#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f16 s ASP 1 N 0.00 5.96 -0.03 6.12 1.01 -1.26 -4.98 116.67 123.49 2f16 s ASP 1 Ca 0.00 1.10 -0.19 0.00 0.71 0.00 0.00 52.55 54.17 2f16 s ASP 1 Cb 0.00 -2.16 -0.05 0.00 1.01 0.00 0.00 42.92 41.72 2f16 s ASP 1 CO 0.00 -0.92 0.55 -0.63 0.21 0.00 0.00 175.17 174.38 2f16 s ILE 2 N -3.07 4.99 -0.22 0.77 -1.09 -1.26 -4.87 121.20 116.45 2f16 s ILE 2 Ca 0.53 1.14 -0.04 0.00 -2.23 0.00 0.00 60.65 60.05 2f16 s ILE 2 Cb -0.11 -3.88 0.08 0.00 -1.58 0.00 0.00 42.46 36.97 2f16 s ILE 2 CO 0.50 0.41 0.11 -0.63 -1.23 0.00 0.00 174.94 174.10 2f16 s ILE 3 N -0.06 -0.09 0.16 2.92 -1.09 -1.26 -1.47 121.20 120.31 2f16 s ILE 3 Ca 0.29 -0.41 0.10 0.00 -2.23 0.00 0.00 60.65 58.40 2f16 s ILE 3 Cb -0.17 -0.75 -0.04 0.00 -1.58 0.00 0.00 42.46 39.92 2f16 s ILE 3 CO 0.15 -0.47 -0.21 -0.76 -1.23 0.00 0.00 174.94 172.42 2f16 s LEU 4 N 2.13 2.41 -0.13 2.97 1.43 0.08 -2.50 118.68 125.07 2f16 s LEU 4 Ca 0.05 -0.83 -0.13 0.00 -1.03 0.00 0.00 54.13 52.19 2f16 s LEU 4 Cb -0.16 -0.99 0.03 0.00 0.03 0.00 0.00 46.19 45.11 2f16 s LEU 4 CO -0.21 0.05 0.37 -0.83 0.23 0.00 0.00 176.35 175.96 2f16 s GLY 5 N -2.52 -0.27 -0.02 -3.19 0.00 -0.48 -1.46 107.32 99.39 2f16 s GLY 5 Ca 0.16 0.98 -0.00 0.00 0.00 0.00 0.00 44.72 45.86 2f16 s GLY 5 CO 0.07 0.83 0.03 -1.50 0.00 0.00 0.00 173.10 172.53 2f16 s ILE 6 N 0.05 -0.06 -0.39 0.90 2.07 -0.04 -1.33 121.20 122.41 2f16 s ILE 6 Ca -0.01 0.20 -0.14 0.00 -1.41 0.00 0.00 60.65 59.29 2f16 s ILE 6 Cb -0.03 -0.08 0.01 0.00 0.13 0.00 0.00 42.46 42.50 2f16 s ILE 6 CO 0.01 0.08 0.28 -0.60 -1.91 0.00 0.00 174.94 172.80 2f16 s ARG 7 N 1.00 3.09 0.01 3.50 3.52 0.24 -0.39 118.95 129.92 2f16 s ARG 7 Ca -0.08 -0.93 0.00 0.00 -0.13 0.00 0.00 55.73 54.59 2f16 s ARG 7 Cb -0.12 -3.91 0.00 0.00 -1.56 0.00 0.00 34.95 29.36 2f16 s ARG 7 CO -0.03 -0.67 0.02 1.33 -0.81 0.00 0.00 175.30 175.14 2f16 n VAL 8 N 5.13 0.00 -0.24 7.11 0.24 0.04 -4.85 118.33 125.76 2f16 n VAL 8 Ca -0.12 -0.04 -0.08 0.00 -2.04 0.00 0.00 64.34 62.06 2f16 n VAL 8 Cb 0.48 -0.92 -0.04 0.00 -1.47 0.00 0.00 33.84 31.89 2f16 n VAL 8 CO 0.00 0.00 0.00 -0.61 -2.14 0.00 0.00 176.83 174.08 2f16 h GLN 9 N 0.00 -0.19 0.00 7.34 5.75 -1.28 -3.27 115.11 123.47 2f16 h GLN 9 Ca -0.01 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 2f16 h GLN 9 Cb 0.03 0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.62 2f16 h GLN 9 CO 0.01 -0.12 -0.07 -0.25 -2.65 0.00 0.00 178.83 175.74 2f16 n ASP 10 N -5.39 1.79 -3.29 -0.69 8.00 -1.26 -4.63 116.55 111.07 2f16 n ASP 10 Ca 0.02 -2.56 -0.06 0.00 0.71 0.00 0.00 54.79 52.90 2f16 n ASP 10 Cb 0.34 -0.27 0.01 0.00 -0.02 0.00 0.00 41.12 41.18 2f16 n ASP 10 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2f16 s SER 11 N -2.01 -0.06 -0.04 -2.24 1.04 -1.24 -4.38 113.70 104.77 2f16 s SER 11 Ca 0.18 -0.85 0.03 0.00 0.48 0.00 0.00 55.95 55.79 2f16 s SER 11 Cb 0.16 0.70 0.00 0.00 0.10 0.00 0.00 66.02 66.98 2f16 s SER 11 CO 0.02 -1.37 -0.14 -0.69 0.98 0.00 0.00 173.24 172.04 2f16 s VAL 12 N -2.66 1.18 -0.11 5.02 1.01 -0.56 -0.78 120.40 123.50 2f16 s VAL 12 Ca 0.16 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.59 2f16 s VAL 12 Cb -0.04 -1.03 -0.01 0.00 0.00 0.00 0.00 36.38 35.29 2f16 s VAL 12 CO 0.08 0.35 -0.15 -0.63 0.00 0.00 0.00 175.10 174.75 2f16 s ILE 13 N 0.22 2.88 -0.17 2.22 1.01 0.47 -1.14 121.20 126.69 2f16 s ILE 13 Ca -0.06 -0.74 -0.00 0.00 0.00 0.00 0.00 60.65 59.85 2f16 s ILE 13 Cb -0.12 -2.18 0.00 0.00 0.01 0.00 0.00 42.46 40.18 2f16 s ILE 13 CO 0.02 0.54 -0.15 -0.76 0.00 0.00 0.00 174.94 174.59 2f16 s LEU 14 N 0.13 2.47 -0.14 2.97 1.43 -0.57 -0.86 118.68 124.10 2f16 s LEU 14 Ca -0.08 -0.49 -0.00 0.00 -1.03 0.00 0.00 54.13 52.53 2f16 s LEU 14 Cb -0.15 -1.57 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 2f16 s LEU 14 CO 0.05 0.06 -0.13 0.00 0.23 0.00 0.00 176.35 176.56 2f16 s ALA 15 N 0.97 2.60 -0.03 4.21 0.00 -0.53 -1.39 121.76 127.58 2f16 s ALA 15 Ca -0.02 -0.95 -0.00 0.00 0.00 0.00 0.00 51.96 50.98 2f16 s ALA 15 Cb -0.15 -1.26 0.03 0.00 0.00 0.00 0.00 23.12 21.74 2f16 s ALA 15 CO -0.02 0.12 0.01 -1.12 0.00 0.00 0.00 175.76 174.74 2f16 s SER 16 N 0.56 0.59 0.68 0.00 0.01 -0.87 -0.74 113.70 113.93 2f16 s SER 16 Ca -0.08 -0.02 -0.17 0.00 1.31 0.00 0.00 55.95 56.99 2f16 s SER 16 Cb -0.16 -0.23 -0.04 0.00 0.21 0.00 0.00 66.02 65.81 2f16 s SER 16 CO 0.03 -0.12 0.69 -1.54 0.41 0.00 0.00 173.24 172.71 2f16 n SER 17 N 4.35 -0.51 -0.00 2.44 3.41 -0.54 -1.23 113.62 121.53 2f16 n SER 17 Ca -0.23 0.66 0.09 0.00 -0.26 0.00 0.00 58.87 59.13 2f16 n SER 17 Cb 0.50 -1.28 -0.11 0.00 -0.26 0.00 0.00 64.21 63.07 2f16 n SER 17 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2f16 n LYS 18 N -0.91 0.95 -2.52 4.33 5.02 0.18 -4.61 118.16 120.59 2f16 n LYS 18 Ca 0.12 -0.01 -0.34 0.00 -2.02 0.00 0.00 58.31 56.05 2f16 n LYS 18 Cb 0.49 -1.37 -0.03 0.00 -0.02 0.00 0.00 35.03 34.10 2f16 n LYS 18 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2f16 s ALA 19 N -2.75 2.88 -0.31 7.82 0.00 -0.86 -1.38 121.76 127.17 2f16 s ALA 19 Ca 0.06 0.64 -0.02 0.00 0.00 0.00 0.00 51.96 52.64 2f16 s ALA 19 Cb 0.14 -3.27 0.11 0.00 0.00 0.00 0.00 23.12 20.11 2f16 s ALA 19 CO 0.75 -0.34 0.17 0.08 0.00 0.00 0.00 175.76 176.42 2f16 s VAL 20 N -1.92 -0.05 -0.13 0.00 1.01 -0.32 -4.89 120.40 114.10 2f16 s VAL 20 Ca 0.67 -0.99 -0.07 0.00 0.00 0.00 0.00 61.98 61.59 2f16 s VAL 20 Cb -0.18 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 2f16 s VAL 20 CO 0.21 -0.77 0.13 -0.89 0.00 0.00 0.00 175.10 173.78 2f16 s THR 21 N 1.83 5.40 -0.32 3.92 2.01 -1.26 -0.45 115.64 126.77 2f16 s THR 21 Ca 0.12 0.17 -0.01 0.00 0.31 0.00 0.00 61.69 62.27 2f16 s THR 21 Cb -0.18 -3.36 0.10 0.00 0.01 0.00 0.00 72.50 69.08 2f16 s THR 21 CO -0.26 0.60 0.12 -0.13 -0.69 0.00 0.00 174.62 174.26 2f16 s ARG 22 N -0.87 0.65 5.55 4.92 1.81 -0.00 -4.92 118.95 126.08 2f16 s ARG 22 Ca 0.14 -1.05 0.00 0.00 -1.72 0.00 0.00 55.73 53.10 2f16 s ARG 22 Cb -0.12 -1.82 0.00 0.00 -0.45 0.00 0.00 34.95 32.56 2f16 s ARG 22 CO 0.03 -1.02 0.00 0.41 -0.68 0.00 0.00 175.30 174.04 2f16 n GLY 23 N 4.78 1.62 0.07 -3.53 0.00 -1.26 -3.10 105.19 103.78 2f16 n GLY 23 Ca -0.01 -0.09 0.07 0.00 0.00 0.00 0.00 46.02 45.99 2f16 n GLY 23 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2f16 n ILE 24 N 0.00 0.56 -4.20 -0.61 0.13 -1.26 -4.97 119.36 109.01 2f16 n ILE 24 Ca 0.00 -0.59 -0.30 0.00 -1.10 0.00 0.00 62.75 60.76 2f16 n ILE 24 Cb 0.00 -0.29 -0.09 0.00 -0.84 0.00 0.00 39.64 38.42 2f16 n ILE 24 CO 0.00 0.00 0.00 -0.44 2.80 0.00 0.00 176.55 178.91 2f16 s SER 25 N -5.12 4.76 -0.57 9.51 0.01 -1.18 -5.07 113.70 116.04 2f16 s SER 25 Ca -0.05 -0.24 -0.19 0.00 1.31 0.00 0.00 55.95 56.78 2f16 s SER 25 Cb 0.11 -1.06 0.09 0.00 0.21 0.00 0.00 66.02 65.37 2f16 s SER 25 CO 0.85 0.19 0.68 -0.69 0.41 0.00 0.00 173.24 174.67 2f16 s VAL 26 N -1.24 4.85 0.27 3.43 1.01 -1.26 -0.82 120.40 126.63 2f16 s VAL 26 Ca 0.23 -0.90 0.18 0.00 0.00 0.00 0.00 61.98 61.49 2f16 s VAL 26 Cb -0.11 -4.44 0.13 0.00 0.00 0.00 0.00 36.38 31.96 2f16 s VAL 26 CO 0.15 -1.04 1.80 -0.07 0.00 0.00 0.00 175.10 175.94 2f16 h LEU 27 N 9.87 0.00 -7.23 3.92 3.38 -1.12 -3.46 115.31 120.67 2f16 h LEU 27 Ca -0.29 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.59 2f16 h LEU 27 Cb 1.09 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.64 2f16 h LEU 27 CO 1.07 0.36 -0.02 -0.75 0.09 0.00 0.00 178.44 179.18 2f16 s LYS 28 N -3.84 0.88 -0.06 1.13 2.20 -1.13 -5.00 119.74 113.92 2f16 s LYS 28 Ca -0.01 0.05 0.09 0.00 -0.36 0.00 0.00 55.97 55.74 2f16 s LYS 28 Cb 0.12 0.41 0.14 0.00 -1.51 0.00 0.00 37.83 36.99 2f16 s LYS 28 CO 0.69 -0.26 1.05 -0.40 -0.36 0.00 0.00 175.35 176.06 2f16 n ASP 29 N 1.07 1.20 -2.67 1.43 3.85 -1.25 -1.17 116.55 119.00 2f16 n ASP 29 Ca -0.20 -2.48 -0.07 0.00 -0.71 0.00 0.00 54.79 51.33 2f16 n ASP 29 Cb 0.57 -0.29 0.04 0.00 -1.35 0.00 0.00 41.12 40.08 2f16 n ASP 29 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 2f16 n SER 30 N -0.71 2.09 -4.68 -1.12 3.41 -1.12 -4.59 113.62 106.90 2f16 n SER 30 Ca 0.08 -2.52 -0.40 0.00 -0.26 0.00 0.00 58.87 55.77 2f16 n SER 30 Cb 0.64 -0.48 -0.06 0.00 -0.26 0.00 0.00 64.21 64.06 2f16 n SER 30 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2f16 s ASP 31 N -3.57 6.74 -0.64 4.04 3.68 -0.48 -5.01 116.67 121.43 2f16 s ASP 31 Ca 0.31 0.89 -0.18 0.00 2.13 0.00 0.00 52.55 55.71 2f16 s ASP 31 Cb 0.38 -2.35 0.13 0.00 -1.45 0.00 0.00 42.92 39.63 2f16 s ASP 31 CO -0.02 -0.18 0.71 -0.62 0.13 0.00 0.00 175.17 175.19 2f16 s ASP 32 N 1.00 6.31 0.00 -0.34 3.68 -1.26 -4.34 116.67 121.72 2f16 s ASP 32 Ca 0.30 -1.74 -0.05 0.00 2.13 0.00 0.00 52.55 53.18 2f16 s ASP 32 Cb -0.16 -2.28 -0.22 0.00 -1.45 0.00 0.00 42.92 38.81 2f16 s ASP 32 CO 0.12 -0.98 3.30 0.29 0.13 0.00 0.00 175.17 178.03 2f16 n LYS 33 N 5.78 1.80 -3.96 4.34 5.02 -1.26 -4.84 118.16 125.04 2f16 n LYS 33 Ca -0.04 -0.81 -0.09 0.00 -2.02 0.00 0.00 58.31 55.35 2f16 n LYS 33 Cb 0.43 -1.81 -0.08 0.00 -0.02 0.00 0.00 35.03 33.56 2f16 n LYS 33 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2f16 s THR 34 N 0.82 0.11 -0.06 -0.18 -1.32 -1.26 -2.24 115.64 111.51 2f16 s THR 34 Ca 0.54 -1.43 -0.07 0.00 -1.21 0.00 0.00 61.69 59.52 2f16 s THR 34 Cb 0.26 -1.68 0.02 0.00 -1.51 0.00 0.00 72.50 69.58 2f16 s THR 34 CO 0.00 -0.49 0.18 -0.13 -2.21 0.00 0.00 174.62 171.97 2f16 s ARG 35 N -3.94 0.27 -0.31 7.08 1.81 -0.77 -5.02 118.95 118.06 2f16 s ARG 35 Ca 0.13 0.14 -0.18 0.00 -1.72 0.00 0.00 55.73 54.11 2f16 s ARG 35 Cb 0.05 0.12 -0.01 0.00 -0.45 0.00 0.00 34.95 34.66 2f16 s ARG 35 CO -0.04 -0.04 0.50 -1.14 -0.68 0.00 0.00 175.30 173.90 2f16 s GLN 36 N -0.16 3.80 0.11 3.54 0.74 -1.26 -1.95 119.66 124.47 2f16 s GLN 36 Ca -0.03 0.02 -0.03 0.00 0.05 0.00 0.00 55.36 55.37 2f16 s GLN 36 Cb -0.02 -3.74 -0.19 0.00 1.10 0.00 0.00 33.01 30.15 2f16 s GLN 36 CO 0.01 -0.52 1.23 -0.07 -0.55 0.00 0.00 175.29 175.38 2f16 h LEU 37 N 8.96 0.40 -7.17 3.68 3.38 -1.54 -3.48 115.31 119.54 2f16 h LEU 37 Ca -0.28 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.30 2f16 h LEU 37 Cb 1.13 -0.13 -0.11 0.00 0.09 0.00 0.00 40.66 41.65 2f16 h LEU 37 CO 0.74 1.25 0.23 -0.94 0.09 0.00 0.00 178.44 179.81 2f16 s SER 38 N -7.07 -0.51 0.53 -0.43 1.04 -1.11 -4.26 113.70 101.89 2f16 s SER 38 Ca -0.04 -0.10 0.44 0.00 0.48 0.00 0.00 55.95 56.72 2f16 s SER 38 Cb 0.08 0.61 1.64 0.00 0.10 0.00 0.00 66.02 68.45 2f16 s SER 38 CO 0.87 -1.02 1.63 1.55 0.98 0.00 0.00 173.24 177.25 2f16 h PRO 39 N 2.00 0.02 -0.08 4.02 0.13 -2.01 -0.15 132.00 135.93 2f16 h PRO 39 Ca -0.31 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2f16 h PRO 39 Cb 1.30 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2f16 h PRO 39 CO 0.35 0.01 0.00 0.72 -0.23 0.00 0.00 178.00 178.85 2f16 n HIS 40 N -4.14 0.24 -3.89 1.56 8.25 -1.26 -3.55 115.22 112.44 2f16 n HIS 40 Ca 0.39 -0.86 -0.21 0.00 -0.26 0.00 0.00 57.72 56.78 2f16 n HIS 40 Cb 1.74 -0.16 -0.17 0.00 1.12 0.00 0.00 29.99 32.52 2f16 n HIS 40 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2f16 s THR 41 N -2.44 0.34 0.03 1.59 2.01 -0.07 -1.04 115.64 116.06 2f16 s THR 41 Ca 0.29 0.08 0.08 0.00 0.31 0.00 0.00 61.69 62.45 2f16 s THR 41 Cb 0.24 -0.46 -0.03 0.00 0.01 0.00 0.00 72.50 72.26 2f16 s THR 41 CO 0.05 0.22 -0.24 -0.22 -0.69 0.00 0.00 174.62 173.74 2f16 s LEU 42 N 1.55 2.14 -0.07 4.42 2.96 0.97 -1.24 118.68 129.40 2f16 s LEU 42 Ca -0.02 -0.54 0.01 0.00 -0.22 0.00 0.00 54.13 53.37 2f16 s LEU 42 Cb -0.13 -1.19 0.02 0.00 0.50 0.00 0.00 46.19 45.39 2f16 s LEU 42 CO -0.03 0.24 -0.08 -0.32 -1.32 0.00 0.00 176.35 174.84 2f16 s MET 43 N -1.07 1.30 0.21 1.98 -2.45 -0.82 0.01 119.30 118.45 2f16 s MET 43 Ca 0.10 -0.23 0.05 0.00 -1.25 0.00 0.00 55.69 54.36 2f16 s MET 43 Cb -0.09 -1.25 -0.03 0.00 1.25 0.00 0.00 34.83 34.70 2f16 s MET 43 CO 0.01 -0.12 0.24 -1.54 1.05 0.00 0.00 175.02 174.67 2f16 s SER 44 N 1.15 5.89 -0.01 1.11 1.04 -0.19 -1.85 113.70 120.84 2f16 s SER 44 Ca -0.06 -0.05 -0.22 0.00 0.48 0.00 0.00 55.95 56.09 2f16 s SER 44 Cb -0.14 -1.63 0.05 0.00 0.10 0.00 0.00 66.02 64.39 2f16 s SER 44 CO -0.01 -0.00 0.48 0.72 0.98 0.00 0.00 173.24 175.41 2f16 s PHE 45 N -1.92 -0.39 -0.07 5.02 -0.12 -0.95 -1.55 117.98 117.99 2f16 s PHE 45 Ca 0.33 0.58 -0.15 0.00 -0.05 0.00 0.00 56.93 57.64 2f16 s PHE 45 Cb -0.09 0.26 0.03 0.00 -0.63 0.00 0.00 43.02 42.59 2f16 s PHE 45 CO 0.26 -0.53 0.36 0.00 -0.05 0.00 0.00 175.22 175.26 2f16 s ALA 46 N -1.65 -0.91 0.00 1.99 0.00 -0.56 -4.87 121.76 115.77 2f16 s ALA 46 Ca -0.10 0.68 0.00 0.00 0.00 0.00 0.00 51.96 52.54 2f16 s ALA 46 Cb -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 22.90 2f16 s ALA 46 CO 0.04 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 175.98 2f16 n GLY 47 N 1.88 -0.28 3.64 0.00 0.00 -1.26 -0.76 105.19 108.40 2f16 n GLY 47 Ca -0.18 -0.93 -0.41 0.00 0.00 0.00 0.00 46.02 44.49 2f16 n GLY 47 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2f16 n GLU 48 N 0.00 1.55 -0.15 1.61 4.07 -0.17 -4.83 120.64 122.72 2f16 n GLU 48 Ca 0.00 0.55 -0.04 0.00 -0.06 0.00 0.00 57.16 57.61 2f16 n GLU 48 Cb 0.00 -2.15 -0.04 0.00 -0.06 0.00 0.00 31.44 29.19 2f16 n GLU 48 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2f16 n ALA 49 N -0.34 -0.24 0.04 4.31 0.00 -1.26 -2.16 120.51 120.86 2f16 n ALA 49 Ca 0.08 0.31 -0.22 0.00 0.00 0.00 0.00 53.44 53.62 2f16 n ALA 49 Cb 0.39 0.21 -0.14 0.00 0.00 0.00 0.00 19.45 19.90 2f16 n ALA 49 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2f16 h GLY 50 N 0.00 0.35 -0.09 0.00 0.00 -1.99 -3.37 103.07 97.98 2f16 h GLY 50 Ca 0.06 -0.90 0.27 0.00 0.00 0.00 0.00 47.33 46.76 2f16 h GLY 50 CO -0.35 0.79 0.68 -0.55 0.00 0.00 0.00 176.54 177.11 2f16 h ASP 51 N -0.23 0.37 0.48 0.19 3.32 -1.92 -2.73 116.42 115.90 2f16 h ASP 51 Ca -0.26 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 56.84 2f16 h ASP 51 Cb 1.81 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.34 2f16 h ASP 51 CO 0.12 0.08 -0.48 0.00 -1.72 0.00 0.00 179.24 177.24 2f16 h THR 52 N 0.33 0.05 -0.08 0.35 1.03 -1.59 -0.75 112.91 112.26 2f16 h THR 52 Ca 0.57 0.00 -0.17 0.00 -0.01 0.00 0.00 66.41 66.79 2f16 h THR 52 Cb 1.56 0.05 0.01 0.00 -1.07 0.00 0.00 68.15 68.70 2f16 h THR 52 CO -0.23 0.00 -0.62 0.58 -0.01 0.00 0.00 175.52 175.23 2f16 h VAL 53 N -0.97 1.36 -0.87 0.00 2.07 -1.76 -2.75 116.25 113.33 2f16 h VAL 53 Ca -0.05 -1.95 0.14 0.00 0.82 0.00 0.00 66.70 65.65 2f16 h VAL 53 Cb 0.84 2.27 -0.09 0.00 -1.52 0.00 0.00 31.29 32.80 2f16 h VAL 53 CO -0.06 0.59 0.48 1.56 0.02 0.00 0.00 177.57 180.15 2f16 h GLN 54 N 0.16 0.69 -0.02 1.57 1.08 -1.49 -0.33 115.11 116.76 2f16 h GLN 54 Ca -0.06 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.09 2f16 h GLN 54 Cb 1.28 -0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 28.56 2f16 h GLN 54 CO 0.13 0.45 -0.03 0.35 -0.95 0.00 0.00 178.83 178.78 2f16 h PHE 55 N 0.71 0.07 -0.19 2.96 3.04 -1.16 -2.09 116.94 120.28 2f16 h PHE 55 Ca 0.46 -0.02 0.05 0.00 3.98 0.00 0.00 57.97 62.44 2f16 h PHE 55 Cb 0.59 -0.01 -0.06 0.00 2.56 0.00 0.00 35.95 39.03 2f16 h PHE 55 CO -0.07 0.57 -0.16 0.00 -2.02 0.00 0.00 178.31 176.63 2f16 h ALA 56 N 0.49 -0.04 -0.09 2.41 0.00 -1.11 -0.23 119.26 120.69 2f16 h ALA 56 Ca 0.00 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2f16 h ALA 56 Cb 0.56 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2f16 h ALA 56 CO 0.01 -0.60 -0.10 0.93 0.00 0.00 0.00 179.25 179.49 2f16 h GLU 57 N -0.18 0.13 -0.17 0.00 5.08 -1.13 0.14 114.58 118.45 2f16 h GLU 57 Ca 0.12 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.41 2f16 h GLU 57 Cb 0.35 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 2f16 h GLU 57 CO -0.29 0.25 -0.05 -0.92 -1.00 0.00 0.00 179.01 176.99 2f16 h TYR 58 N 0.13 0.38 -0.62 4.33 3.20 -0.55 -0.66 116.97 123.18 2f16 h TYR 58 Ca 0.03 -0.09 -0.04 0.00 3.14 0.00 0.00 58.73 61.77 2f16 h TYR 58 Cb 0.27 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.42 2f16 h TYR 58 CO 0.00 0.62 0.23 0.82 -1.64 0.00 0.00 178.16 178.19 2f16 h ILE 59 N 0.03 1.24 0.18 1.81 1.08 -0.55 -2.60 117.51 118.69 2f16 h ILE 59 Ca 0.04 -0.77 0.01 0.00 -0.39 0.00 0.00 64.86 63.75 2f16 h ILE 59 Cb 0.50 0.57 -0.03 0.00 -3.07 0.00 0.00 36.82 34.80 2f16 h ILE 59 CO 0.02 0.30 -0.26 -0.61 -0.69 0.00 0.00 178.15 176.91 2f16 h GLN 60 N 0.88 -0.49 -0.97 2.37 4.15 -0.84 -1.51 115.11 118.71 2f16 h GLN 60 Ca 0.21 0.03 0.17 0.00 0.77 0.00 0.00 58.65 59.83 2f16 h GLN 60 Cb 0.24 0.11 -0.10 0.00 0.21 0.00 0.00 27.48 27.94 2f16 h GLN 60 CO -0.01 -0.32 0.57 0.00 -1.93 0.00 0.00 178.83 177.13 2f16 h ALA 61 N 0.19 1.56 -0.37 3.38 0.00 -0.99 -1.37 119.26 121.66 2f16 h ALA 61 Ca 0.01 0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 2f16 h ALA 61 Cb 0.50 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2f16 h ALA 61 CO -0.11 -0.03 -0.28 -0.91 0.00 0.00 0.00 179.25 177.92 2f16 h ASN 62 N 0.76 0.89 -0.25 0.00 4.21 -1.03 -1.78 115.58 118.38 2f16 h ASN 62 Ca 0.54 -0.44 -0.12 0.00 1.21 0.00 0.00 56.30 57.49 2f16 h ASN 62 Cb 0.80 -0.25 -0.01 0.00 -1.12 0.00 0.00 38.32 37.74 2f16 h ASN 62 CO -0.37 1.14 -0.26 0.40 -1.29 0.00 0.00 177.43 177.05 2f16 h ILE 63 N 0.64 1.28 -0.64 2.81 1.08 -0.76 -1.73 117.51 120.19 2f16 h ILE 63 Ca 0.07 -1.39 -0.03 0.00 -0.39 0.00 0.00 64.86 63.12 2f16 h ILE 63 Cb 0.86 1.28 -0.03 0.00 -3.07 0.00 0.00 36.82 35.86 2f16 h ILE 63 CO 0.07 0.46 0.28 1.56 -0.69 0.00 0.00 178.15 179.83 2f16 h GLN 64 N 0.64 0.95 -0.44 2.37 4.20 -1.21 -0.78 115.11 120.84 2f16 h GLN 64 Ca 0.08 -0.16 -0.06 0.00 0.06 0.00 0.00 58.65 58.58 2f16 h GLN 64 Cb 0.78 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.37 2f16 h GLN 64 CO 0.06 0.78 0.04 1.25 -0.67 0.00 0.00 178.83 180.29 2f16 h LEU 65 N 0.90 0.64 -0.45 1.46 5.85 -1.13 -1.56 115.31 121.02 2f16 h LEU 65 Ca 0.22 -0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.73 2f16 h LEU 65 Cb 0.17 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 2f16 h LEU 65 CO -0.02 0.69 -0.04 0.22 -0.34 0.00 0.00 178.44 178.94 2f16 h TYR 66 N 0.65 0.91 -0.55 1.25 3.20 -0.67 -1.84 116.97 119.93 2f16 h TYR 66 Ca 0.14 -0.17 -0.00 0.00 3.14 0.00 0.00 58.73 61.83 2f16 h TYR 66 Cb 0.35 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.36 2f16 h TYR 66 CO 0.02 0.89 0.34 0.77 -1.64 0.00 0.00 178.16 178.54 2f16 h SER 67 N 0.67 0.65 -0.47 -2.11 0.02 -0.75 -0.78 113.55 110.78 2f16 h SER 67 Ca 0.12 -0.05 -0.06 0.00 -0.84 0.00 0.00 61.79 60.96 2f16 h SER 67 Cb 0.56 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.92 2f16 h SER 67 CO 0.03 0.51 0.05 0.40 -1.14 0.00 0.00 176.83 176.68 2f16 h ILE 68 N 0.74 1.25 -0.37 3.27 1.08 -1.17 0.61 117.51 122.92 2f16 h ILE 68 Ca 0.20 -0.96 -0.09 0.00 -0.39 0.00 0.00 64.86 63.61 2f16 h ILE 68 Cb -0.04 0.97 -0.01 0.00 -3.07 0.00 0.00 36.82 34.67 2f16 h ILE 68 CO -0.04 0.34 -0.14 -0.09 -0.69 0.00 0.00 178.15 177.53 2f16 h ARG 69 N 0.65 0.74 -0.00 2.37 2.43 -1.14 -3.27 114.38 116.16 2f16 h ARG 69 Ca 0.14 -0.31 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 2f16 h ARG 69 Cb 0.43 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 2f16 h ARG 69 CO 0.01 0.91 -0.78 0.39 -1.51 0.00 0.00 179.97 179.00 2f16 n GLU 70 N -4.33 0.18 -3.83 0.20 4.71 -0.32 -4.97 120.64 112.28 2f16 n GLU 70 Ca -0.02 -0.14 -0.32 0.00 -0.01 0.00 0.00 57.16 56.67 2f16 n GLU 70 Cb 0.38 -1.50 0.02 0.00 -1.01 0.00 0.00 31.44 29.34 2f16 n GLU 70 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 2f16 n ASP 71 N -1.28 -3.65 -3.54 1.62 4.64 0.21 -4.95 116.55 109.59 2f16 n ASP 71 Ca 0.05 -1.07 -0.13 0.00 -1.38 0.00 0.00 54.79 52.27 2f16 n ASP 71 Cb 0.35 -2.98 -0.05 0.00 -1.04 0.00 0.00 41.12 37.39 2f16 n ASP 71 CO 0.00 0.00 0.00 -0.47 -0.82 0.00 0.00 177.20 175.91 2f16 s TYR 72 N -3.63 -0.49 -0.25 -0.67 5.04 -1.18 -5.07 117.35 111.10 2f16 s TYR 72 Ca 0.34 0.78 -0.08 0.00 -2.44 0.00 0.00 57.07 55.67 2f16 s TYR 72 Cb -0.14 0.45 -0.03 0.00 0.35 0.00 0.00 41.96 42.59 2f16 s TYR 72 CO 0.89 -0.48 0.09 -2.00 -1.34 0.00 0.00 175.55 172.70 2f16 s GLU 73 N -1.40 3.67 0.58 4.97 2.12 -1.26 -4.17 118.70 123.21 2f16 s GLU 73 Ca -0.05 -0.47 -0.20 0.00 0.36 0.00 0.00 54.97 54.61 2f16 s GLU 73 Cb -0.00 -3.37 -0.03 0.00 0.26 0.00 0.00 34.13 30.98 2f16 s GLU 73 CO 0.03 -0.20 1.31 -0.51 -0.54 0.00 0.00 175.26 175.36 2f16 s LEU 74 N 1.63 3.74 0.76 2.70 1.43 -1.26 -4.97 118.68 122.71 2f16 s LEU 74 Ca 0.06 2.66 -0.12 0.00 -1.03 0.00 0.00 54.13 55.70 2f16 s LEU 74 Cb -0.15 -4.43 0.05 0.00 0.03 0.00 0.00 46.19 41.69 2f16 s LEU 74 CO 0.05 -1.70 1.12 -0.94 0.23 0.00 0.00 176.35 175.10 2f16 s SER 75 N -1.19 4.35 0.32 2.29 1.04 -1.26 -4.78 113.70 114.47 2f16 s SER 75 Ca 0.76 2.01 0.02 0.00 0.48 0.00 0.00 55.95 59.21 2f16 s SER 75 Cb -0.38 -2.55 0.57 0.00 0.10 0.00 0.00 66.02 63.77 2f16 s SER 75 CO 0.43 -2.14 1.94 -0.65 0.98 0.00 0.00 173.24 173.79 2f16 h PRO 76 N -0.82 0.94 -0.74 4.02 0.11 -1.93 -0.89 132.00 132.69 2f16 h PRO 76 Ca -0.45 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 65.57 2f16 h PRO 76 Cb 1.25 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 2f16 h PRO 76 CO 0.50 0.62 0.34 0.37 -0.21 0.00 0.00 178.00 179.62 2f16 h GLN 77 N 0.97 1.07 -0.55 1.05 -0.00 -1.99 -0.77 115.11 114.89 2f16 h GLN 77 Ca 0.35 -0.17 -0.07 0.00 -0.00 0.00 0.00 58.65 58.75 2f16 h GLN 77 Cb 0.14 -0.19 -0.02 0.00 0.00 0.00 0.00 27.48 27.41 2f16 h GLN 77 CO -0.11 0.85 0.06 0.00 0.00 0.00 0.00 178.83 179.63 2f16 h ALA 78 N 1.17 0.74 -0.34 3.38 0.00 -1.59 -1.62 119.26 121.00 2f16 h ALA 78 Ca 0.25 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2f16 h ALA 78 Cb 0.15 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2f16 h ALA 78 CO -0.03 0.51 -0.01 0.28 0.00 0.00 0.00 179.25 179.99 2f16 h VAL 79 N 0.82 1.26 -0.66 0.00 2.07 -0.88 -1.73 116.25 117.13 2f16 h VAL 79 Ca 0.16 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.67 2f16 h VAL 79 Cb 0.45 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 2f16 h VAL 79 CO 0.02 0.33 0.34 0.77 0.02 0.00 0.00 177.57 179.04 2f16 h SER 80 N 0.41 0.85 -0.94 0.57 4.64 -1.05 -0.04 113.55 117.99 2f16 h SER 80 Ca 0.09 -0.12 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 2f16 h SER 80 Cb 0.47 -0.22 -0.05 0.00 -0.31 0.00 0.00 62.40 62.30 2f16 h SER 80 CO 0.02 0.72 0.56 0.28 -0.87 0.00 0.00 176.83 177.55 2f16 h SER 81 N 0.91 1.14 -0.68 4.97 0.02 -1.18 0.11 113.55 118.84 2f16 h SER 81 Ca 0.23 -0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 61.07 2f16 h SER 81 Cb 0.08 -0.29 -0.03 0.00 0.14 0.00 0.00 62.40 62.30 2f16 h SER 81 CO -0.03 0.88 0.29 0.15 -1.14 0.00 0.00 176.83 176.97 2f16 h PHE 82 N 1.30 1.02 -0.40 3.45 3.04 -0.55 -2.05 116.94 122.76 2f16 h PHE 82 Ca 0.34 -0.07 -0.13 0.00 3.98 0.00 0.00 57.97 62.09 2f16 h PHE 82 Cb -0.05 -0.31 -0.01 0.00 2.56 0.00 0.00 35.95 38.14 2f16 h PHE 82 CO 0.01 0.78 -0.26 0.28 -2.02 0.00 0.00 178.31 177.10 2f16 h VAL 83 N 0.96 1.27 -0.01 1.41 2.07 -0.19 -2.66 116.25 119.10 2f16 h VAL 83 Ca 0.23 -1.40 -0.00 0.00 0.82 0.00 0.00 66.70 66.35 2f16 h VAL 83 Cb 0.18 1.24 -0.00 0.00 -1.52 0.00 0.00 31.29 31.19 2f16 h VAL 83 CO -0.02 0.47 0.01 -0.09 0.02 0.00 0.00 177.57 177.95 2f16 h ARG 84 N 0.71 0.01 -0.95 1.57 2.43 -0.57 -2.29 114.38 115.30 2f16 h ARG 84 Ca 0.09 -0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.34 2f16 h ARG 84 Cb 0.80 -0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.28 2f16 h ARG 84 CO 0.07 0.05 0.61 0.37 -1.51 0.00 0.00 179.97 179.56 2f16 h GLN 85 N -0.03 1.00 -0.32 0.20 4.15 -1.32 0.17 115.11 118.96 2f16 h GLN 85 Ca 0.00 -0.06 -0.01 0.00 0.77 0.00 0.00 58.65 59.35 2f16 h GLN 85 Cb 0.04 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.49 2f16 h GLN 85 CO -0.00 0.66 0.15 0.93 -1.93 0.00 0.00 178.83 178.64 2f16 h GLU 86 N 1.03 0.46 -0.40 1.69 4.39 -1.14 -1.65 114.58 118.96 2f16 h GLU 86 Ca 0.43 -0.07 -0.05 0.00 0.34 0.00 0.00 59.36 60.02 2f16 h GLU 86 Cb 0.31 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.86 2f16 h GLU 86 CO -0.19 0.42 0.05 -0.07 -1.16 0.00 0.00 179.01 178.07 2f16 h LEU 87 N 0.38 0.64 -1.30 1.33 3.38 -0.77 -1.36 115.31 117.60 2f16 h LEU 87 Ca 0.11 -0.27 0.08 0.00 0.09 0.00 0.00 57.88 57.89 2f16 h LEU 87 Cb 0.12 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 2f16 h LEU 87 CO -0.01 0.75 0.53 0.00 0.09 0.00 0.00 178.44 179.79 2f16 h ALA 88 N 0.92 1.69 -0.04 1.53 0.00 -0.51 0.15 119.26 122.99 2f16 h ALA 88 Ca 0.12 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2f16 h ALA 88 Cb 0.39 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2f16 h ALA 88 CO 0.01 0.17 0.00 0.87 0.00 0.00 0.00 179.25 180.30 2f16 h LYS 89 N 0.81 0.07 -0.70 0.00 1.57 -1.00 -3.16 116.57 114.15 2f16 h LYS 89 Ca 0.36 -0.02 0.12 0.00 -1.87 0.00 0.00 60.65 59.24 2f16 h LYS 89 Cb 0.35 -0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.56 2f16 h LYS 89 CO -0.14 0.32 0.27 1.03 -0.57 0.00 0.00 179.45 180.37 2f16 h SER 90 N -0.20 0.27 -0.54 0.86 0.87 0.04 -2.59 113.55 112.26 2f16 h SER 90 Ca 0.01 0.10 0.14 0.00 -1.23 0.00 0.00 61.79 60.80 2f16 h SER 90 Cb 0.29 0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.30 2f16 h SER 90 CO 0.00 0.12 0.38 -0.29 -0.53 0.00 0.00 176.83 176.52 2f16 h ILE 90 N 0.44 0.78 -0.59 2.23 -0.00 -0.75 -1.27 117.51 118.36 2f16 h ILE 90 Ca 0.37 -0.04 0.00 0.00 -0.00 0.00 0.00 64.86 65.19 2f16 h ILE 90 Cb 0.52 0.65 0.00 0.00 -0.00 0.00 0.00 36.82 37.99 2f16 h ILE 90 CO -0.36 0.02 0.00 0.54 -0.00 0.00 0.00 178.15 178.35 2f16 n ARG 90 N -4.42 3.66 -2.72 2.19 1.74 -0.98 -4.81 116.66 111.32 2f16 n ARG 90 Ca 0.10 -2.84 -0.23 0.00 -0.77 0.00 0.00 57.85 54.11 2f16 n ARG 90 Cb 0.53 -1.86 0.11 0.00 -1.02 0.00 0.00 32.46 30.22 2f16 n ARG 90 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2f16 s SER 91 N -1.01 4.38 0.10 0.55 1.04 -0.48 -5.03 113.70 113.27 2f16 s SER 91 Ca 0.48 -0.59 -0.27 0.00 0.48 0.00 0.00 55.95 56.05 2f16 s SER 91 Cb 0.32 0.27 -0.10 0.00 0.10 0.00 0.00 66.02 66.61 2f16 s SER 91 CO 0.22 -1.85 1.66 -0.09 0.98 0.00 0.00 173.24 174.15 2f16 h ARG 92 N -0.43 -0.42 -3.19 4.02 2.43 -1.94 -3.36 114.38 111.49 2f16 h ARG 92 Ca -0.33 0.03 -0.61 0.00 -0.81 0.00 0.00 59.98 58.26 2f16 h ARG 92 Cb 1.27 0.10 -0.40 0.00 -0.42 0.00 0.00 29.97 30.51 2f16 h ARG 92 CO 0.38 -0.28 -0.74 0.50 -1.51 0.00 0.00 179.97 178.32 2f16 s ARG 93 N -6.09 1.13 0.70 0.20 3.52 -1.26 -5.12 118.95 112.02 2f16 s ARG 93 Ca -0.15 -1.75 -0.16 0.00 -0.13 0.00 0.00 55.73 53.54 2f16 s ARG 93 Cb 0.07 -2.26 0.02 0.00 -1.56 0.00 0.00 34.95 31.22 2f16 s ARG 93 CO 0.65 -1.11 1.26 -2.14 -0.81 0.00 0.00 175.30 173.15 2f16 s PRO 94 N 0.72 2.27 0.06 5.12 0.02 -1.25 -4.96 135.00 136.98 2f16 s PRO 94 Ca 0.15 1.94 -0.30 0.00 0.02 0.00 0.00 61.00 62.81 2f16 s PRO 94 Cb -0.22 -1.83 -0.05 0.00 0.02 0.00 0.00 34.50 32.42 2f16 s PRO 94 CO -0.06 -1.78 1.06 0.71 -0.33 0.00 0.00 177.00 176.60 2f16 s TYR 95 N -1.67 3.60 -1.02 6.54 2.02 -1.26 -4.96 117.35 120.60 2f16 s TYR 95 Ca 0.79 1.57 -0.05 0.00 -0.37 0.00 0.00 57.07 59.01 2f16 s TYR 95 Cb -0.34 -3.23 0.26 0.00 -0.40 0.00 0.00 41.96 38.25 2f16 s TYR 95 CO 0.43 -0.47 1.02 1.04 -1.57 0.00 0.00 175.55 176.00 2f16 n GLN 96 N 3.55 3.27 -4.11 -0.62 6.02 -1.26 -4.88 117.38 119.36 2f16 n GLN 96 Ca 0.06 -4.48 -0.16 0.00 -0.01 0.00 0.00 57.00 52.40 2f16 n GLN 96 Cb 0.49 -2.49 -0.15 0.00 1.02 0.00 0.00 30.24 29.11 2f16 n GLN 96 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2f16 s VAL 97 N -1.50 0.37 -0.02 5.09 1.01 -1.26 -0.99 120.40 123.09 2f16 s VAL 97 Ca 0.30 -0.14 0.04 0.00 0.00 0.00 0.00 61.98 62.18 2f16 s VAL 97 Cb -0.07 -0.35 -0.03 0.00 0.00 0.00 0.00 36.38 35.93 2f16 s VAL 97 CO -0.08 0.13 -0.12 0.20 0.00 0.00 0.00 175.10 175.24 2f16 s ASN 98 N 0.25 4.25 0.07 3.32 0.01 0.06 -2.28 114.94 120.62 2f16 s ASN 98 Ca -0.03 -0.19 0.01 0.00 -0.71 0.00 0.00 52.86 51.94 2f16 s ASN 98 Cb -0.06 -0.92 -0.04 0.00 0.41 0.00 0.00 41.25 40.64 2f16 s ASN 98 CO -0.00 0.32 -0.05 0.68 -1.51 0.00 0.00 177.10 176.53 2f16 s VAL 99 N -0.85 0.45 -0.09 1.60 -7.23 0.09 -1.50 120.40 112.87 2f16 s VAL 99 Ca 0.14 -1.72 0.03 0.00 -1.81 0.00 0.00 61.98 58.63 2f16 s VAL 99 Cb -0.11 -1.39 0.00 0.00 0.56 0.00 0.00 36.38 35.44 2f16 s VAL 99 CO 0.03 -0.84 -0.20 -0.76 -0.31 0.00 0.00 175.10 173.02 2f16 s LEU 100 N -2.72 1.95 -0.19 1.32 1.43 -0.60 -1.39 118.68 118.48 2f16 s LEU 100 Ca 0.05 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 52.68 2f16 s LEU 100 Cb 0.04 -1.23 0.02 0.00 0.03 0.00 0.00 46.19 45.05 2f16 s LEU 100 CO -0.06 0.12 -0.17 -0.63 0.23 0.00 0.00 176.35 175.84 2f16 s ILE 101 N 0.44 2.26 -0.14 -0.59 1.01 0.12 -1.02 121.20 123.28 2f16 s ILE 101 Ca -0.18 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 59.56 2f16 s ILE 101 Cb -0.17 -1.99 0.00 0.00 0.01 0.00 0.00 42.46 40.30 2f16 s ILE 101 CO 0.07 0.48 -0.19 -0.83 0.00 0.00 0.00 174.94 174.47 2f16 s GLY 102 N 1.30 1.42 0.17 6.18 0.00 0.10 0.43 107.32 116.92 2f16 s GLY 102 Ca 0.04 -1.03 -0.06 0.00 0.00 0.00 0.00 44.72 43.67 2f16 s GLY 102 CO -0.11 -0.07 0.22 -0.32 0.00 0.00 0.00 173.10 172.81 2f16 s GLY 103 N 0.69 0.77 -0.28 0.20 0.00 0.08 -0.02 107.32 108.76 2f16 s GLY 103 Ca -0.09 -1.17 0.01 0.00 0.00 0.00 0.00 44.72 43.47 2f16 s GLY 103 CO 0.01 -1.05 -0.06 -0.47 0.00 0.00 0.00 173.10 171.54 2f16 s TYR 104 N -4.02 3.27 0.00 1.90 6.14 -0.21 -0.33 117.35 124.10 2f16 s TYR 104 Ca 0.23 -2.14 0.00 0.00 0.64 0.00 0.00 57.07 55.80 2f16 s TYR 104 Cb 0.05 -2.02 0.00 0.00 0.42 0.00 0.00 41.96 40.41 2f16 s TYR 104 CO 0.03 -0.85 0.00 -3.47 0.64 0.00 0.00 175.55 171.90 2f16 n ASP 105 N 4.51 0.00 0.00 4.32 4.64 -0.69 -4.89 116.55 124.45 2f16 n ASP 105 Ca -0.13 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.28 2f16 n ASP 105 Cb 0.43 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.51 2f16 n ASP 105 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 2f16 n LYS 10 N 0.00 0.00 -3.59 -0.67 5.02 -1.26 -2.97 118.16 114.69 2f16 n LYS 10 Ca 0.00 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.09 2f16 n LYS 10 Cb 0.00 -2.29 0.05 0.00 -0.02 0.00 0.00 35.03 32.77 2f16 n LYS 10 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2f16 n ASN 106 N 0.00 -1.55 -3.81 4.39 3.02 -1.26 -5.01 115.26 111.04 2f16 n ASN 106 Ca 0.00 -0.74 -0.12 0.00 -0.03 0.00 0.00 54.58 53.68 2f16 n ASN 106 Cb 0.00 -4.47 -0.10 0.00 -0.61 0.00 0.00 39.78 34.59 2f16 n ASN 106 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2f16 s LYS 107 N -5.73 0.43 0.46 3.52 1.02 -1.16 -5.07 119.74 113.22 2f16 s LYS 107 Ca 0.01 -0.04 -0.18 0.00 0.02 0.00 0.00 55.97 55.78 2f16 s LYS 107 Cb -0.00 0.19 -0.09 0.00 -0.52 0.00 0.00 37.83 37.41 2f16 s LYS 107 CO 0.78 -0.09 0.95 -1.25 -0.92 0.00 0.00 175.35 174.82 2f16 s PRO 108 N -0.71 4.07 -0.05 -1.68 0.04 -1.26 -1.70 135.00 133.72 2f16 s PRO 108 Ca -0.08 1.00 -0.03 0.00 0.04 0.00 0.00 61.00 61.92 2f16 s PRO 108 Cb -0.04 -2.18 0.02 0.00 0.04 0.00 0.00 34.50 32.33 2f16 s PRO 108 CO 0.02 -0.13 0.11 -1.21 0.04 0.00 0.00 177.00 175.83 2f16 s GLU 109 N -3.61 0.11 -0.11 4.56 2.02 0.55 -4.92 118.70 117.31 2f16 s GLU 109 Ca 0.60 0.20 0.03 0.00 0.02 0.00 0.00 54.97 55.82 2f16 s GLU 109 Cb -0.10 -0.00 0.01 0.00 0.10 0.00 0.00 34.13 34.14 2f16 s GLU 109 CO 0.22 -0.05 -0.19 -1.17 0.02 0.00 0.00 175.26 174.09 2f16 s LEU 110 N 0.34 1.90 -0.10 1.80 2.96 -1.26 -0.74 118.68 123.59 2f16 s LEU 110 Ca -0.02 -0.49 0.04 0.00 -0.22 0.00 0.00 54.13 53.43 2f16 s LEU 110 Cb -0.04 -1.22 0.00 0.00 0.50 0.00 0.00 46.19 45.43 2f16 s LEU 110 CO -0.01 0.07 -0.22 -0.31 -1.32 0.00 0.00 176.35 174.56 2f16 s TYR 111 N 0.72 2.37 -0.17 5.38 2.02 0.17 -2.29 117.35 125.56 2f16 s TYR 111 Ca -0.11 -0.98 -0.05 0.00 -0.37 0.00 0.00 57.07 55.55 2f16 s TYR 111 Cb -0.16 -1.60 -0.03 0.00 -0.40 0.00 0.00 41.96 39.76 2f16 s TYR 111 CO 0.02 -0.41 -0.00 -1.14 -1.57 0.00 0.00 175.55 172.44 2f16 s GLN 112 N 0.45 3.76 -0.04 -0.62 0.74 -0.37 0.14 119.66 123.72 2f16 s GLN 112 Ca -0.17 -0.47 -0.02 0.00 0.05 0.00 0.00 55.36 54.76 2f16 s GLN 112 Cb -0.17 -3.02 0.03 0.00 1.10 0.00 0.00 33.01 30.95 2f16 s GLN 112 CO 0.07 0.24 0.05 0.42 -0.55 0.00 0.00 175.29 175.51 2f16 s ILE 113 N 0.41 -0.04 0.65 -2.34 1.01 -0.49 -1.36 121.20 119.05 2f16 s ILE 113 Ca -0.02 0.35 -0.03 0.00 0.00 0.00 0.00 60.65 60.95 2f16 s ILE 113 Cb -0.14 -0.19 0.06 0.00 0.01 0.00 0.00 42.46 42.20 2f16 s ILE 113 CO 0.02 0.17 0.92 1.51 0.00 0.00 0.00 174.94 177.57 2f16 s ASP 114 N 1.95 4.91 0.52 3.58 3.84 -0.80 -0.73 116.67 129.93 2f16 s ASP 114 Ca 0.02 0.19 0.32 0.00 -0.00 0.00 0.00 52.55 53.08 2f16 s ASP 114 Cb -0.12 -0.89 1.76 0.00 -1.38 0.00 0.00 42.92 42.29 2f16 s ASP 114 CO -0.03 -1.47 1.98 0.10 -0.00 0.00 0.00 175.17 175.75 2f16 h TYR 115 N -0.35 0.00 0.00 2.11 -0.00 -1.79 -0.28 116.97 116.66 2f16 h TYR 115 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.30 2f16 h TYR 115 Cb 1.30 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.03 2f16 h TYR 115 CO 0.26 0.00 -0.08 1.28 -0.00 0.00 0.00 178.16 179.62 2f16 n LEU 116 N -2.68 0.37 0.00 0.10 4.77 -1.26 -4.59 117.00 113.71 2f16 n LEU 116 Ca -0.02 0.47 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 2f16 n LEU 116 Cb 0.11 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 2f16 n LEU 116 CO 0.14 -0.06 0.00 0.61 -1.33 0.00 0.00 177.39 176.76 2f16 n GLY 117 N 1.42 1.24 3.56 -0.72 0.00 -0.12 -4.25 105.19 106.33 2f16 n GLY 117 Ca 0.06 -0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 2f16 n GLY 117 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2f16 s THR 118 N -2.00 4.71 0.12 2.61 2.01 -1.23 -4.81 115.64 117.05 2f16 s THR 118 Ca 0.00 0.61 0.07 0.00 0.31 0.00 0.00 61.69 62.68 2f16 s THR 118 Cb 0.00 -4.25 -0.04 0.00 0.01 0.00 0.00 72.50 68.22 2f16 s THR 118 CO 0.00 -0.56 -0.06 -0.75 -0.69 0.00 0.00 174.62 172.56 2f16 s LYS 119 N 3.14 2.27 -0.20 4.92 2.20 -1.26 -1.91 119.74 128.90 2f16 s LYS 119 Ca 0.30 -1.00 -0.26 0.00 -0.36 0.00 0.00 55.97 54.64 2f16 s LYS 119 Cb -0.13 -2.36 0.07 0.00 -1.51 0.00 0.00 37.83 33.90 2f16 s LYS 119 CO 0.19 0.50 0.69 0.54 -0.36 0.00 0.00 175.35 176.91 2f16 s VAL 120 N -1.34 0.00 -0.15 4.02 0.11 -0.46 -5.01 120.40 117.57 2f16 s VAL 120 Ca 0.24 -0.01 -0.12 0.00 -2.93 0.00 0.00 61.98 59.16 2f16 s VAL 120 Cb -0.11 -0.97 -0.05 0.00 -1.53 0.00 0.00 36.38 33.72 2f16 s VAL 120 CO 0.16 -0.00 0.24 -0.70 -3.33 0.00 0.00 175.10 171.46 2f16 s GLU 121 N -0.11 4.07 0.08 1.54 2.12 -1.26 -1.24 118.70 123.90 2f16 s GLU 121 Ca -0.03 0.01 -0.01 0.00 0.36 0.00 0.00 54.97 55.29 2f16 s GLU 121 Cb -0.03 -3.37 -0.04 0.00 0.26 0.00 0.00 34.13 30.95 2f16 s GLU 121 CO 0.04 0.39 0.01 -0.51 -0.54 0.00 0.00 175.26 174.65 2f16 s LEU 122 N 0.05 2.15 0.20 2.70 1.43 -0.97 -5.00 118.68 119.24 2f16 s LEU 122 Ca 0.15 -1.07 -0.02 0.00 -1.03 0.00 0.00 54.13 52.16 2f16 s LEU 122 Cb -0.13 0.27 0.13 0.00 0.03 0.00 0.00 46.19 46.50 2f16 s LEU 122 CO 0.03 -0.66 1.51 -0.65 0.23 0.00 0.00 176.35 176.81 2f16 h PRO 123 N 3.02 0.48 -2.32 1.29 0.11 -1.90 -3.39 132.00 129.29 2f16 h PRO 123 Ca -0.34 -0.32 -0.08 0.00 0.11 0.00 0.00 66.00 65.37 2f16 h PRO 123 Cb 1.17 0.04 -0.20 0.00 0.11 0.00 0.00 31.00 32.12 2f16 h PRO 123 CO 0.63 0.92 0.04 1.52 -0.21 0.00 0.00 178.00 180.90 2f16 s TYR 124 N -3.91 -0.52 0.26 0.65 1.13 -1.26 0.79 117.35 114.48 2f16 s TYR 124 Ca -0.07 0.91 -0.11 0.00 -1.41 0.00 0.00 57.07 56.40 2f16 s TYR 124 Cb 0.11 0.31 -0.00 0.00 -1.10 0.00 0.00 41.96 41.28 2f16 s TYR 124 CO 0.83 -0.53 0.47 0.20 -2.51 0.00 0.00 175.55 174.01 2f16 s GLY 125 N -1.13 0.69 0.18 5.49 0.00 -0.44 -5.01 107.32 107.10 2f16 s GLY 125 Ca -0.11 -1.00 -0.18 0.00 0.00 0.00 0.00 44.72 43.44 2f16 s GLY 125 CO 0.08 -0.71 0.50 0.00 0.00 0.00 0.00 173.10 172.97 2f16 s ALA 126 N -3.87 -0.98 0.07 3.20 0.00 -1.26 -1.38 121.76 117.54 2f16 s ALA 126 Ca 0.24 -0.13 0.06 0.00 0.00 0.00 0.00 51.96 52.13 2f16 s ALA 126 Cb -0.00 0.82 -0.03 0.00 0.00 0.00 0.00 23.12 23.91 2f16 s ALA 126 CO 0.11 -0.77 -0.16 -1.01 0.00 0.00 0.00 175.76 173.93 2f16 s HIS 127 N -3.85 1.37 0.00 0.00 3.76 -1.04 -4.74 115.29 110.79 2f16 s HIS 127 Ca 0.07 -0.42 0.00 0.00 -0.15 0.00 0.00 55.06 54.57 2f16 s HIS 127 Cb -0.00 -0.78 0.00 0.00 1.11 0.00 0.00 32.58 32.90 2f16 s HIS 127 CO -0.06 0.08 0.00 0.41 -0.85 0.00 0.00 174.74 174.33 2f16 n GLY 128 N 1.46 -0.09 0.00 -2.22 0.00 -1.26 -3.59 105.19 99.49 2f16 n GLY 128 Ca -0.20 -1.07 0.14 0.00 0.00 0.00 0.00 46.02 44.89 2f16 n GLY 128 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2f16 n TYR 129 N 4.83 0.00 -0.10 1.61 4.01 -1.26 -4.01 117.16 122.24 2f16 n TYR 129 Ca 0.00 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.68 2f16 n TYR 129 Cb 0.00 -0.42 0.00 0.00 -0.31 0.00 0.00 39.34 38.62 2f16 n TYR 129 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 2f16 h SER 130 N 0.02 -0.58 -0.91 7.72 0.02 -1.90 -0.55 113.55 117.37 2f16 h SER 130 Ca 0.00 0.14 0.22 0.00 -0.84 0.00 0.00 61.79 61.31 2f16 h SER 130 Cb 0.49 0.32 -0.06 0.00 0.14 0.00 0.00 62.40 63.28 2f16 h SER 130 CO 0.00 -0.20 0.61 1.23 -1.14 0.00 0.00 176.83 177.33 2f16 h GLY 131 N -0.11 0.74 1.48 -3.77 0.00 -1.79 -1.32 103.07 98.29 2f16 h GLY 131 Ca 0.18 -0.15 0.07 0.00 0.00 0.00 0.00 47.33 47.42 2f16 h GLY 131 CO -0.43 -0.02 0.20 0.74 0.00 0.00 0.00 176.54 177.03 2f16 h PHE 132 N 0.33 0.00 0.00 5.60 0.04 -1.35 0.25 116.94 121.81 2f16 h PHE 132 Ca 0.47 0.00 -0.28 0.00 2.80 0.00 0.00 57.97 60.97 2f16 h PHE 132 Cb 1.30 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 39.40 2f16 h PHE 132 CO -0.00 0.00 -2.04 0.66 -0.60 0.00 0.00 178.31 176.33 2f16 n TYR 133 N -4.18 0.00 0.03 -0.55 4.01 -0.56 -4.73 117.16 111.18 2f16 n TYR 133 Ca 0.03 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.63 2f16 n TYR 133 Cb 0.34 -0.73 -0.14 0.00 -0.31 0.00 0.00 39.34 38.51 2f16 n TYR 133 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 2f16 h THR 134 N 0.00 1.09 -0.36 -0.72 1.35 -1.27 -3.37 112.91 109.63 2f16 h THR 134 Ca -0.41 -2.80 0.10 0.00 -0.55 0.00 0.00 66.41 62.75 2f16 h THR 134 Cb 1.77 2.65 -0.01 0.00 -1.73 0.00 0.00 68.15 70.83 2f16 h THR 134 CO -0.02 0.76 0.34 -0.26 -0.25 0.00 0.00 175.52 176.09 2f16 h PHE 135 N 0.04 0.00 0.10 4.73 0.04 -1.17 -0.22 116.94 120.46 2f16 h PHE 135 Ca -0.24 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.33 2f16 h PHE 135 Cb 1.98 0.00 0.02 0.00 2.20 0.00 0.00 35.95 40.16 2f16 h PHE 135 CO 0.04 0.00 -0.84 0.66 -0.60 0.00 0.00 178.31 177.57 2f16 h SER 136 N 0.00 0.57 -0.45 2.17 4.64 -1.79 -1.22 113.55 117.48 2f16 h SER 136 Ca 0.17 -0.87 0.02 0.00 -0.47 0.00 0.00 61.79 60.63 2f16 h SER 136 Cb 0.85 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.73 2f16 h SER 136 CO -0.00 1.39 0.27 -0.07 -0.87 0.00 0.00 176.83 177.55 2f16 h LEU 137 N -0.16 0.45 -0.21 5.97 3.38 -1.37 -2.18 115.31 121.18 2f16 h LEU 137 Ca -0.13 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 2f16 h LEU 137 Cb 1.60 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 42.25 2f16 h LEU 137 CO 0.16 0.32 -0.03 -0.07 0.09 0.00 0.00 178.44 178.91 2f16 h LEU 138 N 0.55 0.39 -1.60 1.67 3.38 -1.17 -0.61 115.31 117.92 2f16 h LEU 138 Ca 0.17 -0.35 0.22 0.00 0.09 0.00 0.00 57.88 58.02 2f16 h LEU 138 Cb -0.01 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 40.57 2f16 h LEU 138 CO -0.07 0.64 0.61 0.44 0.09 0.00 0.00 178.44 180.15 2f16 h ASP 139 N 0.13 0.32 0.00 -0.43 3.32 -1.05 -0.72 116.42 118.00 2f16 h ASP 139 Ca 0.06 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2f16 h ASP 139 Cb 0.46 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.99 2f16 h ASP 139 CO 0.02 0.12 0.00 1.57 -1.72 0.00 0.00 179.24 179.23 2f16 n HIS 140 N -4.47 0.00 1.62 4.55 -0.00 -0.84 -4.39 115.22 111.69 2f16 n HIS 140 Ca 0.19 0.00 0.02 0.00 0.46 0.00 0.00 57.72 58.39 2f16 n HIS 140 Cb 0.76 -0.49 0.05 0.00 -0.12 0.00 0.00 29.99 30.19 2f16 n HIS 140 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2f16 n HIS 141 N -1.97 0.14 -3.23 1.57 8.25 -0.28 -4.92 115.22 114.79 2f16 n HIS 141 Ca 0.00 -0.07 -0.39 0.00 -0.26 0.00 0.00 57.72 57.00 2f16 n HIS 141 Cb 0.00 -0.01 -0.06 0.00 1.12 0.00 0.00 29.99 31.04 2f16 n HIS 141 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 2f16 s TYR 142 N -1.83 3.82 -0.02 4.41 5.04 -0.28 -5.02 117.35 123.47 2f16 s TYR 142 Ca 0.07 1.32 -0.01 0.00 -2.44 0.00 0.00 57.07 56.01 2f16 s TYR 142 Cb 0.04 -2.54 0.02 0.00 0.35 0.00 0.00 41.96 39.83 2f16 s TYR 142 CO 0.05 0.58 0.05 1.03 -1.34 0.00 0.00 175.55 175.91 2f16 s ARG 143 N -1.10 0.01 0.62 4.97 1.81 -1.26 -5.02 118.95 118.98 2f16 s ARG 143 Ca 0.30 0.16 0.32 0.00 -1.72 0.00 0.00 55.73 54.79 2f16 s ARG 143 Cb -0.20 -0.14 1.79 0.00 -0.45 0.00 0.00 34.95 35.95 2f16 s ARG 143 CO 0.20 -0.11 2.11 -1.35 -0.68 0.00 0.00 175.30 175.48 2f16 h PRO 144 N 6.83 0.00 -0.56 3.54 0.11 -1.97 -2.42 132.00 137.53 2f16 h PRO 144 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2f16 h PRO 144 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2f16 h PRO 144 CO 0.48 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.87 2f16 n ASP 145 N -3.50 3.65 -4.62 -2.05 3.85 -1.26 -3.57 116.55 109.04 2f16 n ASP 145 Ca 0.00 -2.09 -0.38 0.00 -0.71 0.00 0.00 54.79 51.61 2f16 n ASP 145 Cb 0.30 -0.40 0.05 0.00 -1.35 0.00 0.00 41.12 39.72 2f16 n ASP 145 CO 0.00 0.00 0.00 0.23 -1.01 0.00 0.00 177.20 176.42 2f16 n MET 146 N 1.06 0.97 -2.57 0.11 2.81 -0.91 -4.60 117.12 113.99 2f16 n MET 146 Ca 0.19 0.37 -0.26 0.00 -1.81 0.00 0.00 57.70 56.20 2f16 n MET 146 Cb 0.59 -2.19 0.02 0.00 -0.71 0.00 0.00 33.22 30.93 2f16 n MET 146 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2f16 s THR 147 N -1.49 3.88 0.53 2.03 -4.23 -1.26 -1.38 115.64 113.73 2f16 s THR 147 Ca 0.75 -0.10 0.21 0.00 -1.18 0.00 0.00 61.69 61.37 2f16 s THR 147 Cb -0.42 -3.51 0.33 0.00 1.34 0.00 0.00 72.50 70.24 2f16 s THR 147 CO 0.48 -0.48 2.09 0.74 -0.54 0.00 0.00 174.62 176.90 2f16 h THR 148 N 0.01 0.83 -0.14 3.99 2.02 -1.97 0.12 112.91 117.78 2f16 h THR 148 Ca -0.46 0.00 -0.19 0.00 0.77 0.00 0.00 66.41 66.53 2f16 h THR 148 Cb 1.25 0.88 -0.00 0.00 -1.74 0.00 0.00 68.15 68.54 2f16 h THR 148 CO 0.60 0.00 -0.69 -0.08 0.37 0.00 0.00 175.52 175.72 2f16 h GLU 149 N 0.00 0.57 -0.13 6.66 4.57 -2.00 -2.07 114.58 122.17 2f16 h GLU 149 Ca 0.11 -0.43 -0.14 0.00 -1.18 0.00 0.00 59.36 57.72 2f16 h GLU 149 Cb 0.46 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.12 2f16 h GLU 149 CO -0.00 1.05 -0.52 0.93 -1.18 0.00 0.00 179.01 179.29 2f16 h GLU 150 N 0.40 0.38 0.16 1.92 5.08 -1.43 -2.69 114.58 118.40 2f16 h GLU 150 Ca -0.02 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 2f16 h GLU 150 Cb 1.27 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2f16 h GLU 150 CO 0.13 0.81 -0.08 0.78 -1.00 0.00 0.00 179.01 179.65 2f16 h GLY 151 N 1.24 -0.23 2.00 -3.84 0.00 -0.67 -1.18 103.07 100.39 2f16 h GLY 151 Ca 0.01 0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.42 2f16 h GLY 151 CO 0.09 -0.08 -0.01 1.41 0.00 0.00 0.00 176.54 177.94 2f16 h LEU 152 N -0.25 0.00 -0.06 3.11 3.38 -1.29 -1.09 115.31 119.11 2f16 h LEU 152 Ca -0.02 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.70 2f16 h LEU 152 Cb 0.19 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.95 2f16 h LEU 152 CO 0.04 0.01 -1.05 0.44 0.09 0.00 0.00 178.44 177.97 2f16 h ASP 153 N 0.00 0.55 -0.60 -0.43 3.45 -1.08 -1.97 116.42 116.33 2f16 h ASP 153 Ca -0.00 -0.48 -0.10 0.00 0.43 0.00 0.00 57.03 56.88 2f16 h ASP 153 Cb 0.03 -0.17 -0.02 0.00 -0.56 0.00 0.00 39.33 38.61 2f16 h ASP 153 CO 0.00 1.30 -0.02 0.25 -1.57 0.00 0.00 179.24 179.20 2f16 h LEU 154 N 0.20 1.06 -0.29 1.55 5.85 -0.16 -1.85 115.31 121.67 2f16 h LEU 154 Ca -0.11 -0.32 -0.04 0.00 0.84 0.00 0.00 57.88 58.26 2f16 h LEU 154 Cb 1.72 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 42.45 2f16 h LEU 154 CO 0.18 1.12 0.03 -0.07 -0.34 0.00 0.00 178.44 179.36 2f16 h LEU 155 N 0.97 0.49 -1.06 2.25 3.38 -1.24 -1.12 115.31 118.98 2f16 h LEU 155 Ca 0.17 -0.28 0.15 0.00 0.09 0.00 0.00 57.88 58.00 2f16 h LEU 155 Cb 0.59 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 41.12 2f16 h LEU 155 CO 0.04 0.65 0.62 0.50 0.09 0.00 0.00 178.44 180.33 2f16 h LYS 156 N 0.31 0.85 -0.36 1.13 3.64 -1.14 0.63 116.57 121.62 2f16 h LYS 156 Ca 0.09 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.36 2f16 h LYS 156 Cb 0.38 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 2f16 h LYS 156 CO 0.01 0.56 0.02 1.25 -2.27 0.00 0.00 179.45 179.02 2f16 h LEU 157 N 0.87 0.61 0.12 5.20 5.85 -0.84 -0.90 115.31 126.23 2f16 h LEU 157 Ca 0.51 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 2f16 h LEU 157 Cb 0.66 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.53 2f16 h LEU 157 CO -0.29 0.76 -0.06 0.00 -0.34 0.00 0.00 178.44 178.51 2f16 h VAL 159 N -0.22 0.96 -0.15 0.00 2.07 0.24 -1.19 116.25 117.96 2f16 h VAL 159 Ca -0.02 -0.02 -0.14 0.00 0.82 0.00 0.00 66.70 67.34 2f16 h VAL 159 Cb 0.17 0.89 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2f16 h VAL 159 CO 0.03 0.01 -0.44 1.56 0.02 0.00 0.00 177.57 178.75 2f16 h GLN 160 N 0.07 0.57 -0.86 1.57 4.20 -0.73 -1.58 115.11 118.34 2f16 h GLN 160 Ca 0.06 -0.41 -0.00 0.00 0.06 0.00 0.00 58.65 58.36 2f16 h GLN 160 Cb 0.17 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.98 2f16 h GLN 160 CO -0.01 1.03 0.53 1.49 -0.67 0.00 0.00 178.83 181.21 2f16 h GLU 161 N 0.21 1.16 -0.58 1.46 4.57 -0.67 -1.33 114.58 119.40 2f16 h GLU 161 Ca -0.01 -0.09 -0.07 0.00 -1.18 0.00 0.00 59.36 58.01 2f16 h GLU 161 Cb 1.06 -0.25 -0.02 0.00 -0.16 0.00 0.00 28.75 29.38 2f16 h GLU 161 CO 0.10 0.80 0.11 -0.07 -1.18 0.00 0.00 179.01 178.76 2f16 h LEU 162 N 1.18 0.91 -1.36 1.64 3.38 -1.13 -1.46 115.31 118.47 2f16 h LEU 162 Ca 0.31 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 2f16 h LEU 162 Cb -0.07 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 2f16 h LEU 162 CO -0.06 0.93 -0.22 -0.33 0.09 0.00 0.00 178.44 178.85 2f16 h GLU 163 N 0.85 0.00 0.00 1.13 5.08 -0.68 -1.50 114.58 119.47 2f16 h GLU 163 Ca 0.18 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.54 2f16 h GLU 163 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 2f16 h GLU 163 CO 0.01 0.22 -0.00 -0.22 -1.00 0.00 0.00 179.01 178.02 2f16 h LYS 164 N 0.00 -0.00 0.00 2.33 3.64 -0.85 -3.41 116.57 118.28 2f16 h LYS 164 Ca -0.00 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.25 2f16 h LYS 164 Cb 0.63 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.43 2f16 h LYS 164 CO 0.03 0.80 -1.67 0.54 -2.27 0.00 0.00 179.45 176.89 2f16 n ARG 165 N -4.64 0.64 -2.53 1.90 5.12 -0.59 -4.95 116.66 111.60 2f16 n ARG 165 Ca -0.08 0.05 -0.40 0.00 -1.93 0.00 0.00 57.85 55.49 2f16 n ARG 165 Cb 0.39 -1.68 -0.05 0.00 -1.16 0.00 0.00 32.46 29.96 2f16 n ARG 165 CO 0.00 0.00 0.00 -1.64 -1.93 0.00 0.00 177.63 174.06 2f16 s MET 166 N -3.10 4.67 0.26 5.56 -1.94 -0.56 -4.96 119.30 119.23 2f16 s MET 166 Ca -0.05 1.73 0.02 0.00 -1.71 0.00 0.00 55.69 55.68 2f16 s MET 166 Cb 0.10 -3.18 0.35 0.00 2.01 0.00 0.00 34.83 34.11 2f16 s MET 166 CO 0.84 0.26 1.68 -1.35 -0.01 0.00 0.00 175.02 176.44 2f16 h PRO 167 N 3.83 0.48 -6.52 2.03 0.11 -1.93 -3.45 132.00 126.55 2f16 h PRO 167 Ca -0.46 -0.20 -0.53 0.00 0.11 0.00 0.00 66.00 64.91 2f16 h PRO 167 Cb 1.21 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 2f16 h PRO 167 CO 0.67 0.74 0.02 -1.64 -0.21 0.00 0.00 178.00 177.58 2f16 s MET 168 N -4.37 4.06 -0.66 1.05 -1.94 -1.26 -5.02 119.30 111.15 2f16 s MET 168 Ca -0.07 0.64 -0.20 0.00 -1.71 0.00 0.00 55.69 54.34 2f16 s MET 168 Cb 0.13 -2.76 0.09 0.00 2.01 0.00 0.00 34.83 34.31 2f16 s MET 168 CO 0.80 0.35 0.86 0.34 -0.01 0.00 0.00 175.02 177.36 2f16 s ASP 169 N -1.91 6.22 -0.02 3.03 -1.08 -1.26 -4.89 116.67 116.76 2f16 s ASP 169 Ca 0.45 -1.30 0.07 0.00 -0.52 0.00 0.00 52.55 51.25 2f16 s ASP 169 Cb -0.14 -2.36 0.24 0.00 -1.46 0.00 0.00 42.92 39.20 2f16 s ASP 169 CO 0.20 -1.26 1.13 2.22 0.52 0.00 0.00 175.17 177.98 2f16 n PHE 170 N 6.95 0.45 -3.92 -5.34 1.16 -1.26 -4.89 117.46 110.60 2f16 n PHE 170 Ca -0.04 -0.19 -0.28 0.00 -1.87 0.00 0.00 57.45 55.07 2f16 n PHE 170 Cb 0.44 -0.06 0.01 0.00 -1.61 0.00 0.00 39.48 38.26 2f16 n PHE 170 CO 0.00 0.00 0.00 1.63 -1.87 0.00 0.00 176.76 176.52 2f16 n LYS 171 N 0.25 -4.65 -1.17 3.97 4.76 -1.26 -2.03 118.16 118.03 2f16 n LYS 171 Ca 0.09 0.54 0.15 0.00 -2.87 0.00 0.00 58.31 56.22 2f16 n LYS 171 Cb 0.31 -5.19 -0.06 0.00 -1.84 0.00 0.00 35.03 28.25 2f16 n LYS 171 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2f16 n GLY 172 N -1.67 -2.55 3.69 0.72 0.00 -1.26 -4.22 105.19 99.90 2f16 n GLY 172 Ca -0.09 -1.17 -0.25 0.00 0.00 0.00 0.00 46.02 44.51 2f16 n GLY 172 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2f16 s VAL 173 N -3.06 2.52 -0.16 1.61 -7.23 -1.26 -0.65 120.40 112.16 2f16 s VAL 173 Ca 0.00 -1.82 -0.01 0.00 -1.81 0.00 0.00 61.98 58.34 2f16 s VAL 173 Cb 0.00 -2.92 -0.01 0.00 0.56 0.00 0.00 36.38 34.01 2f16 s VAL 173 CO 0.00 -0.11 -0.11 -0.63 -0.31 0.00 0.00 175.10 173.94 2f16 s ILE 174 N -2.55 3.06 0.01 -0.62 1.01 -0.37 -4.88 121.20 116.86 2f16 s ILE 174 Ca 0.38 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 60.40 2f16 s ILE 174 Cb 0.02 -2.32 -0.04 0.00 0.01 0.00 0.00 42.46 40.13 2f16 s ILE 174 CO 0.21 0.50 0.04 -0.69 0.00 0.00 0.00 174.94 175.00 2f16 s VAL 175 N 0.77 4.43 0.00 2.92 1.01 -1.26 -2.05 120.40 126.22 2f16 s VAL 175 Ca -0.04 -0.56 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 2f16 s VAL 175 Cb -0.15 -3.02 -0.01 0.00 0.00 0.00 0.00 36.38 33.20 2f16 s VAL 175 CO 0.01 0.32 0.02 -0.54 0.00 0.00 0.00 175.10 174.91 2f16 s LYS 176 N -1.76 0.20 -0.06 2.72 1.02 -0.49 -2.11 119.74 119.26 2f16 s LYS 176 Ca 0.22 -0.28 0.05 0.00 0.02 0.00 0.00 55.97 55.98 2f16 s LYS 176 Cb -0.12 0.08 -0.02 0.00 -0.52 0.00 0.00 37.83 37.25 2f16 s LYS 176 CO 0.13 -0.03 -0.21 0.42 -0.92 0.00 0.00 175.35 174.74 2f16 s ILE 177 N -0.75 2.46 -0.18 2.17 1.09 0.23 -1.52 121.20 124.71 2f16 s ILE 177 Ca -0.08 -0.92 0.01 0.00 -1.10 0.00 0.00 60.65 58.55 2f16 s ILE 177 Cb -0.05 -1.93 0.01 0.00 -1.06 0.00 0.00 42.46 39.43 2f16 s ILE 177 CO -0.00 0.57 -0.18 -0.69 -0.10 0.00 0.00 174.94 174.54 2f16 s VAL 178 N -0.30 2.27 0.19 2.92 1.01 -0.30 -1.66 120.40 124.53 2f16 s VAL 178 Ca 0.01 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.12 2f16 s VAL 178 Cb -0.13 -1.96 0.00 0.00 0.00 0.00 0.00 36.38 34.29 2f16 s VAL 178 CO 0.02 0.52 0.24 -0.90 0.00 0.00 0.00 175.10 174.99 2f16 n ASP 179 N 4.54 -0.66 0.16 3.32 5.68 -0.18 -1.49 116.55 127.92 2f16 n ASP 179 Ca -0.20 -2.05 0.16 0.00 -0.50 0.00 0.00 54.79 52.21 2f16 n ASP 179 Cb 0.50 1.26 0.58 0.00 -1.14 0.00 0.00 41.12 42.32 2f16 n ASP 179 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2f16 h LYS 180 N 0.00 0.00 -0.52 0.11 2.10 -1.92 0.36 116.57 116.69 2f16 h LYS 180 Ca -0.14 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.51 2f16 h LYS 180 Cb 0.64 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 2f16 h LYS 180 CO 0.19 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.39 2f16 n ASP 181 N -3.13 3.67 0.00 7.07 8.00 -1.26 -5.07 116.55 125.82 2f16 n ASP 181 Ca 0.06 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.56 2f16 n ASP 181 Cb 0.78 -0.34 0.00 0.00 -0.02 0.00 0.00 41.12 41.54 2f16 n ASP 181 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2f16 n GLY 183 N 1.57 0.21 3.16 0.44 0.00 0.12 -5.00 105.19 105.69 2f16 n GLY 183 Ca 0.21 -1.93 -0.29 0.00 0.00 0.00 0.00 46.02 44.01 2f16 n GLY 183 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2f16 s ILE 184 N 0.00 1.71 0.07 -0.61 1.01 -1.23 -1.01 121.20 121.14 2f16 s ILE 184 Ca 0.00 -0.83 0.01 0.00 0.00 0.00 0.00 60.65 59.83 2f16 s ILE 184 Cb 0.00 -1.49 -0.04 0.00 0.01 0.00 0.00 42.46 40.95 2f16 s ILE 184 CO 0.00 0.48 -0.05 0.00 0.00 0.00 0.00 174.94 175.37 2f16 s ARG 185 N 0.35 0.69 -0.17 2.79 1.70 -0.66 -4.99 118.95 118.66 2f16 s ARG 185 Ca -0.14 -1.18 -0.03 0.00 -0.47 0.00 0.00 55.73 53.90 2f16 s ARG 185 Cb -0.16 -0.06 -0.02 0.00 -0.57 0.00 0.00 34.95 34.14 2f16 s ARG 185 CO 0.06 -0.04 -0.04 -1.14 -1.08 0.00 0.00 175.30 173.05 2f16 s GLN 186 N -3.42 3.56 -0.86 3.89 0.74 -1.26 -0.60 119.66 121.70 2f16 s GLN 186 Ca 0.06 -0.57 -0.25 0.00 0.05 0.00 0.00 55.36 54.65 2f16 s GLN 186 Cb 0.03 -2.92 -0.01 0.00 1.10 0.00 0.00 33.01 31.21 2f16 s GLN 186 CO -0.06 0.10 1.72 0.08 -0.55 0.00 0.00 175.29 176.58 2f16 s VAL 187 N 0.72 3.59 -0.60 1.34 1.01 -0.89 -4.81 120.40 120.75 2f16 s VAL 187 Ca -0.02 -0.27 0.17 0.00 0.00 0.00 0.00 61.98 61.86 2f16 s VAL 187 Cb -0.15 -4.38 0.17 0.00 0.00 0.00 0.00 36.38 32.03 2f16 s VAL 187 CO 0.02 -1.31 1.53 -0.90 0.00 0.00 0.00 175.10 174.44 2f16 n ASP 188 N 11.85 0.39 -4.00 3.32 3.85 -1.26 -4.09 116.55 126.62 2f16 n ASP 188 Ca 0.30 0.63 -0.32 0.00 -0.71 0.00 0.00 54.79 54.69 2f16 n ASP 188 Cb 0.49 -0.70 -0.10 0.00 -1.35 0.00 0.00 41.12 39.46 2f16 n ASP 188 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.20 177.70 2f16 s ASP 189 N -3.73 5.21 0.00 -1.12 -4.77 -1.26 -4.66 116.67 106.34 2f16 s ASP 189 Ca 0.02 -3.61 0.00 0.00 -3.30 0.00 0.00 52.55 45.66 2f16 s ASP 189 Cb 0.07 -1.75 0.00 0.00 -1.09 0.00 0.00 42.92 40.15 2f16 s ASP 189 CO 0.25 -0.16 0.00 0.33 0.70 0.00 0.00 175.17 176.29 2f16 n PHE 190 N 2.38 0.00 0.24 2.11 -0.00 -1.26 -4.25 117.46 116.67 2f16 n PHE 190 Ca 0.17 0.00 0.11 0.00 -0.00 0.00 0.00 57.45 57.73 2f16 n PHE 190 Cb 0.36 0.00 0.54 0.00 -0.00 0.00 0.00 39.48 40.38 2f16 n PHE 190 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 2f16 n GLN 191 N -0.37 0.15 -2.68 -4.13 3.00 -1.26 -3.80 117.38 108.30 2f16 n GLN 191 Ca 0.00 0.57 -0.05 0.00 -0.01 0.00 0.00 57.00 57.51 2f16 n GLN 191 Cb 0.00 -1.92 0.08 0.00 0.00 0.00 0.00 30.24 28.40 2f16 n GLN 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2f16 n ALA 192 N -1.77 -3.13 1.32 -1.58 0.00 -1.26 -5.18 120.51 108.91 2f16 n ALA 192 Ca -0.00 -0.51 0.13 0.00 0.00 0.00 0.00 53.44 53.06 2f16 n ALA 192 Cb 0.10 -2.90 0.37 0.00 0.00 0.00 0.00 19.45 17.02 2f16 n ALA 192 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44