#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 5.94 -0.04 6.12 1.01 -1.26 -4.98 116.67 123.46 2f16 s ASP 1 Ca 0.00 1.13 -0.20 0.00 0.71 0.00 0.00 52.55 54.20 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 -0.96 0.55 -0.63 0.21 0.00 0.00 175.17 174.34 2f16 s ILE 2 N -3.11 5.00 -0.22 0.77 1.09 -1.26 -4.87 121.20 118.60 2f16 s ILE 2 Ca 0.54 1.14 -0.04 0.00 -1.10 0.00 0.00 60.65 61.19 2f16 s ILE 2 Cb -0.11 -3.89 0.08 0.00 -1.06 0.00 0.00 42.46 37.48 2f16 s ILE 2 CO 0.50 0.40 0.10 -0.63 -0.10 0.00 0.00 174.94 175.21 2f16 s ILE 3 N 0.01 -0.02 0.15 2.92 1.09 -1.26 -1.41 121.20 122.68 2f16 s ILE 3 Ca 0.29 -0.46 0.10 0.00 -1.10 0.00 0.00 60.65 59.48 2f16 s ILE 3 Cb -0.17 -0.79 -0.04 0.00 -1.06 0.00 0.00 42.46 40.39 2f16 s ILE 3 CO 0.15 -0.47 -0.23 -0.76 -0.10 0.00 0.00 174.94 173.53 2f16 s LEU 4 N 2.09 2.38 -0.13 2.97 1.43 0.20 -2.47 118.68 125.15 2f16 s LEU 4 Ca 0.05 -0.80 -0.12 0.00 -1.03 0.00 0.00 54.13 52.23 2f16 s LEU 4 Cb -0.16 -1.04 0.03 0.00 0.03 0.00 0.00 46.19 45.05 2f16 s LEU 4 CO -0.21 0.08 0.35 -0.83 0.23 0.00 0.00 176.35 175.97 2f16 s GLY 5 N -2.38 -0.26 -0.03 -3.19 0.00 -0.41 -1.31 107.32 99.75 2f16 s GLY 5 Ca 0.15 0.99 0.00 0.00 0.00 0.00 0.00 44.72 45.86 2f16 s GLY 5 CO 0.07 0.87 0.01 -1.50 0.00 0.00 0.00 173.10 172.56 2f16 s ILE 6 N 0.24 0.07 -0.42 0.90 2.07 0.01 -1.17 121.20 122.90 2f16 s ILE 6 Ca -0.00 0.15 -0.16 0.00 -1.41 0.00 0.00 60.65 59.23 2f16 s ILE 6 Cb -0.03 -0.19 0.02 0.00 0.13 0.00 0.00 42.46 42.39 2f16 s ILE 6 CO -0.00 0.13 0.36 -0.60 -1.91 0.00 0.00 174.94 172.91 2f16 s ARG 7 N 1.10 3.02 0.00 3.50 3.52 0.27 -0.53 118.95 129.83 2f16 s ARG 7 Ca -0.09 -0.93 0.00 0.00 -0.13 0.00 0.00 55.73 54.58 2f16 s ARG 7 Cb -0.13 -3.98 0.00 0.00 -1.56 0.00 0.00 34.95 29.27 2f16 s ARG 7 CO -0.02 -0.81 0.00 1.33 -0.81 0.00 0.00 175.30 174.99 2f16 n VAL 8 N 5.27 0.00 -0.21 7.11 0.24 -0.09 -4.85 118.33 125.80 2f16 n VAL 8 Ca -0.10 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.10 2f16 n VAL 8 Cb 0.47 -1.00 -0.07 0.00 -1.47 0.00 0.00 33.84 31.77 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 -0.25 0.00 7.34 5.75 -1.30 -3.28 115.11 123.36 2f16 h GLN 9 Ca 0.00 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 2f16 h GLN 9 Cb 0.00 0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.61 2f16 h GLN 9 CO 0.00 -0.17 -0.06 -0.25 -2.65 0.00 0.00 178.83 175.70 2f16 n ASP 10 N -5.37 1.88 -3.36 -0.69 8.00 -1.26 -4.61 116.55 111.14 2f16 n ASP 10 Ca -0.00 -2.62 -0.07 0.00 0.71 0.00 0.00 54.79 52.81 2f16 n ASP 10 Cb 0.33 -0.29 0.01 0.00 -0.02 0.00 0.00 41.12 41.15 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 -2.10 -0.09 -0.04 -2.24 1.04 -1.24 -4.37 113.70 104.66 2f16 s SER 11 Ca 0.19 -0.83 0.04 0.00 0.48 0.00 0.00 55.95 55.84 2f16 s SER 11 Cb 0.17 0.71 -0.00 0.00 0.10 0.00 0.00 66.02 67.00 2f16 s SER 11 CO 0.02 -1.38 -0.15 -0.69 0.98 0.00 0.00 173.24 172.01 2f16 s VAL 12 N -2.85 1.29 -0.10 5.02 1.01 -0.53 -0.91 120.40 123.33 2f16 s VAL 12 Ca 0.15 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.51 2f16 s VAL 12 Cb -0.04 -1.12 -0.01 0.00 0.00 0.00 0.00 36.38 35.21 2f16 s VAL 12 CO 0.08 0.38 -0.17 -0.63 0.00 0.00 0.00 175.10 174.76 2f16 s ILE 13 N 0.09 2.74 -0.16 2.22 1.01 0.31 -1.09 121.20 126.34 2f16 s ILE 13 Ca -0.04 -0.79 0.01 0.00 0.00 0.00 0.00 60.65 59.83 2f16 s ILE 13 Cb -0.11 -2.11 0.00 0.00 0.01 0.00 0.00 42.46 40.25 2f16 s ILE 13 CO 0.02 0.55 -0.16 -0.76 0.00 0.00 0.00 174.94 174.58 2f16 s LEU 14 N 0.11 2.40 -0.14 2.97 1.43 -0.52 -0.81 118.68 124.12 2f16 s LEU 14 Ca -0.08 -0.51 0.00 0.00 -1.03 0.00 0.00 54.13 52.51 2f16 s LEU 14 Cb -0.15 -1.54 -0.01 0.00 0.03 0.00 0.00 46.19 44.52 2f16 s LEU 14 CO 0.05 0.07 -0.14 0.00 0.23 0.00 0.00 176.35 176.57 2f16 s ALA 15 N 0.88 2.57 -0.03 4.21 0.00 -0.43 -1.39 121.76 127.57 2f16 s ALA 15 Ca -0.04 -0.95 -0.00 0.00 0.00 0.00 0.00 51.96 50.96 2f16 s ALA 15 Cb -0.15 -1.22 0.03 0.00 0.00 0.00 0.00 23.12 21.78 2f16 s ALA 15 CO -0.02 0.14 0.02 -1.12 0.00 0.00 0.00 175.76 174.79 2f16 s SER 16 N 0.53 0.47 0.68 0.00 0.01 -0.85 -0.63 113.70 113.91 2f16 s SER 16 Ca -0.09 0.01 -0.17 0.00 1.31 0.00 0.00 55.95 57.01 2f16 s SER 16 Cb -0.16 -0.16 -0.04 0.00 0.21 0.00 0.00 66.02 65.87 2f16 s SER 16 CO 0.04 -0.14 0.66 -1.54 0.41 0.00 0.00 173.24 172.66 2f16 n SER 17 N 4.40 -0.64 -0.00 2.44 3.41 -0.50 -1.27 113.62 121.45 2f16 n SER 17 Ca -0.22 0.66 0.09 0.00 -0.26 0.00 0.00 58.87 59.13 2f16 n SER 17 Cb 0.50 -1.26 -0.10 0.00 -0.26 0.00 0.00 64.21 63.09 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 -0.82 1.04 -2.58 4.33 5.02 0.22 -4.60 118.16 120.76 2f16 n LYS 18 Ca 0.11 -0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 56.06 2f16 n LYS 18 Cb 0.49 -1.35 -0.04 0.00 -0.02 0.00 0.00 35.03 34.11 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 -2.70 2.93 -0.30 7.82 0.00 -0.91 -1.39 121.76 127.20 2f16 s ALA 19 Ca 0.07 0.60 -0.03 0.00 0.00 0.00 0.00 51.96 52.60 2f16 s ALA 19 Cb 0.14 -3.24 0.11 0.00 0.00 0.00 0.00 23.12 20.12 2f16 s ALA 19 CO 0.74 -0.24 0.16 0.08 0.00 0.00 0.00 175.76 176.50 2f16 s VAL 20 N -1.95 -0.05 -0.13 0.00 1.01 -0.36 -4.89 120.40 114.03 2f16 s VAL 20 Ca 0.65 -0.95 -0.07 0.00 0.00 0.00 0.00 61.98 61.62 2f16 s VAL 20 Cb -0.16 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 2f16 s VAL 20 CO 0.20 -0.77 0.11 -0.89 0.00 0.00 0.00 175.10 173.76 2f16 s THR 21 N 1.89 5.28 -0.33 3.92 2.01 -1.26 -0.37 115.64 126.78 2f16 s THR 21 Ca 0.11 0.13 -0.01 0.00 0.31 0.00 0.00 61.69 62.23 2f16 s THR 21 Cb -0.17 -3.31 0.11 0.00 0.01 0.00 0.00 72.50 69.14 2f16 s THR 21 CO -0.28 0.59 0.13 -0.13 -0.69 0.00 0.00 174.62 174.24 2f16 s ARG 22 N -0.79 0.72 5.43 4.92 1.81 0.07 -4.92 118.95 126.19 2f16 s ARG 22 Ca 0.13 -1.16 0.00 0.00 -1.72 0.00 0.00 55.73 52.99 2f16 s ARG 22 Cb -0.12 -1.90 0.00 0.00 -0.45 0.00 0.00 34.95 32.49 2f16 s ARG 22 CO 0.03 -1.03 0.00 0.41 -0.68 0.00 0.00 175.30 174.03 2f16 n GLY 23 N 4.66 1.64 0.06 -3.53 0.00 -1.26 -3.10 105.19 103.66 2f16 n GLY 23 Ca -0.00 -0.09 0.08 0.00 0.00 0.00 0.00 46.02 46.01 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 0.45 -4.21 -0.61 0.13 -1.26 -4.98 119.36 108.89 2f16 n ILE 24 Ca 0.00 -0.57 -0.30 0.00 -1.10 0.00 0.00 62.75 60.77 2f16 n ILE 24 Cb 0.00 -0.23 -0.09 0.00 -0.84 0.00 0.00 39.64 38.48 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 -5.00 4.77 -0.56 9.51 0.01 -1.18 -5.07 113.70 116.18 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 -1.07 0.09 0.00 0.21 0.00 0.00 66.02 65.36 2f16 s SER 25 CO 0.86 0.19 0.66 -0.69 0.41 0.00 0.00 173.24 174.67 2f16 s VAL 26 N -1.23 4.87 0.24 3.43 1.01 -1.26 -0.75 120.40 126.70 2f16 s VAL 26 Ca 0.23 -0.85 0.16 0.00 0.00 0.00 0.00 61.98 61.53 2f16 s VAL 26 Cb -0.11 -4.41 0.10 0.00 0.00 0.00 0.00 36.38 31.96 2f16 s VAL 26 CO 0.15 -0.99 1.74 -0.07 0.00 0.00 0.00 175.10 175.93 2f16 h LEU 27 N 9.80 0.00 -7.25 3.92 3.38 -1.06 -3.46 115.31 120.63 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 -0.20 0.00 0.09 0.00 0.00 40.66 41.65 2f16 h LEU 27 CO 1.05 0.41 -0.04 -0.75 0.09 0.00 0.00 178.44 179.20 2f16 s LYS 28 N -3.75 0.86 -0.06 1.13 2.20 -1.13 -5.00 119.74 113.99 2f16 s LYS 28 Ca -0.01 0.04 0.09 0.00 -0.36 0.00 0.00 55.97 55.73 2f16 s LYS 28 Cb 0.12 0.40 0.14 0.00 -1.51 0.00 0.00 37.83 36.98 2f16 s LYS 28 CO 0.70 -0.26 1.06 -0.40 -0.36 0.00 0.00 175.35 176.09 2f16 n ASP 29 N 1.10 1.20 -2.66 1.43 3.85 -1.25 -1.23 116.55 118.98 2f16 n ASP 29 Ca -0.20 -2.49 -0.08 0.00 -0.71 0.00 0.00 54.79 51.31 2f16 n ASP 29 Cb 0.56 -0.30 0.04 0.00 -1.35 0.00 0.00 41.12 40.07 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 2.13 -4.68 -1.12 3.41 -1.11 -4.60 113.62 106.94 2f16 n SER 30 Ca 0.08 -2.56 -0.39 0.00 -0.26 0.00 0.00 58.87 55.73 2f16 n SER 30 Cb 0.65 -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 -3.55 6.72 -0.65 4.04 3.68 -0.48 -5.01 116.67 121.42 2f16 s ASP 31 Ca 0.31 0.87 -0.18 0.00 2.13 0.00 0.00 52.55 55.68 2f16 s ASP 31 Cb 0.38 -2.34 0.13 0.00 -1.45 0.00 0.00 42.92 39.64 2f16 s ASP 31 CO -0.02 -0.18 0.72 -0.62 0.13 0.00 0.00 175.17 175.20 2f16 s ASP 32 N 1.01 6.31 -0.02 -0.34 3.68 -1.26 -4.33 116.67 121.72 2f16 s ASP 32 Ca 0.29 -1.75 -0.06 0.00 2.13 0.00 0.00 52.55 53.16 2f16 s ASP 32 Cb -0.16 -2.28 -0.24 0.00 -1.45 0.00 0.00 42.92 38.79 2f16 s ASP 32 CO 0.11 -0.98 3.50 0.29 0.13 0.00 0.00 175.17 178.22 2f16 n LYS 33 N 5.79 1.96 -3.96 4.34 5.02 -1.26 -4.84 118.16 125.21 2f16 n LYS 33 Ca -0.04 -0.99 -0.09 0.00 -2.02 0.00 0.00 58.31 55.17 2f16 n LYS 33 Cb 0.43 -1.95 -0.08 0.00 -0.02 0.00 0.00 35.03 33.42 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 0.10 -0.05 -0.18 -1.32 -1.26 -2.15 115.64 111.58 2f16 s THR 34 Ca 0.63 -1.41 -0.07 0.00 -1.21 0.00 0.00 61.69 59.63 2f16 s THR 34 Cb 0.30 -1.71 0.02 0.00 -1.51 0.00 0.00 72.50 69.60 2f16 s THR 34 CO -0.01 -0.45 0.18 -0.13 -2.21 0.00 0.00 174.62 172.01 2f16 s ARG 35 N -3.94 0.29 -0.34 7.08 1.81 -0.71 -5.02 118.95 118.12 2f16 s ARG 35 Ca 0.14 0.11 -0.17 0.00 -1.72 0.00 0.00 55.73 54.09 2f16 s ARG 35 Cb 0.04 0.13 -0.01 0.00 -0.45 0.00 0.00 34.95 34.67 2f16 s ARG 35 CO -0.03 -0.05 0.47 -1.14 -0.68 0.00 0.00 175.30 173.87 2f16 s GLN 36 N -0.25 3.65 0.11 3.54 0.74 -1.26 -1.92 119.66 124.27 2f16 s GLN 36 Ca -0.03 -0.18 -0.05 0.00 0.05 0.00 0.00 55.36 55.15 2f16 s GLN 36 Cb -0.03 -3.79 -0.14 0.00 1.10 0.00 0.00 33.01 30.15 2f16 s GLN 36 CO 0.01 -0.58 1.26 -0.07 -0.55 0.00 0.00 175.29 175.35 2f16 h LEU 37 N 8.98 0.54 -7.28 3.68 3.38 -1.56 -3.48 115.31 119.56 2f16 h LEU 37 Ca -0.28 -0.46 -0.00 0.00 0.09 0.00 0.00 57.88 57.22 2f16 h LEU 37 Cb 1.13 -0.17 -0.10 0.00 0.09 0.00 0.00 40.66 41.61 2f16 h LEU 37 CO 0.75 1.28 0.18 -0.94 0.09 0.00 0.00 178.44 179.80 2f16 s SER 38 N -7.12 -0.46 0.53 -0.43 1.04 -1.10 -4.25 113.70 101.91 2f16 s SER 38 Ca -0.06 -0.18 0.42 0.00 0.48 0.00 0.00 55.95 56.61 2f16 s SER 38 Cb 0.08 0.62 1.62 0.00 0.10 0.00 0.00 66.02 68.44 2f16 s SER 38 CO 0.87 -1.05 1.66 1.55 0.98 0.00 0.00 173.24 177.26 2f16 h PRO 39 N 2.04 0.02 -0.08 4.02 0.13 -2.01 -0.33 132.00 135.80 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 1.29 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2f16 h PRO 39 CO 0.35 0.02 0.00 0.72 -0.23 0.00 0.00 178.00 178.86 2f16 n HIS 40 N -4.14 0.22 -3.91 1.56 8.25 -1.26 -3.56 115.22 112.38 2f16 n HIS 40 Ca 0.37 -0.85 -0.21 0.00 -0.26 0.00 0.00 57.72 56.77 2f16 n HIS 40 Cb 1.66 -0.16 -0.17 0.00 1.12 0.00 0.00 29.99 32.44 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 -2.40 0.38 0.03 1.59 2.01 -0.13 -0.99 115.64 116.12 2f16 s THR 41 Ca 0.28 0.05 0.08 0.00 0.31 0.00 0.00 61.69 62.41 2f16 s THR 41 Cb 0.23 -0.49 -0.02 0.00 0.01 0.00 0.00 72.50 72.22 2f16 s THR 41 CO 0.04 0.23 -0.23 -0.22 -0.69 0.00 0.00 174.62 173.75 2f16 s LEU 42 N 1.51 2.14 -0.07 4.42 2.96 0.72 -1.30 118.68 129.05 2f16 s LEU 42 Ca -0.02 -0.52 0.01 0.00 -0.22 0.00 0.00 54.13 53.38 2f16 s LEU 42 Cb -0.13 -1.14 0.02 0.00 0.50 0.00 0.00 46.19 45.44 2f16 s LEU 42 CO -0.03 0.23 -0.08 -0.32 -1.32 0.00 0.00 176.35 174.82 2f16 s MET 43 N -1.04 1.33 0.19 1.98 -2.45 -0.81 -0.11 119.30 118.40 2f16 s MET 43 Ca 0.09 -0.25 0.05 0.00 -1.25 0.00 0.00 55.69 54.33 2f16 s MET 43 Cb -0.09 -1.25 -0.04 0.00 1.25 0.00 0.00 34.83 34.71 2f16 s MET 43 CO 0.01 -0.09 0.20 -1.54 1.05 0.00 0.00 175.02 174.65 2f16 s SER 44 N 1.05 5.75 -0.00 1.11 1.04 -0.15 -1.74 113.70 120.76 2f16 s SER 44 Ca -0.08 -0.08 -0.21 0.00 0.48 0.00 0.00 55.95 56.06 2f16 s SER 44 Cb -0.14 -1.56 0.04 0.00 0.10 0.00 0.00 66.02 64.46 2f16 s SER 44 CO -0.01 0.03 0.45 0.72 0.98 0.00 0.00 173.24 175.42 2f16 s PHE 45 N -1.86 -0.35 -0.05 5.02 -0.12 -0.92 -1.53 117.98 118.17 2f16 s PHE 45 Ca 0.32 0.49 -0.14 0.00 -0.05 0.00 0.00 56.93 57.55 2f16 s PHE 45 Cb -0.10 0.23 0.03 0.00 -0.63 0.00 0.00 43.02 42.56 2f16 s PHE 45 CO 0.25 -0.52 0.33 0.00 -0.05 0.00 0.00 175.22 175.23 2f16 s ALA 46 N -1.73 -0.84 0.00 1.99 0.00 -0.57 -4.87 121.76 115.74 2f16 s ALA 46 Ca -0.10 0.57 0.00 0.00 0.00 0.00 0.00 51.96 52.43 2f16 s ALA 46 Cb -0.02 -0.14 0.00 0.00 0.00 0.00 0.00 23.12 22.96 2f16 s ALA 46 CO 0.03 -0.23 0.00 0.41 0.00 0.00 0.00 175.76 175.97 2f16 n GLY 47 N 1.78 -0.25 3.63 0.00 0.00 -1.26 -0.76 105.19 108.33 2f16 n GLY 47 Ca -0.19 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 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 1.52 -0.21 1.61 4.07 -0.11 -4.82 120.64 122.71 2f16 n GLU 48 Ca 0.00 0.54 -0.05 0.00 -0.06 0.00 0.00 57.16 57.59 2f16 n GLU 48 Cb 0.00 -2.08 -0.05 0.00 -0.06 0.00 0.00 31.44 29.25 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 -0.22 -0.32 0.03 4.31 0.00 -1.26 -2.14 120.51 120.92 2f16 n ALA 49 Ca 0.08 0.42 -0.22 0.00 0.00 0.00 0.00 53.44 53.73 2f16 n ALA 49 Cb 0.37 0.13 -0.14 0.00 0.00 0.00 0.00 19.45 19.81 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 0.34 -0.00 0.00 0.00 -1.99 -3.37 103.07 98.05 2f16 h GLY 50 Ca 0.08 -0.86 0.25 0.00 0.00 0.00 0.00 47.33 46.80 2f16 h GLY 50 CO -0.46 0.75 0.66 -0.55 0.00 0.00 0.00 176.54 176.93 2f16 h ASP 51 N -0.23 0.42 0.38 0.19 3.32 -1.92 -2.80 116.42 115.78 2f16 h ASP 51 Ca -0.28 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 56.83 2f16 h ASP 51 Cb 1.81 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 41.33 2f16 h ASP 51 CO 0.11 0.11 -0.49 0.00 -1.72 0.00 0.00 179.24 177.25 2f16 h THR 52 N 0.39 0.00 -0.14 0.35 1.03 -1.60 -0.87 112.91 112.07 2f16 h THR 52 Ca 0.55 0.00 -0.20 0.00 -0.01 0.00 0.00 66.41 66.76 2f16 h THR 52 Cb 1.42 0.00 0.01 0.00 -1.07 0.00 0.00 68.15 68.51 2f16 h THR 52 CO -0.24 0.00 -0.69 0.58 -0.01 0.00 0.00 175.52 175.16 2f16 h VAL 53 N -0.90 1.31 -0.82 0.00 2.07 -1.77 -2.73 116.25 113.41 2f16 h VAL 53 Ca -0.05 -1.92 0.11 0.00 0.82 0.00 0.00 66.70 65.66 2f16 h VAL 53 Cb 0.80 2.05 -0.08 0.00 -1.52 0.00 0.00 31.29 32.55 2f16 h VAL 53 CO -0.12 0.60 0.45 1.56 0.02 0.00 0.00 177.57 180.08 2f16 h GLN 54 N 0.40 0.71 -0.05 1.57 1.08 -1.50 -0.53 115.11 116.80 2f16 h GLN 54 Ca -0.05 -0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 57.09 2f16 h GLN 54 Cb 1.32 -0.16 -0.00 0.00 -0.05 0.00 0.00 27.48 28.59 2f16 h GLN 54 CO 0.14 0.47 -0.05 0.35 -0.95 0.00 0.00 178.83 178.79 2f16 h PHE 55 N 0.73 0.15 -0.04 2.96 3.04 -1.19 -1.89 116.94 120.70 2f16 h PHE 55 Ca 0.41 -0.05 0.04 0.00 3.98 0.00 0.00 57.97 62.35 2f16 h PHE 55 Cb 0.43 -0.03 -0.05 0.00 2.56 0.00 0.00 35.95 38.86 2f16 h PHE 55 CO -0.07 0.59 -0.25 0.00 -2.02 0.00 0.00 178.31 176.55 2f16 h ALA 56 N 0.54 -0.31 -0.17 2.41 0.00 -1.13 -0.42 119.26 120.18 2f16 h ALA 56 Ca 0.01 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2f16 h ALA 56 Cb 0.57 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 2f16 h ALA 56 CO 0.01 -0.74 0.01 0.93 0.00 0.00 0.00 179.25 179.46 2f16 h GLU 57 N -0.37 0.24 -0.19 0.00 5.08 -1.17 0.75 114.58 118.92 2f16 h GLU 57 Ca 0.07 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.37 2f16 h GLU 57 Cb 0.47 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 2f16 h GLU 57 CO -0.25 0.25 -0.02 -0.92 -1.00 0.00 0.00 179.01 177.06 2f16 h TYR 58 N 0.24 0.39 -0.59 4.33 3.20 -0.59 -0.71 116.97 123.24 2f16 h TYR 58 Ca 0.06 -0.08 -0.04 0.00 3.14 0.00 0.00 58.73 61.82 2f16 h TYR 58 Cb 0.14 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 2f16 h TYR 58 CO 0.00 0.58 0.22 0.82 -1.64 0.00 0.00 178.16 178.15 2f16 h ILE 59 N 0.08 1.23 0.24 1.81 1.08 -0.48 -2.56 117.51 118.91 2f16 h ILE 59 Ca 0.05 -0.73 0.01 0.00 -0.39 0.00 0.00 64.86 63.80 2f16 h ILE 59 Cb 0.44 0.61 -0.03 0.00 -3.07 0.00 0.00 36.82 34.77 2f16 h ILE 59 CO 0.01 0.28 -0.32 -0.61 -0.69 0.00 0.00 178.15 176.83 2f16 h GLN 60 N 0.81 -0.59 -0.93 2.37 4.15 -0.72 -1.50 115.11 118.70 2f16 h GLN 60 Ca 0.19 0.04 0.19 0.00 0.77 0.00 0.00 58.65 59.84 2f16 h GLN 60 Cb 0.22 0.13 -0.11 0.00 0.21 0.00 0.00 27.48 27.94 2f16 h GLN 60 CO -0.01 -0.40 0.50 0.00 -1.93 0.00 0.00 178.83 176.99 2f16 h ALA 61 N -0.03 1.49 -0.42 3.38 0.00 -1.00 -1.43 119.26 121.25 2f16 h ALA 61 Ca 0.00 0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 2f16 h ALA 61 Cb 0.59 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2f16 h ALA 61 CO -0.11 -0.15 -0.21 -0.91 0.00 0.00 0.00 179.25 177.87 2f16 h ASN 62 N 0.62 0.91 -0.35 0.00 4.21 -0.98 -1.79 115.58 118.20 2f16 h ASN 62 Ca 0.54 -0.41 -0.11 0.00 1.21 0.00 0.00 56.30 57.53 2f16 h ASN 62 Cb 0.88 -0.25 -0.02 0.00 -1.12 0.00 0.00 38.32 37.81 2f16 h ASN 62 CO -0.42 1.12 -0.19 0.40 -1.29 0.00 0.00 177.43 177.05 2f16 h ILE 63 N 0.71 1.27 -0.60 2.81 1.08 -0.70 -1.60 117.51 120.48 2f16 h ILE 63 Ca 0.09 -1.30 -0.02 0.00 -0.39 0.00 0.00 64.86 63.23 2f16 h ILE 63 Cb 0.78 1.14 -0.03 0.00 -3.07 0.00 0.00 36.82 35.65 2f16 h ILE 63 CO 0.06 0.44 0.28 1.56 -0.69 0.00 0.00 178.15 179.81 2f16 h GLN 64 N 0.73 0.87 -0.50 2.37 4.20 -1.22 -0.79 115.11 120.76 2f16 h GLN 64 Ca 0.11 -0.13 -0.05 0.00 0.06 0.00 0.00 58.65 58.63 2f16 h GLN 64 Cb 0.71 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 2f16 h GLN 64 CO 0.05 0.71 0.10 1.25 -0.67 0.00 0.00 178.83 180.27 2f16 h LEU 65 N 0.82 0.72 -0.53 1.46 5.85 -1.14 -1.53 115.31 120.96 2f16 h LEU 65 Ca 0.21 -0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 2f16 h LEU 65 Cb 0.13 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 2f16 h LEU 65 CO -0.02 0.73 0.00 0.22 -0.34 0.00 0.00 178.44 179.02 2f16 h TYR 66 N 0.75 1.01 -0.51 1.25 3.20 -0.70 -1.76 116.97 120.21 2f16 h TYR 66 Ca 0.16 -0.18 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 2f16 h TYR 66 Cb 0.30 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 2f16 h TYR 66 CO 0.02 0.93 0.29 0.77 -1.64 0.00 0.00 178.16 178.53 2f16 h SER 67 N 0.80 0.63 -0.45 -2.11 0.02 -0.71 -1.12 113.55 110.61 2f16 h SER 67 Ca 0.15 -0.08 -0.07 0.00 -0.84 0.00 0.00 61.79 60.96 2f16 h SER 67 Cb 0.53 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.89 2f16 h SER 67 CO 0.03 0.53 0.02 0.40 -1.14 0.00 0.00 176.83 176.67 2f16 h ILE 68 N 0.69 1.26 -0.36 3.27 2.04 -1.15 0.52 117.51 123.77 2f16 h ILE 68 Ca 0.18 -1.01 -0.08 0.00 1.00 0.00 0.00 64.86 64.95 2f16 h ILE 68 Cb 0.02 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 2f16 h ILE 68 CO -0.03 0.35 -0.10 -0.09 0.00 0.00 0.00 178.15 178.27 2f16 h ARG 69 N 0.64 0.70 -0.00 2.37 2.43 -1.17 -3.28 114.38 116.07 2f16 h ARG 69 Ca 0.13 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 2f16 h ARG 69 Cb 0.46 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 2f16 h ARG 69 CO 0.02 0.87 -0.76 0.39 -1.51 0.00 0.00 179.97 178.98 2f16 n GLU 70 N -4.38 0.17 -3.80 0.20 4.71 -0.44 -4.97 120.64 112.13 2f16 n GLU 70 Ca -0.02 -0.13 -0.32 0.00 -0.01 0.00 0.00 57.16 56.68 2f16 n GLU 70 Cb 0.36 -1.50 0.03 0.00 -1.01 0.00 0.00 31.44 29.32 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 -1.30 -4.09 -3.55 1.62 4.64 0.18 -4.95 116.55 109.09 2f16 n ASP 71 Ca 0.05 -1.06 -0.12 0.00 -1.38 0.00 0.00 54.79 52.28 2f16 n ASP 71 Cb 0.35 -3.07 -0.05 0.00 -1.04 0.00 0.00 41.12 37.31 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 -3.58 -0.44 -0.25 -0.67 5.04 -1.19 -5.07 117.35 111.19 2f16 s TYR 72 Ca 0.38 0.72 -0.08 0.00 -2.44 0.00 0.00 57.07 55.65 2f16 s TYR 72 Cb -0.15 0.45 -0.03 0.00 0.35 0.00 0.00 41.96 42.58 2f16 s TYR 72 CO 0.88 -0.43 0.09 -2.00 -1.34 0.00 0.00 175.55 172.75 2f16 s GLU 73 N -1.32 3.69 0.57 4.97 2.12 -1.26 -4.20 118.70 123.27 2f16 s GLU 73 Ca -0.04 -0.46 -0.21 0.00 0.36 0.00 0.00 54.97 54.63 2f16 s GLU 73 Cb -0.00 -3.37 -0.04 0.00 0.26 0.00 0.00 34.13 30.97 2f16 s GLU 73 CO 0.03 -0.19 1.31 -0.51 -0.54 0.00 0.00 175.26 175.35 2f16 s LEU 74 N 1.64 3.77 0.77 2.70 1.43 -1.26 -4.97 118.68 122.76 2f16 s LEU 74 Ca 0.06 2.64 -0.12 0.00 -1.03 0.00 0.00 54.13 55.68 2f16 s LEU 74 Cb -0.15 -4.40 0.06 0.00 0.03 0.00 0.00 46.19 41.73 2f16 s LEU 74 CO 0.05 -1.62 1.13 -0.94 0.23 0.00 0.00 176.35 175.19 2f16 s SER 75 N -1.18 4.25 0.30 2.29 1.04 -1.26 -4.77 113.70 114.37 2f16 s SER 75 Ca 0.74 2.04 0.00 0.00 0.48 0.00 0.00 55.95 59.21 2f16 s SER 75 Cb -0.37 -2.55 0.51 0.00 0.10 0.00 0.00 66.02 63.71 2f16 s SER 75 CO 0.43 -2.21 1.94 -0.65 0.98 0.00 0.00 173.24 173.72 2f16 h PRO 76 N -0.87 1.02 -0.76 4.02 0.11 -1.93 -0.97 132.00 132.62 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 -0.23 -0.03 0.00 0.11 0.00 0.00 31.00 32.10 2f16 h PRO 76 CO 0.50 0.67 0.37 0.37 -0.21 0.00 0.00 178.00 179.70 2f16 h GLN 77 N 1.05 1.08 -0.52 1.05 -0.00 -1.99 -0.87 115.11 114.90 2f16 h GLN 77 Ca 0.35 -0.15 -0.06 0.00 -0.00 0.00 0.00 58.65 58.79 2f16 h GLN 77 Cb 0.08 -0.20 -0.02 0.00 0.00 0.00 0.00 27.48 27.34 2f16 h GLN 77 CO -0.11 0.84 0.10 0.00 0.00 0.00 0.00 178.83 179.66 2f16 h ALA 78 N 1.19 0.69 -0.29 3.38 0.00 -1.60 -1.48 119.26 121.15 2f16 h ALA 78 Ca 0.26 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2f16 h ALA 78 Cb 0.10 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2f16 h ALA 78 CO -0.03 0.42 0.03 0.28 0.00 0.00 0.00 179.25 179.95 2f16 h VAL 79 N 0.74 1.24 -0.74 0.00 2.07 -0.90 -1.66 116.25 117.00 2f16 h VAL 79 Ca 0.16 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 2f16 h VAL 79 Cb 0.38 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 31.33 2f16 h VAL 79 CO 0.01 0.27 0.42 0.77 0.02 0.00 0.00 177.57 179.06 2f16 h SER 80 N 0.30 0.92 -0.71 0.57 4.64 -1.06 0.11 113.55 118.32 2f16 h SER 80 Ca 0.09 -0.09 -0.03 0.00 -0.47 0.00 0.00 61.79 61.30 2f16 h SER 80 Cb 0.36 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.19 2f16 h SER 80 CO 0.01 0.74 0.35 0.28 -0.87 0.00 0.00 176.83 177.34 2f16 h SER 81 N 1.02 0.94 -0.64 4.97 0.02 -1.13 0.99 113.55 119.72 2f16 h SER 81 Ca 0.26 -0.10 -0.06 0.00 -0.84 0.00 0.00 61.79 61.05 2f16 h SER 81 Cb 0.01 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.29 2f16 h SER 81 CO -0.04 0.79 0.16 0.15 -1.14 0.00 0.00 176.83 176.75 2f16 h PHE 82 N 1.03 1.07 -0.35 3.45 3.04 -0.39 -2.09 116.94 122.69 2f16 h PHE 82 Ca 0.25 -0.12 -0.13 0.00 3.98 0.00 0.00 57.97 61.95 2f16 h PHE 82 Cb 0.10 -0.30 -0.01 0.00 2.56 0.00 0.00 35.95 38.30 2f16 h PHE 82 CO 0.01 0.89 -0.31 0.28 -2.02 0.00 0.00 178.31 177.16 2f16 h VAL 83 N 0.94 1.28 0.03 1.41 2.07 -0.29 -2.67 116.25 119.03 2f16 h VAL 83 Ca 0.20 -1.46 -0.00 0.00 0.82 0.00 0.00 66.70 66.27 2f16 h VAL 83 Cb 0.35 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 2f16 h VAL 83 CO 0.00 0.48 -0.01 -0.09 0.02 0.00 0.00 177.57 177.97 2f16 h ARG 84 N 0.65 -0.04 -0.95 1.57 2.43 -0.60 -2.35 114.38 115.09 2f16 h ARG 84 Ca 0.07 0.00 0.10 0.00 -0.81 0.00 0.00 59.98 59.35 2f16 h ARG 84 Cb 0.84 0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.33 2f16 h ARG 84 CO 0.07 0.04 0.61 0.37 -1.51 0.00 0.00 179.97 179.55 2f16 h GLN 85 N -0.11 0.93 -0.25 0.20 4.15 -1.34 0.17 115.11 118.86 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 0.10 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 27.57 2f16 h GLN 85 CO 0.01 0.62 0.12 0.93 -1.93 0.00 0.00 178.83 178.57 2f16 h GLU 86 N 0.96 0.36 -0.41 1.69 4.39 -1.19 -1.75 114.58 118.63 2f16 h GLU 86 Ca 0.44 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 60.05 2f16 h GLU 86 Cb 0.41 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 2f16 h GLU 86 CO -0.20 0.35 0.09 -0.07 -1.16 0.00 0.00 179.01 178.02 2f16 h LEU 87 N 0.27 0.63 -1.37 1.33 3.38 -0.77 -1.44 115.31 117.35 2f16 h LEU 87 Ca 0.09 -0.24 0.07 0.00 0.09 0.00 0.00 57.88 57.89 2f16 h LEU 87 Cb 0.11 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.65 2f16 h LEU 87 CO -0.01 0.71 0.49 0.00 0.09 0.00 0.00 178.44 179.72 2f16 h ALA 88 N 0.94 1.72 -0.03 1.53 0.00 -0.54 0.14 119.26 123.02 2f16 h ALA 88 Ca 0.13 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2f16 h ALA 88 Cb 0.34 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 2f16 h ALA 88 CO 0.00 0.15 0.00 0.87 0.00 0.00 0.00 179.25 180.28 2f16 h LYS 89 N 0.75 0.05 -0.83 0.00 1.57 -0.97 -3.15 116.57 113.99 2f16 h LYS 89 Ca 0.33 -0.01 0.13 0.00 -1.87 0.00 0.00 60.65 59.23 2f16 h LYS 89 Cb 0.32 -0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.53 2f16 h LYS 89 CO -0.11 0.32 0.43 1.03 -0.57 0.00 0.00 179.45 180.54 2f16 h SER 90 N -0.22 0.54 -0.25 0.86 0.87 -0.04 -2.52 113.55 112.78 2f16 h SER 90 Ca 0.01 0.08 0.07 0.00 -1.23 0.00 0.00 61.79 60.72 2f16 h SER 90 Cb 0.29 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 2f16 h SER 90 CO 0.00 0.25 0.18 -0.29 -0.53 0.00 0.00 176.83 176.44 2f16 h ILE 90 N 0.64 0.89 -0.55 2.23 6.09 -0.76 -1.75 117.51 124.31 2f16 h ILE 90 Ca 0.44 -0.01 0.00 0.00 -1.37 0.00 0.00 64.86 63.92 2f16 h ILE 90 Cb 0.58 0.86 0.00 0.00 0.47 0.00 0.00 36.82 38.72 2f16 h ILE 90 CO -0.34 0.01 0.00 0.54 -3.07 0.00 0.00 178.15 175.29 2f16 n ARG 90 N -4.47 3.68 -2.70 2.19 1.74 -0.95 -4.82 116.66 111.33 2f16 n ARG 90 Ca 0.03 -2.83 -0.23 0.00 -0.77 0.00 0.00 57.85 54.05 2f16 n ARG 90 Cb 0.31 -1.87 0.11 0.00 -1.02 0.00 0.00 32.46 29.99 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 -1.06 4.37 0.10 0.55 1.04 -0.66 -5.03 113.70 113.01 2f16 s SER 91 Ca 0.47 -0.56 -0.27 0.00 0.48 0.00 0.00 55.95 56.07 2f16 s SER 91 Cb 0.32 0.23 -0.11 0.00 0.10 0.00 0.00 66.02 66.57 2f16 s SER 91 CO 0.20 -1.86 1.65 -0.09 0.98 0.00 0.00 173.24 174.12 2f16 h ARG 92 N -0.45 -0.45 -3.19 4.02 2.43 -1.94 -3.36 114.38 111.44 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 30.52 2f16 h ARG 92 CO 0.38 -0.30 -0.74 0.50 -1.51 0.00 0.00 179.97 178.30 2f16 s ARG 93 N -6.08 1.18 0.69 0.20 3.52 -1.26 -5.12 118.95 112.07 2f16 s ARG 93 Ca -0.16 -1.81 -0.17 0.00 -0.13 0.00 0.00 55.73 53.47 2f16 s ARG 93 Cb 0.07 -2.31 0.01 0.00 -1.56 0.00 0.00 34.95 31.16 2f16 s ARG 93 CO 0.65 -1.11 1.26 -2.14 -0.81 0.00 0.00 175.30 173.14 2f16 s PRO 94 N 0.64 2.33 0.07 5.12 0.02 -1.25 -4.96 135.00 136.97 2f16 s PRO 94 Ca 0.16 1.94 -0.30 0.00 0.02 0.00 0.00 61.00 62.81 2f16 s PRO 94 Cb -0.23 -1.83 -0.05 0.00 0.02 0.00 0.00 34.50 32.40 2f16 s PRO 94 CO -0.05 -1.73 1.08 0.71 -0.33 0.00 0.00 177.00 176.68 2f16 s TYR 95 N -1.65 3.58 -1.00 6.54 2.02 -1.26 -4.96 117.35 120.62 2f16 s TYR 95 Ca 0.79 1.54 -0.04 0.00 -0.37 0.00 0.00 57.07 58.99 2f16 s TYR 95 Cb -0.34 -3.26 0.26 0.00 -0.40 0.00 0.00 41.96 38.22 2f16 s TYR 95 CO 0.42 -0.58 1.00 1.04 -1.57 0.00 0.00 175.55 175.86 2f16 n GLN 96 N 3.45 3.21 -4.13 -0.62 6.02 -1.26 -4.88 117.38 119.17 2f16 n GLN 96 Ca 0.06 -4.49 -0.17 0.00 -0.01 0.00 0.00 57.00 52.39 2f16 n GLN 96 Cb 0.48 -2.47 -0.15 0.00 1.02 0.00 0.00 30.24 29.12 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 -1.57 0.41 -0.04 5.09 1.01 -1.26 -0.93 120.40 123.10 2f16 s VAL 97 Ca 0.30 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.16 2f16 s VAL 97 Cb -0.06 -0.39 -0.03 0.00 0.00 0.00 0.00 36.38 35.90 2f16 s VAL 97 CO -0.08 0.15 -0.12 0.20 0.00 0.00 0.00 175.10 175.25 2f16 s ASN 98 N 0.30 4.21 0.09 3.32 0.01 0.06 -2.28 114.94 120.65 2f16 s ASN 98 Ca -0.03 -0.17 0.02 0.00 -0.71 0.00 0.00 52.86 51.97 2f16 s ASN 98 Cb -0.07 -0.92 -0.04 0.00 0.41 0.00 0.00 41.25 40.63 2f16 s ASN 98 CO -0.00 0.34 -0.07 0.68 -1.51 0.00 0.00 177.10 176.54 2f16 s VAL 99 N -0.79 0.67 -0.09 1.60 -7.23 0.11 -1.51 120.40 113.15 2f16 s VAL 99 Ca 0.12 -1.84 0.03 0.00 -1.81 0.00 0.00 61.98 58.49 2f16 s VAL 99 Cb -0.11 -1.56 0.00 0.00 0.56 0.00 0.00 36.38 35.27 2f16 s VAL 99 CO 0.02 -0.82 -0.20 -0.76 -0.31 0.00 0.00 175.10 173.02 2f16 s LEU 100 N -2.88 1.95 -0.20 1.32 1.43 -0.58 -1.43 118.68 118.29 2f16 s LEU 100 Ca 0.09 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.72 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 -0.04 0.12 -0.17 -0.63 0.23 0.00 0.00 176.35 175.85 2f16 s ILE 101 N 0.46 2.21 -0.16 -0.59 1.01 0.10 -0.98 121.20 123.26 2f16 s ILE 101 Ca -0.17 -1.00 0.01 0.00 0.00 0.00 0.00 60.65 59.48 2f16 s ILE 101 Cb -0.17 -1.99 0.00 0.00 0.01 0.00 0.00 42.46 40.31 2f16 s ILE 101 CO 0.07 0.44 -0.17 -0.83 0.00 0.00 0.00 174.94 174.45 2f16 s GLY 102 N 1.28 1.44 0.16 6.18 0.00 0.85 0.41 107.32 117.64 2f16 s GLY 102 Ca 0.03 -1.09 -0.04 0.00 0.00 0.00 0.00 44.72 43.62 2f16 s GLY 102 CO -0.11 0.08 0.17 -0.32 0.00 0.00 0.00 173.10 172.91 2f16 s GLY 103 N 0.93 0.93 -0.27 0.20 0.00 -0.11 -0.20 107.32 108.80 2f16 s GLY 103 Ca -0.03 -1.33 0.01 0.00 0.00 0.00 0.00 44.72 43.36 2f16 s GLY 103 CO -0.03 -1.18 -0.06 -0.47 0.00 0.00 0.00 173.10 171.36 2f16 s TYR 104 N -4.05 3.23 0.00 1.90 6.14 -0.17 -0.33 117.35 124.08 2f16 s TYR 104 Ca 0.26 -2.06 0.00 0.00 0.64 0.00 0.00 57.07 55.91 2f16 s TYR 104 Cb 0.06 -2.01 0.00 0.00 0.42 0.00 0.00 41.96 40.43 2f16 s TYR 104 CO 0.04 -0.83 0.00 -3.47 0.64 0.00 0.00 175.55 171.93 2f16 n ASP 105 N 4.53 0.00 0.00 4.32 4.64 -0.68 -4.88 116.55 124.48 2f16 n ASP 105 Ca -0.14 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.27 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 -3.63 -0.67 5.02 -1.26 -3.01 118.16 114.62 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 -2.38 0.05 0.00 -0.02 0.00 0.00 35.03 32.67 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 -1.65 -3.81 4.39 3.02 -1.26 -5.01 115.26 110.94 2f16 n ASN 106 Ca 0.00 -0.78 -0.12 0.00 -0.03 0.00 0.00 54.58 53.65 2f16 n ASN 106 Cb 0.00 -4.30 -0.11 0.00 -0.61 0.00 0.00 39.78 34.76 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 -5.79 0.41 0.45 3.52 1.02 -1.16 -5.07 119.74 113.12 2f16 s LYS 107 Ca 0.03 -0.02 -0.19 0.00 0.02 0.00 0.00 55.97 55.81 2f16 s LYS 107 Cb -0.01 0.18 -0.10 0.00 -0.52 0.00 0.00 37.83 37.39 2f16 s LYS 107 CO 0.79 -0.09 0.94 -1.25 -0.92 0.00 0.00 175.35 174.83 2f16 s PRO 108 N -0.66 4.11 -0.03 -1.68 0.04 -1.26 -1.69 135.00 133.82 2f16 s PRO 108 Ca -0.08 1.01 -0.02 0.00 0.04 0.00 0.00 61.00 61.95 2f16 s PRO 108 Cb -0.04 -2.19 0.01 0.00 0.04 0.00 0.00 34.50 32.32 2f16 s PRO 108 CO 0.01 -0.10 0.08 -1.21 0.04 0.00 0.00 177.00 175.83 2f16 s GLU 109 N -3.48 0.08 -0.11 4.56 2.02 0.56 -4.92 118.70 117.40 2f16 s GLU 109 Ca 0.60 0.14 0.02 0.00 0.02 0.00 0.00 54.97 55.75 2f16 s GLU 109 Cb -0.09 -0.01 0.01 0.00 0.10 0.00 0.00 34.13 34.14 2f16 s GLU 109 CO 0.20 -0.04 -0.18 -1.17 0.02 0.00 0.00 175.26 174.09 2f16 s LEU 110 N 0.25 1.88 -0.10 1.80 2.96 -1.26 -0.94 118.68 123.27 2f16 s LEU 110 Ca -0.02 -0.49 0.04 0.00 -0.22 0.00 0.00 54.13 53.44 2f16 s LEU 110 Cb -0.03 -1.22 0.00 0.00 0.50 0.00 0.00 46.19 45.45 2f16 s LEU 110 CO -0.01 0.06 -0.23 -0.31 -1.32 0.00 0.00 176.35 174.54 2f16 s TYR 111 N 0.82 2.52 -0.17 5.38 2.02 0.17 -2.29 117.35 125.79 2f16 s TYR 111 Ca -0.09 -1.06 -0.05 0.00 -0.37 0.00 0.00 57.07 55.49 2f16 s TYR 111 Cb -0.16 -1.69 -0.03 0.00 -0.40 0.00 0.00 41.96 39.68 2f16 s TYR 111 CO 0.00 -0.44 -0.00 -1.14 -1.57 0.00 0.00 175.55 172.40 2f16 s GLN 112 N 0.43 3.75 -0.04 -0.62 0.74 -0.37 0.02 119.66 123.55 2f16 s GLN 112 Ca -0.17 -0.47 -0.01 0.00 0.05 0.00 0.00 55.36 54.75 2f16 s GLN 112 Cb -0.18 -3.03 0.03 0.00 1.10 0.00 0.00 33.01 30.93 2f16 s GLN 112 CO 0.07 0.21 0.04 0.42 -0.55 0.00 0.00 175.29 175.48 2f16 s ILE 113 N 0.48 0.03 0.62 -2.34 1.01 -0.51 -1.46 121.20 119.03 2f16 s ILE 113 Ca -0.01 0.31 -0.02 0.00 0.00 0.00 0.00 60.65 60.92 2f16 s ILE 113 Cb -0.14 -0.24 0.04 0.00 0.01 0.00 0.00 42.46 42.13 2f16 s ILE 113 CO 0.02 0.19 0.88 1.51 0.00 0.00 0.00 174.94 177.54 2f16 s ASP 114 N 1.91 5.08 0.42 3.58 3.84 -0.66 -0.71 116.67 130.14 2f16 s ASP 114 Ca 0.02 0.21 0.25 0.00 -0.00 0.00 0.00 52.55 53.03 2f16 s ASP 114 Cb -0.12 -0.99 1.35 0.00 -1.38 0.00 0.00 42.92 41.77 2f16 s ASP 114 CO -0.03 -1.34 1.73 0.10 -0.00 0.00 0.00 175.17 175.63 2f16 h TYR 115 N -0.23 0.00 0.00 2.11 -0.00 -1.79 0.30 116.97 117.36 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 0.36 0.00 -0.17 1.28 -0.00 0.00 0.00 178.16 179.62 2f16 n LEU 116 N -2.43 0.18 0.00 0.10 4.77 -1.26 -4.60 117.00 113.76 2f16 n LEU 116 Ca -0.02 0.33 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 2f16 n LEU 116 Cb 0.15 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 2f16 n LEU 116 CO 0.11 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.82 2f16 n GLY 117 N 1.50 1.21 3.56 -0.72 0.00 0.09 -4.27 105.19 106.57 2f16 n GLY 117 Ca 0.06 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 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 4.83 0.10 2.61 2.01 -1.23 -4.80 115.64 117.16 2f16 s THR 118 Ca 0.00 0.55 0.07 0.00 0.31 0.00 0.00 61.69 62.62 2f16 s THR 118 Cb 0.00 -4.14 -0.04 0.00 0.01 0.00 0.00 72.50 68.33 2f16 s THR 118 CO 0.00 -0.41 -0.11 -0.75 -0.69 0.00 0.00 174.62 172.67 2f16 s LYS 119 N 2.84 2.12 -0.21 4.92 2.20 -1.26 -1.65 119.74 128.69 2f16 s LYS 119 Ca 0.26 -1.02 -0.26 0.00 -0.36 0.00 0.00 55.97 54.58 2f16 s LYS 119 Cb -0.14 -2.30 0.07 0.00 -1.51 0.00 0.00 37.83 33.95 2f16 s LYS 119 CO 0.16 0.51 0.70 0.54 -0.36 0.00 0.00 175.35 176.90 2f16 s VAL 120 N -1.19 0.00 -0.13 4.02 0.11 -0.54 -5.01 120.40 117.65 2f16 s VAL 120 Ca 0.21 -0.00 -0.12 0.00 -2.93 0.00 0.00 61.98 59.13 2f16 s VAL 120 Cb -0.11 -0.99 -0.05 0.00 -1.53 0.00 0.00 36.38 33.71 2f16 s VAL 120 CO 0.13 -0.00 0.26 -0.70 -3.33 0.00 0.00 175.10 171.46 2f16 s GLU 121 N -0.01 4.04 0.10 1.54 2.12 -1.26 -1.24 118.70 123.99 2f16 s GLU 121 Ca -0.03 0.05 -0.01 0.00 0.36 0.00 0.00 54.97 55.34 2f16 s GLU 121 Cb -0.04 -3.35 -0.04 0.00 0.26 0.00 0.00 34.13 30.96 2f16 s GLU 121 CO 0.03 0.41 0.03 -0.51 -0.54 0.00 0.00 175.26 174.69 2f16 s LEU 122 N -0.05 2.03 0.19 2.70 1.43 -0.97 -5.00 118.68 119.01 2f16 s LEU 122 Ca 0.16 -1.10 -0.01 0.00 -1.03 0.00 0.00 54.13 52.15 2f16 s LEU 122 Cb -0.13 0.31 0.12 0.00 0.03 0.00 0.00 46.19 46.51 2f16 s LEU 122 CO 0.04 -0.68 1.49 -0.65 0.23 0.00 0.00 176.35 176.78 2f16 h PRO 123 N 2.97 0.44 -2.30 1.29 0.11 -1.91 -3.39 132.00 129.21 2f16 h PRO 123 Ca -0.34 -0.31 -0.08 0.00 0.11 0.00 0.00 66.00 65.38 2f16 h PRO 123 Cb 1.18 0.05 -0.19 0.00 0.11 0.00 0.00 31.00 32.14 2f16 h PRO 123 CO 0.61 0.93 0.05 1.52 -0.21 0.00 0.00 178.00 180.90 2f16 s TYR 124 N -3.80 -0.53 0.24 0.65 1.13 -1.26 0.98 117.35 114.75 2f16 s TYR 124 Ca -0.06 0.92 -0.12 0.00 -1.41 0.00 0.00 57.07 56.40 2f16 s TYR 124 Cb 0.11 0.31 -0.01 0.00 -1.10 0.00 0.00 41.96 41.28 2f16 s TYR 124 CO 0.83 -0.53 0.45 0.20 -2.51 0.00 0.00 175.55 173.99 2f16 s GLY 125 N -1.15 0.57 0.15 5.49 0.00 -0.32 -5.01 107.32 107.06 2f16 s GLY 125 Ca -0.11 -0.91 -0.16 0.00 0.00 0.00 0.00 44.72 43.54 2f16 s GLY 125 CO 0.08 -0.67 0.44 0.00 0.00 0.00 0.00 173.10 172.95 2f16 s ALA 126 N -4.02 -0.92 0.08 3.20 0.00 -1.26 -1.28 121.76 117.56 2f16 s ALA 126 Ca 0.23 -0.12 0.07 0.00 0.00 0.00 0.00 51.96 52.14 2f16 s ALA 126 Cb -0.00 0.76 -0.03 0.00 0.00 0.00 0.00 23.12 23.85 2f16 s ALA 126 CO 0.08 -0.70 -0.18 -1.01 0.00 0.00 0.00 175.76 173.95 2f16 s HIS 127 N -3.83 1.59 0.00 0.00 3.76 -1.03 -4.73 115.29 111.04 2f16 s HIS 127 Ca 0.05 -0.42 0.00 0.00 -0.15 0.00 0.00 55.06 54.55 2f16 s HIS 127 Cb 0.01 -0.89 0.00 0.00 1.11 0.00 0.00 32.58 32.81 2f16 s HIS 127 CO -0.09 0.13 0.00 0.41 -0.85 0.00 0.00 174.74 174.35 2f16 n GLY 128 N 1.32 0.01 0.01 -2.22 0.00 -1.26 -3.54 105.19 99.51 2f16 n GLY 128 Ca -0.19 -1.04 0.13 0.00 0.00 0.00 0.00 46.02 44.92 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 6.36 0.00 -0.08 1.61 4.01 -1.26 -4.07 117.16 123.73 2f16 n TYR 129 Ca 0.00 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.67 2f16 n TYR 129 Cb 0.00 -0.38 -0.00 0.00 -0.31 0.00 0.00 39.34 38.65 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 0.06 -0.68 -0.90 7.72 0.02 -1.90 -0.70 113.55 117.17 2f16 h SER 130 Ca 0.00 0.14 0.23 0.00 -0.84 0.00 0.00 61.79 61.32 2f16 h SER 130 Cb 0.48 0.35 -0.05 0.00 0.14 0.00 0.00 62.40 63.31 2f16 h SER 130 CO 0.00 -0.24 0.62 1.23 -1.14 0.00 0.00 176.83 177.30 2f16 h GLY 131 N -0.17 0.50 1.62 -3.77 0.00 -1.79 -1.13 103.07 98.33 2f16 h GLY 131 Ca 0.16 -0.10 0.05 0.00 0.00 0.00 0.00 47.33 47.44 2f16 h GLY 131 CO -0.42 -0.01 0.14 0.74 0.00 0.00 0.00 176.54 176.99 2f16 h PHE 132 N 0.22 0.00 0.00 5.60 0.04 -1.37 -0.38 116.94 121.05 2f16 h PHE 132 Ca 0.46 0.00 -0.31 0.00 2.80 0.00 0.00 57.97 60.92 2f16 h PHE 132 Cb 1.43 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 39.52 2f16 h PHE 132 CO -0.00 0.00 -2.15 0.66 -0.60 0.00 0.00 178.31 176.22 2f16 n TYR 133 N -4.35 0.00 0.04 -0.55 4.01 -0.50 -4.73 117.16 111.08 2f16 n TYR 133 Ca 0.01 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.60 2f16 n TYR 133 Cb 0.27 -0.80 -0.14 0.00 -0.31 0.00 0.00 39.34 38.36 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 1.06 -0.31 -0.72 1.35 -1.29 -3.37 112.91 109.63 2f16 h THR 134 Ca -0.45 -2.75 0.09 0.00 -0.55 0.00 0.00 66.41 62.75 2f16 h THR 134 Cb 1.84 2.68 -0.01 0.00 -1.73 0.00 0.00 68.15 70.93 2f16 h THR 134 CO -0.03 0.78 0.38 -0.26 -0.25 0.00 0.00 175.52 176.14 2f16 h PHE 135 N 0.06 0.00 0.21 4.73 0.04 -1.29 -0.08 116.94 120.60 2f16 h PHE 135 Ca -0.26 0.00 -0.28 0.00 2.80 0.00 0.00 57.97 60.23 2f16 h PHE 135 Cb 2.01 0.00 0.03 0.00 2.20 0.00 0.00 35.95 40.19 2f16 h PHE 135 CO 0.05 0.00 -1.26 0.66 -0.60 0.00 0.00 178.31 177.17 2f16 h SER 136 N 0.00 0.68 -0.50 2.17 4.64 -1.79 -1.48 113.55 117.28 2f16 h SER 136 Ca 0.15 -0.93 0.00 0.00 -0.47 0.00 0.00 61.79 60.54 2f16 h SER 136 Cb 0.90 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.74 2f16 h SER 136 CO -0.00 1.60 0.31 -0.07 -0.87 0.00 0.00 176.83 177.80 2f16 h LEU 137 N -0.06 0.59 -0.21 5.97 3.38 -1.28 -2.28 115.31 121.41 2f16 h LEU 137 Ca -0.22 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 2f16 h LEU 137 Cb 1.96 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 42.56 2f16 h LEU 137 CO 0.22 0.45 -0.07 -0.07 0.09 0.00 0.00 178.44 179.05 2f16 h LEU 138 N 0.67 0.44 -1.62 1.67 3.38 -1.16 -0.62 115.31 118.07 2f16 h LEU 138 Ca 0.18 -0.39 0.21 0.00 0.09 0.00 0.00 57.88 57.97 2f16 h LEU 138 Cb -0.04 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.53 2f16 h LEU 138 CO -0.04 0.73 0.59 0.44 0.09 0.00 0.00 178.44 180.25 2f16 h ASP 139 N 0.15 0.32 0.00 -0.43 3.32 -1.13 -0.92 116.42 117.74 2f16 h ASP 139 Ca 0.05 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 2f16 h ASP 139 Cb 0.55 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.07 2f16 h ASP 139 CO 0.03 0.13 -0.00 -0.74 -1.72 0.00 0.00 179.24 176.93 2f16 h HIS 140 N 0.32 -0.00 -0.10 4.55 2.76 -0.98 -3.39 115.15 118.31 2f16 h HIS 140 Ca 0.45 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.62 2f16 h HIS 140 Cb 1.25 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.21 2f16 h HIS 140 CO -0.00 -0.00 0.00 0.72 -1.30 0.00 0.00 177.93 177.35 2f16 n HIS 141 N -2.06 0.14 -3.26 5.26 8.25 -0.28 -4.92 115.22 118.35 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 -1.84 3.79 -0.02 4.41 5.04 -0.35 -5.02 117.35 123.36 2f16 s TYR 142 Ca 0.07 1.27 -0.00 0.00 -2.44 0.00 0.00 57.07 55.96 2f16 s TYR 142 Cb 0.04 -2.52 0.02 0.00 0.35 0.00 0.00 41.96 39.84 2f16 s TYR 142 CO 0.04 0.55 0.03 1.03 -1.34 0.00 0.00 175.55 175.86 2f16 s ARG 143 N -0.94 -0.01 0.63 4.97 1.81 -1.26 -5.02 118.95 119.12 2f16 s ARG 143 Ca 0.29 0.15 0.33 0.00 -1.72 0.00 0.00 55.73 54.78 2f16 s ARG 143 Cb -0.19 -0.16 1.81 0.00 -0.45 0.00 0.00 34.95 35.96 2f16 s ARG 143 CO 0.19 -0.12 2.11 -1.35 -0.68 0.00 0.00 175.30 175.45 2f16 h PRO 144 N 6.92 0.00 -0.54 3.54 0.11 -1.97 -2.33 132.00 137.73 2f16 h PRO 144 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2f16 h PRO 144 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 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 -3.42 3.66 -4.62 -2.05 3.85 -1.26 -3.62 116.55 109.09 2f16 n ASP 145 Ca -0.00 -2.12 -0.38 0.00 -0.71 0.00 0.00 54.79 51.58 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 0.99 0.90 -2.55 0.11 2.81 -0.88 -4.60 117.12 113.90 2f16 n MET 146 Ca 0.19 0.35 -0.26 0.00 -1.81 0.00 0.00 57.70 56.17 2f16 n MET 146 Cb 0.60 -2.19 0.02 0.00 -0.71 0.00 0.00 33.22 30.94 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 -1.51 3.96 0.54 2.03 -4.23 -1.26 -1.41 115.64 113.76 2f16 s THR 147 Ca 0.76 -0.05 0.23 0.00 -1.18 0.00 0.00 61.69 61.45 2f16 s THR 147 Cb -0.41 -3.54 0.34 0.00 1.34 0.00 0.00 72.50 70.23 2f16 s THR 147 CO 0.46 -0.52 2.08 0.74 -0.54 0.00 0.00 174.62 176.85 2f16 h THR 148 N 0.01 0.77 -0.08 3.99 2.02 -1.97 0.13 112.91 117.79 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 0.86 -0.00 0.00 -1.74 0.00 0.00 68.15 68.51 2f16 h THR 148 CO 0.60 0.00 -0.75 -0.08 0.37 0.00 0.00 175.52 175.66 2f16 h GLU 149 N 0.00 0.45 -0.11 6.66 4.57 -2.00 -2.17 114.58 121.99 2f16 h GLU 149 Ca 0.12 -0.37 -0.16 0.00 -1.18 0.00 0.00 59.36 57.77 2f16 h GLU 149 Cb 0.52 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.18 2f16 h GLU 149 CO -0.00 1.01 -0.62 0.93 -1.18 0.00 0.00 179.01 179.15 2f16 h GLU 150 N 0.30 0.38 0.11 1.92 5.08 -1.38 -2.77 114.58 118.23 2f16 h GLU 150 Ca -0.04 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.05 2f16 h GLU 150 Cb 1.33 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.62 2f16 h GLU 150 CO 0.13 0.88 -0.05 0.78 -1.00 0.00 0.00 179.01 179.75 2f16 h GLY 151 N 1.29 -0.16 2.00 -3.84 0.00 -0.69 -1.23 103.07 100.44 2f16 h GLY 151 Ca -0.01 0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 2f16 h GLY 151 CO 0.10 -0.06 -0.03 1.41 0.00 0.00 0.00 176.54 177.97 2f16 h LEU 152 N -0.17 0.00 0.03 3.11 3.38 -1.33 -0.99 115.31 119.35 2f16 h LEU 152 Ca -0.02 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.69 2f16 h LEU 152 Cb 0.13 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.89 2f16 h LEU 152 CO 0.03 0.03 -1.16 0.44 0.09 0.00 0.00 178.44 177.86 2f16 h ASP 153 N 0.00 0.52 -0.55 -0.43 3.45 -1.12 -2.17 116.42 116.12 2f16 h ASP 153 Ca -0.00 -0.50 -0.11 0.00 0.43 0.00 0.00 57.03 56.85 2f16 h ASP 153 Cb 0.07 -0.17 -0.02 0.00 -0.56 0.00 0.00 39.33 38.65 2f16 h ASP 153 CO 0.00 1.35 -0.09 0.25 -1.57 0.00 0.00 179.24 179.18 2f16 h LEU 154 N 0.15 1.03 -0.33 1.55 5.85 -0.25 -1.81 115.31 121.50 2f16 h LEU 154 Ca -0.13 -0.34 -0.05 0.00 0.84 0.00 0.00 57.88 58.21 2f16 h LEU 154 Cb 1.85 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.58 2f16 h LEU 154 CO 0.20 1.13 0.02 -0.07 -0.34 0.00 0.00 178.44 179.38 2f16 h LEU 155 N 0.92 0.56 -1.11 2.25 3.38 -1.24 -1.32 115.31 118.75 2f16 h LEU 155 Ca 0.15 -0.29 0.14 0.00 0.09 0.00 0.00 57.88 57.96 2f16 h LEU 155 Cb 0.66 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 41.18 2f16 h LEU 155 CO 0.05 0.71 0.61 0.50 0.09 0.00 0.00 178.44 180.39 2f16 h LYS 156 N 0.39 0.83 -0.38 1.13 3.64 -1.15 0.60 116.57 121.63 2f16 h LYS 156 Ca 0.10 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.36 2f16 h LYS 156 Cb 0.41 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 2f16 h LYS 156 CO 0.01 0.55 -0.01 1.25 -2.27 0.00 0.00 179.45 178.98 2f16 h LEU 157 N 0.86 0.67 0.20 5.20 5.85 -0.90 -0.84 115.31 126.35 2f16 h LEU 157 Ca 0.49 -0.32 -0.01 0.00 0.84 0.00 0.00 57.88 58.88 2f16 h LEU 157 Cb 0.62 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.47 2f16 h LEU 157 CO -0.26 0.82 -0.10 0.00 -0.34 0.00 0.00 178.44 178.57 2f16 h VAL 159 N -0.33 0.96 -0.15 0.00 2.07 0.17 -1.15 116.25 117.82 2f16 h VAL 159 Ca -0.03 -0.01 -0.15 0.00 0.82 0.00 0.00 66.70 67.33 2f16 h VAL 159 Cb 0.25 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2f16 h VAL 159 CO 0.05 0.01 -0.50 1.56 0.02 0.00 0.00 177.57 178.70 2f16 h GLN 160 N 0.04 0.61 -0.93 1.57 4.20 -0.74 -1.57 115.11 118.29 2f16 h GLN 160 Ca 0.05 -0.45 -0.00 0.00 0.06 0.00 0.00 58.65 58.31 2f16 h GLN 160 Cb 0.17 0.08 -0.05 0.00 0.30 0.00 0.00 27.48 27.98 2f16 h GLN 160 CO -0.00 1.07 0.56 1.49 -0.67 0.00 0.00 178.83 181.28 2f16 h GLU 161 N 0.27 1.26 -0.65 1.46 4.57 -0.66 -1.31 114.58 119.53 2f16 h GLU 161 Ca -0.02 -0.11 -0.05 0.00 -1.18 0.00 0.00 59.36 58.00 2f16 h GLU 161 Cb 1.13 -0.27 -0.03 0.00 -0.16 0.00 0.00 28.75 29.42 2f16 h GLU 161 CO 0.11 0.88 0.20 -0.07 -1.18 0.00 0.00 179.01 178.95 2f16 h LEU 162 N 1.28 0.94 -1.28 1.64 3.38 -1.14 -1.31 115.31 118.83 2f16 h LEU 162 Ca 0.33 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 2f16 h LEU 162 Cb -0.06 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 2f16 h LEU 162 CO -0.06 0.90 -0.19 -0.33 0.09 0.00 0.00 178.44 178.85 2f16 h GLU 163 N 0.93 0.00 0.00 1.13 5.08 -0.66 -1.58 114.58 119.49 2f16 h GLU 163 Ca 0.21 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.55 2f16 h GLU 163 Cb 0.29 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 2f16 h GLU 163 CO -0.01 0.19 -0.11 -0.22 -1.00 0.00 0.00 179.01 177.85 2f16 h LYS 164 N 0.00 0.00 0.00 2.33 3.64 -0.74 -3.41 116.57 118.38 2f16 h LYS 164 Ca -0.00 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.29 2f16 h LYS 164 Cb 0.66 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.46 2f16 h LYS 164 CO 0.02 0.83 -1.59 0.54 -2.27 0.00 0.00 179.45 176.99 2f16 n ARG 165 N -4.62 0.64 -2.59 1.90 5.12 -0.54 -4.95 116.66 111.62 2f16 n ARG 165 Ca -0.10 0.03 -0.40 0.00 -1.93 0.00 0.00 57.85 55.45 2f16 n ARG 165 Cb 0.42 -1.69 -0.05 0.00 -1.16 0.00 0.00 32.46 29.98 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 -3.20 4.71 0.27 5.56 -1.94 -0.59 -4.96 119.30 119.14 2f16 s MET 166 Ca -0.05 1.67 0.02 0.00 -1.71 0.00 0.00 55.69 55.62 2f16 s MET 166 Cb 0.10 -3.20 0.36 0.00 2.01 0.00 0.00 34.83 34.11 2f16 s MET 166 CO 0.84 0.32 1.68 -1.35 -0.01 0.00 0.00 175.02 176.51 2f16 h PRO 167 N 3.90 0.47 -6.50 2.03 0.11 -1.92 -3.45 132.00 126.63 2f16 h PRO 167 Ca -0.46 -0.20 -0.53 0.00 0.11 0.00 0.00 66.00 64.92 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 0.73 0.01 -1.64 -0.21 0.00 0.00 178.00 177.56 2f16 s MET 168 N -4.38 4.04 -0.66 1.05 -1.94 -1.26 -5.02 119.30 111.12 2f16 s MET 168 Ca -0.07 0.61 -0.20 0.00 -1.71 0.00 0.00 55.69 54.32 2f16 s MET 168 Cb 0.13 -2.77 0.10 0.00 2.01 0.00 0.00 34.83 34.30 2f16 s MET 168 CO 0.80 0.37 0.86 0.34 -0.01 0.00 0.00 175.02 177.37 2f16 s ASP 169 N -1.90 6.25 -0.03 3.03 -1.08 -1.26 -4.89 116.67 116.79 2f16 s ASP 169 Ca 0.44 -1.37 0.06 0.00 -0.52 0.00 0.00 52.55 51.16 2f16 s ASP 169 Cb -0.14 -2.36 0.22 0.00 -1.46 0.00 0.00 42.92 39.18 2f16 s ASP 169 CO 0.20 -1.23 1.05 2.22 0.52 0.00 0.00 175.17 177.93 2f16 n PHE 170 N 6.84 0.44 -3.98 -5.34 1.16 -1.26 -4.89 117.46 110.43 2f16 n PHE 170 Ca -0.03 -0.18 -0.30 0.00 -1.87 0.00 0.00 57.45 55.08 2f16 n PHE 170 Cb 0.44 -0.09 0.00 0.00 -1.61 0.00 0.00 39.48 38.23 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 0.17 -4.34 -1.16 3.97 4.76 -1.26 -2.14 118.16 118.16 2f16 n LYS 171 Ca 0.08 0.50 0.15 0.00 -2.87 0.00 0.00 58.31 56.17 2f16 n LYS 171 Cb 0.33 -5.14 -0.05 0.00 -1.84 0.00 0.00 35.03 28.32 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 -1.65 -2.46 3.66 0.72 0.00 -1.26 -4.23 105.19 99.95 2f16 n GLY 172 Ca -0.07 -1.18 -0.25 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.94 2.50 -0.15 1.61 -7.23 -1.26 -0.61 120.40 112.31 2f16 s VAL 173 Ca 0.00 -1.91 -0.01 0.00 -1.81 0.00 0.00 61.98 58.25 2f16 s VAL 173 Cb 0.00 -2.87 -0.01 0.00 0.56 0.00 0.00 36.38 34.06 2f16 s VAL 173 CO 0.00 -0.13 -0.12 -0.63 -0.31 0.00 0.00 175.10 173.91 2f16 s ILE 174 N -2.56 3.09 0.02 -0.62 1.01 -0.40 -4.88 121.20 116.86 2f16 s ILE 174 Ca 0.36 -0.64 0.02 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 0.20 0.51 0.01 -0.69 0.00 0.00 0.00 174.94 174.96 2f16 s VAL 175 N 0.57 4.17 -0.00 2.92 1.01 -1.26 -2.01 120.40 125.80 2f16 s VAL 175 Ca -0.07 -0.67 -0.02 0.00 0.00 0.00 0.00 61.98 61.22 2f16 s VAL 175 Cb -0.15 -2.89 -0.00 0.00 0.00 0.00 0.00 36.38 33.33 2f16 s VAL 175 CO 0.03 0.32 0.03 -0.54 0.00 0.00 0.00 175.10 174.94 2f16 s LYS 176 N -1.73 0.20 -0.05 2.72 1.02 -0.49 -2.09 119.74 119.32 2f16 s LYS 176 Ca 0.21 -0.23 0.05 0.00 0.02 0.00 0.00 55.97 56.02 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 0.12 -0.04 -0.20 0.42 -0.92 0.00 0.00 175.35 174.74 2f16 s ILE 177 N -0.68 2.55 -0.17 2.17 1.01 0.14 -1.43 121.20 124.78 2f16 s ILE 177 Ca -0.07 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.68 2f16 s ILE 177 Cb -0.05 -1.96 0.02 0.00 0.01 0.00 0.00 42.46 40.48 2f16 s ILE 177 CO -0.00 0.58 -0.20 -0.69 0.00 0.00 0.00 174.94 174.62 2f16 s VAL 178 N -0.48 2.02 0.16 2.92 1.01 -0.25 -1.77 120.40 124.02 2f16 s VAL 178 Ca 0.06 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.11 2f16 s VAL 178 Cb -0.12 -1.82 0.00 0.00 0.00 0.00 0.00 36.38 34.45 2f16 s VAL 178 CO 0.01 0.54 0.20 -0.90 0.00 0.00 0.00 175.10 174.95 2f16 n ASP 179 N 4.46 -0.56 0.17 3.32 5.68 -0.21 -1.45 116.55 127.97 2f16 n ASP 179 Ca -0.20 -1.89 0.16 0.00 -0.50 0.00 0.00 54.79 52.36 2f16 n ASP 179 Cb 0.50 1.07 0.61 0.00 -1.14 0.00 0.00 41.12 42.17 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 -0.60 0.11 2.10 -1.93 0.27 116.57 116.52 2f16 h LYS 180 Ca -0.12 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.53 2f16 h LYS 180 Cb 0.54 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.87 2f16 h LYS 180 CO 0.17 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.37 2f16 n ASP 181 N -3.15 3.78 0.00 7.07 8.00 -1.26 -5.07 116.55 125.92 2f16 n ASP 181 Ca 0.05 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.55 2f16 n ASP 181 Cb 0.72 -0.40 0.00 0.00 -0.02 0.00 0.00 41.12 41.43 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 1.60 0.19 3.18 0.44 0.00 0.94 -5.00 105.19 106.55 2f16 n GLY 183 Ca 0.23 -1.92 -0.29 0.00 0.00 0.00 0.00 46.02 44.03 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 1.77 0.06 -0.61 1.01 -1.23 -1.05 121.20 121.16 2f16 s ILE 184 Ca 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 60.65 59.78 2f16 s ILE 184 Cb 0.00 -1.53 -0.04 0.00 0.01 0.00 0.00 42.46 40.90 2f16 s ILE 184 CO 0.00 0.50 -0.04 0.00 0.00 0.00 0.00 174.94 175.39 2f16 s ARG 185 N 0.23 0.65 -0.17 2.79 1.70 -0.73 -4.99 118.95 118.43 2f16 s ARG 185 Ca -0.12 -1.16 -0.03 0.00 -0.47 0.00 0.00 55.73 53.94 2f16 s ARG 185 Cb -0.15 0.04 -0.02 0.00 -0.57 0.00 0.00 34.95 34.24 2f16 s ARG 185 CO 0.06 -0.06 -0.05 -1.14 -1.08 0.00 0.00 175.30 173.02 2f16 s GLN 186 N -3.49 3.54 -0.89 3.89 0.74 -1.26 -0.69 119.66 121.50 2f16 s GLN 186 Ca 0.05 -0.58 -0.25 0.00 0.05 0.00 0.00 55.36 54.64 2f16 s GLN 186 Cb 0.04 -2.91 -0.01 0.00 1.10 0.00 0.00 33.01 31.23 2f16 s GLN 186 CO -0.07 0.10 1.76 0.08 -0.55 0.00 0.00 175.29 176.61 2f16 s VAL 187 N 0.73 3.58 -0.69 1.34 1.01 -0.89 -4.81 120.40 120.67 2f16 s VAL 187 Ca -0.02 -0.35 0.15 0.00 0.00 0.00 0.00 61.98 61.75 2f16 s VAL 187 Cb -0.15 -4.34 0.14 0.00 0.00 0.00 0.00 36.38 32.04 2f16 s VAL 187 CO 0.02 -1.27 1.45 -0.90 0.00 0.00 0.00 175.10 174.40 2f16 n ASP 188 N 12.15 0.29 -3.99 3.32 3.85 -1.26 -4.06 116.55 126.86 2f16 n ASP 188 Ca 0.33 0.60 -0.31 0.00 -0.71 0.00 0.00 54.79 54.70 2f16 n ASP 188 Cb 0.49 -0.65 -0.11 0.00 -1.35 0.00 0.00 41.12 39.50 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 -3.54 5.11 0.00 -1.12 -4.77 -1.26 -4.66 116.67 106.43 2f16 s ASP 189 Ca 0.02 -3.59 0.00 0.00 -3.30 0.00 0.00 52.55 45.69 2f16 s ASP 189 Cb 0.06 -1.74 0.00 0.00 -1.09 0.00 0.00 42.92 40.16 2f16 s ASP 189 CO 0.21 -0.16 0.00 0.33 0.70 0.00 0.00 175.17 176.25 2f16 n PHE 190 N 2.40 0.00 0.23 2.11 -0.00 -1.26 -4.27 117.46 116.68 2f16 n PHE 190 Ca 0.17 0.00 0.11 0.00 -0.00 0.00 0.00 57.45 57.72 2f16 n PHE 190 Cb 0.35 0.00 0.53 0.00 -0.00 0.00 0.00 39.48 40.36 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 -3.79 117.38 108.30 2f16 n GLN 191 Ca 0.00 0.56 -0.05 0.00 -0.01 0.00 0.00 57.00 57.50 2f16 n GLN 191 Cb 0.00 -1.91 0.08 0.00 0.00 0.00 0.00 30.24 28.41 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 -1.76 -3.12 1.34 -1.58 0.00 -1.26 -5.18 120.51 108.95 2f16 n ALA 192 Ca -0.00 -0.50 0.13 0.00 0.00 0.00 0.00 53.44 53.07 2f16 n ALA 192 Cb 0.09 -2.90 0.39 0.00 0.00 0.00 0.00 19.45 17.03 2f16 n ALA 192 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44