#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bvu s PRO 5 N 0.00 3.68 0.40 7.34 0.05 -1.26 -4.82 135.00 140.39 2bvu s PRO 5 Ca 0.00 1.70 -0.27 0.00 0.05 0.00 0.00 61.00 62.48 2bvu s PRO 5 Cb 0.00 -2.30 -0.09 0.00 0.05 0.00 0.00 34.50 32.16 2bvu s PRO 5 CO 0.00 -0.59 1.37 -2.14 0.05 0.00 0.00 177.00 175.69 2bvu s PRO 6 N -2.86 4.00 1.25 0.56 0.02 -1.26 -4.95 135.00 131.77 2bvu s PRO 6 Ca 0.66 2.32 -0.21 0.00 0.02 0.00 0.00 61.00 63.79 2bvu s PRO 6 Cb -0.26 -2.84 0.31 0.00 0.02 0.00 0.00 34.50 31.73 2bvu s PRO 6 CO 0.31 -0.52 1.11 0.20 -0.33 0.00 0.00 177.00 177.78 2bvu s GLY 7 N -0.51 1.59 0.61 0.52 0.00 -1.26 -5.03 107.32 103.25 2bvu s GLY 7 Ca 0.55 -1.08 -0.02 0.00 0.00 0.00 0.00 44.72 44.18 2bvu s GLY 7 CO 0.55 -0.13 0.87 -0.35 0.00 0.00 0.00 173.10 174.04 2bvu s ASP 8 N -3.99 5.07 0.26 1.64 -1.08 -1.26 -4.84 116.67 112.47 2bvu s ASP 8 Ca 0.72 0.16 0.11 0.00 -0.52 0.00 0.00 52.55 53.01 2bvu s ASP 8 Cb -0.08 -0.94 -0.05 0.00 -1.46 0.00 0.00 42.92 40.40 2bvu s ASP 8 CO 0.56 -1.34 -0.11 0.27 0.52 0.00 0.00 175.17 175.07 2bvu s ILE 9 N -2.96 2.95 -0.05 4.11 -4.36 -1.26 -1.47 121.20 118.16 2bvu s ILE 9 Ca 0.59 -2.11 -0.00 0.00 -0.26 0.00 0.00 60.65 58.87 2bvu s ILE 9 Cb -0.10 -2.55 -0.03 0.00 1.25 0.00 0.00 42.46 41.02 2bvu s ILE 9 CO 0.41 -0.35 -0.01 0.20 0.24 0.00 0.00 174.94 175.44 2bvu s ASN 10 N -3.47 5.12 0.07 4.36 0.01 -0.19 -4.79 114.94 116.06 2bvu s ASN 10 Ca 0.30 0.07 0.07 0.00 -0.71 0.00 0.00 52.86 52.59 2bvu s ASN 10 Cb -0.06 -1.39 -0.03 0.00 0.41 0.00 0.00 41.25 40.18 2bvu s ASN 10 CO 0.17 0.34 -0.20 0.42 -1.51 0.00 0.00 177.10 176.32 2bvu s THR 11 N -0.96 1.62 -0.13 1.60 -4.23 -1.26 -0.16 115.64 112.12 2bvu s THR 11 Ca 0.16 -1.37 0.01 0.00 -1.18 0.00 0.00 61.69 59.31 2bvu s THR 11 Cb -0.11 -1.45 0.02 0.00 1.34 0.00 0.00 72.50 72.30 2bvu s THR 11 CO 0.05 0.03 -0.13 -1.10 -0.54 0.00 0.00 174.62 172.93 2bvu s GLN 12 N -1.58 2.13 0.94 3.99 -0.21 -0.25 -3.03 119.66 121.65 2bvu s GLN 12 Ca 0.06 -0.51 -0.12 0.00 0.02 0.00 0.00 55.36 54.81 2bvu s GLN 12 Cb -0.09 -1.92 0.16 0.00 1.00 0.00 0.00 33.01 32.15 2bvu s GLN 12 CO 0.03 -0.17 1.09 -1.25 -2.12 0.00 0.00 175.29 172.87 2bvu s PRO 13 N 1.31 0.87 -0.09 2.91 0.04 -1.26 -0.56 135.00 138.22 2bvu s PRO 13 Ca 0.00 0.70 -0.16 0.00 0.04 0.00 0.00 61.00 61.57 2bvu s PRO 13 Cb -0.14 -1.77 -0.28 0.00 0.04 0.00 0.00 34.50 32.35 2bvu s PRO 13 CO -0.07 -2.47 0.62 0.66 0.04 0.00 0.00 177.00 175.78 2bvu h SER 14 N -1.71 0.41 0.00 6.66 4.64 -1.96 -3.42 113.55 118.17 2bvu h SER 14 Ca -0.52 -0.87 -0.01 0.00 -0.47 0.00 0.00 61.79 59.92 2bvu h SER 14 Cb 1.30 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2bvu h SER 14 CO 0.56 1.60 -1.26 0.00 -0.87 0.00 0.00 176.83 176.85 2bvu n GLN 15 N -3.93 0.49 -3.64 4.77 10.64 -1.26 -4.84 117.38 119.60 2bvu n GLN 15 Ca -0.23 -0.04 0.01 0.00 -1.83 0.00 0.00 57.00 54.90 2bvu n GLN 15 Cb 0.90 -1.13 -0.01 0.00 -0.86 0.00 0.00 30.24 29.15 2bvu n GLN 15 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.06 173.64 2bvu s LYS 16 N -2.35 0.52 -0.05 2.61 -2.85 -1.26 -4.15 119.74 112.21 2bvu s LYS 16 Ca -0.02 -0.28 0.01 0.00 -1.00 0.00 0.00 55.97 54.68 2bvu s LYS 16 Cb 0.03 0.18 0.02 0.00 -2.06 0.00 0.00 37.83 36.00 2bvu s LYS 16 CO 0.22 -0.24 -0.07 -1.50 0.10 0.00 0.00 175.35 173.87 2bvu s ILE 17 N -2.55 0.72 -0.09 3.79 1.10 -0.66 -4.70 121.20 118.81 2bvu s ILE 17 Ca 0.14 -0.24 0.03 0.00 -0.51 0.00 0.00 60.65 60.07 2bvu s ILE 17 Cb 0.04 -0.71 -0.01 0.00 0.15 0.00 0.00 42.46 41.93 2bvu s ILE 17 CO -0.03 0.26 -0.20 -0.69 -2.11 0.00 0.00 174.94 172.17 2bvu s VAL 18 N 0.82 2.43 -0.09 4.00 1.01 -1.26 -0.91 120.40 126.41 2bvu s VAL 18 Ca -0.12 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 60.96 2bvu s VAL 18 Cb -0.15 -1.95 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 2bvu s VAL 18 CO 0.01 0.55 -0.10 -0.36 0.00 0.00 0.00 175.10 175.21 2bvu s PHE 19 N 0.13 2.85 -0.15 5.22 0.08 -0.36 -4.96 117.98 120.79 2bvu s PHE 19 Ca -0.10 -0.21 -0.07 0.00 0.12 0.00 0.00 56.93 56.67 2bvu s PHE 19 Cb -0.16 -1.74 -0.04 0.00 -0.57 0.00 0.00 43.02 40.51 2bvu s PHE 19 CO 0.06 0.13 0.10 -0.80 -0.10 0.00 0.00 175.22 174.61 2bvu s ASN 20 N -0.41 6.02 0.78 1.36 0.01 -1.26 -0.39 114.94 121.05 2bvu s ASN 20 Ca 0.05 0.28 -0.14 0.00 -0.71 0.00 0.00 52.86 52.34 2bvu s ASN 20 Cb -0.12 -1.97 0.04 0.00 0.41 0.00 0.00 41.25 39.60 2bvu s ASN 20 CO 0.02 0.29 0.96 0.00 -1.51 0.00 0.00 177.10 176.86 2bvu n ALA 21 N 2.74 -0.55 -1.79 0.60 0.00 -0.46 -4.60 120.51 116.45 2bvu n ALA 21 Ca -0.18 -0.30 -0.35 0.00 0.00 0.00 0.00 53.44 52.61 2bvu n ALA 21 Cb 0.53 -2.11 -0.06 0.00 0.00 0.00 0.00 19.45 17.82 2bvu n ALA 21 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2bvu s PRO 22 N -3.63 4.32 -0.31 0.00 0.04 -1.26 -5.04 135.00 129.13 2bvu s PRO 22 Ca 0.71 1.32 0.11 0.00 0.04 0.00 0.00 61.00 63.17 2bvu s PRO 22 Cb -0.31 -2.50 0.71 0.00 0.04 0.00 0.00 34.50 32.44 2bvu s PRO 22 CO 0.53 0.03 1.74 0.66 0.04 0.00 0.00 177.00 180.00 2bvu n TYR 23 N -0.06 2.19 1.13 0.56 4.01 -1.26 -4.33 117.16 119.39 2bvu n TYR 23 Ca 0.05 -1.20 0.11 0.00 -0.16 0.00 0.00 57.90 56.70 2bvu n TYR 23 Cb 0.51 -0.63 0.36 0.00 -0.31 0.00 0.00 39.34 39.27 2bvu n TYR 23 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 2bvu n ASP 24 N -0.27 1.96 -4.21 7.72 5.68 -1.26 -1.97 116.55 124.19 2bvu n ASP 24 Ca 0.38 -1.73 -0.12 0.00 -0.50 0.00 0.00 54.79 52.82 2bvu n ASP 24 Cb 1.31 -0.11 -0.10 0.00 -1.14 0.00 0.00 41.12 41.08 2bvu n ASP 24 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2bvu s ASP 25 N -1.64 0.89 0.21 -1.12 -1.08 -1.26 -4.90 116.67 107.78 2bvu s ASP 25 Ca 0.34 -1.19 -0.27 0.00 -0.52 0.00 0.00 52.55 50.90 2bvu s ASP 25 Cb 0.19 0.18 -0.09 0.00 -1.46 0.00 0.00 42.92 41.74 2bvu s ASP 25 CO 0.28 -0.63 0.86 -0.75 0.52 0.00 0.00 175.17 175.45 2bvu s LYS 26 N -3.97 4.69 0.11 4.34 2.20 -1.26 -3.96 119.74 121.90 2bvu s LYS 26 Ca 0.24 1.31 0.08 0.00 -0.36 0.00 0.00 55.97 57.25 2bvu s LYS 26 Cb 0.07 -3.22 -0.04 0.00 -1.51 0.00 0.00 37.83 33.13 2bvu s LYS 26 CO 0.04 0.52 -0.21 -1.01 -0.36 0.00 0.00 175.35 174.33 2bvu s HIS 27 N -1.21 1.80 -0.21 4.03 3.76 -0.19 -4.99 115.29 118.28 2bvu s HIS 27 Ca 0.39 -0.43 -0.02 0.00 -0.15 0.00 0.00 55.06 54.86 2bvu s HIS 27 Cb -0.24 -0.97 0.06 0.00 1.11 0.00 0.00 32.58 32.54 2bvu s HIS 27 CO 0.29 0.23 0.03 0.99 -0.85 0.00 0.00 174.74 175.42 2bvu s THR 28 N -1.29 0.71 0.41 1.30 2.01 -1.26 -0.48 115.64 117.03 2bvu s THR 28 Ca 0.08 -0.75 0.08 0.00 0.31 0.00 0.00 61.69 61.41 2bvu s THR 28 Cb -0.09 -1.21 0.01 0.00 0.01 0.00 0.00 72.50 71.21 2bvu s THR 28 CO 0.05 -0.25 0.56 -0.31 -0.69 0.00 0.00 174.62 173.98 2bvu s TYR 29 N 1.76 2.84 0.46 4.92 1.51 0.23 -4.89 117.35 124.19 2bvu s TYR 29 Ca -0.01 -0.37 0.03 0.00 -1.01 0.00 0.00 57.07 55.71 2bvu s TYR 29 Cb -0.17 -2.35 -0.03 0.00 -0.11 0.00 0.00 41.96 39.30 2bvu s TYR 29 CO -0.10 -0.39 0.03 -1.01 -1.11 0.00 0.00 175.55 172.98 2bvu s HIS 30 N -2.34 1.96 -0.18 2.71 3.76 -1.26 0.19 115.29 120.13 2bvu s HIS 30 Ca 0.54 -0.98 -0.09 0.00 -0.15 0.00 0.00 55.06 54.38 2bvu s HIS 30 Cb -0.10 -1.52 0.07 0.00 1.11 0.00 0.00 32.58 32.14 2bvu s HIS 30 CO 0.33 0.14 0.43 0.42 -0.85 0.00 0.00 174.74 175.21 2bvu s ILE 31 N -2.95 -0.19 -0.27 0.60 1.01 0.24 -4.66 121.20 114.99 2bvu s ILE 31 Ca 0.16 0.11 -0.19 0.00 0.00 0.00 0.00 60.65 60.73 2bvu s ILE 31 Cb 0.04 -0.65 -0.02 0.00 0.01 0.00 0.00 42.46 41.84 2bvu s ILE 31 CO 0.09 0.04 0.58 -0.75 0.00 0.00 0.00 174.94 174.90 2bvu s LYS 32 N 1.74 4.05 -0.23 2.79 2.20 0.27 -0.54 119.74 130.02 2bvu s LYS 32 Ca -0.08 0.41 -0.08 0.00 -0.36 0.00 0.00 55.97 55.86 2bvu s LYS 32 Cb -0.09 -3.67 -0.04 0.00 -1.51 0.00 0.00 37.83 32.53 2bvu s LYS 32 CO -0.13 -0.42 0.09 0.42 -0.36 0.00 0.00 175.35 174.94 2bvu s ILE 33 N 2.45 4.61 0.04 5.43 1.01 -0.16 -1.09 121.20 133.49 2bvu s ILE 33 Ca 0.24 -0.08 0.09 0.00 0.00 0.00 0.00 60.65 60.90 2bvu s ILE 33 Cb -0.15 -3.14 -0.03 0.00 0.01 0.00 0.00 42.46 39.15 2bvu s ILE 33 CO 0.09 0.36 -0.25 -0.89 0.00 0.00 0.00 174.94 174.25 2bvu s THR 34 N 1.24 2.05 -0.48 2.92 2.01 0.77 -1.30 115.64 122.84 2bvu s THR 34 Ca 0.05 -1.35 -0.20 0.00 0.31 0.00 0.00 61.69 60.50 2bvu s THR 34 Cb -0.14 -1.75 0.04 0.00 0.01 0.00 0.00 72.50 70.65 2bvu s THR 34 CO 0.04 0.35 0.67 0.21 -0.69 0.00 0.00 174.62 175.20 2bvu s ASN 35 N -1.20 6.28 -0.10 3.53 3.84 -0.81 -1.02 114.94 125.44 2bvu s ASN 35 Ca 0.11 -0.60 0.11 0.00 0.21 0.00 0.00 52.86 52.69 2bvu s ASN 35 Cb -0.10 -2.32 0.49 0.00 -0.55 0.00 0.00 41.25 38.77 2bvu s ASN 35 CO 0.02 -0.89 1.32 0.00 -2.79 0.00 0.00 177.10 174.75 2bvu n ALA 36 N 6.38 3.09 -3.88 1.71 0.00 -0.54 -0.86 120.51 126.41 2bvu n ALA 36 Ca -0.03 -1.10 -0.23 0.00 0.00 0.00 0.00 53.44 52.07 2bvu n ALA 36 Cb 0.47 -1.04 -0.00 0.00 0.00 0.00 0.00 19.45 18.87 2bvu n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bvu n GLY 37 N 0.67 2.88 0.02 0.00 0.00 -1.17 -4.61 105.19 102.98 2bvu n GLY 37 Ca 0.17 -2.28 0.11 0.00 0.00 0.00 0.00 46.02 44.02 2bvu n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bvu n GLY 38 N -0.31 -1.12 3.49 -0.02 0.00 -1.26 -4.40 105.19 101.57 2bvu n GLY 38 Ca -0.03 -0.44 -0.24 0.00 0.00 0.00 0.00 46.02 45.31 2bvu n GLY 38 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bvu s ARG 39 N -2.97 1.71 0.34 1.61 0.52 -1.26 -4.85 118.95 114.05 2bvu s ARG 39 Ca 0.11 -1.81 -0.29 0.00 -0.52 0.00 0.00 55.73 53.22 2bvu s ARG 39 Cb 0.17 -1.72 -0.10 0.00 0.52 0.00 0.00 34.95 33.82 2bvu s ARG 39 CO 0.75 0.27 1.36 0.50 0.02 0.00 0.00 175.30 178.19 2bvu s ARG 40 N -3.55 4.29 0.10 3.54 3.52 -1.26 -4.26 118.95 121.33 2bvu s ARG 40 Ca 0.30 2.32 0.07 0.00 -0.13 0.00 0.00 55.73 58.29 2bvu s ARG 40 Cb -0.03 -3.05 -0.03 0.00 -1.56 0.00 0.00 34.95 30.28 2bvu s ARG 40 CO 0.15 -0.29 -0.19 0.96 -0.81 0.00 0.00 175.30 175.12 2bvu s ILE 41 N -1.07 1.56 -0.10 4.11 -4.36 -0.51 -2.19 121.20 118.64 2bvu s ILE 41 Ca 0.50 -1.52 -0.03 0.00 -0.26 0.00 0.00 60.65 59.34 2bvu s ILE 41 Cb -0.42 -1.46 -0.04 0.00 1.25 0.00 0.00 42.46 41.79 2bvu s ILE 41 CO 0.55 -0.13 0.05 -0.83 0.24 0.00 0.00 174.94 174.82 2bvu s GLY 42 N -1.95 1.95 0.03 6.27 0.00 -0.50 -0.70 107.32 112.43 2bvu s GLY 42 Ca 0.05 -0.75 0.01 0.00 0.00 0.00 0.00 44.72 44.03 2bvu s GLY 42 CO 0.04 -0.51 -0.05 0.66 0.00 0.00 0.00 173.10 173.24 2bvu s TRP 43 N -0.94 0.45 0.05 1.90 1.48 -0.08 -1.92 118.94 119.87 2bvu s TRP 43 Ca 0.14 -0.57 -0.00 0.00 -1.06 0.00 0.00 56.10 54.60 2bvu s TRP 43 Cb -0.12 -0.29 -0.03 0.00 -1.16 0.00 0.00 33.47 31.87 2bvu s TRP 43 CO 0.03 -0.16 -0.04 0.00 -4.06 0.00 0.00 176.95 172.72 2bvu s ALA 44 N -1.69 0.44 -0.01 2.67 0.00 0.10 -1.51 121.76 121.76 2bvu s ALA 44 Ca -0.11 -1.03 0.04 0.00 0.00 0.00 0.00 51.96 50.86 2bvu s ALA 44 Cb -0.08 0.22 -0.01 0.00 0.00 0.00 0.00 23.12 23.25 2bvu s ALA 44 CO -0.01 -0.28 -0.12 0.42 0.00 0.00 0.00 175.76 175.77 2bvu s ILE 45 N -3.09 0.93 0.18 0.00 -1.09 -0.72 -0.54 121.20 116.87 2bvu s ILE 45 Ca 0.00 -0.50 0.09 0.00 -2.23 0.00 0.00 60.65 58.01 2bvu s ILE 45 Cb 0.02 -0.78 -0.04 0.00 -1.58 0.00 0.00 42.46 40.07 2bvu s ILE 45 CO -0.07 0.27 -0.18 -0.54 -1.23 0.00 0.00 174.94 173.19 2bvu s LYS 46 N -0.24 1.32 0.22 2.79 1.02 -0.68 -4.85 119.74 119.32 2bvu s LYS 46 Ca 0.04 -1.46 0.09 0.00 0.02 0.00 0.00 55.97 54.66 2bvu s LYS 46 Cb -0.05 -1.35 -0.05 0.00 -0.52 0.00 0.00 37.83 35.86 2bvu s LYS 46 CO -0.00 0.27 -0.16 0.95 -0.92 0.00 0.00 175.35 175.49 2bvu s THR 47 N -2.18 1.90 -2.00 2.17 -4.23 -1.26 -1.11 115.64 108.93 2bvu s THR 47 Ca 0.18 -2.24 0.28 0.00 -1.18 0.00 0.00 61.69 58.73 2bvu s THR 47 Cb -0.05 -2.09 0.79 0.00 1.34 0.00 0.00 72.50 72.49 2bvu s THR 47 CO 0.07 -0.54 2.03 0.35 -0.54 0.00 0.00 174.62 175.99 2bvu n THR 48 N -0.39 0.00 -3.04 3.99 -2.24 -1.01 -4.64 114.28 106.94 2bvu n THR 48 Ca -0.08 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.54 2bvu n THR 48 Cb 0.60 -0.51 -0.01 0.00 -2.10 0.00 0.00 70.33 68.32 2bvu n THR 48 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2bvu n ASN 49 N -0.97 -0.49 0.00 3.42 2.85 -1.26 -4.97 115.26 113.85 2bvu n ASN 49 Ca 0.21 -3.10 0.08 0.00 -0.11 0.00 0.00 54.58 51.66 2bvu n ASN 49 Cb 0.10 0.22 0.37 0.00 1.24 0.00 0.00 39.78 41.70 2bvu n ASN 49 CO 0.00 0.00 0.00 0.23 -2.11 0.00 0.00 177.26 175.38 2bvu n MET 50 N 0.79 0.01 0.12 1.20 2.81 -1.26 0.75 117.12 121.53 2bvu n MET 50 Ca 0.18 0.21 -0.03 0.00 -1.81 0.00 0.00 57.70 56.25 2bvu n MET 50 Cb 0.63 -1.51 0.14 0.00 -0.71 0.00 0.00 33.22 31.76 2bvu n MET 50 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2bvu h ARG 51 N 0.00 0.08 0.00 0.03 3.08 -1.99 -3.38 114.38 112.20 2bvu h ARG 51 Ca 0.00 -0.06 -0.43 0.00 0.07 0.00 0.00 59.98 59.56 2bvu h ARG 51 Cb 0.30 0.01 -0.07 0.00 0.08 0.00 0.00 29.97 30.29 2bvu h ARG 51 CO 0.00 0.69 -2.48 -2.13 -1.07 0.00 0.00 179.97 174.98 2bvu n ARG 52 N -3.80 0.59 -4.30 0.04 0.63 0.23 -4.89 116.66 105.16 2bvu n ARG 52 Ca -0.02 0.21 -0.34 0.00 -0.92 0.00 0.00 57.85 56.79 2bvu n ARG 52 Cb 0.64 -1.47 -0.09 0.00 0.45 0.00 0.00 32.46 31.99 2bvu n ARG 52 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2bvu s LEU 53 N -7.11 3.63 0.21 6.15 1.43 -0.09 -1.28 118.68 121.61 2bvu s LEU 53 Ca -0.36 0.11 0.05 0.00 -1.03 0.00 0.00 54.13 52.90 2bvu s LEU 53 Cb 0.12 -1.94 -0.05 0.00 0.03 0.00 0.00 46.19 44.36 2bvu s LEU 53 CO 0.51 0.34 -0.06 -0.94 0.23 0.00 0.00 176.35 176.43 2bvu s SER 54 N -1.18 2.02 0.00 2.29 1.04 0.16 -4.24 113.70 113.79 2bvu s SER 54 Ca 0.16 -1.12 0.03 0.00 0.48 0.00 0.00 55.95 55.50 2bvu s SER 54 Cb -0.11 -0.03 -0.01 0.00 0.10 0.00 0.00 66.02 65.96 2bvu s SER 54 CO 0.06 -0.39 -0.09 -0.69 0.98 0.00 0.00 173.24 173.10 2bvu s VAL 55 N -3.29 0.74 -0.29 5.02 1.01 -1.26 -1.72 120.40 120.61 2bvu s VAL 55 Ca 0.24 -0.53 -0.12 0.00 0.00 0.00 0.00 61.98 61.57 2bvu s VAL 55 Cb 0.04 -0.64 0.11 0.00 0.00 0.00 0.00 36.38 35.89 2bvu s VAL 55 CO 0.06 0.12 0.67 -0.62 0.00 0.00 0.00 175.10 175.33 2bvu s ASP 56 N -0.46 -1.07 0.48 3.32 2.15 -0.77 -4.35 116.67 115.97 2bvu s ASP 56 Ca 0.02 1.55 -0.20 0.00 0.43 0.00 0.00 52.55 54.35 2bvu s ASP 56 Cb -0.05 1.99 -0.09 0.00 -0.30 0.00 0.00 42.92 44.47 2bvu s ASP 56 CO -0.00 -0.23 1.01 -2.16 -0.17 0.00 0.00 175.17 173.62 2bvu s PRO 57 N 2.46 3.90 0.00 4.34 0.04 -1.26 -1.31 135.00 143.17 2bvu s PRO 57 Ca -0.07 1.23 0.31 0.00 0.04 0.00 0.00 61.00 62.50 2bvu s PRO 57 Cb -0.10 -2.12 1.66 0.00 0.04 0.00 0.00 34.50 33.99 2bvu s PRO 57 CO -0.19 -0.33 2.10 -0.35 0.04 0.00 0.00 177.00 178.27 2bvu n PRO 58 N -1.04 0.92 -3.61 0.56 -0.04 -1.26 -4.85 135.00 125.68 2bvu n PRO 58 Ca 0.08 -0.13 0.01 0.00 -0.04 0.00 0.00 63.50 63.42 2bvu n PRO 58 Cb 0.53 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.49 2bvu n PRO 58 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bvu n GLY 60 N -0.44 -1.25 3.27 0.00 0.00 -0.57 -4.99 105.19 101.21 2bvu n GLY 60 Ca -0.08 -0.88 -0.21 0.00 0.00 0.00 0.00 46.02 44.86 2bvu n GLY 60 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bvu s VAL 61 N -2.78 1.56 -0.19 1.61 1.01 -1.26 -0.91 120.40 119.45 2bvu s VAL 61 Ca 0.00 -1.69 -0.05 0.00 0.00 0.00 0.00 61.98 60.24 2bvu s VAL 61 Cb 0.00 -1.58 0.09 0.00 0.00 0.00 0.00 36.38 34.89 2bvu s VAL 61 CO 0.00 -0.27 0.33 -0.76 0.00 0.00 0.00 175.10 174.40 2bvu s LEU 62 N -2.30 -0.46 0.76 3.92 1.02 0.12 -4.99 118.68 116.75 2bvu s LEU 62 Ca 0.09 0.51 -0.11 0.00 0.02 0.00 0.00 54.13 54.64 2bvu s LEU 62 Cb -0.07 0.95 0.05 0.00 0.02 0.00 0.00 46.19 47.14 2bvu s LEU 62 CO 0.04 -0.26 1.09 -1.81 0.02 0.00 0.00 176.35 175.43 2bvu s ASP 63 N 2.50 4.82 0.20 2.29 1.01 -1.26 -1.42 116.67 124.80 2bvu s ASP 63 Ca 0.04 1.36 -0.32 0.00 0.71 0.00 0.00 52.55 54.34 2bvu s ASP 63 Cb -0.13 -2.14 -0.15 0.00 1.01 0.00 0.00 42.92 41.51 2bvu s ASP 63 CO -0.12 -1.77 1.16 -2.65 0.21 0.00 0.00 175.17 172.00 2bvu n PRO 64 N -3.31 1.28 0.00 8.23 -0.02 -1.26 -1.15 135.00 138.77 2bvu n PRO 64 Ca 0.07 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 2bvu n PRO 64 Cb 0.56 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 2bvu n PRO 64 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2bvu n LYS 65 N 1.62 0.00 -2.26 -0.52 4.01 -0.04 -4.97 118.16 115.99 2bvu n LYS 65 Ca 0.14 0.00 -0.35 0.00 -0.51 0.00 0.00 58.31 57.59 2bvu n LYS 65 Cb 0.26 -2.01 0.00 0.00 -0.51 0.00 0.00 35.03 32.78 2bvu n LYS 65 CO 0.00 0.00 0.00 -2.00 -1.11 0.00 0.00 177.40 174.29 2bvu s GLU 66 N 0.00 3.38 0.22 1.97 2.12 -0.30 -4.68 118.70 121.41 2bvu s GLU 66 Ca 0.00 1.61 0.09 0.00 0.36 0.00 0.00 54.97 57.04 2bvu s GLU 66 Cb 0.00 -2.02 -0.05 0.00 0.26 0.00 0.00 34.13 32.32 2bvu s GLU 66 CO 0.00 -0.83 -0.17 0.15 -0.54 0.00 0.00 175.26 173.87 2bvu s LYS 67 N -3.26 1.43 0.01 4.30 1.02 -1.26 -1.93 119.74 120.04 2bvu s LYS 67 Ca 0.72 -1.60 -0.05 0.00 0.02 0.00 0.00 55.97 55.07 2bvu s LYS 67 Cb -0.24 -1.39 -0.00 0.00 -0.52 0.00 0.00 37.83 35.67 2bvu s LYS 67 CO 0.27 0.26 0.08 0.54 -0.92 0.00 0.00 175.35 175.58 2bvu s VAL 68 N -2.56 0.09 -0.13 3.17 0.11 -0.42 -5.00 120.40 115.66 2bvu s VAL 68 Ca 0.23 -0.73 -0.03 0.00 -2.93 0.00 0.00 61.98 58.52 2bvu s VAL 68 Cb -0.03 -0.37 -0.03 0.00 -1.53 0.00 0.00 36.38 34.42 2bvu s VAL 68 CO 0.09 -0.40 -0.02 -0.22 -3.33 0.00 0.00 175.10 171.22 2bvu s LEU 69 N -1.35 3.36 -0.01 2.54 2.96 -1.26 -0.99 118.68 123.93 2bvu s LEU 69 Ca -0.14 -0.03 0.04 0.00 -0.22 0.00 0.00 54.13 53.78 2bvu s LEU 69 Cb -0.08 -1.79 -0.01 0.00 0.50 0.00 0.00 46.19 44.81 2bvu s LEU 69 CO 0.01 0.25 -0.13 0.00 -1.32 0.00 0.00 176.35 175.16 2bvu s MET 70 N -0.12 1.07 -0.24 1.98 0.23 0.30 -4.76 119.30 117.76 2bvu s MET 70 Ca 0.03 -0.47 -0.10 0.00 -1.03 0.00 0.00 55.69 54.11 2bvu s MET 70 Cb -0.13 -1.04 -0.05 0.00 -1.53 0.00 0.00 34.83 32.09 2bvu s MET 70 CO 0.02 0.28 0.16 0.00 -2.03 0.00 0.00 175.02 173.46 2bvu s ALA 71 N -0.31 3.57 -0.30 3.16 0.00 -0.43 -0.59 121.76 126.87 2bvu s ALA 71 Ca 0.05 -0.92 -0.04 0.00 0.00 0.00 0.00 51.96 51.04 2bvu s ALA 71 Cb -0.05 -2.33 0.03 0.00 0.00 0.00 0.00 23.12 20.78 2bvu s ALA 71 CO -0.01 -0.25 0.03 0.08 0.00 0.00 0.00 175.76 175.62 2bvu s VAL 72 N 1.16 3.39 0.07 0.00 1.01 0.13 -1.85 120.40 124.32 2bvu s VAL 72 Ca 0.07 -1.11 0.01 0.00 0.00 0.00 0.00 61.98 60.95 2bvu s VAL 72 Cb -0.14 -2.86 -0.04 0.00 0.00 0.00 0.00 36.38 33.34 2bvu s VAL 72 CO 0.05 -0.04 0.20 -0.94 0.00 0.00 0.00 175.10 174.38 2bvu s SER 73 N 1.36 6.25 -0.15 3.32 1.04 -0.70 -0.60 113.70 124.21 2bvu s SER 73 Ca -0.02 0.22 -0.03 0.00 0.48 0.00 0.00 55.95 56.61 2bvu s SER 73 Cb -0.19 -1.89 0.05 0.00 0.10 0.00 0.00 66.02 64.09 2bvu s SER 73 CO 0.00 0.16 0.04 0.00 0.98 0.00 0.00 173.24 174.42 2bvu s ASP 75 N 1.97 3.76 0.78 0.00 2.15 -0.41 -1.02 116.67 123.89 2bvu s ASP 75 Ca 0.01 1.00 -0.15 0.00 0.43 0.00 0.00 52.55 53.84 2bvu s ASP 75 Cb -0.16 -1.59 0.04 0.00 -0.30 0.00 0.00 42.92 40.91 2bvu s ASP 75 CO -0.07 -2.40 1.00 0.41 -0.17 0.00 0.00 175.17 173.94 2bvu n THR 76 N -3.67 2.22 -3.59 1.71 -1.04 -1.25 -4.81 114.28 103.85 2bvu n THR 76 Ca 0.07 -0.29 -0.05 0.00 -2.04 0.00 0.00 64.05 61.74 2bvu n THR 76 Cb 0.59 -1.09 -0.02 0.00 -1.82 0.00 0.00 70.33 67.99 2bvu n THR 76 CO 0.00 0.00 0.00 0.72 -0.64 0.00 0.00 175.07 175.15 2bvu s PHE 77 N -1.99 -0.14 -0.61 -1.42 -0.71 -0.83 -5.02 117.98 107.25 2bvu s PHE 77 Ca 0.72 0.12 -0.23 0.00 -1.04 0.00 0.00 56.93 56.50 2bvu s PHE 77 Cb -0.31 0.51 0.06 0.00 -1.21 0.00 0.00 43.02 42.07 2bvu s PHE 77 CO 0.52 -0.21 0.93 1.21 -1.34 0.00 0.00 175.22 176.33 2bvu s ASN 78 N -2.02 6.24 0.00 1.98 3.04 -1.26 -4.63 114.94 118.29 2bvu s ASN 78 Ca 0.08 -0.75 0.19 0.00 0.04 0.00 0.00 52.86 52.43 2bvu s ASN 78 Cb -0.01 -2.42 1.13 0.00 -1.54 0.00 0.00 41.25 38.42 2bvu s ASN 78 CO -0.05 -1.33 1.55 0.00 -3.04 0.00 0.00 177.10 174.23 2bvu n ALA 79 N 7.51 2.20 1.10 1.71 0.00 -1.26 -1.60 120.51 130.17 2bvu n ALA 79 Ca -0.02 -0.12 0.12 0.00 0.00 0.00 0.00 53.44 53.42 2bvu n ALA 79 Cb 0.46 -1.31 0.19 0.00 0.00 0.00 0.00 19.45 18.79 2bvu n ALA 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bvu n ALA 80 N -1.02 3.53 0.00 0.00 0.00 -1.26 -4.67 120.51 117.09 2bvu n ALA 80 Ca 0.14 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.10 2bvu n ALA 80 Cb 0.07 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.53 2bvu n ALA 80 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2bvu n THR 81 N -0.79 0.00 -3.81 0.00 -1.04 -0.63 -5.12 114.28 102.90 2bvu n THR 81 Ca 0.09 0.00 -0.26 0.00 -2.04 0.00 0.00 64.05 61.84 2bvu n THR 81 Cb 0.37 -0.05 0.00 0.00 -1.82 0.00 0.00 70.33 68.84 2bvu n THR 81 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2bvu s GLU 82 N -0.79 2.26 0.26 -2.82 2.02 -0.77 -5.07 118.70 113.78 2bvu s GLU 82 Ca 0.00 -1.99 -0.30 0.00 0.02 0.00 0.00 54.97 52.70 2bvu s GLU 82 Cb 0.00 -2.15 -0.10 0.00 0.10 0.00 0.00 34.13 31.98 2bvu s GLU 82 CO 0.00 -0.65 1.37 -0.98 0.02 0.00 0.00 175.26 175.02 2bvu s ARG 83 N -4.32 4.32 0.00 1.61 1.70 -1.26 -4.90 118.95 116.10 2bvu s ARG 83 Ca 0.36 2.22 0.00 0.00 -0.47 0.00 0.00 55.73 57.84 2bvu s ARG 83 Cb -0.03 -3.12 0.00 0.00 -0.57 0.00 0.00 34.95 31.24 2bvu s ARG 83 CO 0.23 -0.30 0.06 1.28 -1.08 0.00 0.00 175.30 175.48 2bvu n LEU 84 N 1.90 0.12 -0.09 -1.89 4.77 -1.26 -5.01 117.00 115.54 2bvu n LEU 84 Ca 0.04 -0.48 -0.11 0.00 -0.03 0.00 0.00 56.01 55.44 2bvu n LEU 84 Cb 0.41 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.37 2bvu n LEU 84 CO 0.59 0.03 -1.12 0.59 -1.33 0.00 0.00 177.39 176.15 2bvu n ASN 85 N -0.71 1.06 -2.07 -1.43 3.02 -1.26 -4.61 115.26 109.27 2bvu n ASN 85 Ca 0.00 -0.03 -0.25 0.00 -0.03 0.00 0.00 54.58 54.27 2bvu n ASN 85 Cb 0.01 0.58 0.02 0.00 -0.61 0.00 0.00 39.78 39.78 2bvu n ASN 85 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2bvu n ASN 86 N -2.80 5.03 -4.87 6.41 3.02 -1.26 -5.02 115.26 115.78 2bvu n ASN 86 Ca -0.32 -3.75 -0.33 0.00 -0.03 0.00 0.00 54.58 50.15 2bvu n ASN 86 Cb 1.04 -0.38 -0.05 0.00 -0.61 0.00 0.00 39.78 39.77 2bvu n ASN 86 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2bvu s ASP 87 N -3.51 6.65 -0.10 6.41 1.01 -1.26 -4.96 116.67 120.91 2bvu s ASP 87 Ca 0.51 0.88 -0.30 0.00 0.71 0.00 0.00 52.55 54.35 2bvu s ASP 87 Cb 0.41 -2.21 0.12 0.00 1.01 0.00 0.00 42.92 42.25 2bvu s ASP 87 CO 0.02 0.03 0.99 0.00 0.21 0.00 0.00 175.17 176.41 2bvu s ARG 88 N -2.45 0.64 0.01 8.23 1.70 -1.26 -1.02 118.95 124.80 2bvu s ARG 88 Ca 0.42 -0.10 0.02 0.00 -0.47 0.00 0.00 55.73 55.59 2bvu s ARG 88 Cb -0.13 0.30 -0.04 0.00 -0.57 0.00 0.00 34.95 34.51 2bvu s ARG 88 CO 0.21 -0.25 0.01 0.42 -1.08 0.00 0.00 175.30 174.61 2bvu s ILE 89 N -2.24 4.20 -0.08 4.99 1.01 0.09 -2.42 121.20 126.76 2bvu s ILE 89 Ca 0.03 -0.63 0.00 0.00 0.00 0.00 0.00 60.65 60.06 2bvu s ILE 89 Cb -0.01 -2.90 0.02 0.00 0.01 0.00 0.00 42.46 39.59 2bvu s ILE 89 CO -0.04 0.34 -0.07 -0.89 0.00 0.00 0.00 174.94 174.28 2bvu s THR 90 N -1.13 0.84 -0.18 2.92 2.01 -0.27 -1.01 115.64 118.83 2bvu s THR 90 Ca 0.21 -0.23 -0.04 0.00 0.31 0.00 0.00 61.69 61.94 2bvu s THR 90 Cb -0.12 -0.85 -0.02 0.00 0.01 0.00 0.00 72.50 71.52 2bvu s THR 90 CO 0.12 0.32 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.69 2bvu s ILE 91 N 1.33 3.72 -0.02 1.82 1.01 0.50 -1.68 121.20 127.88 2bvu s ILE 91 Ca -0.03 -0.40 0.04 0.00 0.00 0.00 0.00 60.65 60.25 2bvu s ILE 91 Cb -0.14 -2.65 -0.03 0.00 0.01 0.00 0.00 42.46 39.65 2bvu s ILE 91 CO -0.03 0.46 -0.11 -1.61 0.00 0.00 0.00 174.94 173.65 2bvu s GLU 92 N 0.75 2.47 0.13 2.79 2.02 0.30 -1.45 118.70 125.70 2bvu s GLU 92 Ca -0.02 -0.74 -0.10 0.00 0.02 0.00 0.00 54.97 54.13 2bvu s GLU 92 Cb -0.14 -2.41 0.00 0.00 0.10 0.00 0.00 34.13 31.68 2bvu s GLU 92 CO 0.02 0.61 0.27 1.67 0.02 0.00 0.00 175.26 177.85 2bvu s TRP 93 N -0.87 0.17 0.11 1.61 -2.14 -0.66 0.01 118.94 117.17 2bvu s TRP 93 Ca 0.14 -0.55 -0.12 0.00 2.66 0.00 0.00 56.10 58.22 2bvu s TRP 93 Cb -0.11 0.02 0.02 0.00 -3.10 0.00 0.00 33.47 30.29 2bvu s TRP 93 CO 0.04 -0.65 0.31 -0.08 -2.66 0.00 0.00 176.95 173.91 2bvu s THR 94 N -3.89 0.10 0.48 0.66 -1.32 -0.81 -1.39 115.64 109.47 2bvu s THR 94 Ca 0.09 -0.90 -0.22 0.00 -1.21 0.00 0.00 61.69 59.45 2bvu s THR 94 Cb 0.04 -1.30 -0.07 0.00 -1.51 0.00 0.00 72.50 69.66 2bvu s THR 94 CO -0.07 -0.45 1.19 0.20 -2.21 0.00 0.00 174.62 173.28 2bvu s ASN 95 N -2.84 5.99 0.14 8.08 0.01 -1.26 -1.41 114.94 123.64 2bvu s ASN 95 Ca 0.05 2.36 -0.14 0.00 -0.71 0.00 0.00 52.86 54.42 2bvu s ASN 95 Cb 0.03 -2.61 -0.07 0.00 0.41 0.00 0.00 41.25 39.02 2bvu s ASN 95 CO -0.10 -1.04 0.54 0.28 -1.51 0.00 0.00 177.10 175.26 2bvu s THR 96 N -1.53 4.87 0.77 1.60 -1.32 -0.93 -4.77 115.64 114.33 2bvu s THR 96 Ca 0.66 0.82 -0.12 0.00 -1.21 0.00 0.00 61.69 61.84 2bvu s THR 96 Cb -0.30 -3.74 0.06 0.00 -1.51 0.00 0.00 72.50 67.01 2bvu s THR 96 CO 0.36 0.27 1.12 -2.16 -2.21 0.00 0.00 174.62 172.00 2bvu s PRO 97 N -1.90 2.11 0.13 7.08 0.04 -1.26 -4.90 135.00 136.31 2bvu s PRO 97 Ca 0.37 1.39 -0.35 0.00 0.04 0.00 0.00 61.00 62.45 2bvu s PRO 97 Cb -0.15 -1.87 -0.15 0.00 0.04 0.00 0.00 34.50 32.37 2bvu s PRO 97 CO 0.19 -1.78 1.42 -0.25 0.04 0.00 0.00 177.00 176.62 2bvu n ASP 98 N -3.28 2.26 -1.02 6.66 8.00 -1.26 -1.97 116.55 125.94 2bvu n ASP 98 Ca 0.11 1.11 -0.11 0.00 0.71 0.00 0.00 54.79 56.61 2bvu n ASP 98 Cb 0.52 -1.30 -0.03 0.00 -0.02 0.00 0.00 41.12 40.29 2bvu n ASP 98 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bvu n GLY 99 N 2.80 0.59 3.79 0.44 0.00 -1.26 -4.99 105.19 106.56 2bvu n GLY 99 Ca 0.17 -0.49 -0.36 0.00 0.00 0.00 0.00 46.02 45.35 2bvu n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bvu s ALA 100 N -2.47 3.13 1.10 4.61 0.00 -0.83 -5.06 121.76 122.24 2bvu s ALA 100 Ca 0.00 0.53 -0.14 0.00 0.00 0.00 0.00 51.96 52.35 2bvu s ALA 100 Cb 0.00 -3.19 0.19 0.00 0.00 0.00 0.00 23.12 20.12 2bvu s ALA 100 CO 0.00 0.08 0.88 0.00 0.00 0.00 0.00 175.76 176.71 2bvu n ALA 101 N 0.08 -1.86 -1.51 0.00 0.00 -1.26 -4.97 120.51 110.99 2bvu n ALA 101 Ca 0.04 -1.22 -0.15 0.00 0.00 0.00 0.00 53.44 52.11 2bvu n ALA 101 Cb 0.51 -0.07 0.15 0.00 0.00 0.00 0.00 19.45 20.04 2bvu n ALA 101 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2bvu n LYS 102 N -3.52 2.30 -4.68 0.00 4.81 -1.26 -4.89 118.16 110.92 2bvu n LYS 102 Ca 0.12 -3.35 -0.33 0.00 -0.87 0.00 0.00 58.31 53.87 2bvu n LYS 102 Cb 0.42 -2.01 -0.15 0.00 0.02 0.00 0.00 35.03 33.32 2bvu n LYS 102 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 2bvu s GLN 103 N -3.40 3.29 0.21 1.64 1.11 -1.26 -4.72 119.66 116.52 2bvu s GLN 103 Ca 0.50 -0.72 -0.31 0.00 0.01 0.00 0.00 55.36 54.83 2bvu s GLN 103 Cb 0.43 -2.62 -0.11 0.00 -1.01 0.00 0.00 33.01 29.70 2bvu s GLN 103 CO 0.02 0.11 1.64 0.12 0.01 0.00 0.00 175.29 177.19 2bvu s PHE 104 N 0.58 2.93 -0.19 0.91 5.36 -1.26 -4.99 117.98 121.32 2bvu s PHE 104 Ca -0.09 0.53 0.01 0.00 -0.96 0.00 0.00 56.93 56.43 2bvu s PHE 104 Cb -0.16 -4.05 0.03 0.00 -0.34 0.00 0.00 43.02 38.51 2bvu s PHE 104 CO 0.03 -3.85 -0.14 -0.98 -1.46 0.00 0.00 175.22 168.82 2bvu s ARG 105 N 0.82 2.42 0.62 10.12 1.70 -1.26 -5.02 118.95 128.36 2bvu s ARG 105 Ca 0.71 -0.86 0.30 0.00 -0.47 0.00 0.00 55.73 55.40 2bvu s ARG 105 Cb -0.47 -2.48 1.62 0.00 -0.57 0.00 0.00 34.95 33.05 2bvu s ARG 105 CO 0.35 -0.34 1.97 0.00 -1.08 0.00 0.00 175.30 176.20 2bvu h ARG 106 N 7.95 0.00 -0.07 3.89 2.47 -2.02 -1.85 114.38 124.74 2bvu h ARG 106 Ca -0.34 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.38 2bvu h ARG 106 Cb 1.11 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.43 2bvu h ARG 106 CO 0.54 0.00 0.00 -1.91 0.56 0.00 0.00 179.97 179.16 2bvu n GLU 107 N -3.36 1.23 0.09 0.04 4.07 -1.26 -1.79 120.64 119.66 2bvu n GLU 107 Ca 0.02 -0.36 -0.04 0.00 -0.06 0.00 0.00 57.16 56.73 2bvu n GLU 107 Cb 0.45 -1.23 -0.04 0.00 -0.06 0.00 0.00 31.44 30.56 2bvu n GLU 107 CO 0.00 0.00 0.00 -1.49 -0.06 0.00 0.00 177.13 175.58 2bvu h TRP 108 N 0.66 0.00 -0.00 4.31 6.55 -1.75 -3.30 115.95 122.42 2bvu h TRP 108 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 2bvu h TRP 108 Cb 0.15 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.45 2bvu h TRP 108 CO 0.05 0.83 -0.46 1.19 -1.05 0.00 0.00 178.44 179.00 2bvu n PHE 109 N -3.38 0.00 -0.08 0.49 3.01 -0.74 -4.48 117.46 112.28 2bvu n PHE 109 Ca 0.00 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.34 2bvu n PHE 109 Cb 0.84 -0.22 -0.07 0.00 -0.01 0.00 0.00 39.48 40.03 2bvu n PHE 109 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 2bvu n GLN 110 N -1.31 0.37 -0.37 -1.08 6.02 -1.24 -4.97 117.38 114.80 2bvu n GLN 110 Ca 0.07 0.10 -0.15 0.00 -0.01 0.00 0.00 57.00 57.01 2bvu n GLN 110 Cb 0.34 -1.26 0.13 0.00 1.02 0.00 0.00 30.24 30.46 2bvu n GLN 110 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2bvu n GLY 111 N 2.63 -3.03 3.66 1.08 0.00 -1.25 -4.87 105.19 103.41 2bvu n GLY 111 Ca -0.28 -1.40 -0.42 0.00 0.00 0.00 0.00 46.02 43.92 2bvu n GLY 111 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bvu s ASP 112 N -2.80 6.43 0.00 1.61 1.11 -1.26 -4.88 116.67 116.89 2bvu s ASP 112 Ca 0.34 2.57 0.00 0.00 0.18 0.00 0.00 52.55 55.64 2bvu s ASP 112 Cb -0.04 -2.53 0.00 0.00 1.07 0.00 0.00 42.92 41.42 2bvu s ASP 112 CO 0.27 -1.08 0.00 0.61 1.18 0.00 0.00 175.17 176.15 2bvu n GLY 113 N 4.54 -0.68 3.38 0.21 0.00 -1.26 -5.13 105.19 106.26 2bvu n GLY 113 Ca 0.20 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 45.13 2bvu n GLY 113 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2bvu s MET 114 N -0.57 2.18 -0.05 1.61 -1.94 -1.26 -5.11 119.30 114.17 2bvu s MET 114 Ca 0.00 -0.89 0.05 0.00 -1.71 0.00 0.00 55.69 53.13 2bvu s MET 114 Cb 0.00 -2.15 -0.00 0.00 2.01 0.00 0.00 34.83 34.69 2bvu s MET 114 CO 0.00 0.57 -0.18 0.08 -0.01 0.00 0.00 175.02 175.48 2bvu s VAL 115 N -0.71 1.54 0.07 -6.03 1.01 -1.26 -4.61 120.40 110.41 2bvu s VAL 115 Ca 0.11 -0.77 0.08 0.00 0.00 0.00 0.00 61.98 61.40 2bvu s VAL 115 Cb -0.10 -1.32 -0.03 0.00 0.00 0.00 0.00 36.38 34.93 2bvu s VAL 115 CO 0.01 0.44 -0.19 -0.60 0.00 0.00 0.00 175.10 174.76 2bvu s ARG 116 N 0.02 1.95 0.08 2.72 3.52 -0.49 -4.97 118.95 121.77 2bvu s ARG 116 Ca -0.04 -1.06 0.01 0.00 -0.13 0.00 0.00 55.73 54.50 2bvu s ARG 116 Cb -0.12 -2.15 -0.04 0.00 -1.56 0.00 0.00 34.95 31.08 2bvu s ARG 116 CO 0.03 0.52 -0.05 -0.98 -0.81 0.00 0.00 175.30 174.00 2bvu s ARG 117 N -1.69 0.73 -0.06 5.12 1.70 -1.26 -1.66 118.95 121.84 2bvu s ARG 117 Ca 0.16 -1.25 -0.04 0.00 -0.47 0.00 0.00 55.73 54.13 2bvu s ARG 117 Cb -0.10 -0.07 0.03 0.00 -0.57 0.00 0.00 34.95 34.24 2bvu s ARG 117 CO 0.07 -0.04 0.15 0.21 -1.08 0.00 0.00 175.30 174.61 2bvu s LYS 118 N -3.69 0.13 -0.04 3.89 2.20 -0.53 -5.00 119.74 116.71 2bvu s LYS 118 Ca 0.08 0.31 -0.00 0.00 -0.36 0.00 0.00 55.97 56.01 2bvu s LYS 118 Cb 0.05 -0.07 -0.04 0.00 -1.51 0.00 0.00 37.83 36.26 2bvu s LYS 118 CO -0.06 -0.11 0.02 -0.80 -0.36 0.00 0.00 175.35 174.04 2bvu s ASN 119 N 0.74 5.31 -0.38 1.43 0.01 -1.26 -0.37 114.94 120.41 2bvu s ASN 119 Ca -0.05 0.09 0.02 0.00 -0.71 0.00 0.00 52.86 52.21 2bvu s ASN 119 Cb -0.07 -1.47 0.11 0.00 0.41 0.00 0.00 41.25 40.24 2bvu s ASN 119 CO -0.04 0.32 0.15 -0.76 -1.51 0.00 0.00 177.10 175.26 2bvu s LEU 120 N -1.32 3.16 0.55 0.60 1.43 -0.18 -4.83 118.68 118.08 2bvu s LEU 120 Ca 0.18 -2.22 -0.21 0.00 -1.03 0.00 0.00 54.13 50.85 2bvu s LEU 120 Cb -0.12 -1.17 -0.06 0.00 0.03 0.00 0.00 46.19 44.87 2bvu s LEU 120 CO 0.08 -0.34 1.11 -2.65 0.23 0.00 0.00 176.35 174.78 2bvu n PRO 121 N 4.10 1.27 -3.54 1.29 -0.02 -1.26 -0.73 135.00 136.12 2bvu n PRO 121 Ca 0.04 0.47 -0.36 0.00 -2.02 0.00 0.00 63.50 61.62 2bvu n PRO 121 Cb 0.38 -2.29 -0.07 0.00 -0.02 0.00 0.00 33.50 31.50 2bvu n PRO 121 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2bvu s ILE 122 N -1.38 5.30 -0.10 4.25 -1.09 -0.19 -1.66 121.20 126.33 2bvu s ILE 122 Ca 0.72 0.53 0.01 0.00 -2.23 0.00 0.00 60.65 59.68 2bvu s ILE 122 Cb -0.45 -3.63 -0.02 0.00 -1.58 0.00 0.00 42.46 36.78 2bvu s ILE 122 CO 0.50 0.38 -0.12 -1.61 -1.23 0.00 0.00 174.94 172.86 2bvu s GLU 123 N 0.58 3.06 -0.43 2.79 2.02 -0.09 -4.60 118.70 122.03 2bvu s GLU 123 Ca 0.16 -0.65 -0.16 0.00 0.02 0.00 0.00 54.97 54.34 2bvu s GLU 123 Cb -0.13 -2.58 0.04 0.00 0.10 0.00 0.00 34.13 31.56 2bvu s GLU 123 CO 0.04 0.40 0.36 0.71 0.02 0.00 0.00 175.26 176.79 2bvu s TYR 124 N -0.13 3.23 -0.78 1.61 2.02 -1.26 -1.22 117.35 120.81 2bvu s TYR 124 Ca -0.01 -0.67 -0.26 0.00 -0.37 0.00 0.00 57.07 55.77 2bvu s TYR 124 Cb -0.13 -2.84 0.02 0.00 -0.40 0.00 0.00 41.96 38.60 2bvu s TYR 124 CO 0.03 -0.68 1.45 1.21 -1.57 0.00 0.00 175.55 175.99 2bvu s ASN 125 N 2.02 6.02 0.00 2.29 2.47 0.47 -4.96 114.94 123.25 2bvu s ASN 125 Ca 0.06 -0.52 0.28 0.00 0.42 0.00 0.00 52.86 53.10 2bvu s ASN 125 Cb -0.20 -2.56 1.69 0.00 -1.45 0.00 0.00 41.25 38.73 2bvu s ASN 125 CO 0.09 -1.92 2.03 0.18 -3.72 0.00 0.00 177.10 173.77