#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f16 s SER 2 N 0.00 2.67 0.03 8.00 0.01 -1.26 -1.02 113.70 122.12 2f16 s SER 2 Ca 0.00 -0.57 0.01 0.00 1.31 0.00 0.00 55.95 56.70 2f16 s SER 2 Cb 0.00 -0.90 -0.02 0.00 0.21 0.00 0.00 66.02 65.31 2f16 s SER 2 CO 0.00 -0.17 -0.05 0.27 0.41 0.00 0.00 173.24 173.71 2f16 s ILE 3 N 1.65 0.26 0.08 1.44 -4.36 -0.83 -1.32 121.20 118.12 2f16 s ILE 3 Ca 0.02 -1.02 -0.26 0.00 -0.26 0.00 0.00 60.65 59.13 2f16 s ILE 3 Cb -0.15 -0.45 0.07 0.00 1.25 0.00 0.00 42.46 43.19 2f16 s ILE 3 CO -0.08 -0.49 0.66 0.00 0.24 0.00 0.00 174.94 175.27 2f16 s MET 4 N -1.65 1.16 -0.02 0.37 0.23 -0.42 -0.93 119.30 118.04 2f16 s MET 4 Ca -0.13 -0.23 0.01 0.00 -1.03 0.00 0.00 55.69 54.31 2f16 s MET 4 Cb -0.09 0.54 0.01 0.00 -1.53 0.00 0.00 34.83 33.76 2f16 s MET 4 CO -0.01 -0.47 -0.03 0.00 -2.03 0.00 0.00 175.02 172.48 2f16 s ALA 5 N -2.89 0.44 -0.06 3.16 0.00 -0.36 -0.38 121.76 121.66 2f16 s ALA 5 Ca -0.02 -0.04 0.02 0.00 0.00 0.00 0.00 51.96 51.92 2f16 s ALA 5 Cb -0.01 -0.25 0.02 0.00 0.00 0.00 0.00 23.12 22.88 2f16 s ALA 5 CO -0.06 0.02 -0.10 0.08 0.00 0.00 0.00 175.76 175.70 2f16 s VAL 6 N 0.53 0.96 -0.01 0.00 1.01 -0.15 -1.04 120.40 121.71 2f16 s VAL 6 Ca -0.06 -0.38 -0.18 0.00 0.00 0.00 0.00 61.98 61.36 2f16 s VAL 6 Cb -0.09 -0.90 -0.06 0.00 0.00 0.00 0.00 36.38 35.33 2f16 s VAL 6 CO -0.01 0.32 0.51 0.42 0.00 0.00 0.00 175.10 176.34 2f16 s THR 7 N 0.71 4.96 0.35 3.92 -4.23 -0.71 -1.06 115.64 119.59 2f16 s THR 7 Ca -0.14 1.06 0.06 0.00 -1.18 0.00 0.00 61.69 61.49 2f16 s THR 7 Cb -0.15 -3.84 -0.02 0.00 1.34 0.00 0.00 72.50 69.83 2f16 s THR 7 CO 0.03 0.48 0.22 2.22 -0.54 0.00 0.00 174.62 177.03 2f16 n PHE 8 N 2.40 -0.40 -0.36 3.99 1.16 -0.90 -4.56 117.46 118.79 2f16 n PHE 8 Ca -0.10 -2.65 0.02 0.00 -1.87 0.00 0.00 57.45 52.85 2f16 n PHE 8 Cb 0.51 0.16 0.08 0.00 -1.61 0.00 0.00 39.48 38.63 2f16 n PHE 8 CO 0.00 0.00 0.00 1.17 -1.87 0.00 0.00 176.76 176.06 2f16 n LYS 9 N -0.73 -0.17 0.00 3.97 4.81 -0.69 -1.80 118.16 123.55 2f16 n LYS 9 Ca 0.02 1.50 0.14 0.00 -0.87 0.00 0.00 58.31 59.10 2f16 n LYS 9 Cb 0.59 -2.23 0.52 0.00 0.02 0.00 0.00 35.03 33.93 2f16 n LYS 9 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2f16 n ASP 10 N -5.49 1.30 0.00 3.14 10.43 -1.26 -4.94 116.55 119.73 2f16 n ASP 10 Ca 0.12 -1.33 0.00 0.00 2.57 0.00 0.00 54.79 56.15 2f16 n ASP 10 Cb 0.43 0.02 0.00 0.00 1.84 0.00 0.00 41.12 43.41 2f16 n ASP 10 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2f16 n GLY 11 N 1.20 -0.27 3.60 0.44 0.00 -0.75 -4.31 105.19 105.11 2f16 n GLY 11 Ca 0.18 0.02 -0.11 0.00 0.00 0.00 0.00 46.02 46.11 2f16 n GLY 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f16 s VAL 12 N 0.00 0.00 -0.01 1.61 0.11 -0.71 -2.13 120.40 119.27 2f16 s VAL 12 Ca 0.00 0.00 0.06 0.00 -2.93 0.00 0.00 61.98 59.11 2f16 s VAL 12 Cb 0.00 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.83 2f16 s VAL 12 CO 0.00 0.00 -0.20 -0.63 -3.33 0.00 0.00 175.10 170.94 2f16 s ILE 13 N -0.58 1.62 -0.07 7.04 -1.09 -0.22 -0.72 121.20 127.17 2f16 s ILE 13 Ca -0.01 -0.91 0.01 0.00 -2.23 0.00 0.00 60.65 57.51 2f16 s ILE 13 Cb -0.02 -1.35 -0.03 0.00 -1.58 0.00 0.00 42.46 39.48 2f16 s ILE 13 CO -0.01 0.43 -0.08 -0.76 -1.23 0.00 0.00 174.94 173.29 2f16 s LEU 14 N -0.56 3.09 0.06 2.97 1.02 -0.13 -0.98 118.68 124.15 2f16 s LEU 14 Ca 0.08 -0.07 0.02 0.00 0.02 0.00 0.00 54.13 54.18 2f16 s LEU 14 Cb -0.08 -1.67 -0.03 0.00 0.02 0.00 0.00 46.19 44.43 2f16 s LEU 14 CO -0.00 0.34 -0.07 -0.83 0.02 0.00 0.00 176.35 175.81 2f16 s GLY 15 N -0.67 0.58 0.08 -3.19 0.00 0.49 -0.75 107.32 103.85 2f16 s GLY 15 Ca 0.10 -0.97 -0.26 0.00 0.00 0.00 0.00 44.72 43.59 2f16 s GLY 15 CO 0.02 -1.05 0.75 0.00 0.00 0.00 0.00 173.10 172.82 2f16 s ALA 16 N -2.25 -1.71 0.77 3.20 0.00 -0.57 -1.30 121.76 119.89 2f16 s ALA 16 Ca -0.02 0.75 -0.04 0.00 0.00 0.00 0.00 51.96 52.65 2f16 s ALA 16 Cb -0.04 0.64 0.11 0.00 0.00 0.00 0.00 23.12 23.83 2f16 s ALA 16 CO -0.02 -0.73 0.69 -0.40 0.00 0.00 0.00 175.76 175.30 2f16 n ASP 17 N -0.31 0.51 -0.79 0.00 5.75 -0.43 -1.01 116.55 120.26 2f16 n ASP 17 Ca -0.13 -1.53 0.05 0.00 -0.01 0.00 0.00 54.79 53.18 2f16 n ASP 17 Cb 0.63 -0.49 0.13 0.00 -1.03 0.00 0.00 41.12 40.37 2f16 n ASP 17 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2f16 n SER 18 N -3.18 1.45 -4.52 -1.12 3.41 -0.46 -4.59 113.62 104.60 2f16 n SER 18 Ca 0.10 -3.09 -0.34 0.00 -0.26 0.00 0.00 58.87 55.28 2f16 n SER 18 Cb 0.36 -0.42 -0.12 0.00 -0.26 0.00 0.00 64.21 63.77 2f16 n SER 18 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2f16 s ARG 19 N -1.98 3.73 -0.09 4.33 3.52 -1.19 -0.39 118.95 126.88 2f16 s ARG 19 Ca 0.33 -0.48 0.04 0.00 -0.13 0.00 0.00 55.73 55.49 2f16 s ARG 19 Cb 0.34 -2.98 -0.00 0.00 -1.56 0.00 0.00 34.95 30.74 2f16 s ARG 19 CO -0.08 0.24 -0.24 0.95 -0.81 0.00 0.00 175.30 175.37 2f16 s THR 20 N 0.38 2.13 0.22 4.11 -4.23 -0.41 -4.72 115.64 113.12 2f16 s THR 20 Ca -0.03 -1.01 0.09 0.00 -1.18 0.00 0.00 61.69 59.57 2f16 s THR 20 Cb -0.14 -1.80 -0.05 0.00 1.34 0.00 0.00 72.50 71.85 2f16 s THR 20 CO 0.02 0.56 -0.18 0.42 -0.54 0.00 0.00 174.62 174.91 2f16 s THR 21 N 0.21 2.03 -0.54 3.99 -4.23 -1.26 -1.09 115.64 114.75 2f16 s THR 21 Ca -0.15 -2.18 0.04 0.00 -1.18 0.00 0.00 61.69 58.22 2f16 s THR 21 Cb -0.17 -2.08 0.16 0.00 1.34 0.00 0.00 72.50 71.75 2f16 s THR 21 CO 0.07 -0.43 0.36 -0.89 -0.54 0.00 0.00 174.62 173.20 2f16 s THR 22 N -2.50 1.79 0.00 3.99 2.01 -0.47 -4.86 115.64 115.60 2f16 s THR 22 Ca 0.23 -3.28 0.00 0.00 0.31 0.00 0.00 61.69 58.94 2f16 s THR 22 Cb -0.04 -2.21 0.00 0.00 0.01 0.00 0.00 72.50 70.26 2f16 s THR 22 CO 0.09 -1.01 0.00 0.61 -0.69 0.00 0.00 174.62 173.62 2f16 n GLY 23 N 2.75 2.13 0.92 4.40 0.00 -1.26 -2.61 105.19 111.53 2f16 n GLY 23 Ca 0.18 -0.45 0.09 0.00 0.00 0.00 0.00 46.02 45.84 2f16 n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f16 n ALA 24 N 9.52 2.37 -2.71 4.61 0.00 -1.26 -4.92 120.51 128.13 2f16 n ALA 24 Ca 0.00 -0.98 -0.37 0.00 0.00 0.00 0.00 53.44 52.09 2f16 n ALA 24 Cb 0.00 -0.68 -0.07 0.00 0.00 0.00 0.00 19.45 18.70 2f16 n ALA 24 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2f16 s TYR 25 N -1.24 3.50 -0.67 0.00 5.04 -1.07 -5.02 117.35 117.89 2f16 s TYR 25 Ca 0.31 0.69 -0.24 0.00 -2.44 0.00 0.00 57.07 55.39 2f16 s TYR 25 Cb 0.18 -2.36 0.06 0.00 0.35 0.00 0.00 41.96 40.19 2f16 s TYR 25 CO 0.25 0.29 1.04 0.42 -1.34 0.00 0.00 175.55 176.21 2f16 s ILE 26 N 0.28 4.17 0.17 3.14 1.01 -1.26 -1.37 121.20 127.34 2f16 s ILE 26 Ca 0.19 -0.12 -0.11 0.00 0.00 0.00 0.00 60.65 60.61 2f16 s ILE 26 Cb -0.14 -4.74 0.07 0.00 0.01 0.00 0.00 42.46 37.67 2f16 s ILE 26 CO 0.06 -1.54 1.70 0.00 0.00 0.00 0.00 174.94 175.16 2f16 h ALA 27 N 9.67 0.79 -3.45 9.38 0.00 -1.44 -3.42 119.26 130.78 2f16 h ALA 27 Ca -0.28 -0.21 -0.31 0.00 0.00 0.00 0.00 54.91 54.10 2f16 h ALA 27 Cb 1.07 -0.23 -0.35 0.00 0.00 0.00 0.00 17.79 18.27 2f16 h ALA 27 CO 1.20 0.48 -0.72 1.21 0.00 0.00 0.00 179.25 181.41 2f16 s ASN 28 N -6.24 0.29 0.00 0.00 3.84 -1.05 -5.01 114.94 106.77 2f16 s ASN 28 Ca -0.13 0.07 0.18 0.00 0.21 0.00 0.00 52.86 53.19 2f16 s ASN 28 Cb 0.13 -0.06 -0.02 0.00 -0.55 0.00 0.00 41.25 40.74 2f16 s ASN 28 CO 0.81 -0.16 0.89 -2.11 -2.79 0.00 0.00 177.10 173.75 2f16 n ARG 29 N 4.44 1.56 -1.57 0.43 1.85 -1.26 -1.28 116.66 120.83 2f16 n ARG 29 Ca -0.22 -0.77 -0.08 0.00 -1.00 0.00 0.00 57.85 55.78 2f16 n ARG 29 Cb 0.50 -1.32 0.09 0.00 -1.05 0.00 0.00 32.46 30.68 2f16 n ARG 29 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 177.63 178.95 2f16 n VAL 30 N -0.23 2.04 -1.88 8.89 0.24 -1.10 -4.39 118.33 121.90 2f16 n VAL 30 Ca 0.07 -3.44 -0.39 0.00 -2.04 0.00 0.00 64.34 58.54 2f16 n VAL 30 Cb 0.36 -0.35 0.02 0.00 -1.47 0.00 0.00 33.84 32.40 2f16 n VAL 30 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2f16 s THR 31 N -3.61 2.26 -0.44 3.34 2.01 0.48 -5.00 115.64 114.68 2f16 s THR 31 Ca 0.42 0.21 -0.05 0.00 0.31 0.00 0.00 61.69 62.58 2f16 s THR 31 Cb 0.38 -3.12 0.11 0.00 0.01 0.00 0.00 72.50 69.89 2f16 s THR 31 CO -0.03 0.01 0.26 -0.62 -0.69 0.00 0.00 174.62 173.56 2f16 s ASP 32 N -0.83 5.42 0.00 3.53 3.68 -1.26 -4.42 116.67 122.79 2f16 s ASP 32 Ca 0.65 -2.00 0.28 0.00 2.13 0.00 0.00 52.55 53.61 2f16 s ASP 32 Cb -0.40 -1.90 1.00 0.00 -1.45 0.00 0.00 42.92 40.17 2f16 s ASP 32 CO 0.49 -0.60 1.71 0.29 0.13 0.00 0.00 175.17 177.20 2f16 n LYS 33 N 4.69 1.36 -3.25 4.34 5.02 -1.26 -4.67 118.16 124.38 2f16 n LYS 33 Ca -0.04 -0.76 -0.45 0.00 -2.02 0.00 0.00 58.31 55.04 2f16 n LYS 33 Cb 0.41 -1.48 -0.06 0.00 -0.02 0.00 0.00 35.03 33.88 2f16 n LYS 33 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2f16 s LEU 34 N -2.17 5.56 -0.11 -0.35 1.43 -1.26 -1.99 118.68 119.79 2f16 s LEU 34 Ca 0.34 -1.37 -0.03 0.00 -1.03 0.00 0.00 54.13 52.04 2f16 s LEU 34 Cb 0.20 -2.28 -0.03 0.00 0.03 0.00 0.00 46.19 44.11 2f16 s LEU 34 CO 0.40 -0.86 -0.00 -0.89 0.23 0.00 0.00 176.35 175.22 2f16 s THR 35 N 2.10 4.27 -0.25 5.49 2.01 -0.69 -4.94 115.64 123.64 2f16 s THR 35 Ca 0.08 -0.25 -0.21 0.00 0.31 0.00 0.00 61.69 61.62 2f16 s THR 35 Cb -0.24 -2.82 -0.02 0.00 0.01 0.00 0.00 72.50 69.42 2f16 s THR 35 CO 0.07 0.57 0.66 -0.60 -0.69 0.00 0.00 174.62 174.62 2f16 s ARG 36 N -0.51 4.13 0.00 4.92 3.52 -1.26 -0.29 118.95 129.45 2f16 s ARG 36 Ca 0.09 0.61 0.13 0.00 -0.13 0.00 0.00 55.73 56.43 2f16 s ARG 36 Cb -0.12 -3.64 -0.02 0.00 -1.56 0.00 0.00 34.95 29.61 2f16 s ARG 36 CO 0.02 -0.41 0.74 1.33 -0.81 0.00 0.00 175.30 176.17 2f16 n VAL 37 N 5.16 0.00 -3.59 7.11 0.24 -0.72 -4.94 118.33 121.59 2f16 n VAL 37 Ca 0.00 -0.35 -0.05 0.00 -2.04 0.00 0.00 64.34 61.91 2f16 n VAL 37 Cb 0.49 1.14 -0.03 0.00 -1.47 0.00 0.00 33.84 33.98 2f16 n VAL 37 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2f16 s HIS 38 N -1.71 -0.16 0.18 6.34 5.65 -0.73 -4.49 115.29 120.38 2f16 s HIS 38 Ca 0.11 0.14 -0.14 0.00 0.25 0.00 0.00 55.06 55.41 2f16 s HIS 38 Cb 0.11 0.51 0.18 0.00 -1.18 0.00 0.00 32.58 32.20 2f16 s HIS 38 CO 0.36 -0.23 1.22 -0.25 -0.65 0.00 0.00 174.74 175.19 2f16 n ASP 39 N 0.04 -0.52 -1.17 9.88 8.00 -1.26 -1.73 116.55 129.79 2f16 n ASP 39 Ca -0.01 1.38 -0.02 0.00 0.71 0.00 0.00 54.79 56.84 2f16 n ASP 39 Cb 0.59 -0.31 0.13 0.00 -0.02 0.00 0.00 41.12 41.51 2f16 n ASP 39 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2f16 n LYS 40 N -5.16 1.96 -3.69 -1.24 5.02 -1.26 -4.93 118.16 108.87 2f16 n LYS 40 Ca 0.08 -3.41 -0.27 0.00 -2.02 0.00 0.00 58.31 52.69 2f16 n LYS 40 Cb 0.31 -1.62 -0.17 0.00 -0.02 0.00 0.00 35.03 33.53 2f16 n LYS 40 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2f16 s ILE 41 N -3.29 0.32 0.45 -0.18 1.01 -0.71 -0.37 121.20 118.45 2f16 s ILE 41 Ca 0.40 -0.48 0.05 0.00 0.00 0.00 0.00 60.65 60.62 2f16 s ILE 41 Cb 0.38 -0.91 -0.05 0.00 0.01 0.00 0.00 42.46 41.89 2f16 s ILE 41 CO -0.05 -0.27 0.03 0.26 0.00 0.00 0.00 174.94 174.91 2f16 s TRP 42 N 1.95 2.24 0.11 3.97 0.52 0.33 -1.75 118.94 126.31 2f16 s TRP 42 Ca 0.01 -0.78 -0.04 0.00 0.02 0.00 0.00 56.10 55.31 2f16 s TRP 42 Cb -0.17 -1.73 -0.03 0.00 -1.15 0.00 0.00 33.47 30.39 2f16 s TRP 42 CO -0.10 0.31 0.10 0.00 0.02 0.00 0.00 176.95 177.28 2f16 s ARG 45 N 0.59 3.73 -0.01 0.00 0.52 -0.84 -1.58 118.95 121.35 2f16 s ARG 45 Ca -0.08 -0.31 -0.05 0.00 -0.52 0.00 0.00 55.73 54.76 2f16 s ARG 45 Cb -0.16 -3.15 0.00 0.00 0.52 0.00 0.00 34.95 32.17 2f16 s ARG 45 CO 0.03 0.43 0.11 -1.54 0.02 0.00 0.00 175.30 174.36 2f16 s SER 46 N -0.07 0.00 0.00 0.23 1.04 -0.55 -4.92 113.70 109.43 2f16 s SER 46 Ca 0.07 -0.10 0.00 0.00 0.48 0.00 0.00 55.95 56.40 2f16 s SER 46 Cb -0.12 0.21 0.00 0.00 0.10 0.00 0.00 66.02 66.21 2f16 s SER 46 CO 0.01 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.58 2f16 n GLY 47 N 1.95 0.67 3.68 7.32 0.00 -1.26 0.13 105.19 117.68 2f16 n GLY 47 Ca -0.20 -1.55 -0.43 0.00 0.00 0.00 0.00 46.02 43.85 2f16 n GLY 47 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2f16 s SER 48 N -4.00 7.02 0.15 1.61 0.15 0.81 -4.93 113.70 114.51 2f16 s SER 48 Ca 0.00 1.76 -0.17 0.00 0.70 0.00 0.00 55.95 58.24 2f16 s SER 48 Cb 0.00 -2.55 -0.00 0.00 -1.71 0.00 0.00 66.02 61.76 2f16 s SER 48 CO 0.00 -0.65 1.79 0.00 1.20 0.00 0.00 173.24 175.58 2f16 h ALA 49 N 7.71 0.47 -0.21 5.45 0.00 -1.92 -0.73 119.26 130.04 2f16 h ALA 49 Ca -0.31 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 2f16 h ALA 49 Cb 1.14 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2f16 h ALA 49 CO 0.91 -0.04 0.09 0.00 0.00 0.00 0.00 179.25 180.21 2f16 h ALA 50 N 1.11 0.27 0.30 0.00 0.00 -1.96 -0.96 119.26 118.02 2f16 h ALA 50 Ca 0.13 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2f16 h ALA 50 Cb -0.02 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 2f16 h ALA 50 CO -0.03 -0.15 -0.18 -0.44 0.00 0.00 0.00 179.25 178.45 2f16 h ASP 51 N 0.19 -0.45 -0.75 0.00 3.32 -1.84 -1.45 116.42 115.44 2f16 h ASP 51 Ca 0.07 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 2f16 h ASP 51 Cb 0.16 0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.80 2f16 h ASP 51 CO -0.01 -0.29 0.36 0.71 -1.72 0.00 0.00 179.24 178.29 2f16 h THR 52 N -0.46 1.24 -0.07 0.35 1.35 -1.12 -0.08 112.91 114.12 2f16 h THR 52 Ca -0.03 -0.69 -0.00 0.00 -0.55 0.00 0.00 66.41 65.13 2f16 h THR 52 Cb 0.38 0.28 -0.00 0.00 -1.73 0.00 0.00 68.15 67.07 2f16 h THR 52 CO 0.04 0.29 0.04 1.56 -0.25 0.00 0.00 175.52 177.19 2f16 h GLN 53 N 1.09 0.09 -0.47 4.72 4.20 -1.05 0.17 115.11 123.85 2f16 h GLN 53 Ca 0.26 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.97 2f16 h GLN 53 Cb 0.12 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.86 2f16 h GLN 53 CO -0.03 0.15 0.30 0.00 -0.67 0.00 0.00 178.83 178.58 2f16 h ALA 54 N 0.94 0.60 0.01 3.87 0.00 -0.98 0.62 119.26 124.33 2f16 h ALA 54 Ca 0.02 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2f16 h ALA 54 Cb 0.08 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2f16 h ALA 54 CO -0.00 0.03 -0.01 0.82 0.00 0.00 0.00 179.25 180.09 2f16 h ILE 55 N 0.62 1.01 -0.04 0.00 2.04 -0.77 -2.11 117.51 118.26 2f16 h ILE 55 Ca 0.18 -0.08 0.03 0.00 1.00 0.00 0.00 64.86 65.99 2f16 h ILE 55 Cb -0.05 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 2f16 h ILE 55 CO -0.05 0.02 -0.14 0.00 0.00 0.00 0.00 178.15 177.98 2f16 h ALA 56 N 0.93 -0.13 -0.96 1.87 0.00 -0.31 -0.84 119.26 119.82 2f16 h ALA 56 Ca -0.00 0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.07 2f16 h ALA 56 Cb 0.05 0.26 -0.08 0.00 0.00 0.00 0.00 17.79 18.01 2f16 h ALA 56 CO 0.00 -0.62 0.61 -0.44 0.00 0.00 0.00 179.25 178.80 2f16 h ASP 57 N -0.22 0.79 -0.23 0.00 3.45 -0.76 -0.03 116.42 119.42 2f16 h ASP 57 Ca 0.06 0.05 -0.06 0.00 0.43 0.00 0.00 57.03 57.51 2f16 h ASP 57 Cb 0.30 -0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 38.96 2f16 h ASP 57 CO -0.16 0.40 -0.10 0.40 -1.57 0.00 0.00 179.24 178.20 2f16 h ILE 58 N 0.84 1.30 -0.72 0.35 1.08 -0.65 -1.62 117.51 118.08 2f16 h ILE 58 Ca 0.49 -1.16 -0.00 0.00 -0.39 0.00 0.00 64.86 63.80 2f16 h ILE 58 Cb 0.64 1.57 -0.04 0.00 -3.07 0.00 0.00 36.82 35.93 2f16 h ILE 58 CO -0.25 0.36 0.45 0.58 -0.69 0.00 0.00 178.15 178.60 2f16 h VAL 59 N 0.19 1.20 -0.05 1.67 2.07 -0.36 -0.35 116.25 120.62 2f16 h VAL 59 Ca 0.05 -0.42 0.02 0.00 0.82 0.00 0.00 66.70 67.17 2f16 h VAL 59 Cb 0.59 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 2f16 h VAL 59 CO 0.03 0.20 -0.06 -0.61 0.02 0.00 0.00 177.57 177.16 2f16 h GLN 60 N 0.98 -0.08 -0.41 1.57 4.15 -0.93 0.85 115.11 121.25 2f16 h GLN 60 Ca 0.26 0.01 0.08 0.00 0.77 0.00 0.00 58.65 59.76 2f16 h GLN 60 Cb -0.06 0.02 -0.07 0.00 0.21 0.00 0.00 27.48 27.58 2f16 h GLN 60 CO -0.05 -0.05 -0.01 -0.92 -1.93 0.00 0.00 178.83 175.87 2f16 h TYR 61 N -0.08 -0.04 -0.38 3.99 3.20 -0.79 -0.99 116.97 121.89 2f16 h TYR 61 Ca 0.04 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.96 2f16 h TYR 61 Cb 0.14 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.47 2f16 h TYR 61 CO -0.15 -0.09 0.22 0.45 -1.64 0.00 0.00 178.16 176.95 2f16 h HIS 62 N 0.10 0.41 -0.20 -3.82 3.86 -0.24 -1.91 115.15 113.34 2f16 h HIS 62 Ca 0.20 0.01 -0.10 0.00 -1.16 0.00 0.00 60.37 59.33 2f16 h HIS 62 Cb 0.29 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 2f16 h HIS 62 CO -0.28 0.24 -0.29 -0.07 0.86 0.00 0.00 177.93 178.39 2f16 h LEU 63 N 0.45 0.40 -0.71 2.43 3.38 -0.55 0.63 115.31 121.34 2f16 h LEU 63 Ca 0.15 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 2f16 h LEU 63 Cb 0.01 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2f16 h LEU 63 CO -0.07 0.68 0.18 -0.08 0.09 0.00 0.00 178.44 179.25 2f16 h GLU 64 N 0.35 1.14 -0.03 1.13 4.81 -0.89 0.18 114.58 121.27 2f16 h GLU 64 Ca 0.05 -0.27 -0.15 0.00 -0.13 0.00 0.00 59.36 58.86 2f16 h GLU 64 Cb 0.69 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.90 2f16 h GLU 64 CO 0.05 1.00 -0.67 1.25 -0.73 0.00 0.00 179.01 179.91 2f16 h LEU 65 N 1.08 0.14 0.02 1.64 5.85 -1.03 -2.02 115.31 120.98 2f16 h LEU 65 Ca 0.23 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 2f16 h LEU 65 Cb 0.36 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.35 2f16 h LEU 65 CO 0.00 0.77 -0.01 0.22 -0.34 0.00 0.00 178.44 179.08 2f16 h TYR 66 N 0.08 -0.02 0.05 1.25 3.20 -0.31 -2.86 116.97 118.36 2f16 h TYR 66 Ca -0.01 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.87 2f16 h TYR 66 Cb 1.19 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 39.45 2f16 h TYR 66 CO 0.01 0.22 -0.12 1.15 -1.64 0.00 0.00 178.16 177.79 2f16 h THR 67 N -0.26 0.72 -1.25 1.81 2.02 -0.61 0.62 112.91 115.96 2f16 h THR 67 Ca -0.00 0.00 0.37 0.00 0.77 0.00 0.00 66.41 67.55 2f16 h THR 67 Cb 0.25 0.72 -0.10 0.00 -1.74 0.00 0.00 68.15 67.28 2f16 h THR 67 CO 0.00 0.00 0.83 0.28 0.37 0.00 0.00 175.52 177.01 2f16 h SER 68 N -0.22 0.25 0.00 4.18 0.02 -1.32 -0.09 113.55 116.38 2f16 h SER 68 Ca 0.03 0.09 -0.34 0.00 -0.84 0.00 0.00 61.79 60.73 2f16 h SER 68 Cb 0.25 0.06 -0.06 0.00 0.14 0.00 0.00 62.40 62.79 2f16 h SER 68 CO -0.08 -0.05 -2.27 0.00 -1.14 0.00 0.00 176.83 173.29 2f16 n GLN 69 N -4.53 0.61 -0.06 3.45 6.02 -0.74 -4.77 117.38 117.37 2f16 n GLN 69 Ca 0.32 0.12 0.02 0.00 -0.01 0.00 0.00 57.00 57.45 2f16 n GLN 69 Cb 1.25 -1.45 0.03 0.00 1.02 0.00 0.00 30.24 31.10 2f16 n GLN 69 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2f16 n TYR 70 N -3.11 0.00 -0.68 1.08 4.02 0.21 -5.11 117.16 113.56 2f16 n TYR 70 Ca -0.39 -0.50 0.00 0.00 -0.01 0.00 0.00 57.90 57.01 2f16 n TYR 70 Cb 0.94 -0.07 -0.00 0.00 -0.02 0.00 0.00 39.34 40.19 2f16 n TYR 70 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2f16 n GLY 72 N -0.60 -2.23 3.63 2.72 0.00 -0.06 -4.88 105.19 103.76 2f16 n GLY 72 Ca 0.04 -1.51 -0.52 0.00 0.00 0.00 0.00 46.02 44.02 2f16 n GLY 72 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2f16 n THR 73 N -0.92 0.08 -2.89 2.61 -1.04 -1.26 -3.83 114.28 107.03 2f16 n THR 73 Ca 0.00 -0.01 -0.32 0.00 -2.04 0.00 0.00 64.05 61.67 2f16 n THR 73 Cb 0.01 -1.02 -0.06 0.00 -1.82 0.00 0.00 70.33 67.45 2f16 n THR 73 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2f16 s PRO 74 N 1.24 4.02 0.74 -2.82 0.04 -1.26 -5.03 135.00 131.94 2f16 s PRO 74 Ca 0.87 0.81 -0.11 0.00 0.04 0.00 0.00 61.00 62.60 2f16 s PRO 74 Cb -0.93 -2.31 0.04 0.00 0.04 0.00 0.00 34.50 31.33 2f16 s PRO 74 CO 0.49 0.01 1.08 -1.54 0.04 0.00 0.00 177.00 177.08 2f16 s SER 75 N -2.50 5.00 0.28 6.66 1.04 -1.26 -4.93 113.70 117.98 2f16 s SER 75 Ca 0.57 1.43 0.03 0.00 0.48 0.00 0.00 55.95 58.46 2f16 s SER 75 Cb -0.10 -2.24 0.40 0.00 0.10 0.00 0.00 66.02 64.17 2f16 s SER 75 CO 0.20 -1.66 1.70 0.74 0.98 0.00 0.00 173.24 175.20 2f16 h THR 76 N -0.87 1.28 -0.58 2.02 2.02 -1.95 -2.02 112.91 112.80 2f16 h THR 76 Ca -0.45 -1.37 0.00 0.00 0.77 0.00 0.00 66.41 65.36 2f16 h THR 76 Cb 1.24 1.46 -0.03 0.00 -1.74 0.00 0.00 68.15 69.08 2f16 h THR 76 CO 0.59 0.43 0.36 -0.08 0.37 0.00 0.00 175.52 177.19 2f16 h GLU 77 N 0.37 0.77 -0.44 6.66 4.81 -1.99 -1.73 114.58 123.04 2f16 h GLU 77 Ca 0.05 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 2f16 h GLU 77 Cb 0.74 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 2f16 h GLU 77 CO 0.06 0.53 -0.10 1.15 -0.73 0.00 0.00 179.01 179.92 2f16 h THR 78 N 0.79 1.27 -0.86 0.32 2.02 -1.74 -1.86 112.91 112.86 2f16 h THR 78 Ca 0.21 -1.21 -0.03 0.00 0.77 0.00 0.00 66.41 66.16 2f16 h THR 78 Cb -0.06 1.15 -0.04 0.00 -1.74 0.00 0.00 68.15 67.46 2f16 h THR 78 CO -0.04 0.41 0.44 0.00 0.37 0.00 0.00 175.52 176.69 2f16 h ALA 79 N 0.87 1.11 -0.25 6.16 0.00 -1.09 -1.73 119.26 124.33 2f16 h ALA 79 Ca 0.11 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 2f16 h ALA 79 Cb 0.63 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2f16 h ALA 79 CO 0.04 0.65 -0.18 0.00 0.00 0.00 0.00 179.25 179.76 2f16 h ALA 80 N 1.24 1.23 -0.58 0.00 0.00 -1.19 -2.20 119.26 117.76 2f16 h ALA 80 Ca 0.30 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2f16 h ALA 80 Cb 0.08 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2f16 h ALA 80 CO -0.04 0.50 0.09 1.03 0.00 0.00 0.00 179.25 180.83 2f16 h SER 81 N 0.39 0.93 -0.38 0.00 0.87 -0.50 0.13 113.55 114.99 2f16 h SER 81 Ca 0.07 -0.26 -0.07 0.00 -1.23 0.00 0.00 61.79 60.29 2f16 h SER 81 Cb 0.55 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 2f16 h SER 81 CO 0.04 0.96 -0.05 0.58 -0.53 0.00 0.00 176.83 177.82 2f16 h VAL 82 N 0.87 1.27 -0.28 2.23 2.07 -1.09 0.61 116.25 121.92 2f16 h VAL 82 Ca 0.18 -1.10 0.00 0.00 0.82 0.00 0.00 66.70 66.60 2f16 h VAL 82 Cb 0.43 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 2f16 h VAL 82 CO 0.01 0.37 0.18 -0.26 0.02 0.00 0.00 177.57 177.89 2f16 h PHE 83 N 0.52 0.36 -0.32 1.57 0.04 -1.25 -1.92 116.94 115.94 2f16 h PHE 83 Ca 0.10 0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.88 2f16 h PHE 83 Cb 0.55 -0.12 -0.02 0.00 2.20 0.00 0.00 35.95 38.56 2f16 h PHE 83 CO 0.04 0.24 0.19 -0.22 -0.60 0.00 0.00 178.31 177.97 2f16 h LYS 84 N 0.38 0.43 -0.70 1.51 3.64 -0.81 0.71 116.57 121.72 2f16 h LYS 84 Ca 0.10 -0.04 0.08 0.00 -1.27 0.00 0.00 60.65 59.53 2f16 h LYS 84 Cb -0.03 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 31.64 2f16 h LYS 84 CO -0.02 0.32 0.36 1.49 -2.27 0.00 0.00 179.45 179.33 2f16 h GLU 85 N 0.41 0.62 -0.08 1.90 4.57 -0.60 0.35 114.58 121.76 2f16 h GLU 85 Ca 0.11 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.23 2f16 h GLU 85 Cb -0.00 -0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 28.45 2f16 h GLU 85 CO -0.02 0.41 -0.05 -0.07 -1.18 0.00 0.00 179.01 178.09 2f16 h LEU 86 N 0.64 0.18 -0.81 1.64 3.38 -0.97 -2.54 115.31 116.83 2f16 h LEU 86 Ca 0.33 -0.45 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 2f16 h LEU 86 Cb 0.30 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 2f16 h LEU 86 CO -0.23 0.59 0.10 0.00 0.09 0.00 0.00 178.44 178.99 2f16 h TYR 88 N 0.94 -0.24 -0.04 0.00 5.03 -0.38 -2.20 116.97 120.07 2f16 h TYR 88 Ca 0.19 -0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.51 2f16 h TYR 88 Cb 0.41 0.08 -0.00 0.00 1.55 0.00 0.00 36.73 38.77 2f16 h TYR 88 CO 0.03 0.12 0.11 1.49 -1.32 0.00 0.00 178.16 178.59 2f16 h GLU 89 N -0.94 0.00 0.00 1.82 4.57 -1.53 -1.83 114.58 116.67 2f16 h GLU 89 Ca -0.03 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.15 2f16 h GLU 89 Cb 0.48 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.06 2f16 h GLU 89 CO 0.04 0.00 -0.36 0.09 -1.18 0.00 0.00 179.01 177.60 2f16 n ASN 90 N -3.36 1.87 -0.26 1.04 3.02 -0.95 -4.81 115.26 111.81 2f16 n ASN 90 Ca -0.02 -3.63 0.20 0.00 -0.03 0.00 0.00 54.58 51.10 2f16 n ASN 90 Cb 0.19 -0.50 0.51 0.00 -0.61 0.00 0.00 39.78 39.37 2f16 n ASN 90 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 2f16 h LYS 91 N 0.70 0.39 0.00 3.52 2.10 -0.66 -1.33 116.57 121.30 2f16 h LYS 91 Ca -0.00 -0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 58.61 2f16 h LYS 91 Cb 1.02 -0.09 -0.00 0.00 -0.90 0.00 0.00 32.23 32.26 2f16 h LYS 91 CO 0.00 0.26 -0.08 -0.44 -2.00 0.00 0.00 179.45 177.19 2f16 h ASP 92 N 0.40 0.00 0.00 7.07 3.45 -1.87 -3.25 116.42 122.22 2f16 h ASP 92 Ca 0.50 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.96 2f16 h ASP 92 Cb 1.27 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 40.03 2f16 h ASP 92 CO -0.20 0.08 -0.12 0.59 -1.57 0.00 0.00 179.24 178.01 2f16 n ASN 94 N -3.30 2.09 -4.14 6.45 3.02 -0.51 -5.04 115.26 113.83 2f16 n ASN 94 Ca -0.01 -3.14 -0.15 0.00 -0.03 0.00 0.00 54.58 51.25 2f16 n ASN 94 Cb 0.27 -0.43 -0.11 0.00 -0.61 0.00 0.00 39.78 38.90 2f16 n ASN 94 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2f16 s LEU 95 N -2.73 2.32 -0.45 3.41 1.43 -1.17 -5.07 118.68 116.43 2f16 s LEU 95 Ca 0.31 -0.67 0.03 0.00 -1.03 0.00 0.00 54.13 52.77 2f16 s LEU 95 Cb 0.28 -0.31 0.16 0.00 0.03 0.00 0.00 46.19 46.34 2f16 s LEU 95 CO 0.01 -0.19 0.33 -0.89 0.23 0.00 0.00 176.35 175.84 2f16 s THR 96 N -1.77 0.85 -0.07 5.49 2.01 -1.26 -4.94 115.64 115.95 2f16 s THR 96 Ca -0.02 -2.73 -0.01 0.00 0.31 0.00 0.00 61.69 59.24 2f16 s THR 96 Cb -0.07 -1.59 0.03 0.00 0.01 0.00 0.00 72.50 70.88 2f16 s THR 96 CO 0.01 -1.11 0.00 0.00 -0.69 0.00 0.00 174.62 172.83 2f16 s ALA 97 N 0.03 0.64 -0.37 7.40 0.00 -1.26 -0.13 121.76 128.08 2f16 s ALA 97 Ca 0.27 -0.08 -0.07 0.00 0.00 0.00 0.00 51.96 52.07 2f16 s ALA 97 Cb -0.06 -0.70 0.05 0.00 0.00 0.00 0.00 23.12 22.42 2f16 s ALA 97 CO -0.13 -0.42 0.16 0.20 0.00 0.00 0.00 175.76 175.57 2f16 s GLY 98 N 1.88 1.89 -0.05 0.00 0.00 0.12 -4.12 107.32 107.04 2f16 s GLY 98 Ca 0.03 -1.90 0.06 0.00 0.00 0.00 0.00 44.72 42.92 2f16 s GLY 98 CO -0.05 0.85 -0.25 -0.42 0.00 0.00 0.00 173.10 173.23 2f16 s ILE 99 N 1.40 2.10 -0.21 0.90 1.01 -0.23 -1.48 121.20 124.69 2f16 s ILE 99 Ca 0.00 -1.06 -0.04 0.00 0.00 0.00 0.00 60.65 59.56 2f16 s ILE 99 Cb -0.21 -1.75 -0.01 0.00 0.01 0.00 0.00 42.46 40.50 2f16 s ILE 99 CO 0.03 0.57 -0.04 -0.63 0.00 0.00 0.00 174.94 174.86 2f16 s ILE 100 N -0.24 3.40 -0.22 2.92 1.01 -0.62 0.18 121.20 127.62 2f16 s ILE 100 Ca -0.01 -0.49 -0.08 0.00 0.00 0.00 0.00 60.65 60.07 2f16 s ILE 100 Cb -0.13 -2.54 -0.04 0.00 0.01 0.00 0.00 42.46 39.76 2f16 s ILE 100 CO 0.03 0.43 0.08 -0.69 0.00 0.00 0.00 174.94 174.79 2f16 s VAL 101 N 1.38 4.66 -0.03 2.92 1.01 0.13 0.13 120.40 130.60 2f16 s VAL 101 Ca 0.05 -0.06 0.03 0.00 0.00 0.00 0.00 61.98 61.99 2f16 s VAL 101 Cb -0.14 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.09 2f16 s VAL 101 CO -0.02 0.38 -0.11 0.00 0.00 0.00 0.00 175.10 175.34 2f16 s ALA 102 N 1.10 1.03 0.05 5.51 0.00 -0.48 -0.50 121.76 128.49 2f16 s ALA 102 Ca 0.05 -0.44 -0.15 0.00 0.00 0.00 0.00 51.96 51.42 2f16 s ALA 102 Cb -0.14 -0.35 0.03 0.00 0.00 0.00 0.00 23.12 22.65 2f16 s ALA 102 CO 0.04 0.18 0.34 0.20 0.00 0.00 0.00 175.76 176.52 2f16 s GLY 103 N 0.10 -0.18 -0.23 0.00 0.00 -0.94 -0.51 107.32 105.56 2f16 s GLY 103 Ca -0.02 0.06 -0.02 0.00 0.00 0.00 0.00 44.72 44.74 2f16 s GLY 103 CO 0.01 -0.17 -0.06 -0.47 0.00 0.00 0.00 173.10 172.40 2f16 s TYR 104 N -2.73 2.99 0.13 1.90 6.14 0.50 -1.50 117.35 124.78 2f16 s TYR 104 Ca -0.04 -1.28 0.07 0.00 0.64 0.00 0.00 57.07 56.46 2f16 s TYR 104 Cb -0.00 -2.07 -0.04 0.00 0.42 0.00 0.00 41.96 40.27 2f16 s TYR 104 CO -0.04 -0.66 -0.08 0.34 0.64 0.00 0.00 175.55 175.75 2f16 s ASP 105 N 1.39 4.47 0.08 4.32 2.15 0.14 -4.85 116.67 124.37 2f16 s ASP 105 Ca 0.03 -0.41 -0.08 0.00 0.43 0.00 0.00 52.55 52.52 2f16 s ASP 105 Cb -0.15 -0.86 -0.24 0.00 -0.30 0.00 0.00 42.92 41.37 2f16 s ASP 105 CO -0.05 0.15 1.17 -0.78 -0.17 0.00 0.00 175.17 175.49 2f16 h ASP 10 N 3.32 0.61 0.31 -0.34 3.58 -1.99 0.42 116.42 122.32 2f16 h ASP 10 Ca -0.48 -0.58 -0.31 0.00 0.42 0.00 0.00 57.03 56.09 2f16 h ASP 10 Cb 1.18 -0.19 0.03 0.00 1.72 0.00 0.00 39.33 42.06 2f16 h ASP 10 CO 0.54 1.41 -1.32 0.50 -2.88 0.00 0.00 179.24 177.49 2f16 h LYS 10 N 0.18 0.50 -0.02 0.28 3.11 -2.05 -3.34 116.57 115.23 2f16 h LYS 10 Ca -0.14 -0.77 0.00 0.00 -2.81 0.00 0.00 60.65 56.93 2f16 h LYS 10 Cb 1.86 0.27 0.00 0.00 -1.00 0.00 0.00 32.23 33.37 2f16 h LYS 10 CO 0.21 1.36 -0.43 0.09 -2.81 0.00 0.00 179.45 177.86 2f16 n ASN 106 N -3.70 2.00 0.00 4.20 3.02 -1.25 -5.07 115.26 114.47 2f16 n ASN 106 Ca -0.13 -1.49 0.00 0.00 -0.03 0.00 0.00 54.58 52.92 2f16 n ASN 106 Cb 1.03 0.42 0.00 0.00 -0.61 0.00 0.00 39.78 40.63 2f16 n ASN 106 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 2f16 n LYS 107 N 0.00 0.00 -3.80 3.52 4.81 0.15 -4.65 118.16 118.20 2f16 n LYS 107 Ca 0.10 0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 57.17 2f16 n LYS 107 Cb 0.47 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.46 2f16 n LYS 107 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 2f16 s GLY 108 N -0.26 2.23 0.05 3.14 0.00 -1.25 0.26 107.32 111.49 2f16 s GLY 108 Ca 0.00 -0.55 0.03 0.00 0.00 0.00 0.00 44.72 44.21 2f16 s GLY 108 CO 0.00 -0.26 -0.11 -0.54 0.00 0.00 0.00 173.10 172.19 2f16 s GLU 109 N -1.03 0.66 -0.06 2.90 2.02 -0.56 -4.93 118.70 117.70 2f16 s GLU 109 Ca 0.17 -0.83 0.00 0.00 0.02 0.00 0.00 54.97 54.33 2f16 s GLU 109 Cb -0.13 -0.53 0.02 0.00 0.10 0.00 0.00 34.13 33.59 2f16 s GLU 109 CO 0.06 0.11 -0.04 0.08 0.02 0.00 0.00 175.26 175.49 2f16 s VAL 110 N -1.31 0.59 -0.11 2.63 1.01 -1.25 -2.21 120.40 119.74 2f16 s VAL 110 Ca -0.06 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 61.84 2f16 s VAL 110 Cb -0.10 -0.64 0.01 0.00 0.00 0.00 0.00 36.38 35.66 2f16 s VAL 110 CO 0.01 0.26 -0.16 -0.31 0.00 0.00 0.00 175.10 174.90 2f16 s TYR 111 N 1.26 2.09 -0.13 5.22 1.51 0.35 -0.75 117.35 126.89 2f16 s TYR 111 Ca -0.05 -0.99 -0.05 0.00 -1.01 0.00 0.00 57.07 54.96 2f16 s TYR 111 Cb -0.14 -1.49 -0.04 0.00 -0.11 0.00 0.00 41.96 40.19 2f16 s TYR 111 CO -0.02 -0.50 0.07 -0.08 -1.11 0.00 0.00 175.55 173.91 2f16 s THR 112 N 0.95 4.85 -0.36 -0.71 -1.32 0.20 0.17 115.64 119.42 2f16 s THR 112 Ca -0.07 -0.03 0.02 0.00 -1.21 0.00 0.00 61.69 60.40 2f16 s THR 112 Cb -0.15 -3.11 0.11 0.00 -1.51 0.00 0.00 72.50 67.84 2f16 s THR 112 CO -0.01 0.57 0.11 -0.63 -2.21 0.00 0.00 174.62 172.44 2f16 s ILE 113 N -0.54 1.68 0.88 5.08 1.09 0.13 -1.01 121.20 128.49 2f16 s ILE 113 Ca 0.11 -2.12 -0.12 0.00 -1.10 0.00 0.00 60.65 57.41 2f16 s ILE 113 Cb -0.12 -2.23 0.15 0.00 -1.06 0.00 0.00 42.46 39.20 2f16 s ILE 113 CO 0.02 -0.69 1.22 -2.16 -0.10 0.00 0.00 174.94 173.24 2f16 s PRO 114 N 0.97 1.17 0.02 2.79 0.04 -1.25 -1.07 135.00 137.69 2f16 s PRO 114 Ca 0.12 -0.39 -0.04 0.00 0.04 0.00 0.00 61.00 60.72 2f16 s PRO 114 Cb -0.20 -1.96 -0.01 0.00 0.04 0.00 0.00 34.50 32.37 2f16 s PRO 114 CO -0.12 -2.02 0.68 1.28 0.04 0.00 0.00 177.00 176.85 2f16 n LEU 115 N -3.48 -0.15 -0.35 -3.56 4.32 -1.26 -1.49 117.00 111.04 2f16 n LEU 115 Ca 0.13 0.71 0.31 0.00 -0.02 0.00 0.00 56.01 57.14 2f16 n LEU 115 Cb 0.60 -0.26 0.57 0.00 -1.62 0.00 0.00 43.42 42.71 2f16 n LEU 115 CO 0.48 -0.43 1.11 1.23 -1.22 0.00 0.00 177.39 178.55 2f16 h GLY 116 N 0.00 2.06 0.00 -0.72 0.00 -1.93 -3.44 103.07 99.03 2f16 h GLY 116 Ca 0.02 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.19 2f16 h GLY 116 CO -0.13 -0.66 0.00 0.61 0.00 0.00 0.00 176.54 176.36 2f16 n GLY 117 N -1.31 1.37 3.85 4.60 0.00 -0.55 -4.49 105.19 108.65 2f16 n GLY 117 Ca 0.36 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.06 2f16 n GLY 117 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2f16 s SER 118 N -2.00 6.61 -0.03 1.61 1.04 -1.26 -4.43 113.70 115.24 2f16 s SER 118 Ca 0.00 1.52 0.03 0.00 0.48 0.00 0.00 55.95 57.97 2f16 s SER 118 Cb 0.00 -2.49 -0.03 0.00 0.10 0.00 0.00 66.02 63.60 2f16 s SER 118 CO 0.00 -0.56 -0.10 -0.69 0.98 0.00 0.00 173.24 172.87 2f16 s VAL 119 N -2.59 3.45 -0.10 5.02 1.01 -1.26 -3.79 120.40 122.13 2f16 s VAL 119 Ca 0.58 -0.68 -0.03 0.00 0.00 0.00 0.00 61.98 61.84 2f16 s VAL 119 Cb -0.10 -2.43 0.05 0.00 0.00 0.00 0.00 36.38 33.90 2f16 s VAL 119 CO 0.31 0.52 0.08 -1.00 0.00 0.00 0.00 175.10 175.02 2f16 s HIS 120 N -0.85 0.09 -0.12 5.22 3.76 -0.18 -4.97 115.29 118.23 2f16 s HIS 120 Ca 0.14 0.03 -0.20 0.00 -0.15 0.00 0.00 55.06 54.88 2f16 s HIS 120 Cb -0.11 -0.55 -0.04 0.00 1.11 0.00 0.00 32.58 32.99 2f16 s HIS 120 CO 0.03 -0.35 0.57 0.21 -0.85 0.00 0.00 174.74 174.35 2f16 s LYS 121 N 2.17 4.33 0.17 1.40 2.20 -1.26 0.59 119.74 129.34 2f16 s LYS 121 Ca 0.04 0.59 -0.07 0.00 -0.36 0.00 0.00 55.97 56.17 2f16 s LYS 121 Cb -0.14 -3.47 -0.02 0.00 -1.51 0.00 0.00 37.83 32.69 2f16 s LYS 121 CO -0.06 0.04 0.24 -0.51 -0.36 0.00 0.00 175.35 174.70 2f16 s LEU 122 N 0.97 1.08 0.17 5.43 1.43 0.07 -4.99 118.68 122.85 2f16 s LEU 122 Ca 0.29 -0.99 -0.12 0.00 -1.03 0.00 0.00 54.13 52.28 2f16 s LEU 122 Cb -0.16 0.99 0.08 0.00 0.03 0.00 0.00 46.19 47.13 2f16 s LEU 122 CO 0.12 -0.88 1.76 -0.65 0.23 0.00 0.00 176.35 176.94 2f16 h PRO 123 N 2.59 0.85 -3.64 1.29 0.11 -1.96 -3.33 132.00 127.90 2f16 h PRO 123 Ca -0.32 -0.12 -0.07 0.00 0.11 0.00 0.00 66.00 65.60 2f16 h PRO 123 Cb 1.23 -0.16 -0.12 0.00 0.11 0.00 0.00 31.00 32.06 2f16 h PRO 123 CO 0.50 0.68 -0.20 1.52 -0.21 0.00 0.00 178.00 180.29 2f16 s TYR 124 N -5.73 0.13 -0.05 0.65 -0.85 -1.26 -1.73 117.35 108.51 2f16 s TYR 124 Ca -0.13 -0.49 -0.13 0.00 -0.52 0.00 0.00 57.07 55.80 2f16 s TYR 124 Cb 0.13 0.11 0.02 0.00 0.38 0.00 0.00 41.96 42.60 2f16 s TYR 124 CO 0.78 -0.74 0.30 0.00 -1.52 0.00 0.00 175.55 174.37 2f16 s ALA 125 N -3.90 -0.75 0.02 9.51 0.00 -0.20 -5.00 121.76 121.43 2f16 s ALA 125 Ca 0.11 0.51 0.04 0.00 0.00 0.00 0.00 51.96 52.62 2f16 s ALA 125 Cb 0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 23.12 22.97 2f16 s ALA 125 CO -0.04 -0.21 -0.13 0.96 0.00 0.00 0.00 175.76 176.34 2f16 s ILE 126 N -0.75 1.00 0.33 0.00 -0.00 -1.26 -1.23 121.20 119.29 2f16 s ILE 126 Ca -0.08 -0.75 -0.10 0.00 -0.00 0.00 0.00 60.65 59.71 2f16 s ILE 126 Cb -0.04 -0.88 0.02 0.00 -0.00 0.00 0.00 42.46 41.56 2f16 s ILE 126 CO 0.03 0.12 0.58 0.00 -0.00 0.00 0.00 174.94 175.66 2f16 s ALA 127 N -0.58 -0.03 0.00 2.27 0.00 -0.10 -4.99 121.76 118.32 2f16 s ALA 127 Ca 0.03 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.92 2f16 s ALA 127 Cb -0.06 0.98 0.00 0.00 0.00 0.00 0.00 23.12 24.04 2f16 s ALA 127 CO 0.00 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 175.30 2f16 n GLY 128 N -0.50 1.60 0.33 0.00 0.00 -1.26 -1.96 105.19 103.39 2f16 n GLY 128 Ca -0.03 -1.83 0.13 0.00 0.00 0.00 0.00 46.02 44.29 2f16 n GLY 128 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2f16 h SER 129 N 0.00 0.51 0.93 1.61 4.64 -1.50 -0.91 113.55 118.83 2f16 h SER 129 Ca 0.00 0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2f16 h SER 129 Cb 0.00 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2f16 h SER 129 CO 0.00 0.10 0.00 0.61 -0.87 0.00 0.00 176.83 176.67 2f16 n GLY 130 N -1.33 -1.38 0.28 -0.77 0.00 -0.69 -3.53 105.19 97.78 2f16 n GLY 130 Ca 0.23 0.01 0.02 0.00 0.00 0.00 0.00 46.02 46.28 2f16 n GLY 130 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2f16 h SER 131 N 0.00 0.40 -0.81 1.61 4.64 -1.33 -2.71 113.55 115.35 2f16 h SER 131 Ca 0.00 -0.05 0.14 0.00 -0.47 0.00 0.00 61.79 61.42 2f16 h SER 131 Cb 0.47 -0.10 -0.06 0.00 -0.31 0.00 0.00 62.40 62.40 2f16 h SER 131 CO 0.00 0.41 0.53 0.71 -0.87 0.00 0.00 176.83 177.61 2f16 h THR 132 N 0.43 0.82 0.00 2.95 1.35 -1.72 -1.20 112.91 115.53 2f16 h THR 132 Ca 0.10 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 2f16 h THR 132 Cb 0.18 0.24 0.00 0.00 -1.73 0.00 0.00 68.15 66.83 2f16 h THR 132 CO -0.00 0.10 0.00 0.49 -0.25 0.00 0.00 175.52 175.85 2f16 n PHE 133 N -4.51 0.77 -0.77 4.73 3.72 -1.02 -3.41 117.46 116.97 2f16 n PHE 133 Ca 0.15 0.27 0.07 0.00 -0.05 0.00 0.00 57.45 57.89 2f16 n PHE 133 Cb 0.50 -0.93 0.16 0.00 -0.94 0.00 0.00 39.48 38.27 2f16 n PHE 133 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 2f16 n ILE 134 N -2.17 1.78 -0.16 4.37 -0.00 -0.46 -4.65 119.36 118.08 2f16 n ILE 134 Ca 0.04 -1.78 -0.08 0.00 -0.00 0.00 0.00 62.75 60.93 2f16 n ILE 134 Cb 0.31 -0.04 0.01 0.00 -0.00 0.00 0.00 39.64 39.92 2f16 n ILE 134 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 176.55 178.43 2f16 h TYR 135 N 0.92 0.64 0.37 4.28 0.05 -1.55 -1.13 116.97 120.55 2f16 h TYR 135 Ca 0.00 -0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.74 2f16 h TYR 135 Cb 1.05 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 38.59 2f16 h TYR 135 CO 0.21 0.49 -0.18 0.78 -1.05 0.00 0.00 178.16 178.41 2f16 h GLY 136 N 0.61 -0.52 0.15 3.88 0.00 -1.85 -2.07 103.07 103.26 2f16 h GLY 136 Ca 0.16 0.19 0.01 0.00 0.00 0.00 0.00 47.33 47.70 2f16 h GLY 136 CO -0.03 -0.19 -0.49 -1.82 0.00 0.00 0.00 176.54 174.01 2f16 h TYR 137 N -0.67 -1.42 -0.89 5.60 3.20 -1.84 -1.34 116.97 119.61 2f16 h TYR 137 Ca -0.05 0.03 0.11 0.00 3.14 0.00 0.00 58.73 61.97 2f16 h TYR 137 Cb 0.48 0.60 -0.08 0.00 1.54 0.00 0.00 36.73 39.27 2f16 h TYR 137 CO -0.01 -0.56 0.52 0.00 -1.64 0.00 0.00 178.16 176.47 2f16 h ASP 139 N 0.83 0.35 0.76 0.00 1.82 -1.04 -1.66 116.42 117.48 2f16 h ASP 139 Ca 0.45 -0.10 -0.25 0.00 -0.39 0.00 0.00 57.03 56.74 2f16 h ASP 139 Cb 0.47 -0.09 -0.01 0.00 0.68 0.00 0.00 39.33 40.37 2f16 h ASP 139 CO -0.28 0.56 -1.17 0.11 -1.61 0.00 0.00 179.24 176.85 2f16 h LYS 140 N 0.33 0.16 -0.02 0.28 1.79 -0.06 -3.37 116.57 115.69 2f16 h LYS 140 Ca 0.06 -0.27 0.00 0.00 -2.18 0.00 0.00 60.65 58.25 2f16 h LYS 140 Cb 0.52 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.27 2f16 h LYS 140 CO 0.03 1.12 -0.42 0.09 -1.08 0.00 0.00 179.45 179.19 2f16 n ASN 141 N -3.45 2.08 -4.76 0.86 4.13 0.08 -4.97 115.26 109.23 2f16 n ASN 141 Ca -0.06 -1.54 -0.40 0.00 1.68 0.00 0.00 54.58 54.27 2f16 n ASN 141 Cb 0.99 0.41 -0.06 0.00 -1.54 0.00 0.00 39.78 39.59 2f16 n ASN 141 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 2f16 s PHE 142 N -2.43 3.86 0.02 3.10 5.36 -0.64 -5.05 117.98 122.21 2f16 s PHE 142 Ca 0.20 1.65 0.01 0.00 -0.96 0.00 0.00 56.93 57.84 2f16 s PHE 142 Cb 0.18 -2.85 -0.02 0.00 -0.34 0.00 0.00 43.02 40.00 2f16 s PHE 142 CO 0.54 0.41 -0.05 1.03 -1.46 0.00 0.00 175.22 175.69 2f16 s ARG 143 N -0.72 0.40 0.47 10.12 0.52 -1.26 -5.03 118.95 123.45 2f16 s ARG 143 Ca 0.39 -0.49 -0.17 0.00 -0.52 0.00 0.00 55.73 54.93 2f16 s ARG 143 Cb -0.23 -0.22 -0.09 0.00 0.52 0.00 0.00 34.95 34.94 2f16 s ARG 143 CO 0.27 0.04 0.95 -1.21 0.02 0.00 0.00 175.30 175.37 2f16 s GLU 144 N -0.99 4.02 -1.18 3.54 2.02 -1.26 -4.12 118.70 120.72 2f16 s GLU 144 Ca -0.07 0.95 -0.07 0.00 0.02 0.00 0.00 54.97 55.80 2f16 s GLU 144 Cb -0.07 -2.18 0.01 0.00 0.10 0.00 0.00 34.13 31.99 2f16 s GLU 144 CO -0.00 -0.16 0.90 0.09 0.02 0.00 0.00 175.26 176.11 2f16 n ASN 145 N -1.24 -5.66 -4.53 -0.19 5.03 -1.26 -4.94 115.26 102.47 2f16 n ASN 145 Ca 0.06 -0.41 -0.29 0.00 0.87 0.00 0.00 54.58 54.81 2f16 n ASN 145 Cb 0.54 -4.32 0.16 0.00 -1.02 0.00 0.00 39.78 35.14 2f16 n ASN 145 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 2f16 s MET 146 N -5.99 0.70 0.34 3.52 -1.94 -1.26 -4.29 119.30 110.38 2f16 s MET 146 Ca 0.45 0.11 0.00 0.00 -1.71 0.00 0.00 55.69 54.54 2f16 s MET 146 Cb -0.20 -1.80 -0.03 0.00 2.01 0.00 0.00 34.83 34.80 2f16 s MET 146 CO 0.55 -2.46 0.54 -1.54 -0.01 0.00 0.00 175.02 172.10 2f16 s SER 147 N -4.17 6.30 0.28 3.03 1.04 -1.26 -1.71 113.70 117.22 2f16 s SER 147 Ca 0.67 0.44 0.02 0.00 0.48 0.00 0.00 55.95 57.56 2f16 s SER 147 Cb -0.12 -2.03 0.68 0.00 0.10 0.00 0.00 66.02 64.65 2f16 s SER 147 CO 0.54 -0.28 1.70 0.50 0.98 0.00 0.00 173.24 176.68 2f16 h LYS 148 N 0.81 0.41 -0.45 4.02 3.64 -1.98 0.25 116.57 123.26 2f16 h LYS 148 Ca -0.50 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 58.80 2f16 h LYS 148 Cb 1.22 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.93 2f16 h LYS 148 CO 0.62 0.27 0.07 0.93 -2.27 0.00 0.00 179.45 179.07 2f16 h GLU 149 N 0.42 0.75 -0.51 1.90 5.08 -1.99 0.44 114.58 120.68 2f16 h GLU 149 Ca 0.53 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.67 2f16 h GLU 149 Cb 0.98 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.12 2f16 h GLU 149 CO -0.50 0.77 0.24 0.93 -1.00 0.00 0.00 179.01 179.45 2f16 h GLU 150 N 0.62 0.73 0.21 2.33 5.08 -1.42 -1.92 114.58 120.19 2f16 h GLU 150 Ca 0.14 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2f16 h GLU 150 Cb 0.39 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2f16 h GLU 150 CO 0.01 0.61 -0.10 1.15 -1.00 0.00 0.00 179.01 179.68 2f16 h THR 151 N 0.67 0.86 -0.75 1.13 2.02 -0.42 0.35 112.91 116.78 2f16 h THR 151 Ca 0.17 -0.35 0.15 0.00 0.77 0.00 0.00 66.41 67.15 2f16 h THR 151 Cb 0.12 1.07 -0.05 0.00 -1.74 0.00 0.00 68.15 67.56 2f16 h THR 151 CO -0.02 0.08 0.50 0.58 0.37 0.00 0.00 175.52 177.03 2f16 h VAL 152 N -0.45 0.78 -0.18 3.16 2.07 -0.86 0.20 116.25 120.98 2f16 h VAL 152 Ca -0.03 -0.13 -0.20 0.00 0.82 0.00 0.00 66.70 67.16 2f16 h VAL 152 Cb 0.34 0.37 0.01 0.00 -1.52 0.00 0.00 31.29 30.49 2f16 h VAL 152 CO 0.05 0.07 -0.67 0.44 0.02 0.00 0.00 177.57 177.47 2f16 h ASP 153 N 0.38 0.90 0.38 0.57 3.45 -0.90 -0.81 116.42 120.39 2f16 h ASP 153 Ca 0.37 -0.61 -0.02 0.00 0.43 0.00 0.00 57.03 57.20 2f16 h ASP 153 Cb 0.89 -0.26 0.00 0.00 -0.56 0.00 0.00 39.33 39.39 2f16 h ASP 153 CO -0.11 1.36 -0.18 0.15 -1.57 0.00 0.00 179.24 178.88 2f16 h PHE 154 N 0.50 -0.47 -0.59 4.55 3.57 0.50 -0.48 116.94 124.52 2f16 h PHE 154 Ca -0.03 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.48 2f16 h PHE 154 Cb 1.30 0.16 -0.04 0.00 2.79 0.00 0.00 35.95 40.16 2f16 h PHE 154 CO 0.09 -0.29 0.36 0.82 -2.23 0.00 0.00 178.31 177.06 2f16 h ILE 155 N -0.51 1.06 -0.90 1.41 2.04 -1.05 -0.97 117.51 118.60 2f16 h ILE 155 Ca -0.05 -0.24 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 2f16 h ILE 155 Cb 0.39 0.30 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 2f16 h ILE 155 CO 0.09 0.13 0.51 0.50 0.00 0.00 0.00 178.15 179.37 2f16 h LYS 156 N 0.71 1.24 -0.01 2.37 3.64 -0.85 -1.34 116.57 122.33 2f16 h LYS 156 Ca 0.24 -0.13 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 2f16 h LYS 156 Cb 0.03 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 31.60 2f16 h LYS 156 CO -0.10 0.89 -0.11 0.45 -2.27 0.00 0.00 179.45 178.31 2f16 h HIS 157 N 1.25 0.12 -0.26 1.91 3.86 -0.88 -2.72 115.15 118.43 2f16 h HIS 157 Ca 0.32 -0.06 0.06 0.00 -1.16 0.00 0.00 60.37 59.53 2f16 h HIS 157 Cb -0.00 -0.02 -0.07 0.00 1.06 0.00 0.00 27.41 28.38 2f16 h HIS 157 CO 0.01 0.81 -0.20 0.77 0.86 0.00 0.00 177.93 180.18 2f16 h SER 158 N -0.60 -0.66 -0.14 2.45 0.02 -1.09 -2.21 113.55 111.31 2f16 h SER 158 Ca -0.01 0.13 -0.10 0.00 -0.84 0.00 0.00 61.79 60.97 2f16 h SER 158 Cb 0.83 0.33 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 2f16 h SER 158 CO 0.02 -0.24 -0.22 -0.07 -1.14 0.00 0.00 176.83 175.18 2f16 h LEU 159 N -0.19 0.58 -1.49 5.07 3.38 -1.35 -1.93 115.31 119.37 2f16 h LEU 159 Ca 0.14 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 2f16 h LEU 159 Cb 0.41 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2f16 h LEU 159 CO -0.38 0.80 -0.26 0.77 0.09 0.00 0.00 178.44 179.47 2f16 h SER 160 N 0.52 0.00 -0.14 -0.43 4.64 -1.12 0.38 113.55 117.39 2f16 h SER 160 Ca 0.08 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.24 2f16 h SER 160 Cb 0.67 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.76 2f16 h SER 160 CO 0.05 0.26 -0.53 1.56 -0.87 0.00 0.00 176.83 177.30 2f16 h GLN 161 N 0.00 0.60 -0.36 4.77 1.08 -1.00 -1.08 115.11 119.13 2f16 h GLN 161 Ca -0.00 -0.46 -0.00 0.00 -1.45 0.00 0.00 58.65 56.73 2f16 h GLN 161 Cb 0.51 0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 28.01 2f16 h GLN 161 CO 0.03 1.09 0.21 0.00 -0.95 0.00 0.00 178.83 179.21 2f16 h ALA 162 N 0.52 0.45 -0.22 3.87 0.00 -0.65 -1.78 119.26 121.46 2f16 h ALA 162 Ca -0.03 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2f16 h ALA 162 Cb 1.16 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 2f16 h ALA 162 CO 0.11 -0.04 0.00 0.82 0.00 0.00 0.00 179.25 180.14 2f16 h ILE 163 N 0.46 1.14 -0.50 0.00 5.03 -0.25 -0.50 117.51 122.89 2f16 h ILE 163 Ca 0.13 -0.54 -0.07 0.00 -0.12 0.00 0.00 64.86 64.26 2f16 h ILE 163 Cb 0.02 0.98 -0.02 0.00 -3.03 0.00 0.00 36.82 34.77 2f16 h ILE 163 CO -0.02 0.18 0.05 0.50 -0.68 0.00 0.00 178.15 178.18 2f16 h LYS 164 N 0.32 0.84 0.06 2.37 3.64 -0.35 -3.34 116.57 120.11 2f16 h LYS 164 Ca 0.07 -0.24 -0.35 0.00 -1.27 0.00 0.00 60.65 58.86 2f16 h LYS 164 Cb 0.22 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.91 2f16 h LYS 164 CO 0.00 0.85 -2.03 0.91 -2.27 0.00 0.00 179.45 176.91 2f16 n TRP 165 N -4.38 0.88 -3.04 1.91 7.02 -0.87 -4.88 117.44 114.09 2f16 n TRP 165 Ca 0.01 0.23 -0.42 0.00 -1.02 0.00 0.00 57.50 56.30 2f16 n TRP 165 Cb 0.28 -1.13 -0.06 0.00 -2.42 0.00 0.00 31.31 27.98 2f16 n TRP 165 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 2f16 s ASP 166 N -6.57 6.50 0.50 -0.99 2.15 -0.21 -4.93 116.67 113.12 2f16 s ASP 166 Ca -0.19 0.29 0.34 0.00 0.43 0.00 0.00 52.55 53.42 2f16 s ASP 166 Cb 0.07 -2.36 1.58 0.00 -0.30 0.00 0.00 42.92 41.91 2f16 s ASP 166 CO 0.76 -0.64 2.01 1.23 -0.17 0.00 0.00 175.17 178.36 2f16 h GLY 167 N 9.51 0.00 1.75 2.66 0.00 -1.87 -1.62 103.07 113.51 2f16 h GLY 167 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2f16 h GLY 167 CO 0.87 0.00 -0.02 1.44 0.00 0.00 0.00 176.54 178.83 2f16 n SER 168 N -2.84 0.04 -4.55 0.19 7.64 -1.26 -4.79 113.62 108.05 2f16 n SER 168 Ca -0.00 0.18 -0.30 0.00 1.01 0.00 0.00 58.87 59.75 2f16 n SER 168 Cb 0.20 -0.37 -0.11 0.00 -1.01 0.00 0.00 64.21 62.92 2f16 n SER 168 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2f16 s SER 169 N -2.81 4.31 0.00 6.43 0.01 -0.61 -2.42 113.70 118.60 2f16 s SER 169 Ca 0.20 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.10 2f16 s SER 169 Cb 0.19 -0.83 0.00 0.00 0.21 0.00 0.00 66.02 65.60 2f16 s SER 169 CO 0.51 0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.98 2f16 n GLY 170 N 1.02 -1.44 4.84 3.44 0.00 -1.26 -4.81 105.19 106.98 2f16 n GLY 170 Ca -0.14 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.75 2f16 n GLY 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f16 n GLY 171 N -0.06 1.28 3.69 -0.02 0.00 -1.26 -1.35 105.19 107.46 2f16 n GLY 171 Ca 0.00 -0.77 -0.24 0.00 0.00 0.00 0.00 46.02 45.00 2f16 n GLY 171 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2f16 s VAL 172 N 0.00 3.80 -0.17 1.61 -7.23 -1.26 -4.23 120.40 112.92 2f16 s VAL 172 Ca 0.00 -1.59 -0.12 0.00 -1.81 0.00 0.00 61.98 58.46 2f16 s VAL 172 Cb 0.00 -2.99 -0.05 0.00 0.56 0.00 0.00 36.38 33.90 2f16 s VAL 172 CO 0.00 -0.26 0.22 -0.63 -0.31 0.00 0.00 175.10 174.12 2f16 s ILE 173 N -2.04 5.35 0.06 -0.62 1.01 -0.20 -2.74 121.20 122.01 2f16 s ILE 173 Ca 0.30 0.39 0.06 0.00 0.00 0.00 0.00 60.65 61.41 2f16 s ILE 173 Cb -0.08 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.80 2f16 s ILE 173 CO 0.21 0.42 -0.12 -0.13 0.00 0.00 0.00 174.94 175.31 2f16 s ARG 174 N 0.33 2.19 0.05 2.79 0.52 -0.18 -0.60 118.95 124.05 2f16 s ARG 174 Ca 0.13 -0.94 -0.00 0.00 -0.52 0.00 0.00 55.73 54.39 2f16 s ARG 174 Cb -0.12 -2.30 -0.04 0.00 0.52 0.00 0.00 34.95 33.01 2f16 s ARG 174 CO 0.02 0.54 -0.04 -1.64 0.02 0.00 0.00 175.30 174.20 2f16 s MET 175 N -1.74 0.57 -0.06 3.54 -1.94 0.21 -1.52 119.30 118.36 2f16 s MET 175 Ca 0.18 -1.09 -0.03 0.00 -1.71 0.00 0.00 55.69 53.05 2f16 s MET 175 Cb -0.11 0.12 0.04 0.00 2.01 0.00 0.00 34.83 36.89 2f16 s MET 175 CO 0.09 -0.08 0.10 0.08 -0.01 0.00 0.00 175.02 175.20 2f16 s VAL 176 N -3.26 -0.17 -0.20 -6.03 1.01 0.07 -0.97 120.40 110.85 2f16 s VAL 176 Ca 0.02 0.39 -0.11 0.00 0.00 0.00 0.00 61.98 62.27 2f16 s VAL 176 Cb 0.03 -0.21 -0.05 0.00 0.00 0.00 0.00 36.38 36.15 2f16 s VAL 176 CO -0.07 0.16 0.19 -0.69 0.00 0.00 0.00 175.10 174.69 2f16 s VAL 177 N 2.17 5.36 -0.25 2.92 1.01 0.14 -0.96 120.40 130.79 2f16 s VAL 177 Ca 0.03 0.29 0.01 0.00 0.00 0.00 0.00 61.98 62.32 2f16 s VAL 177 Cb -0.12 -3.53 0.05 0.00 0.00 0.00 0.00 36.38 32.78 2f16 s VAL 177 CO -0.04 0.39 -0.11 -0.76 0.00 0.00 0.00 175.10 174.58 2f16 s LEU 178 N 0.66 3.23 0.33 3.92 1.02 0.10 -1.65 118.68 126.29 2f16 s LEU 178 Ca 0.10 -1.17 -0.01 0.00 0.02 0.00 0.00 54.13 53.07 2f16 s LEU 178 Cb -0.12 -1.57 -0.01 0.00 0.02 0.00 0.00 46.19 44.51 2f16 s LEU 178 CO 0.02 -0.16 0.42 0.42 0.02 0.00 0.00 176.35 177.07 2f16 s THR 179 N 1.19 0.00 0.48 5.49 -4.23 -0.91 -1.74 115.64 115.91 2f16 s THR 179 Ca -0.05 -1.68 0.14 0.00 -1.18 0.00 0.00 61.69 58.92 2f16 s THR 179 Cb -0.18 -2.58 0.24 0.00 1.34 0.00 0.00 72.50 71.32 2f16 s THR 179 CO -0.06 0.00 2.08 0.00 -0.54 0.00 0.00 174.62 176.11 2f16 h ALA 180 N 2.15 1.85 0.00 3.99 0.00 -1.95 -0.12 119.26 125.19 2f16 h ALA 180 Ca -0.28 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 2f16 h ALA 180 Cb 1.24 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 2f16 h ALA 180 CO 0.39 0.11 -0.09 0.00 0.00 0.00 0.00 179.25 179.66 2f16 h ALA 181 N 1.90 1.36 0.00 0.00 0.00 -1.95 -3.48 119.26 117.08 2f16 h ALA 181 Ca 0.02 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2f16 h ALA 181 Cb 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2f16 h ALA 181 CO 0.00 0.11 0.00 0.41 0.00 0.00 0.00 179.25 179.77 2f16 n GLY 183 N -0.86 0.53 3.25 0.00 0.00 -0.06 -5.07 105.19 102.98 2f16 n GLY 183 Ca -0.02 -1.68 -0.32 0.00 0.00 0.00 0.00 46.02 44.00 2f16 n GLY 183 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f16 s VAL 184 N -2.78 2.17 -0.04 1.61 1.01 -1.26 -2.14 120.40 118.97 2f16 s VAL 184 Ca 0.00 -0.99 0.03 0.00 0.00 0.00 0.00 61.98 61.02 2f16 s VAL 184 Cb 0.00 -1.83 0.01 0.00 0.00 0.00 0.00 36.38 34.56 2f16 s VAL 184 CO 0.00 0.56 -0.12 -0.70 0.00 0.00 0.00 175.10 174.84 2f16 s GLU 185 N 0.25 1.40 -0.19 2.72 2.12 -0.66 -4.97 118.70 119.37 2f16 s GLU 185 Ca -0.15 -0.40 -0.09 0.00 0.36 0.00 0.00 54.97 54.68 2f16 s GLU 185 Cb -0.17 -1.22 -0.05 0.00 0.26 0.00 0.00 34.13 32.95 2f16 s GLU 185 CO 0.08 0.10 0.11 1.03 -0.54 0.00 0.00 175.26 176.04 2f16 s ARG 186 N 0.36 4.12 0.07 4.30 1.81 -1.26 0.26 118.95 128.61 2f16 s ARG 186 Ca -0.08 -0.25 0.08 0.00 -1.72 0.00 0.00 55.73 53.77 2f16 s ARG 186 Cb -0.12 -3.36 -0.03 0.00 -0.45 0.00 0.00 34.95 30.99 2f16 s ARG 186 CO 0.02 0.30 -0.23 -0.51 -0.68 0.00 0.00 175.30 174.21 2f16 s LEU 187 N 0.33 2.23 -0.02 2.53 1.43 -0.14 -4.98 118.68 120.06 2f16 s LEU 187 Ca 0.07 -0.62 -0.01 0.00 -1.03 0.00 0.00 54.13 52.54 2f16 s LEU 187 Cb -0.11 -1.04 0.02 0.00 0.03 0.00 0.00 46.19 45.09 2f16 s LEU 187 CO -0.01 0.15 0.04 -0.51 0.23 0.00 0.00 176.35 176.24 2f16 s ILE 18 N -0.95 -0.03 -0.07 -0.59 2.07 -1.26 -0.62 121.20 119.74 2f16 s ILE 18 Ca 0.09 0.12 0.02 0.00 -1.41 0.00 0.00 60.65 59.46 2f16 s ILE 18 Cb -0.10 -0.07 0.01 0.00 0.13 0.00 0.00 42.46 42.44 2f16 s ILE 18 CO 0.03 0.05 -0.12 -0.36 -1.91 0.00 0.00 174.94 172.63 2f16 s PHE 18 N 0.60 1.49 0.43 3.50 0.08 0.23 -4.98 117.98 119.33 2f16 s PHE 18 Ca -0.05 -0.58 -0.03 0.00 0.12 0.00 0.00 56.93 56.39 2f16 s PHE 18 Cb -0.07 -1.11 -0.04 0.00 -0.57 0.00 0.00 43.02 41.24 2f16 s PHE 18 CO -0.02 -0.31 0.69 0.71 -0.10 0.00 0.00 175.22 176.19 2f16 s TYR 18 N 0.79 3.54 0.17 0.36 2.02 -1.26 -1.04 117.35 121.93 2f16 s TYR 18 Ca -0.12 0.64 -0.24 0.00 -0.37 0.00 0.00 57.07 56.98 2f16 s TYR 18 Cb -0.15 -2.15 0.06 0.00 -0.40 0.00 0.00 41.96 39.32 2f16 s TYR 18 CO 0.02 -0.12 1.58 -1.35 -1.57 0.00 0.00 175.55 174.11 2f16 h PRO 18 N 0.48 -0.22 0.00 -1.71 0.11 -1.98 0.21 132.00 128.88 2f16 h PRO 18 Ca -0.48 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2f16 h PRO 18 Cb 1.21 0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2f16 h PRO 18 CO 0.62 -0.15 0.53 -0.44 -0.21 0.00 0.00 178.00 178.35 2f16 h ASP 18 N -0.23 0.00 0.00 -2.05 3.32 -1.95 -1.01 116.42 114.50 2f16 h ASP 18 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 2f16 h ASP 18 Cb 0.56 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.11 2f16 h ASP 18 CO -0.64 0.00 -0.15 1.21 -1.72 0.00 0.00 179.24 177.93 2f16 n GLU 18 N -2.73 0.11 0.29 3.56 2.13 0.04 -4.59 120.64 119.45 2f16 n GLU 18 Ca -0.01 0.21 0.18 0.00 0.66 0.00 0.00 57.16 58.20 2f16 n GLU 18 Cb 0.56 -0.87 0.87 0.00 0.27 0.00 0.00 31.44 32.28 2f16 n GLU 18 CO 0.00 0.00 0.00 0.10 -0.41 0.00 0.00 177.13 176.82 2f16 h TYR 18 N -0.22 0.00 0.00 4.31 -0.00 -1.39 -2.92 116.97 116.75 2f16 h TYR 18 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 58.73 58.70 2f16 h TYR 18 Cb 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 36.88 2f16 h TYR 18 CO -0.07 0.04 -0.16 0.93 -0.00 0.00 0.00 178.16 178.90 2f16 h GLU 18 N 0.00 0.00 -0.68 0.10 5.08 -1.44 -2.77 114.58 114.87 2f16 h GLU 18 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2f16 h GLU 18 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 2f16 h GLU 18 CO 0.01 0.16 0.00 0.94 -1.00 0.00 0.00 179.01 179.12 2f16 n GLN 18 N -3.69 2.96 0.00 2.33 -0.06 -1.10 -5.12 117.38 112.71 2f16 n GLN 18 Ca -0.02 -2.66 0.09 0.00 -2.00 0.00 0.00 57.00 52.41 2f16 n GLN 18 Cb 0.28 -1.61 0.51 0.00 -4.06 0.00 0.00 30.24 25.36 2f16 n GLN 18 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14