b7f s PRO 4 N 3.56 3.39 -0.05 2.79 0.02 -1.26 -5.02 135.00 138.43 2b7f s PRO 4 Ca 0.34 1.66 -0.03 0.00 0.02 0.00 0.00 61.00 62.99 2b7f s PRO 4 Cb -0.11 -2.07 -0.04 0.00 0.02 0.00 0.00 34.50 32.30 2b7f s PRO 4 CO 0.25 -0.83 0.10 -0.51 -0.33 0.00 0.00 177.00 175.68 2b7f s LEU 5 N -3.69 4.07 -0.28 -5.54 1.43 -1.26 -4.92 118.68 108.50 2b7f s LEU 5 Ca 0.72 0.28 -0.13 0.00 -1.03 0.00 0.00 54.13 53.96 2b7f s LEU 5 Cb -0.25 -2.20 0.10 0.00 0.03 0.00 0.00 46.19 43.86 2b7f s LEU 5 CO 0.29 0.33 0.65 -0.62 0.23 0.00 0.00 176.35 177.23 2b7f s ASP 6 N -1.43 -0.98 0.35 2.29 2.15 -1.26 -5.06 116.67 112.72 2b7f s ASP 6 Ca 0.20 1.49 0.25 0.00 0.43 0.00 0.00 52.55 54.92 2b7f s ASP 6 Cb -0.12 1.72 1.25 0.00 -0.30 0.00 0.00 42.92 45.46 2b7f s ASP 6 CO 0.10 -0.23 1.75 1.55 -0.17 0.00 0.00 175.17 178.17 2b7f h PRO 7 N 7.44 0.00 0.00 4.34 0.13 -2.02 -3.02 132.00 138.87 2b7f h PRO 7 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 2b7f h PRO 7 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2b7f h PRO 7 CO 0.14 0.00 -1.33 0.00 -0.23 0.00 0.00 178.00 176.58 2b7f n ALA 8 N -1.82 3.96 -3.90 -0.56 0.00 -1.26 -4.79 120.51 112.14 2b7f n ALA 8 Ca -0.01 -0.55 -0.29 0.00 0.00 0.00 0.00 53.44 52.59 2b7f n ALA 8 Cb 0.10 -0.79 -0.16 0.00 0.00 0.00 0.00 19.45 18.60 2b7f n ALA 8 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2b7f s ARG 9 N -3.19 1.49 0.33 0.00 0.52 -1.14 -5.11 118.95 111.84 2b7f s ARG 9 Ca 0.02 -0.75 -0.29 0.00 -0.52 0.00 0.00 55.73 54.19 2b7f s ARG 9 Cb 0.15 -2.33 -0.10 0.00 0.52 0.00 0.00 34.95 33.19 2b7f s ARG 9 CO 0.87 -0.53 1.39 1.03 0.02 0.00 0.00 175.30 178.09 2b7f s ARG 10 N 1.53 4.26 -0.20 3.54 0.52 -1.26 -4.35 118.95 122.99 2b7f s ARG 10 Ca -0.03 2.35 -0.27 0.00 -0.52 0.00 0.00 55.73 57.26 2b7f s ARG 10 Cb -0.17 -3.05 -0.00 0.00 0.52 0.00 0.00 34.95 32.25 2b7f s ARG 10 CO -0.07 -0.34 0.92 -1.25 0.02 0.00 0.00 175.30 174.57 2b7f s PRO 11 N -1.57 4.28 0.07 3.54 0.04 -1.26 -5.02 135.00 135.07 2b7f s PRO 11 Ca 0.52 1.15 0.04 0.00 0.04 0.00 0.00 61.00 62.76 2b7f s PRO 11 Cb -0.42 -3.61 -0.03 0.00 0.04 0.00 0.00 34.50 30.48 2b7f s PRO 11 CO 0.54 -0.46 -0.12 0.14 0.04 0.00 0.00 177.00 177.13 2b7f s VAL 12 N 2.61 0.96 0.12 -0.36 -7.23 -1.26 -1.56 120.40 113.68 2b7f s VAL 12 Ca 0.41 -1.29 0.04 0.00 -1.81 0.00 0.00 61.98 59.33 2b7f s VAL 12 Cb -0.16 -0.99 -0.04 0.00 0.56 0.00 0.00 36.38 35.75 2b7f s VAL 12 CO 0.10 -0.29 -0.10 -0.51 -0.31 0.00 0.00 175.10 173.99 2b7f s ILE 13 N -1.41 1.00 -0.21 -0.62 2.07 -0.78 -4.94 121.20 116.30 2b7f s ILE 13 Ca -0.03 -1.86 -0.10 0.00 -1.41 0.00 0.00 60.65 57.25 2b7f s ILE 13 Cb -0.09 -1.61 -0.05 0.00 0.13 0.00 0.00 42.46 40.84 2b7f s ILE 13 CO 0.02 -0.68 0.14 -0.54 -1.91 0.00 0.00 174.94 171.97 2b7f s LYS 14 N -3.34 4.16 -0.04 3.50 -0.14 -1.26 -0.67 119.74 121.96 2b7f s LYS 14 Ca 0.11 -0.23 0.02 0.00 -1.36 0.00 0.00 55.97 54.51 2b7f s LYS 14 Cb 0.01 -3.45 0.01 0.00 -1.68 0.00 0.00 37.83 32.72 2b7f s LYS 14 CO -0.01 0.23 -0.06 0.00 -0.76 0.00 0.00 175.35 174.75 2b7f s ALA 15 N 0.56 0.74 -0.19 5.17 0.00 -0.28 -3.88 121.76 123.88 2b7f s ALA 15 Ca 0.08 -0.16 -0.27 0.00 0.00 0.00 0.00 51.96 51.61 2b7f s ALA 15 Cb -0.12 -0.38 -0.00 0.00 0.00 0.00 0.00 23.12 22.62 2b7f s ALA 15 CO -0.00 0.05 0.93 -1.14 0.00 0.00 0.00 175.76 175.60 2b7f s GLN 16 N 0.62 4.29 -0.17 0.00 0.74 -0.00 -1.00 119.66 124.14 2b7f s GLN 16 Ca -0.09 1.19 -0.03 0.00 0.05 0.00 0.00 55.36 56.48 2b7f s GLN 16 Cb -0.12 -3.60 -0.02 0.00 1.10 0.00 0.00 33.01 30.37 2b7f s GLN 16 CO 0.01 -0.46 -0.07 0.08 -0.55 0.00 0.00 175.29 174.30 2b7f s VAL 17 N 2.60 3.48 -0.38 1.34 1.01 0.12 -0.86 120.40 127.71 2b7f s VAL 17 Ca 0.41 -0.49 -0.08 0.00 0.00 0.00 0.00 61.98 61.83 2b7f s VAL 17 Cb -0.16 -2.53 0.06 0.00 0.00 0.00 0.00 36.38 33.76 2b7f s VAL 17 CO 0.10 0.48 0.19 -0.62 0.00 0.00 0.00 175.10 175.26 2b7f s ASP 18 N 0.69 5.49 0.00 3.32 2.15 0.16 -1.80 116.67 126.68 2b7f s ASP 18 Ca -0.03 -1.37 0.30 0.00 0.43 0.00 0.00 52.55 51.88 2b7f s ASP 18 Cb -0.15 -1.93 1.51 0.00 -0.30 0.00 0.00 42.92 42.05 2b7f s ASP 18 CO 0.02 -0.45 2.01 0.35 -0.17 0.00 0.00 175.17 176.94 2b7f n THR 19 N 4.86 0.00 -1.12 1.71 -2.24 -1.26 -1.65 114.28 114.57 2b7f n THR 19 Ca -0.10 -0.06 -0.09 0.00 -2.27 0.00 0.00 64.05 61.53 2b7f n THR 19 Cb 0.44 -0.20 -0.04 0.00 -2.10 0.00 0.00 70.33 68.43 2b7f n THR 19 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2b7f n GLN 20 N -0.82 -1.53 -0.06 -0.78 6.02 -1.26 -4.71 117.38 114.23 2b7f n GLN 20 Ca 0.19 0.62 0.02 0.00 -0.01 0.00 0.00 57.00 57.82 2b7f n GLN 20 Cb 0.22 -4.70 0.06 0.00 1.02 0.00 0.00 30.24 26.84 2b7f n GLN 20 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2b7f n THR 21 N -1.66 0.81 0.00 5.09 -2.24 -1.26 -5.08 114.28 109.94 2b7f n THR 21 Ca -0.09 -0.91 0.00 0.00 -2.27 0.00 0.00 64.05 60.79 2b7f n THR 21 Cb 0.39 0.61 0.00 0.00 -2.10 0.00 0.00 70.33 69.24 2b7f n THR 21 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2b7f n SER 22 N -0.01 0.00 -4.73 3.42 3.41 -1.26 -3.87 113.62 110.58 2b7f n SER 22 Ca 0.04 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.24 2b7f n SER 22 Cb 0.29 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.21 2b7f n SER 22 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2b7f s HIS 23 N -2.00 2.95 0.06 7.33 0.09 -1.26 -4.48 115.29 117.99 2b7f s HIS 23 Ca 0.00 0.64 -0.37 0.00 -0.00 0.00 0.00 55.06 55.33 2b7f s HIS 23 Cb 0.00 -4.00 -0.18 0.00 -0.00 0.00 0.00 32.58 28.40 2b7f s HIS 23 CO 0.00 -3.59 1.08 -2.30 -0.00 0.00 0.00 174.74 169.93 2b7f n PRO 24 N 3.38 0.39 -5.26 8.40 -0.02 -1.26 -4.90 135.00 135.73 2b7f n PRO 24 Ca 0.12 0.14 -0.31 0.00 -2.02 0.00 0.00 63.50 61.43 2b7f n PRO 24 Cb 0.38 -1.62 -0.16 0.00 -0.02 0.00 0.00 33.50 32.08 2b7f n PRO 24 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2b7f s LYS 25 N -0.05 2.29 -0.10 -0.52 1.02 -0.74 -4.93 119.74 116.72 2b7f s LYS 25 Ca 0.84 -0.90 -0.27 0.00 0.02 0.00 0.00 55.97 55.66 2b7f s LYS 25 Cb -1.11 -2.11 -0.02 0.00 -0.52 0.00 0.00 37.83 34.06 2b7f s LYS 25 CO 0.54 0.51 0.91 0.99 -0.92 0.00 0.00 175.35 177.37 2b7f s THR 26 N -0.47 4.87 0.24 2.17 2.01 -1.26 0.15 115.64 123.35 2b7f s THR 26 Ca 0.06 1.84 0.04 0.00 0.31 0.00 0.00 61.69 63.94 2b7f s THR 26 Cb -0.11 -4.22 -0.05 0.00 0.01 0.00 0.00 72.50 68.12 2b7f s THR 26 CO 0.01 0.08 -0.02 0.27 -0.69 0.00 0.00 174.62 174.26 2b7f s ILE 27 N 1.68 1.21 -0.13 1.82 -4.36 -0.17 -4.92 121.20 116.34 2b7f s ILE 27 Ca 0.45 -2.06 -0.16 0.00 -0.26 0.00 0.00 60.65 58.61 2b7f s ILE 27 Cb -0.18 -2.36 -0.04 0.00 1.25 0.00 0.00 42.46 41.12 2b7f s ILE 27 CO 0.18 -0.33 0.41 -0.70 0.24 0.00 0.00 174.94 174.75 2b7f s GLU 28 N -3.82 4.29 0.01 0.37 2.12 -1.26 -1.12 118.70 119.28 2b7f s GLU 28 Ca 0.28 0.33 0.03 0.00 0.36 0.00 0.00 54.97 55.97 2b7f s GLU 28 Cb 0.05 -3.42 -0.01 0.00 0.26 0.00 0.00 34.13 31.01 2b7f s GLU 28 CO 0.09 0.21 -0.11 0.00 -0.54 0.00 0.00 175.26 174.92 2b7f s ALA 29 N 0.49 0.88 0.25 6.30 0.00 0.16 -4.71 121.76 125.13 2b7f s ALA 29 Ca 0.23 -0.53 -0.30 0.00 0.00 0.00 0.00 51.96 51.35 2b7f s ALA 29 Cb -0.14 -0.19 -0.10 0.00 0.00 0.00 0.00 23.12 22.69 2b7f s ALA 29 CO 0.08 0.19 1.46 -1.17 0.00 0.00 0.00 175.76 176.32 2b7f s LEU 30 N -0.52 4.38 -0.45 0.00 2.96 0.27 -1.87 118.68 123.45 2b7f s LEU 30 Ca 0.02 2.70 -0.20 0.00 -0.22 0.00 0.00 54.13 56.43 2b7f s LEU 30 Cb -0.05 -3.62 0.03 0.00 0.50 0.00 0.00 46.19 43.05 2b7f s LEU 30 CO 0.00 -0.73 0.63 -0.76 -1.32 0.00 0.00 176.35 174.17 2b7f s LEU 31 N -0.38 4.61 -0.29 -0.68 1.43 -0.60 -0.23 118.68 122.53 2b7f s LEU 31 Ca 0.60 -0.48 -0.04 0.00 -1.03 0.00 0.00 54.13 53.18 2b7f s LEU 31 Cb -0.43 -2.65 0.10 0.00 0.03 0.00 0.00 46.19 43.25 2b7f s LEU 31 CO 0.44 -0.80 0.13 -0.62 0.23 0.00 0.00 176.35 175.73 2b7f s ASP 32 N 2.14 3.57 0.07 2.29 2.15 -0.92 -4.79 116.67 121.18 2b7f s ASP 32 Ca 0.20 -1.35 0.21 0.00 0.43 0.00 0.00 52.55 52.05 2b7f s ASP 32 Cb -0.15 -0.40 0.87 0.00 -0.30 0.00 0.00 42.92 42.94 2b7f s ASP 32 CO 0.17 -0.43 1.67 0.35 -0.17 0.00 0.00 175.17 176.75 2b7f n THR 33 N 5.18 0.66 -0.13 1.71 -2.24 -1.26 -2.13 114.28 116.06 2b7f n THR 33 Ca -0.05 0.12 0.05 0.00 -2.27 0.00 0.00 64.05 61.90 2b7f n THR 33 Cb 0.42 -0.85 0.25 0.00 -2.10 0.00 0.00 70.33 68.05 2b7f n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b7f n GLY 34 N 0.54 2.33 3.35 3.38 0.00 -1.26 -4.82 105.19 108.72 2b7f n GLY 34 Ca 0.04 -0.57 -0.36 0.00 0.00 0.00 0.00 46.02 45.13 2b7f n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b7f s ALA 35 N -2.05 2.99 0.19 4.61 0.00 -0.91 -4.98 121.76 121.61 2b7f s ALA 35 Ca 0.34 -1.27 -0.11 0.00 0.00 0.00 0.00 51.96 50.91 2b7f s ALA 35 Cb 0.25 -1.96 0.20 0.00 0.00 0.00 0.00 23.12 21.61 2b7f s ALA 35 CO 0.11 -0.64 1.78 -0.44 0.00 0.00 0.00 175.76 176.56 2b7f h ASP 36 N 8.18 0.37 -4.64 0.00 3.32 -1.89 -1.65 116.42 120.11 2b7f h ASP 36 Ca -0.37 0.04 -0.32 0.00 0.02 0.00 0.00 57.03 56.40 2b7f h ASP 36 Cb 1.15 -0.02 -0.21 0.00 0.22 0.00 0.00 39.33 40.47 2b7f h ASP 36 CO 0.59 0.24 -0.75 0.00 -1.72 0.00 0.00 179.24 177.61 2b7f s MET 37 N -6.11 0.65 0.61 3.56 0.23 -1.26 -3.29 119.30 113.69 2b7f s MET 37 Ca -0.13 -0.86 -0.19 0.00 -1.03 0.00 0.00 55.69 53.49 2b7f s MET 37 Cb 0.15 -0.48 -0.04 0.00 -1.53 0.00 0.00 34.83 32.93 2b7f s MET 37 CO 0.74 0.10 1.13 2.41 -2.03 0.00 0.00 175.02 177.37 2b7f n THR 38 N 1.32 4.17 -4.43 3.16 -1.04 -1.26 -4.52 114.28 111.68 2b7f n THR 38 Ca -0.22 -0.50 -0.27 0.00 -2.04 0.00 0.00 64.05 61.03 2b7f n THR 38 Cb 0.55 -1.33 -0.17 0.00 -1.82 0.00 0.00 70.33 67.56 2b7f n THR 38 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2b7f s VAL 39 N -1.44 1.26 0.09 12.58 1.01 0.12 -1.57 120.40 132.46 2b7f s VAL 39 Ca 0.78 -0.51 0.07 0.00 0.00 0.00 0.00 61.98 62.32 2b7f s VAL 39 Cb -0.41 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.77 2b7f s VAL 39 CO 0.45 0.39 -0.19 0.27 0.00 0.00 0.00 175.10 176.02 2b7f s ILE 40 N 0.96 1.57 0.30 2.22 -4.36 -0.74 -1.74 121.20 119.41 2b7f s ILE 40 Ca -0.08 -1.47 -0.29 0.00 -0.26 0.00 0.00 60.65 58.55 2b7f s ILE 40 Cb -0.15 -1.44 -0.10 0.00 1.25 0.00 0.00 42.46 42.02 2b7f s ILE 40 CO -0.00 -0.08 1.23 -2.16 0.24 0.00 0.00 174.94 174.16 2b7f s PRO 41 N -1.83 4.47 0.55 0.37 0.04 -1.18 -0.74 135.00 136.69 2b7f s PRO 41 Ca 0.05 2.04 0.28 0.00 0.04 0.00 0.00 61.00 63.40 2b7f s PRO 41 Cb -0.10 -3.13 1.46 0.00 0.04 0.00 0.00 34.50 32.77 2b7f s PRO 41 CO 0.04 -0.04 1.97 0.97 0.04 0.00 0.00 177.00 179.97 2b7f h ILE 42 N 3.14 0.58 0.00 0.56 2.10 -1.09 -1.94 117.51 120.86 2b7f h ILE 42 Ca -0.48 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.46 2b7f h ILE 42 Cb 1.22 0.69 0.00 0.00 -1.09 0.00 0.00 36.82 37.64 2b7f h ILE 42 CO 0.67 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 177.74 2b7f n ALA 43 N -2.54 1.65 1.36 0.18 0.00 -1.26 -1.76 120.51 118.15 2b7f n ALA 43 Ca 0.10 -0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.64 2b7f n ALA 43 Cb 0.64 -1.10 0.42 0.00 0.00 0.00 0.00 19.45 19.42 2b7f n ALA 43 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2b7f n LEU 44 N -1.07 1.68 -4.57 0.00 4.77 -0.73 -4.90 117.00 112.18 2b7f n LEU 44 Ca 0.04 -0.55 -0.29 0.00 -0.03 0.00 0.00 56.01 55.18 2b7f n LEU 44 Cb 0.03 -0.02 -0.10 0.00 -2.33 0.00 0.00 43.42 41.00 2b7f n LEU 44 CO 0.04 0.29 -0.43 -0.36 -1.33 0.00 0.00 177.39 175.59 2b7f s PHE 45 N -2.09 2.70 0.80 -1.77 0.40 -0.72 -4.71 117.98 112.59 2b7f s PHE 45 Ca 0.34 -0.18 -0.11 0.00 -0.60 0.00 0.00 56.93 56.37 2b7f s PHE 45 Cb 0.20 -1.40 0.07 0.00 0.51 0.00 0.00 43.02 42.41 2b7f s PHE 45 CO 0.37 0.44 1.09 -1.54 0.70 0.00 0.00 175.22 176.27 2b7f s SER 46 N -2.32 4.43 0.05 1.36 1.04 -1.25 -4.92 113.70 112.09 2b7f s SER 46 Ca 0.22 1.42 0.19 0.00 0.48 0.00 0.00 55.95 58.25 2b7f s SER 46 Cb -0.11 -2.16 0.78 0.00 0.10 0.00 0.00 66.02 64.64 2b7f s SER 46 CO 0.14 -2.03 1.59 -1.20 0.98 0.00 0.00 173.24 172.72 2b7f n SER 47 N -3.48 0.14 -0.16 7.02 7.64 -1.26 -1.51 113.62 122.01 2b7f n SER 47 Ca 0.07 0.53 -0.09 0.00 1.01 0.00 0.00 58.87 60.39 2b7f n SER 47 Cb 0.55 -0.56 -0.00 0.00 -1.01 0.00 0.00 64.21 63.19 2b7f n SER 47 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 2b7f h ASN 48 N 0.00 0.72 -1.89 6.43 -1.24 -1.98 -3.48 115.58 114.13 2b7f h ASN 48 Ca 0.00 -0.25 -0.65 0.00 0.71 0.00 0.00 56.30 56.11 2b7f h ASN 48 Cb 0.33 -0.19 0.04 0.00 0.73 0.00 0.00 38.32 39.22 2b7f h ASN 48 CO 0.00 0.79 0.82 0.41 -1.29 0.00 0.00 177.43 178.15 2b7f n THR 49 N -4.47 0.23 -2.97 -3.57 -1.04 -0.57 -4.97 114.28 96.91 2b7f n THR 49 Ca 0.00 -0.04 -0.39 0.00 -2.04 0.00 0.00 64.05 61.58 2b7f n THR 49 Cb 0.24 -1.38 -0.06 0.00 -1.82 0.00 0.00 70.33 67.31 2b7f n THR 49 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2b7f s PRO 50 N 2.25 4.57 0.04 -2.82 0.04 -1.26 -5.05 135.00 132.76 2b7f s PRO 50 Ca 0.88 1.16 0.04 0.00 0.04 0.00 0.00 61.00 63.12 2b7f s PRO 50 Cb -0.84 -3.24 -0.02 0.00 0.04 0.00 0.00 34.50 30.44 2b7f s PRO 50 CO 0.50 0.56 -0.11 -0.51 0.04 0.00 0.00 177.00 177.48 2b7f s LEU 51 N -1.20 2.18 0.27 -3.56 1.43 -1.26 -4.78 118.68 111.76 2b7f s LEU 51 Ca 0.36 -0.44 -0.29 0.00 -1.03 0.00 0.00 54.13 52.73 2b7f s LEU 51 Cb -0.23 -0.42 -0.09 0.00 0.03 0.00 0.00 46.19 45.48 2b7f s LEU 51 CO 0.26 -0.04 0.97 -0.54 0.23 0.00 0.00 176.35 177.23 2b7f s LYS 52 N -1.17 4.74 0.65 1.70 3.01 -0.19 -4.82 119.74 123.66 2b7f s LYS 52 Ca -0.02 1.51 -0.17 0.00 -1.01 0.00 0.00 55.97 56.27 2b7f s LYS 52 Cb -0.08 -3.14 -0.01 0.00 -1.01 0.00 0.00 37.83 33.60 2b7f s LYS 52 CO 0.01 0.40 1.22 -0.80 0.51 0.00 0.00 175.35 176.69 2b7f s ASN 53 N -1.24 4.77 -0.17 2.83 0.01 -1.26 0.62 114.94 120.50 2b7f s ASN 53 Ca 0.44 2.42 -0.32 0.00 -0.71 0.00 0.00 52.86 54.69 2b7f s ASN 53 Cb -0.25 -2.60 0.14 0.00 0.41 0.00 0.00 41.25 38.95 2b7f s ASN 53 CO 0.32 -1.88 1.14 0.28 -1.51 0.00 0.00 177.10 175.45 2b7f s THR 54 N -1.69 0.00 0.09 1.60 -1.32 -1.26 -4.69 115.64 108.38 2b7f s THR 54 Ca 0.77 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 61.34 2b7f s THR 54 Cb -0.31 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.64 2b7f s THR 54 CO 0.38 0.00 -0.19 -0.94 -2.21 0.00 0.00 174.62 171.66 2b7f s SER 55 N -1.83 3.78 -0.01 8.08 1.04 -1.26 -4.54 113.70 118.96 2b7f s SER 55 Ca 0.06 -0.54 0.03 0.00 0.48 0.00 0.00 55.95 55.98 2b7f s SER 55 Cb -0.01 -0.52 -0.01 0.00 0.10 0.00 0.00 66.02 65.58 2b7f s SER 55 CO -0.05 0.20 -0.09 -0.69 0.98 0.00 0.00 173.24 173.60 2b7f s VAL 56 N -1.06 0.69 -0.11 5.02 1.01 -0.50 -5.03 120.40 120.42 2b7f s VAL 56 Ca 0.16 -0.37 -0.14 0.00 0.00 0.00 0.00 61.98 61.63 2b7f s VAL 56 Cb -0.10 -0.58 -0.05 0.00 0.00 0.00 0.00 36.38 35.65 2b7f s VAL 56 CO 0.08 0.20 0.35 -0.22 0.00 0.00 0.00 175.10 175.50 2b7f s LEU 57 N -0.20 4.31 -0.27 3.92 0.20 -1.26 -0.55 118.68 124.83 2b7f s LEU 57 Ca 0.03 0.67 -0.15 0.00 0.69 0.00 0.00 54.13 55.38 2b7f s LEU 57 Cb -0.03 -2.47 0.08 0.00 -0.43 0.00 0.00 46.19 43.34 2b7f s LEU 57 CO -0.00 0.15 0.67 -0.83 -0.29 0.00 0.00 176.35 176.05 2b7f s GLY 58 N 0.05 -0.63 0.00 7.98 0.00 -1.21 -5.00 107.32 108.51 2b7f s GLY 58 Ca 0.20 2.37 0.00 0.00 0.00 0.00 0.00 44.72 47.29 2b7f s GLY 58 CO 0.07 2.42 0.00 0.00 0.00 0.00 0.00 173.10 175.59 2b7f n ALA 59 N 4.40 0.00 0.31 3.20 0.00 -1.26 -0.00 120.51 127.16 2b7f n ALA 59 Ca -0.20 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.39 2b7f n ALA 59 Cb 0.58 0.00 0.76 0.00 0.00 0.00 0.00 19.45 20.79 2b7f n ALA 59 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2b7f h GLY 60 N 0.00 0.00 0.00 0.00 0.00 -2.01 -3.49 103.07 97.56 2b7f h GLY 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2b7f h GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2b7f n GLY 61 N -1.26 -2.16 3.49 4.60 0.00 1.00 -5.00 105.19 105.84 2b7f n GLY 61 Ca -0.01 -1.95 -0.42 0.00 0.00 0.00 0.00 46.02 43.63 2b7f n GLY 61 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2b7f s GLN 62 N -0.18 3.19 0.08 1.61 0.74 -1.26 -3.30 119.66 120.53 2b7f s GLN 62 Ca 0.00 -0.72 -0.30 0.00 0.05 0.00 0.00 55.36 54.39 2b7f s GLN 62 Cb 0.00 -4.31 -0.05 0.00 1.10 0.00 0.00 33.01 29.75 2b7f s GLN 62 CO 0.00 -1.94 0.97 -0.08 -0.55 0.00 0.00 175.29 173.70 2b7f s THR 63 N 4.54 4.60 -0.08 -0.34 -1.32 0.28 -4.91 115.64 118.42 2b7f s THR 63 Ca 0.28 2.05 0.15 0.00 -1.21 0.00 0.00 61.69 62.96 2b7f s THR 63 Cb -0.13 -4.31 -0.23 0.00 -1.51 0.00 0.00 72.50 66.32 2b7f s THR 63 CO 0.09 0.26 0.36 0.00 -2.21 0.00 0.00 174.62 173.12 2b7f n GLN 64 N 3.15 0.60 0.00 7.08 1.13 -1.26 -1.41 117.38 126.66 2b7f n GLN 64 Ca 0.04 -0.13 0.00 0.00 -1.94 0.00 0.00 57.00 54.97 2b7f n GLN 64 Cb 0.50 -1.35 0.00 0.00 0.11 0.00 0.00 30.24 29.50 2b7f n GLN 64 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2b7f n ASP 65 N -1.97 1.33 0.07 1.08 8.00 -1.26 -4.60 116.55 119.20 2b7f n ASP 65 Ca -0.02 -0.15 -0.00 0.00 0.71 0.00 0.00 54.79 55.33 2b7f n ASP 65 Cb 0.38 0.56 0.30 0.00 -0.02 0.00 0.00 41.12 42.34 2b7f n ASP 65 CO 0.00 0.00 0.00 0.45 -0.39 0.00 0.00 177.20 177.26 2b7f h HIS 66 N 0.00 0.36 -2.88 1.24 3.86 -1.91 -3.46 115.15 112.37 2b7f h HIS 66 Ca 0.00 -0.06 -0.62 0.00 -1.16 0.00 0.00 60.37 58.54 2b7f h HIS 66 Cb 0.00 -0.10 -0.13 0.00 1.06 0.00 0.00 27.41 28.24 2b7f h HIS 66 CO 0.00 0.51 -0.71 -0.06 0.86 0.00 0.00 177.93 178.53 2b7f s PHE 67 N -4.60 2.64 0.35 2.45 0.08 -1.26 -1.57 117.98 116.07 2b7f s PHE 67 Ca -0.06 -0.22 0.04 0.00 0.12 0.00 0.00 56.93 56.81 2b7f s PHE 67 Cb 0.15 -1.27 -0.03 0.00 -0.57 0.00 0.00 43.02 41.30 2b7f s PHE 67 CO 0.76 0.53 0.15 0.15 -0.10 0.00 0.00 175.22 176.71 2b7f s LYS 68 N -2.96 1.75 0.21 0.44 1.02 -0.55 -4.45 119.74 115.20 2b7f s LYS 68 Ca 0.26 -2.03 0.10 0.00 0.02 0.00 0.00 55.97 54.32 2b7f s LYS 68 Cb -0.08 -0.33 -0.04 0.00 -0.52 0.00 0.00 37.83 36.85 2b7f s LYS 68 CO 0.16 -0.46 -0.12 -0.51 -0.92 0.00 0.00 175.35 173.50 2b7f s LEU 69 N -3.48 2.85 0.44 3.17 1.43 0.20 -1.07 118.68 122.24 2b7f s LEU 69 Ca 0.31 -0.70 -0.07 0.00 -1.03 0.00 0.00 54.13 52.64 2b7f s LEU 69 Cb 0.04 -1.50 -0.05 0.00 0.03 0.00 0.00 46.19 44.71 2b7f s LEU 69 CO 0.17 0.08 0.77 0.42 0.23 0.00 0.00 176.35 178.03 2b7f s THR 70 N -1.89 4.86 -0.04 5.49 -4.23 -1.10 -1.03 115.64 117.71 2b7f s THR 70 Ca 0.26 0.38 0.12 0.00 -1.18 0.00 0.00 61.69 61.26 2b7f s THR 70 Cb -0.08 -3.81 -0.18 0.00 1.34 0.00 0.00 72.50 69.77 2b7f s THR 70 CO 0.15 -0.70 0.22 -1.54 -0.54 0.00 0.00 174.62 172.21 2b7f n SER 71 N -1.82 2.16 -4.95 3.99 3.41 -1.26 -4.68 113.62 110.48 2b7f n SER 71 Ca 0.01 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.38 2b7f n SER 71 Cb 0.55 1.40 -0.02 0.00 -0.26 0.00 0.00 64.21 65.88 2b7f n SER 71 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2b7f s LEU 72 N -4.07 4.19 1.00 1.04 1.43 -1.26 -5.01 118.68 115.99 2b7f s LEU 72 Ca -0.05 0.31 -0.12 0.00 -1.03 0.00 0.00 54.13 53.25 2b7f s LEU 72 Cb 0.07 -3.12 0.19 0.00 0.03 0.00 0.00 46.19 43.36 2b7f s LEU 72 CO 0.51 -0.13 1.08 -2.84 0.23 0.00 0.00 176.35 175.20 2b7f s PRO 73 N -3.85 0.41 -0.10 1.29 0.02 -1.22 -4.62 135.00 126.94 2b7f s PRO 73 Ca 0.37 1.00 0.01 0.00 0.02 0.00 0.00 61.00 62.40 2b7f s PRO 73 Cb -0.10 -1.70 0.02 0.00 0.02 0.00 0.00 34.50 32.74 2b7f s PRO 73 CO 0.31 -2.87 -0.09 0.08 -0.33 0.00 0.00 177.00 174.10 2b7f s VAL 74 N -2.70 1.08 -0.11 3.83 1.01 -0.58 -4.64 120.40 118.29 2b7f s VAL 74 Ca 0.66 -0.36 -0.06 0.00 0.00 0.00 0.00 61.98 62.22 2b7f s VAL 74 Cb -0.22 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 2b7f s VAL 74 CO 0.60 0.36 0.12 -0.76 0.00 0.00 0.00 175.10 175.42 2b7f s LEU 75 N 1.33 4.26 -0.07 3.92 1.43 -0.66 -1.84 118.68 127.05 2b7f s LEU 75 Ca -0.02 0.41 0.02 0.00 -1.03 0.00 0.00 54.13 53.51 2b7f s LEU 75 Cb -0.14 -2.07 0.02 0.00 0.03 0.00 0.00 46.19 44.03 2b7f s LEU 75 CO -0.04 0.39 -0.10 -0.63 0.23 0.00 0.00 176.35 176.20 2b7f s ILE 76 N -1.03 0.99 -0.10 -0.59 1.01 -0.63 -0.67 121.20 120.18 2b7f s ILE 76 Ca 0.16 -0.38 0.01 0.00 0.00 0.00 0.00 60.65 60.44 2b7f s ILE 76 Cb -0.12 -0.94 -0.02 0.00 0.01 0.00 0.00 42.46 41.39 2b7f s ILE 76 CO 0.05 0.33 -0.12 -0.13 0.00 0.00 0.00 174.94 175.07 2b7f s ARG 77 N 0.85 3.09 0.26 2.79 0.52 -0.04 -0.97 118.95 125.45 2b7f s ARG 77 Ca -0.11 -0.65 0.06 0.00 -0.52 0.00 0.00 55.73 54.51 2b7f s ARG 77 Cb -0.15 -2.59 -0.03 0.00 0.52 0.00 0.00 34.95 32.70 2b7f s ARG 77 CO 0.02 0.39 0.28 -0.51 0.02 0.00 0.00 175.30 175.49 2b7f s LEU 78 N -0.09 4.01 0.07 2.53 1.43 -1.26 -0.82 118.68 124.55 2b7f s LEU 78 Ca -0.01 -0.13 -0.33 0.00 -1.03 0.00 0.00 54.13 52.63 2b7f s LEU 78 Cb -0.14 -2.56 -0.12 0.00 0.03 0.00 0.00 46.19 43.40 2b7f s LEU 78 CO 0.03 -0.08 1.77 -2.65 0.23 0.00 0.00 176.35 175.65 2b7f n PRO 79 N -1.30 2.41 -1.66 1.29 -0.02 -1.25 -2.13 135.00 132.34 2b7f n PRO 79 Ca -0.08 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 2b7f n PRO 79 Cb 0.58 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 2b7f n PRO 79 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2b7f n PHE 80 N 5.24 0.00 -4.03 6.00 3.72 -1.26 -5.08 117.46 122.05 2b7f n PHE 80 Ca 0.19 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.44 2b7f n PHE 80 Cb 0.32 -0.83 -0.15 0.00 -0.94 0.00 0.00 39.48 37.89 2b7f n PHE 80 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2b7f s ARG 81 N -3.37 0.28 -0.04 -1.08 1.81 -0.90 -5.03 118.95 110.62 2b7f s ARG 81 Ca 0.00 -0.09 -0.06 0.00 -1.72 0.00 0.00 55.73 53.86 2b7f s ARG 81 Cb 0.00 -0.31 -0.29 0.00 -0.45 0.00 0.00 34.95 33.91 2b7f s ARG 81 CO 0.00 0.03 0.69 1.15 -0.68 0.00 0.00 175.30 176.49 2b7f h THR 82 N 5.28 0.96 -1.81 0.02 2.02 -1.98 -3.40 112.91 114.00 2b7f h THR 82 Ca -0.29 -2.59 -0.61 0.00 0.77 0.00 0.00 66.41 63.68 2b7f h THR 82 Cb 1.19 2.71 0.00 0.00 -1.74 0.00 0.00 68.15 70.31 2b7f h THR 82 CO 0.50 0.83 1.32 0.41 0.37 0.00 0.00 175.52 178.95 2b7f n THR 83 N -3.50 0.43 -2.79 3.16 -1.04 -1.26 -4.93 114.28 104.35 2b7f n THR 83 Ca -0.23 -0.26 -0.37 0.00 -2.04 0.00 0.00 64.05 61.15 2b7f n THR 83 Cb 1.06 -2.08 -0.06 0.00 -1.82 0.00 0.00 70.33 67.43 2b7f n THR 83 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2b7f s PRO 84 N 5.36 4.60 0.20 -2.82 0.05 -1.26 -4.76 135.00 136.37 2b7f s PRO 84 Ca 0.99 1.33 -0.31 0.00 0.05 0.00 0.00 61.00 63.06 2b7f s PRO 84 Cb -0.60 -2.86 -0.10 0.00 0.05 0.00 0.00 34.50 31.00 2b7f s PRO 84 CO 0.45 0.31 1.50 0.42 0.05 0.00 0.00 177.00 179.73 2b7f s ILE 85 N -1.56 2.67 -0.19 0.56 1.01 -0.14 -4.89 121.20 118.66 2b7f s ILE 85 Ca 0.49 0.52 -0.01 0.00 0.00 0.00 0.00 60.65 61.64 2b7f s ILE 85 Cb -0.19 -3.33 0.00 0.00 0.01 0.00 0.00 42.46 38.94 2b7f s ILE 85 CO 0.25 0.06 -0.11 -0.69 0.00 0.00 0.00 174.94 174.44 2b7f s VAL 86 N 0.59 2.86 -0.18 2.92 1.01 -1.26 -1.61 120.40 124.73 2b7f s VAL 86 Ca 0.65 -0.68 -0.04 0.00 0.00 0.00 0.00 61.98 61.91 2b7f s VAL 86 Cb -0.42 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 33.68 2b7f s VAL 86 CO 0.37 0.48 -0.03 -0.76 0.00 0.00 0.00 175.10 175.16 2b7f s LEU 87 N 1.22 3.17 0.32 3.92 1.43 -0.77 -4.98 118.68 122.99 2b7f s LEU 87 Ca 0.02 -0.21 0.04 0.00 -1.03 0.00 0.00 54.13 52.95 2b7f s LEU 87 Cb -0.14 -1.78 0.55 0.00 0.03 0.00 0.00 46.19 44.84 2b7f s LEU 87 CO -0.05 0.10 1.83 0.74 0.23 0.00 0.00 176.35 179.20 2b7f h THR 88 N 5.33 1.22 -2.83 5.49 2.02 -1.92 -1.53 112.91 120.70 2b7f h THR 88 Ca -0.34 -0.93 -0.07 0.00 0.77 0.00 0.00 66.41 65.84 2b7f h THR 88 Cb 1.18 1.06 -0.17 0.00 -1.74 0.00 0.00 68.15 68.49 2b7f h THR 88 CO 0.61 0.31 -0.04 -0.55 0.37 0.00 0.00 175.52 176.22 2b7f s SER 89 N -6.76 -0.37 0.18 4.18 0.15 -1.26 -3.43 113.70 106.39 2b7f s SER 89 Ca -0.07 0.15 -0.15 0.00 0.70 0.00 0.00 55.95 56.58 2b7f s SER 89 Cb 0.15 0.45 0.02 0.00 -1.71 0.00 0.00 66.02 64.92 2b7f s SER 89 CO 0.77 -0.65 0.44 0.00 1.20 0.00 0.00 173.24 175.00 2b7f s LEU 91 N -2.89 3.64 -0.09 0.00 1.43 -0.61 -2.70 118.68 117.47 2b7f s LEU 91 Ca 0.11 1.67 0.03 0.00 -1.03 0.00 0.00 54.13 54.91 2b7f s LEU 91 Cb 0.01 -4.52 0.00 0.00 0.03 0.00 0.00 46.19 41.71 2b7f s LEU 91 CO -0.03 -0.72 -0.20 -0.69 0.23 0.00 0.00 176.35 174.94 2b7f s VAL 92 N -2.49 1.76 -0.51 -1.59 1.01 -0.23 -1.79 120.40 116.56 2b7f s VAL 92 Ca 0.61 -0.85 -0.21 0.00 0.00 0.00 0.00 61.98 61.54 2b7f s VAL 92 Cb -0.12 -1.54 0.05 0.00 0.00 0.00 0.00 36.38 34.77 2b7f s VAL 92 CO 0.30 0.49 0.71 -0.62 0.00 0.00 0.00 175.10 175.98 2b7f s ASP 93 N 0.44 6.26 0.42 3.32 2.15 0.08 -1.49 116.67 127.86 2b7f s ASP 93 Ca -0.18 -0.73 0.23 0.00 0.43 0.00 0.00 52.55 52.30 2b7f s ASP 93 Cb -0.17 -2.33 0.81 0.00 -0.30 0.00 0.00 42.92 40.92 2b7f s ASP 93 CO 0.07 -0.97 1.78 0.71 -0.17 0.00 0.00 175.17 176.58 2b7f h THR 94 N 5.90 0.57 0.00 1.71 1.35 -1.62 0.13 112.91 120.96 2b7f h THR 94 Ca -0.27 -1.24 0.00 0.00 -0.55 0.00 0.00 66.41 64.35 2b7f h THR 94 Cb 1.09 1.85 0.00 0.00 -1.73 0.00 0.00 68.15 69.35 2b7f h THR 94 CO 0.99 0.24 0.00 0.29 -0.25 0.00 0.00 175.52 176.80 2b7f n LYS 95 N -3.37 0.40 -2.23 4.72 4.76 -1.26 -4.85 118.16 116.34 2b7f n LYS 95 Ca 0.00 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.29 2b7f n LYS 95 Cb 0.47 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 32.14 2b7f n LYS 95 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2b7f n ASN 96 N -1.30 -4.54 0.14 4.39 3.02 -0.89 -4.90 115.26 111.19 2b7f n ASN 96 Ca 0.14 0.17 0.02 0.00 -0.03 0.00 0.00 54.58 54.87 2b7f n ASN 96 Cb 0.25 -3.88 0.12 0.00 -0.61 0.00 0.00 39.78 35.66 2b7f n ASN 96 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 2b7f h ASN 97 N 0.00 0.00 -3.49 6.41 4.21 -1.93 -3.48 115.58 117.30 2b7f h ASN 97 Ca -0.36 0.00 -0.47 0.00 1.21 0.00 0.00 56.30 56.68 2b7f h ASN 97 Cb 1.22 0.00 -0.33 0.00 -1.12 0.00 0.00 38.32 38.09 2b7f h ASN 97 CO 0.44 0.56 -0.80 0.26 -1.29 0.00 0.00 177.43 176.60 2b7f s TRP 98 N -3.20 1.16 -0.23 1.19 0.23 -1.26 -5.08 118.94 111.75 2b7f s TRP 98 Ca 0.02 -0.38 -0.02 0.00 -2.03 0.00 0.00 56.10 53.68 2b7f s TRP 98 Cb 0.10 -0.88 0.07 0.00 0.03 0.00 0.00 33.47 32.79 2b7f s TRP 98 CO 0.74 -0.22 0.06 0.00 0.96 0.00 0.00 176.95 178.49 2b7f s ALA 99 N 0.67 1.10 -0.11 0.98 0.00 -1.26 -3.07 121.76 120.07 2b7f s ALA 99 Ca -0.12 -0.98 0.01 0.00 0.00 0.00 0.00 51.96 50.87 2b7f s ALA 99 Cb -0.14 -1.31 0.02 0.00 0.00 0.00 0.00 23.12 21.69 2b7f s ALA 99 CO 0.02 -1.34 -0.11 0.42 0.00 0.00 0.00 175.76 174.75 2b7f s ILE 100 N 1.82 1.22 -0.51 0.00 1.01 -0.71 0.96 121.20 124.98 2b7f s ILE 100 Ca 0.02 -0.44 -0.22 0.00 0.00 0.00 0.00 60.65 60.01 2b7f s ILE 100 Cb -0.17 -1.16 0.04 0.00 0.01 0.00 0.00 42.46 41.18 2b7f s ILE 100 CO -0.15 0.39 0.81 -0.63 0.00 0.00 0.00 174.94 175.36 2b7f s ILE 101 N 1.31 4.59 0.00 2.92 -1.09 0.68 0.13 121.20 129.74 2b7f s ILE 101 Ca -0.01 0.12 0.00 0.00 -2.23 0.00 0.00 60.65 58.52 2b7f s ILE 101 Cb -0.14 -4.41 0.00 0.00 -1.58 0.00 0.00 42.46 36.33 2b7f s ILE 101 CO -0.05 -0.92 0.00 0.61 -1.23 0.00 0.00 174.94 173.36 2b7f n GLY 102 N 5.09 1.63 0.17 6.18 0.00 -1.26 -2.16 105.19 114.85 2b7f n GLY 102 Ca -0.00 -2.04 0.02 0.00 0.00 0.00 0.00 46.02 43.99 2b7f n GLY 102 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2b7f h ARG 103 N 0.00 0.00 -0.71 1.61 3.08 -1.44 -0.77 114.38 116.16 2b7f h ARG 103 Ca 0.00 0.00 0.16 0.00 0.07 0.00 0.00 59.98 60.21 2b7f h ARG 103 Cb 0.00 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 29.93 2b7f h ARG 103 CO 0.00 0.46 0.07 0.38 -1.07 0.00 0.00 179.97 179.81 2b7f h ASP 104 N 0.00 -0.18 0.06 7.04 3.04 -1.81 0.12 116.42 124.68 2b7f h ASP 104 Ca -0.00 0.16 -0.17 0.00 -3.24 0.00 0.00 57.03 53.78 2b7f h ASP 104 Cb 0.85 0.27 0.02 0.00 -1.04 0.00 0.00 39.33 39.42 2b7f h ASP 104 CO 0.06 -0.11 -0.70 0.00 -2.04 0.00 0.00 179.24 176.45 2b7f h ALA 105 N 1.63 0.01 -0.81 4.15 0.00 -1.73 -3.22 119.26 119.28 2b7f h ALA 105 Ca 0.39 -0.62 0.04 0.00 0.00 0.00 0.00 54.91 54.72 2b7f h ALA 105 Cb 0.67 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.47 2b7f h ALA 105 CO -0.57 0.37 0.51 -0.07 0.00 0.00 0.00 179.25 179.49 2b7f h LEU 106 N -0.20 0.83 -0.38 0.00 3.38 -1.00 -1.44 115.31 116.50 2b7f h LEU 106 Ca -0.10 0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.95 2b7f h LEU 106 Cb 1.45 -0.17 -0.08 0.00 0.09 0.00 0.00 40.66 41.95 2b7f h LEU 106 CO 0.13 0.56 -0.13 -0.61 0.09 0.00 0.00 178.44 178.48 2b7f h GLN 107 N 0.97 -0.05 0.00 1.13 4.15 -1.07 -0.06 115.11 120.18 2b7f h GLN 107 Ca 0.34 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.70 2b7f h GLN 107 Cb 0.07 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.77 2b7f h GLN 107 CO -0.14 -0.03 -0.27 1.96 -1.93 0.00 0.00 178.83 178.42 2b7f h GLN 108 N -0.05 0.00 -0.09 1.69 4.20 -1.30 -1.81 115.11 117.75 2b7f h GLN 108 Ca 0.19 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.90 2b7f h GLN 108 Cb 0.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.11 2b7f h GLN 108 CO -0.42 0.27 0.00 0.00 -0.67 0.00 0.00 178.83 178.01 2b7f n GLN 110 N 0.97 -0.52 -1.80 0.00 6.02 -0.16 -5.02 117.38 116.87 2b7f n GLN 110 Ca 0.16 0.38 -0.38 0.00 -0.01 0.00 0.00 57.00 57.16 2b7f n GLN 110 Cb 0.51 -4.24 0.05 0.00 1.02 0.00 0.00 30.24 27.58 2b7f n GLN 110 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2b7f s GLY 111 N -2.73 2.87 0.20 1.08 0.00 -0.47 -5.01 107.32 103.25 2b7f s GLY 111 Ca 0.00 1.26 -0.00 0.00 0.00 0.00 0.00 44.72 45.98 2b7f s GLY 111 CO 0.00 1.74 0.09 -1.34 0.00 0.00 0.00 173.10 173.59 2b7f s VAL 112 N -1.36 0.22 -0.07 1.40 -7.23 -1.26 -4.80 120.40 107.30 2b7f s VAL 112 Ca 0.75 -1.98 0.05 0.00 -1.81 0.00 0.00 61.98 58.99 2b7f s VAL 112 Cb -0.38 -2.40 -0.01 0.00 0.56 0.00 0.00 36.38 34.14 2b7f s VAL 112 CO 0.44 -0.14 -0.22 -0.22 -0.31 0.00 0.00 175.10 174.64 2b7f s LEU 113 N -3.17 2.22 -0.14 1.32 2.96 -1.26 -5.10 118.68 115.51 2b7f s LEU 113 Ca 0.34 -0.46 0.01 0.00 -0.22 0.00 0.00 54.13 53.80 2b7f s LEU 113 Cb 0.07 -1.42 0.02 0.00 0.50 0.00 0.00 46.19 45.36 2b7f s LEU 113 CO 0.09 0.24 -0.14 -0.47 -1.32 0.00 0.00 176.35 174.75 2b7f s TYR 114 N -0.12 2.06 -0.33 5.38 5.04 -1.26 -5.10 117.35 123.01 2b7f s TYR 114 Ca -0.04 -1.10 -0.05 0.00 -2.44 0.00 0.00 57.07 53.44 2b7f s TYR 114 Cb -0.14 -1.52 0.05 0.00 0.35 0.00 0.00 41.96 40.70 2b7f s TYR 114 CO 0.04 -0.61 0.08 -0.51 -1.34 0.00 0.00 175.55 173.21 2b7f s LEU 115 N 1.39 4.27 0.00 6.97 1.43 -1.26 -5.15 118.68 126.32 2b7f s LEU 115 Ca 0.02 -1.26 0.00 0.00 -1.03 0.00 0.00 54.13 51.86 2b7f s LEU 115 Cb -0.13 -1.82 0.00 0.00 0.03 0.00 0.00 46.19 44.27 2b7f s LEU 115 CO -0.08 -0.33 0.47 -2.65 0.23 0.00 0.00 176.35 173.99