#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vb5 s ILE 1 N 0.00 0.00 -0.32 1.12 1.10 -1.26 -5.15 121.20 116.69 2vb5 s ILE 1 Ca 0.00 0.00 -0.14 0.00 -0.51 0.00 0.00 60.65 60.00 2vb5 s ILE 1 Cb 0.00 -1.00 -0.02 0.00 0.15 0.00 0.00 42.46 41.59 2vb5 s ILE 1 CO 0.00 0.00 0.31 0.00 -2.11 0.00 0.00 174.94 173.14 2vb5 s GLN 2 N 1.51 3.68 -0.07 3.50 -2.07 -1.26 -5.07 119.66 119.89 2vb5 s GLN 2 Ca -0.09 -0.38 -0.26 0.00 -1.82 0.00 0.00 55.36 52.81 2vb5 s GLN 2 Cb -0.05 -3.76 -0.03 0.00 -1.09 0.00 0.00 33.01 28.08 2vb5 s GLN 2 CO -0.18 -0.41 0.83 1.03 -1.32 0.00 0.00 175.29 175.24 2vb5 s ARG 3 N 1.92 4.45 0.36 9.60 3.00 -1.26 -4.99 118.95 132.04 2vb5 s ARG 3 Ca 0.10 1.11 -0.13 0.00 0.00 0.00 0.00 55.73 56.81 2vb5 s ARG 3 Cb -0.17 -3.48 -0.08 0.00 0.00 0.00 0.00 34.95 31.22 2vb5 s ARG 3 CO 0.11 -0.07 0.75 0.95 0.00 0.00 0.00 175.30 177.04 2vb5 s THR 4 N 1.20 4.72 -0.12 0.02 -4.23 -1.24 -1.87 115.64 114.13 2vb5 s THR 4 Ca 0.43 0.82 -0.29 0.00 -1.18 0.00 0.00 61.69 61.47 2vb5 s THR 4 Cb -0.19 -3.66 -0.05 0.00 1.34 0.00 0.00 72.50 69.95 2vb5 s THR 4 CO 0.20 -0.33 1.72 -2.16 -0.54 0.00 0.00 174.62 173.51 2vb5 s PRO 5 N -3.34 3.96 -0.23 3.99 0.04 -1.26 -4.46 135.00 133.71 2vb5 s PRO 5 Ca 0.53 2.03 -0.28 0.00 0.04 0.00 0.00 61.00 63.32 2vb5 s PRO 5 Cb -0.10 -4.05 0.01 0.00 0.04 0.00 0.00 34.50 30.39 2vb5 s PRO 5 CO 0.23 -1.11 1.01 0.21 0.04 0.00 0.00 177.00 177.38 2vb5 s LYS 6 N 4.48 4.26 0.09 4.56 2.20 -0.51 -4.91 119.74 129.90 2vb5 s LYS 6 Ca 0.76 1.31 -0.30 0.00 -0.36 0.00 0.00 55.97 57.38 2vb5 s LYS 6 Cb -0.31 -3.64 -0.06 0.00 -1.51 0.00 0.00 37.83 32.32 2vb5 s LYS 6 CO 0.31 -0.60 1.07 0.96 -0.36 0.00 0.00 175.35 176.73 2vb5 s ILE 7 N 3.10 4.28 -0.43 5.43 -4.36 -1.26 -2.87 121.20 125.09 2vb5 s ILE 7 Ca 0.43 1.77 0.06 0.00 -0.26 0.00 0.00 60.65 62.66 2vb5 s ILE 7 Cb -0.15 -4.13 0.22 0.00 1.25 0.00 0.00 42.46 39.64 2vb5 s ILE 7 CO 0.07 0.21 0.56 0.00 0.24 0.00 0.00 174.94 176.02 2vb5 n GLN 8 N 3.25 0.56 -3.38 0.37 6.02 -1.22 -5.05 117.38 117.93 2vb5 n GLN 8 Ca 0.05 -2.80 -0.45 0.00 -0.01 0.00 0.00 57.00 53.79 2vb5 n GLN 8 Cb 0.48 -1.41 -0.02 0.00 1.02 0.00 0.00 30.24 30.30 2vb5 n GLN 8 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2vb5 s VAL 9 N -0.27 5.47 0.41 5.09 1.01 -1.26 -2.30 120.40 128.55 2vb5 s VAL 9 Ca 0.33 -2.82 0.07 0.00 0.00 0.00 0.00 61.98 59.57 2vb5 s VAL 9 Cb 0.13 -4.37 -0.06 0.00 0.00 0.00 0.00 36.38 32.08 2vb5 s VAL 9 CO -0.15 -1.06 0.15 -0.72 0.00 0.00 0.00 175.10 173.32 2vb5 s TYR 10 N -0.28 2.60 -0.26 5.22 1.13 -1.02 -1.86 117.35 122.88 2vb5 s TYR 10 Ca 0.21 -0.59 -0.19 0.00 -1.41 0.00 0.00 57.07 55.09 2vb5 s TYR 10 Cb -0.11 -1.91 -0.02 0.00 -1.10 0.00 0.00 41.96 38.82 2vb5 s TYR 10 CO -0.08 0.23 0.58 -1.12 -2.51 0.00 0.00 175.55 172.65 2vb5 s SER 11 N -3.87 6.52 -0.00 -0.18 0.01 -1.26 -1.75 113.70 113.16 2vb5 s SER 11 Ca 0.40 0.63 -0.21 0.00 1.31 0.00 0.00 55.95 58.07 2vb5 s SER 11 Cb 0.04 -2.31 -0.12 0.00 0.21 0.00 0.00 66.02 63.84 2vb5 s SER 11 CO 0.22 -0.33 0.91 -0.09 0.41 0.00 0.00 173.24 174.36 2vb5 h ARG 12 N 7.94 -0.74 -7.36 12.44 9.65 -1.76 -3.45 114.38 131.10 2vb5 h ARG 12 Ca -0.28 0.05 -0.49 0.00 -1.10 0.00 0.00 59.98 58.16 2vb5 h ARG 12 Cb 1.13 0.17 0.07 0.00 -1.39 0.00 0.00 29.97 29.95 2vb5 h ARG 12 CO 0.75 -0.50 0.34 -1.01 2.80 0.00 0.00 179.97 182.35 2vb5 s HIS 13 N -4.08 3.33 0.38 2.20 3.76 -1.26 -5.02 115.29 114.60 2vb5 s HIS 13 Ca -0.11 0.95 -0.27 0.00 -0.15 0.00 0.00 55.06 55.48 2vb5 s HIS 13 Cb 0.01 -2.94 -0.09 0.00 1.11 0.00 0.00 32.58 30.67 2vb5 s HIS 13 CO 0.34 -1.03 1.27 -1.25 -0.85 0.00 0.00 174.74 173.22 2vb5 s PRO 14 N -5.23 4.11 -1.22 8.40 0.04 -1.26 -4.89 135.00 134.95 2vb5 s PRO 14 Ca 0.56 2.10 -0.16 0.00 0.04 0.00 0.00 61.00 63.55 2vb5 s PRO 14 Cb -0.11 -2.84 -0.04 0.00 0.04 0.00 0.00 34.50 31.55 2vb5 s PRO 14 CO 0.50 -0.35 2.18 0.00 0.04 0.00 0.00 177.00 179.36 2vb5 n ALA 15 N 0.34 4.92 -2.71 8.56 0.00 -1.26 -4.92 120.51 125.45 2vb5 n ALA 15 Ca 0.03 -3.57 -0.40 0.00 0.00 0.00 0.00 53.44 49.49 2vb5 n ALA 15 Cb 0.44 -3.53 -0.04 0.00 0.00 0.00 0.00 19.45 16.31 2vb5 n ALA 15 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2vb5 s GLU 16 N 3.73 4.44 0.20 0.00 2.12 -1.26 -5.01 118.70 122.91 2vb5 s GLU 16 Ca 0.52 1.01 -0.32 0.00 0.36 0.00 0.00 54.97 56.54 2vb5 s GLU 16 Cb 0.14 -3.47 -0.12 0.00 0.26 0.00 0.00 34.13 30.95 2vb5 s GLU 16 CO -0.02 -0.02 1.72 -0.80 -0.54 0.00 0.00 175.26 175.60 2vb5 s ASN 17 N 0.90 6.40 -1.22 -1.70 -0.87 -1.26 -2.91 114.94 114.28 2vb5 s ASN 17 Ca 0.41 2.84 -0.03 0.00 -1.57 0.00 0.00 52.86 54.51 2vb5 s ASN 17 Cb -0.18 -2.60 0.00 0.00 -0.02 0.00 0.00 41.25 38.45 2vb5 s ASN 17 CO 0.19 -0.96 1.03 0.61 -2.57 0.00 0.00 177.10 175.40 2vb5 n GLY 18 N 3.98 -0.39 3.64 0.66 0.00 -0.05 -5.01 105.19 108.01 2vb5 n GLY 18 Ca 0.16 0.13 -0.06 0.00 0.00 0.00 0.00 46.02 46.25 2vb5 n GLY 18 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2vb5 s LYS 19 N -5.63 0.67 0.56 1.61 2.20 -1.15 -5.05 119.74 112.95 2vb5 s LYS 19 Ca 0.18 1.18 -0.20 0.00 -0.36 0.00 0.00 55.97 56.78 2vb5 s LYS 19 Cb -0.08 0.18 -0.06 0.00 -1.51 0.00 0.00 37.83 36.36 2vb5 s LYS 19 CO 0.71 -0.15 0.99 0.43 -0.36 0.00 0.00 175.35 176.97 2vb5 n SER 20 N 4.33 0.96 -3.71 1.43 7.64 -1.26 -4.32 113.62 118.68 2vb5 n SER 20 Ca -0.19 0.86 -0.12 0.00 1.01 0.00 0.00 58.87 60.43 2vb5 n SER 20 Cb 0.58 -1.39 -0.11 0.00 -1.01 0.00 0.00 64.21 62.29 2vb5 n SER 20 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2vb5 s ASN 21 N -1.11 -0.46 -0.03 6.43 3.84 -0.28 -4.94 114.94 118.39 2vb5 s ASN 21 Ca 0.73 0.82 -0.22 0.00 0.21 0.00 0.00 52.86 54.40 2vb5 s ASN 21 Cb -0.44 0.75 -0.05 0.00 -0.55 0.00 0.00 41.25 40.96 2vb5 s ASN 21 CO 0.50 -0.17 0.63 -0.36 -2.79 0.00 0.00 177.10 174.91 2vb5 s PHE 22 N 0.94 3.64 0.26 0.43 0.08 -1.26 -1.27 117.98 120.79 2vb5 s PHE 22 Ca -0.06 1.21 -0.25 0.00 0.12 0.00 0.00 56.93 57.94 2vb5 s PHE 22 Cb -0.06 -2.68 -0.09 0.00 -0.57 0.00 0.00 43.02 39.61 2vb5 s PHE 22 CO -0.07 0.24 0.87 -1.17 -0.10 0.00 0.00 175.22 174.98 2vb5 s LEU 23 N 0.23 4.45 -0.62 -0.37 2.96 -1.14 -2.10 118.68 122.08 2vb5 s LEU 23 Ca 0.33 1.74 0.04 0.00 -0.22 0.00 0.00 54.13 56.03 2vb5 s LEU 23 Cb -0.18 -3.72 0.16 0.00 0.50 0.00 0.00 46.19 42.95 2vb5 s LEU 23 CO 0.17 0.05 0.40 0.20 -1.32 0.00 0.00 176.35 175.85 2vb5 s ASN 24 N -1.45 4.47 -1.11 3.68 -0.87 -0.72 -3.92 114.94 115.01 2vb5 s ASN 24 Ca 0.44 -3.51 -0.21 0.00 -1.57 0.00 0.00 52.86 48.02 2vb5 s ASN 24 Cb -0.20 -1.56 0.06 0.00 -0.02 0.00 0.00 41.25 39.53 2vb5 s ASN 24 CO 0.25 -0.14 1.53 0.00 -2.57 0.00 0.00 177.10 176.17 2vb5 s TYR 26 N 4.54 3.01 -0.47 0.00 5.04 -0.97 -1.66 117.35 126.84 2vb5 s TYR 26 Ca 0.48 -1.09 -0.15 0.00 -2.44 0.00 0.00 57.07 53.86 2vb5 s TYR 26 Cb 0.01 -4.19 0.07 0.00 0.35 0.00 0.00 41.96 38.20 2vb5 s TYR 26 CO -0.04 -1.45 0.39 0.08 -1.34 0.00 0.00 175.55 173.19 2vb5 s VAL 27 N 2.89 5.23 -0.13 3.14 1.01 -0.75 -3.40 120.40 128.39 2vb5 s VAL 27 Ca 0.23 -1.03 -0.03 0.00 0.00 0.00 0.00 61.98 61.15 2vb5 s VAL 27 Cb -0.13 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 2vb5 s VAL 27 CO -0.00 -0.56 -0.01 -0.94 0.00 0.00 0.00 175.10 173.58 2vb5 s SER 28 N 2.54 5.05 0.00 3.32 1.04 -1.14 -2.17 113.70 122.34 2vb5 s SER 28 Ca 0.04 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.47 2vb5 s SER 28 Cb -0.24 -1.68 0.00 0.00 0.10 0.00 0.00 66.02 64.21 2vb5 s SER 28 CO 0.07 0.25 0.00 0.61 0.98 0.00 0.00 173.24 175.15 2vb5 n GLY 29 N 3.03 0.80 3.35 7.32 0.00 -0.84 -1.43 105.19 117.42 2vb5 n GLY 29 Ca -0.18 -0.41 -0.45 0.00 0.00 0.00 0.00 46.02 44.98 2vb5 n GLY 29 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2vb5 s PHE 30 N -2.56 3.09 -0.26 1.61 -0.12 -1.26 -3.73 117.98 114.75 2vb5 s PHE 30 Ca 0.00 -1.06 -0.08 0.00 -0.05 0.00 0.00 56.93 55.74 2vb5 s PHE 30 Cb 0.00 -3.92 -0.03 0.00 -0.63 0.00 0.00 43.02 38.45 2vb5 s PHE 30 CO 0.00 -1.19 0.09 -1.01 -0.05 0.00 0.00 175.22 173.06 2vb5 s HIS 31 N 2.30 3.10 0.86 3.49 3.76 -0.78 -3.27 115.29 124.75 2vb5 s HIS 31 Ca 0.09 -0.44 -0.13 0.00 -0.15 0.00 0.00 55.06 54.43 2vb5 s HIS 31 Cb -0.26 -2.26 0.13 0.00 1.11 0.00 0.00 32.58 31.30 2vb5 s HIS 31 CO 0.05 -0.37 1.21 -1.25 -0.85 0.00 0.00 174.74 173.54 2vb5 s PRO 32 N 1.62 1.43 0.15 8.40 0.04 -1.26 -4.02 135.00 141.36 2vb5 s PRO 32 Ca 0.06 -0.20 0.14 0.00 0.04 0.00 0.00 61.00 61.04 2vb5 s PRO 32 Cb -0.15 -1.95 0.66 0.00 0.04 0.00 0.00 34.50 33.10 2vb5 s PRO 32 CO 0.04 -1.89 1.42 -1.13 0.04 0.00 0.00 177.00 175.48 2vb5 n SER 33 N -3.44 0.31 -4.02 6.66 3.41 -1.20 -4.40 113.62 110.94 2vb5 n SER 33 Ca 0.11 0.62 -0.41 0.00 -0.26 0.00 0.00 58.87 58.93 2vb5 n SER 33 Cb 0.60 -0.67 -0.02 0.00 -0.26 0.00 0.00 64.21 63.87 2vb5 n SER 33 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2vb5 n ASP 34 N -1.88 3.84 -4.90 4.04 -0.08 -1.26 -4.94 116.55 111.36 2vb5 n ASP 34 Ca 0.00 -2.82 -0.24 0.00 -1.51 0.00 0.00 54.79 50.23 2vb5 n ASP 34 Cb 0.08 -1.59 -0.03 0.00 2.34 0.00 0.00 41.12 41.91 2vb5 n ASP 34 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 2vb5 s ILE 35 N 4.54 4.98 -0.61 5.18 2.07 -1.26 -4.21 121.20 131.90 2vb5 s ILE 35 Ca 0.53 -0.99 0.05 0.00 -1.41 0.00 0.00 60.65 58.83 2vb5 s ILE 35 Cb 0.10 -3.63 0.17 0.00 0.13 0.00 0.00 42.46 39.23 2vb5 s ILE 35 CO 0.01 -0.21 0.44 -1.61 -1.91 0.00 0.00 174.94 171.66 2vb5 s GLU 36 N -3.55 1.95 -1.00 3.50 2.02 -0.53 -5.00 118.70 116.09 2vb5 s GLU 36 Ca 0.33 -2.93 -0.17 0.00 0.02 0.00 0.00 54.97 52.23 2vb5 s GLU 36 Cb -0.10 -2.78 0.15 0.00 0.10 0.00 0.00 34.13 31.51 2vb5 s GLU 36 CO 0.27 -1.31 1.18 0.08 0.02 0.00 0.00 175.26 175.50 2vb5 s VAL 37 N -0.94 4.90 -0.89 2.63 1.01 -1.26 -2.65 120.40 123.21 2vb5 s VAL 37 Ca 0.27 -1.97 -0.00 0.00 0.00 0.00 0.00 61.98 60.28 2vb5 s VAL 37 Cb -0.03 -4.79 0.34 0.00 0.00 0.00 0.00 36.38 31.90 2vb5 s VAL 37 CO -0.17 -1.50 1.73 -0.67 0.00 0.00 0.00 175.10 174.49 2vb5 n ASP 38 N 6.03 6.88 -4.68 3.32 2.03 -1.00 -4.94 116.55 124.19 2vb5 n ASP 38 Ca 0.27 -3.73 -0.35 0.00 0.52 0.00 0.00 54.79 51.49 2vb5 n ASP 38 Cb 0.47 -1.02 0.10 0.00 -0.72 0.00 0.00 41.12 39.95 2vb5 n ASP 38 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2vb5 n LEU 39 N -0.24 4.72 -4.40 -2.67 -0.00 -1.26 -4.44 117.00 108.71 2vb5 n LEU 39 Ca 0.46 0.68 -0.20 0.00 -0.00 0.00 0.00 56.01 56.96 2vb5 n LEU 39 Cb 0.29 -1.50 -0.10 0.00 -0.00 0.00 0.00 43.42 42.11 2vb5 n LEU 39 CO 0.48 -1.56 -0.29 -0.76 -0.00 0.00 0.00 177.39 175.27 2vb5 s LEU 40 N -4.60 2.11 -0.22 1.47 1.43 -0.58 -3.10 118.68 115.19 2vb5 s LEU 40 Ca 0.76 -1.33 -0.03 0.00 -1.03 0.00 0.00 54.13 52.50 2vb5 s LEU 40 Cb -0.33 -0.30 0.11 0.00 0.03 0.00 0.00 46.19 45.69 2vb5 s LEU 40 CO 0.47 -0.59 0.27 -1.59 0.23 0.00 0.00 176.35 175.14 2vb5 s LYS 41 N -3.90 0.25 -1.56 1.70 -2.85 -0.02 -3.41 119.74 109.96 2vb5 s LYS 41 Ca 0.35 0.29 0.00 0.00 -1.00 0.00 0.00 55.97 55.60 2vb5 s LYS 41 Cb 0.08 -0.96 0.00 0.00 -2.06 0.00 0.00 37.83 34.89 2vb5 s LYS 41 CO 0.13 -0.67 0.00 0.09 0.10 0.00 0.00 175.35 175.00 2vb5 n ASN 42 N 5.33 -5.27 0.00 0.03 4.13 -1.08 -1.01 115.26 117.38 2vb5 n ASN 42 Ca -0.05 0.06 0.00 0.00 1.68 0.00 0.00 54.58 56.27 2vb5 n ASN 42 Cb 0.50 -4.42 0.00 0.00 -1.54 0.00 0.00 39.78 34.32 2vb5 n ASN 42 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2vb5 n GLY 43 N -0.94 3.01 3.87 7.41 0.00 -1.26 -5.04 105.19 112.24 2vb5 n GLY 43 Ca -0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.50 2vb5 n GLY 43 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2vb5 s GLU 44 N -0.08 3.42 -0.07 1.61 2.02 -0.18 -5.03 118.70 120.39 2vb5 s GLU 44 Ca 0.00 0.71 -0.11 0.00 0.02 0.00 0.00 54.97 55.59 2vb5 s GLU 44 Cb 0.00 -2.06 -0.05 0.00 0.10 0.00 0.00 34.13 32.12 2vb5 s GLU 44 CO 0.00 -0.69 0.27 0.50 0.02 0.00 0.00 175.26 175.36 2vb5 s ARG 45 N -5.21 3.71 -0.58 1.61 3.52 -1.26 -0.84 118.95 119.91 2vb5 s ARG 45 Ca 0.56 0.13 -0.23 0.00 -0.13 0.00 0.00 55.73 56.06 2vb5 s ARG 45 Cb -0.11 -3.22 0.06 0.00 -1.56 0.00 0.00 34.95 30.11 2vb5 s ARG 45 CO 0.54 0.70 0.88 0.42 -0.81 0.00 0.00 175.30 177.03 2vb5 s ILE 46 N -0.95 4.47 -0.30 4.11 1.01 -1.18 -4.92 121.20 123.44 2vb5 s ILE 46 Ca 0.19 -0.11 -0.05 0.00 0.00 0.00 0.00 60.65 60.69 2vb5 s ILE 46 Cb -0.14 -4.54 -0.05 0.00 0.01 0.00 0.00 42.46 37.74 2vb5 s ILE 46 CO 0.08 -1.17 3.07 1.21 0.00 0.00 0.00 174.94 178.13 2vb5 n GLU 47 N 7.26 2.26 -2.71 2.79 4.07 -1.26 -4.00 120.64 129.05 2vb5 n GLU 47 Ca -0.02 -1.88 -0.07 0.00 -0.06 0.00 0.00 57.16 55.14 2vb5 n GLU 47 Cb 0.46 -2.09 0.07 0.00 -0.06 0.00 0.00 31.44 29.82 2vb5 n GLU 47 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 2vb5 n LYS 48 N 1.43 0.54 -2.75 5.31 4.81 -1.26 -5.12 118.16 121.12 2vb5 n LYS 48 Ca 0.47 -1.33 -0.43 0.00 -0.87 0.00 0.00 58.31 56.15 2vb5 n LYS 48 Cb 0.68 -0.89 -0.03 0.00 0.02 0.00 0.00 35.03 34.80 2vb5 n LYS 48 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2vb5 s VAL 49 N 0.39 4.42 -0.18 3.15 1.01 -1.26 -4.75 120.40 123.19 2vb5 s VAL 49 Ca 0.28 0.99 -0.16 0.00 0.00 0.00 0.00 61.98 63.09 2vb5 s VAL 49 Cb 0.24 -4.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 2vb5 s VAL 49 CO -0.17 -0.82 0.39 -1.61 0.00 0.00 0.00 175.10 172.90 2vb5 s GLU 50 N 3.89 4.22 -0.05 2.72 2.02 -1.22 -4.99 118.70 125.29 2vb5 s GLU 50 Ca 0.40 0.22 0.04 0.00 0.02 0.00 0.00 54.97 55.65 2vb5 s GLU 50 Cb -0.10 -3.50 -0.00 0.00 0.10 0.00 0.00 34.13 30.63 2vb5 s GLU 50 CO 0.26 0.05 -0.18 -3.38 0.02 0.00 0.00 175.26 172.03 2vb5 s HIS 51 N 1.02 1.79 0.00 1.61 -3.43 -1.26 -1.55 115.29 113.47 2vb5 s HIS 51 Ca 0.20 -0.52 0.00 0.00 -0.80 0.00 0.00 55.06 53.93 2vb5 s HIS 51 Cb -0.14 -1.21 0.00 0.00 -1.43 0.00 0.00 32.58 29.80 2vb5 s HIS 51 CO 0.07 -0.18 0.00 -1.13 -2.00 0.00 0.00 174.74 171.51 2vb5 n SER 52 N 3.14 0.00 -3.76 7.38 3.41 -1.06 -5.03 113.62 117.69 2vb5 n SER 52 Ca -0.18 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.30 2vb5 n SER 52 Cb 0.53 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.38 2vb5 n SER 52 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2vb5 s ASP 53 N -1.09 -0.28 -1.20 4.04 1.11 -1.26 -5.03 116.67 112.96 2vb5 s ASP 53 Ca 0.00 0.43 -0.19 0.00 0.18 0.00 0.00 52.55 52.97 2vb5 s ASP 53 Cb 0.00 0.53 -0.02 0.00 1.07 0.00 0.00 42.92 44.50 2vb5 s ASP 53 CO 0.00 -0.24 1.94 -0.11 1.18 0.00 0.00 175.17 177.94 2vb5 n LEU 54 N 2.29 4.75 -4.88 1.23 7.94 -1.26 -4.35 117.00 122.72 2vb5 n LEU 54 Ca -0.16 -3.58 -0.37 0.00 -1.11 0.00 0.00 56.01 50.78 2vb5 n LEU 54 Cb 0.57 -1.60 -0.06 0.00 0.53 0.00 0.00 43.42 42.86 2vb5 n LEU 54 CO 0.18 -0.22 -0.16 -0.44 -1.11 0.00 0.00 177.39 175.64 2vb5 s SER 55 N 4.70 6.40 -0.52 1.96 0.01 -1.26 -4.94 113.70 120.05 2vb5 s SER 55 Ca 0.57 0.48 -0.23 0.00 1.31 0.00 0.00 55.95 58.08 2vb5 s SER 55 Cb 0.07 -2.08 0.04 0.00 0.21 0.00 0.00 66.02 64.27 2vb5 s SER 55 CO 0.06 0.40 0.83 -0.36 0.41 0.00 0.00 173.24 174.58 2vb5 s PHE 56 N -1.00 2.90 0.12 2.43 0.08 -1.26 -2.16 117.98 119.08 2vb5 s PHE 56 Ca 0.15 -0.10 -0.19 0.00 0.12 0.00 0.00 56.93 56.91 2vb5 s PHE 56 Cb -0.12 -3.84 -0.06 0.00 -0.57 0.00 0.00 43.02 38.43 2vb5 s PHE 56 CO 0.04 -1.19 1.71 1.03 -0.10 0.00 0.00 175.22 176.72 2vb5 h SER 57 N 9.16 0.31 -0.47 1.36 0.87 -1.70 -3.39 113.55 119.69 2vb5 h SER 57 Ca -0.26 -0.09 -0.29 0.00 -1.23 0.00 0.00 61.79 59.92 2vb5 h SER 57 Cb 1.08 -0.08 -0.24 0.00 -0.44 0.00 0.00 62.40 62.73 2vb5 h SER 57 CO 1.03 0.31 -0.66 2.29 -0.53 0.00 0.00 176.83 179.26 2vb5 n LYS 58 N -4.85 1.11 -3.15 2.24 2.85 -1.26 -5.04 118.16 110.06 2vb5 n LYS 58 Ca -0.03 -2.35 -0.22 0.00 -1.05 0.00 0.00 58.31 54.66 2vb5 n LYS 58 Cb 0.08 -0.76 0.02 0.00 -0.65 0.00 0.00 35.03 33.72 2vb5 n LYS 58 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2vb5 n ASP 59 N -0.13 -6.83 0.00 -5.58 -0.08 -1.26 -4.79 116.55 97.88 2vb5 n ASP 59 Ca 0.05 0.22 0.00 0.00 -1.51 0.00 0.00 54.79 53.55 2vb5 n ASP 59 Cb 0.78 -3.68 0.00 0.00 2.34 0.00 0.00 41.12 40.56 2vb5 n ASP 59 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2vb5 n GLY 60 N -0.25 0.71 0.00 0.27 0.00 -1.26 -5.13 105.19 99.52 2vb5 n GLY 60 Ca 0.02 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.30 2vb5 n GLY 60 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2vb5 n SER 61 N 0.00 0.00 -4.45 1.61 3.41 -1.26 -4.98 113.62 107.95 2vb5 n SER 61 Ca 0.00 0.00 -0.44 0.00 -0.26 0.00 0.00 58.87 58.17 2vb5 n SER 61 Cb 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 2vb5 n SER 61 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2vb5 s PHE 62 N 0.00 3.13 -0.81 7.33 0.08 -1.26 -1.67 117.98 124.79 2vb5 s PHE 62 Ca 0.00 -0.57 -0.18 0.00 0.12 0.00 0.00 56.93 56.30 2vb5 s PHE 62 Cb 0.00 -3.24 0.14 0.00 -0.57 0.00 0.00 43.02 39.35 2vb5 s PHE 62 CO 0.00 -0.87 0.94 1.52 -0.10 0.00 0.00 175.22 176.71 2vb5 s TYR 63 N 2.24 3.20 -0.19 0.36 1.13 -0.92 -1.98 117.35 121.18 2vb5 s TYR 63 Ca 0.12 -1.35 -0.01 0.00 -1.41 0.00 0.00 57.07 54.41 2vb5 s TYR 63 Cb -0.20 -4.12 0.01 0.00 -1.10 0.00 0.00 41.96 36.55 2vb5 s TYR 63 CO 0.11 -1.35 -0.14 -1.17 -2.51 0.00 0.00 175.55 170.50 2vb5 s LEU 64 N 2.24 2.43 -0.02 -3.49 0.20 -0.92 -4.35 118.68 114.77 2vb5 s LEU 64 Ca 0.24 -0.55 -0.22 0.00 0.69 0.00 0.00 54.13 54.29 2vb5 s LEU 64 Cb -0.12 -1.58 -0.05 0.00 -0.43 0.00 0.00 46.19 44.02 2vb5 s LEU 64 CO -0.04 -0.01 0.65 -0.22 -0.29 0.00 0.00 176.35 176.45 2vb5 s LEU 65 N 1.35 4.38 -0.50 -0.68 2.96 -1.26 -1.81 118.68 123.12 2vb5 s LEU 65 Ca 0.05 1.19 0.04 0.00 -0.22 0.00 0.00 54.13 55.19 2vb5 s LEU 65 Cb -0.14 -3.01 0.13 0.00 0.50 0.00 0.00 46.19 43.67 2vb5 s LEU 65 CO -0.09 0.01 0.24 -0.31 -1.32 0.00 0.00 176.35 174.88 2vb5 s TYR 66 N 0.23 3.07 -0.18 5.38 2.02 -0.66 -2.55 117.35 124.65 2vb5 s TYR 66 Ca 0.34 -3.07 -0.02 0.00 -0.37 0.00 0.00 57.07 53.95 2vb5 s TYR 66 Cb -0.18 -2.71 -0.01 0.00 -0.40 0.00 0.00 41.96 38.66 2vb5 s TYR 66 CO 0.18 -0.76 -0.09 1.52 -1.57 0.00 0.00 175.55 174.83 2vb5 s TYR 67 N -0.13 2.89 0.16 2.71 -0.85 -0.59 -3.60 117.35 117.94 2vb5 s TYR 67 Ca 0.17 -0.90 0.03 0.00 -0.52 0.00 0.00 57.07 55.85 2vb5 s TYR 67 Cb -0.25 -1.99 0.03 0.00 0.38 0.00 0.00 41.96 40.13 2vb5 s TYR 67 CO -0.01 -0.44 0.22 -2.37 -1.52 0.00 0.00 175.55 171.43 2vb5 n THR 68 N 4.29 0.00 -3.69 -3.49 5.66 -1.25 -3.41 114.28 112.38 2vb5 n THR 68 Ca -0.18 -0.54 -0.30 0.00 -3.05 0.00 0.00 64.05 59.98 2vb5 n THR 68 Cb 0.51 -0.86 -0.14 0.00 -1.55 0.00 0.00 70.33 68.30 2vb5 n THR 68 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 2vb5 s GLU 69 N -2.73 0.90 0.22 1.09 2.12 -1.26 -2.90 118.70 116.13 2vb5 s GLU 69 Ca 0.17 -1.46 -0.07 0.00 0.36 0.00 0.00 54.97 53.97 2vb5 s GLU 69 Cb -0.01 -2.01 -0.06 0.00 0.26 0.00 0.00 34.13 32.30 2vb5 s GLU 69 CO 0.11 -1.08 0.49 -0.59 -0.54 0.00 0.00 175.26 173.65 2vb5 s PHE 70 N 1.07 3.45 -0.65 5.30 -0.71 -0.40 -4.85 117.98 121.19 2vb5 s PHE 70 Ca 0.14 0.72 -0.14 0.00 -1.04 0.00 0.00 56.93 56.61 2vb5 s PHE 70 Cb -0.21 -2.14 0.17 0.00 -1.21 0.00 0.00 43.02 39.63 2vb5 s PHE 70 CO -0.12 0.30 0.58 0.99 -1.34 0.00 0.00 175.22 175.63 2vb5 s THR 71 N -1.83 5.15 0.11 -4.49 2.01 -1.26 -1.12 115.64 114.21 2vb5 s THR 71 Ca 0.45 -2.00 -0.31 0.00 0.31 0.00 0.00 61.69 60.13 2vb5 s THR 71 Cb -0.11 -4.26 -0.08 0.00 0.01 0.00 0.00 72.50 68.06 2vb5 s THR 71 CO 0.24 -0.92 1.39 -2.16 -0.69 0.00 0.00 174.62 172.48 2vb5 s PRO 72 N 0.91 4.32 0.00 4.92 0.04 -1.26 -4.95 135.00 138.98 2vb5 s PRO 72 Ca 0.10 2.07 0.00 0.00 0.04 0.00 0.00 61.00 63.21 2vb5 s PRO 72 Cb -0.21 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.07 2vb5 s PRO 72 CO -0.02 -0.44 0.00 0.25 0.04 0.00 0.00 177.00 176.83 2vb5 n THR 73 N 3.96 0.00 0.04 1.26 -2.24 -1.26 -0.87 114.28 115.17 2vb5 n THR 73 Ca 0.11 0.14 0.00 0.00 -2.27 0.00 0.00 64.05 62.03 2vb5 n THR 73 Cb 0.42 -0.70 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 2vb5 n THR 73 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2vb5 n GLU 74 N -1.25 0.00 -1.56 -0.78 2.13 -1.26 -2.86 120.64 115.06 2vb5 n GLU 74 Ca 0.00 0.00 -0.31 0.00 0.66 0.00 0.00 57.16 57.51 2vb5 n GLU 74 Cb 0.00 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 31.66 2vb5 n GLU 74 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2vb5 n LYS 75 N -2.42 3.34 -2.90 5.31 4.81 -1.26 -4.93 118.16 120.10 2vb5 n LYS 75 Ca 0.00 -2.50 -0.19 0.00 -0.87 0.00 0.00 58.31 54.75 2vb5 n LYS 75 Cb 0.00 -2.40 0.03 0.00 0.02 0.00 0.00 35.03 32.68 2vb5 n LYS 75 CO 0.00 0.00 0.00 0.16 1.17 0.00 0.00 177.40 178.73 2vb5 s ASP 76 N 0.92 5.43 -0.46 3.14 -4.77 -1.26 -5.11 116.67 114.56 2vb5 s ASP 76 Ca 0.60 -0.37 0.04 0.00 -3.30 0.00 0.00 52.55 49.52 2vb5 s ASP 76 Cb 0.27 -0.55 0.19 0.00 -1.09 0.00 0.00 42.92 41.74 2vb5 s ASP 76 CO -0.12 -0.98 0.80 -1.83 0.70 0.00 0.00 175.17 173.74 2vb5 s GLU 77 N -4.53 0.84 0.41 2.11 1.03 -1.26 -5.08 118.70 112.21 2vb5 s GLU 77 Ca 0.57 -0.75 -0.13 0.00 0.03 0.00 0.00 54.97 54.69 2vb5 s GLU 77 Cb -0.09 -0.02 -0.07 0.00 -0.80 0.00 0.00 34.13 33.15 2vb5 s GLU 77 CO 0.36 -1.06 0.81 0.71 -1.33 0.00 0.00 175.26 174.74 2vb5 s TYR 78 N 1.08 3.44 -0.25 4.83 2.02 -1.26 -2.65 117.35 124.56 2vb5 s TYR 78 Ca 0.26 1.18 -0.19 0.00 -0.37 0.00 0.00 57.07 57.95 2vb5 s TYR 78 Cb 0.02 -2.54 0.07 0.00 -0.40 0.00 0.00 41.96 39.11 2vb5 s TYR 78 CO -0.07 -0.11 0.64 0.00 -1.57 0.00 0.00 175.55 174.44 2vb5 s ALA 79 N -2.32 -1.64 -0.09 3.71 0.00 -1.22 -3.54 121.76 116.66 2vb5 s ALA 79 Ca 0.54 2.01 -0.21 0.00 0.00 0.00 0.00 51.96 54.30 2vb5 s ALA 79 Cb -0.10 -1.18 -0.04 0.00 0.00 0.00 0.00 23.12 21.80 2vb5 s ALA 79 CO 0.27 -0.33 0.59 0.00 0.00 0.00 0.00 175.76 176.30 2vb5 s ARG 81 N 0.64 3.50 -0.68 0.00 6.06 -1.26 -1.30 118.95 125.92 2vb5 s ARG 81 Ca 0.32 -0.41 0.04 0.00 -2.50 0.00 0.00 55.73 53.17 2vb5 s ARG 81 Cb -0.17 -3.83 0.16 0.00 0.06 0.00 0.00 34.95 31.18 2vb5 s ARG 81 CO 0.14 -0.60 0.46 0.08 -2.50 0.00 0.00 175.30 172.88 2vb5 s VAL 82 N 2.12 2.98 0.06 7.11 1.01 -0.82 -2.38 120.40 130.48 2vb5 s VAL 82 Ca 0.13 -4.00 -0.06 0.00 0.00 0.00 0.00 61.98 58.06 2vb5 s VAL 82 Cb -0.16 -2.96 -0.05 0.00 0.00 0.00 0.00 36.38 33.20 2vb5 s VAL 82 CO 0.12 -0.96 0.32 0.20 0.00 0.00 0.00 175.10 174.78 2vb5 s ASN 83 N -1.03 6.51 0.29 3.32 -0.87 -1.08 -3.91 114.94 118.17 2vb5 s ASN 83 Ca 0.23 0.59 -0.20 0.00 -1.57 0.00 0.00 52.86 51.91 2vb5 s ASN 83 Cb -0.10 -2.10 0.03 0.00 -0.02 0.00 0.00 41.25 39.06 2vb5 s ASN 83 CO -0.12 0.17 0.74 -2.28 -2.57 0.00 0.00 177.10 173.04 2vb5 s HIS 84 N -1.44 -0.15 0.35 2.20 2.46 -1.26 -1.45 115.29 116.01 2vb5 s HIS 84 Ca 0.33 -0.34 0.12 0.00 0.47 0.00 0.00 55.06 55.65 2vb5 s HIS 84 Cb -0.13 0.72 0.65 0.00 -0.13 0.00 0.00 32.58 33.69 2vb5 s HIS 84 CO 0.20 -1.26 1.78 0.28 -2.47 0.00 0.00 174.74 173.27 2vb5 h VAL 85 N 2.00 1.30 -0.04 0.89 2.07 -1.91 0.90 116.25 121.46 2vb5 h VAL 85 Ca -0.21 -1.45 -0.06 0.00 0.82 0.00 0.00 66.70 65.80 2vb5 h VAL 85 Cb 1.25 1.78 0.00 0.00 -1.52 0.00 0.00 31.29 32.80 2vb5 h VAL 85 CO 0.25 0.41 -0.20 0.71 0.02 0.00 0.00 177.57 178.76 2vb5 h THR 86 N 0.00 1.48 0.05 2.57 1.35 -1.93 -3.39 112.91 113.03 2vb5 h THR 86 Ca -0.00 -1.71 -0.00 0.00 -0.55 0.00 0.00 66.41 64.15 2vb5 h THR 86 Cb 0.75 2.48 0.00 0.00 -1.73 0.00 0.00 68.15 69.65 2vb5 h THR 86 CO 0.05 0.47 -0.02 -0.07 -0.25 0.00 0.00 175.52 175.70 2vb5 h LEU 87 N -0.38 -0.05 0.00 3.87 3.38 -1.91 -3.47 115.31 116.74 2vb5 h LEU 87 Ca -0.02 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2vb5 h LEU 87 Cb 0.88 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.64 2vb5 h LEU 87 CO 0.04 0.52 0.00 -0.24 0.09 0.00 0.00 178.44 178.85 2vb5 n SER 88 N -4.80 0.00 -4.81 -0.43 2.88 0.30 -4.93 113.62 101.84 2vb5 n SER 88 Ca -0.03 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.19 2vb5 n SER 88 Cb 0.11 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.57 2vb5 n SER 88 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2vb5 s GLN 89 N 0.00 3.42 -0.72 -1.46 -0.21 -1.26 -4.73 119.66 114.69 2vb5 s GLN 89 Ca 0.00 1.17 -0.26 0.00 0.02 0.00 0.00 55.36 56.29 2vb5 s GLN 89 Cb 0.00 -2.05 -0.03 0.00 1.00 0.00 0.00 33.01 31.93 2vb5 s GLN 89 CO 0.00 -0.72 1.89 -1.25 -2.12 0.00 0.00 175.29 173.09 2vb5 s PRO 90 N -4.06 2.61 -0.80 2.91 0.04 -1.26 -4.53 135.00 129.90 2vb5 s PRO 90 Ca 0.63 0.26 -0.20 0.00 0.04 0.00 0.00 61.00 61.73 2vb5 s PRO 90 Cb -0.15 -4.65 0.12 0.00 0.04 0.00 0.00 34.50 29.86 2vb5 s PRO 90 CO 0.36 -2.97 1.00 0.21 0.04 0.00 0.00 177.00 175.64 2vb5 s LYS 91 N 7.01 3.39 -0.69 4.56 2.36 -1.25 -4.98 119.74 130.14 2vb5 s LYS 91 Ca 0.68 -1.49 -0.27 0.00 -2.55 0.00 0.00 55.97 52.34 2vb5 s LYS 91 Cb -0.10 -4.62 0.04 0.00 -1.05 0.00 0.00 37.83 32.10 2vb5 s LYS 91 CO 0.12 -1.73 1.21 0.42 1.55 0.00 0.00 175.35 176.93 2vb5 s ILE 92 N 2.91 3.88 0.21 5.43 -1.09 -1.26 -1.94 121.20 129.34 2vb5 s ILE 92 Ca 0.26 0.41 -0.30 0.00 -2.23 0.00 0.00 60.65 58.79 2vb5 s ILE 92 Cb -0.11 -4.84 -0.08 0.00 -1.58 0.00 0.00 42.46 35.85 2vb5 s ILE 92 CO -0.02 -1.68 0.98 -0.69 -1.23 0.00 0.00 174.94 172.30 2vb5 s VAL 93 N 5.30 4.09 -0.53 2.92 1.01 -0.42 -4.97 120.40 127.79 2vb5 s VAL 93 Ca 0.35 1.98 -0.18 0.00 0.00 0.00 0.00 61.98 64.12 2vb5 s VAL 93 Cb -0.09 -4.26 0.08 0.00 0.00 0.00 0.00 36.38 32.11 2vb5 s VAL 93 CO 0.17 0.42 0.62 -0.54 0.00 0.00 0.00 175.10 175.77 2vb5 s LYS 94 N -0.86 3.07 -0.09 2.72 1.02 -1.26 -3.07 119.74 121.27 2vb5 s LYS 94 Ca 0.43 -1.15 -0.39 0.00 0.02 0.00 0.00 55.97 54.88 2vb5 s LYS 94 Cb -0.26 -4.18 -0.17 0.00 -0.52 0.00 0.00 37.83 32.70 2vb5 s LYS 94 CO 0.33 -1.32 1.45 1.87 -0.92 0.00 0.00 175.35 176.76 2vb5 n TRP 95 N 6.05 1.59 -2.28 3.18 -0.00 -1.23 -4.85 117.44 119.90 2vb5 n TRP 95 Ca -0.09 0.71 -0.43 0.00 -0.00 0.00 0.00 57.50 57.69 2vb5 n TRP 95 Cb 0.44 -2.33 0.00 0.00 -0.00 0.00 0.00 31.31 29.42 2vb5 n TRP 95 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 177.69 177.44 2vb5 n ASP 96 N 3.42 4.62 0.16 5.87 9.92 -0.78 -4.70 116.55 135.05 2vb5 n ASP 96 Ca 0.22 -2.94 0.01 0.00 -0.53 0.00 0.00 54.79 51.56 2vb5 n ASP 96 Cb 0.13 -1.64 0.24 0.00 -0.64 0.00 0.00 41.12 39.21 2vb5 n ASP 96 CO 0.00 0.00 0.00 0.08 0.13 0.00 0.00 177.20 177.41 2vb5 h ARG 97 N 6.58 0.00 -3.36 -1.24 -0.00 -1.89 -3.36 114.38 111.12 2vb5 h ARG 97 Ca 0.46 0.00 -0.72 0.00 -0.00 0.00 0.00 59.98 59.73 2vb5 h ARG 97 Cb 0.74 0.00 -0.06 0.00 -0.00 0.00 0.00 29.97 30.65 2vb5 h ARG 97 CO 1.62 0.52 2.93 -3.47 -0.00 0.00 0.00 179.97 181.57 2vb5 n ASP 98 N -3.73 6.23 0.00 0.08 -0.08 -1.26 -4.84 116.55 112.95 2vb5 n ASP 98 Ca -0.01 -2.89 0.00 0.00 -1.51 0.00 0.00 54.79 50.38 2vb5 n ASP 98 Cb 0.57 -1.53 0.00 0.00 2.34 0.00 0.00 41.12 42.49 2vb5 n ASP 98 CO 0.00 0.00 0.00 0.80 0.12 0.00 0.00 177.20 178.12