#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jvo s GLU 2 N 0.00 3.67 -1.29 0.00 2.12 -1.26 -4.51 118.70 117.44 1jvo s GLU 2 Ca 0.00 -0.48 -0.02 0.00 0.36 0.00 0.00 54.97 54.83 1jvo s GLU 2 Cb 0.00 -3.22 0.00 0.00 0.26 0.00 0.00 34.13 31.17 1jvo s GLU 2 CO 0.00 -0.07 0.21 0.00 -0.54 0.00 0.00 175.26 174.86 1jvo s SER 4 N -2.50 -0.45 -0.01 0.00 1.04 -1.26 -2.10 113.70 108.42 1jvo s SER 4 Ca 0.10 0.37 -0.07 0.00 0.48 0.00 0.00 55.95 56.84 1jvo s SER 4 Cb -0.05 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.47 1jvo s SER 4 CO 0.13 -0.50 0.13 0.54 0.98 0.00 0.00 173.24 174.52 1jvo s VAL 5 N -1.72 0.07 -0.27 5.02 0.11 -0.64 -3.53 120.40 119.44 1jvo s VAL 5 Ca -0.02 -0.59 -0.06 0.00 -2.93 0.00 0.00 61.98 58.38 1jvo s VAL 5 Cb -0.00 -0.39 0.00 0.00 -1.53 0.00 0.00 36.38 34.46 1jvo s VAL 5 CO 0.00 -0.32 0.05 -1.81 -3.33 0.00 0.00 175.10 169.69 1jvo s ASP 6 N -1.14 4.94 0.05 3.54 1.11 -1.26 -1.61 116.67 122.30 1jvo s ASP 6 Ca -0.12 -0.60 0.08 0.00 0.18 0.00 0.00 52.55 52.09 1jvo s ASP 6 Cb -0.07 -1.85 -0.03 0.00 1.07 0.00 0.00 42.92 42.05 1jvo s ASP 6 CO 0.01 -0.14 -0.22 -0.51 1.18 0.00 0.00 175.17 175.50 1jvo s ILE 7 N 1.50 1.75 0.10 0.77 2.07 -0.49 -4.99 121.20 121.92 1jvo s ILE 7 Ca 0.03 -1.28 0.08 0.00 -1.41 0.00 0.00 60.65 58.08 1jvo s ILE 7 Cb -0.16 -1.53 -0.03 0.00 0.13 0.00 0.00 42.46 40.86 1jvo s ILE 7 CO 0.01 0.20 -0.21 -1.10 -1.91 0.00 0.00 174.94 171.93 1jvo s GLN 8 N -1.29 1.14 -0.22 3.50 -0.21 -1.26 -2.31 119.66 119.01 1jvo s GLN 8 Ca 0.08 -1.16 0.01 0.00 0.02 0.00 0.00 55.36 54.31 1jvo s GLN 8 Cb -0.09 -1.42 0.05 0.00 1.00 0.00 0.00 33.01 32.56 1jvo s GLN 8 CO 0.02 0.33 -0.08 0.20 -2.12 0.00 0.00 175.29 173.64 1jvo s GLY 9 N -1.89 1.31 0.62 3.09 0.00 -0.76 -1.86 107.32 107.82 1jvo s GLY 9 Ca 0.07 -1.32 0.07 0.00 0.00 0.00 0.00 44.72 43.54 1jvo s GLY 9 CO 0.04 0.79 0.85 1.16 0.00 0.00 0.00 173.10 175.95 1jvo n ASN 10 N 4.65 1.94 0.27 1.64 0.23 -1.02 -3.84 115.26 119.14 1jvo n ASN 10 Ca -0.13 -2.45 0.17 0.00 -0.53 0.00 0.00 54.58 51.64 1jvo n ASN 10 Cb 0.45 -0.48 0.67 0.00 -2.08 0.00 0.00 39.78 38.34 1jvo n ASN 10 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1jvo h ASP 11 N -0.06 0.00 -0.01 0.53 3.32 -1.91 -2.57 116.42 115.72 1jvo h ASP 11 Ca -0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.77 1jvo h ASP 11 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 1jvo h ASP 11 CO 0.38 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.90 1jvo n GLN 12 N -3.07 1.03 -3.60 3.56 3.00 -1.26 -4.85 117.38 112.19 1jvo n GLN 12 Ca 0.01 -0.03 -0.22 0.00 -0.01 0.00 0.00 57.00 56.75 1jvo n GLN 12 Cb 0.31 -1.26 0.07 0.00 0.00 0.00 0.00 30.24 29.36 1jvo n GLN 12 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.06 176.94 1jvo n MET 13 N -0.23 -6.91 -4.00 -1.09 1.56 -0.97 -5.02 117.12 100.47 1jvo n MET 13 Ca 0.00 0.78 -0.12 0.00 -0.27 0.00 0.00 57.70 58.10 1jvo n MET 13 Cb 0.14 -5.75 -0.12 0.00 2.15 0.00 0.00 33.22 29.63 1jvo n MET 13 CO 0.00 0.00 0.00 -0.65 -0.73 0.00 0.00 175.97 174.59 1jvo s GLN 14 N -6.02 0.30 0.50 2.12 -0.21 -1.26 -4.40 119.66 110.69 1jvo s GLN 14 Ca 0.35 -0.41 -0.05 0.00 0.02 0.00 0.00 55.36 55.27 1jvo s GLN 14 Cb -0.16 -0.10 -0.03 0.00 1.00 0.00 0.00 33.01 33.73 1jvo s GLN 14 CO 0.75 0.01 0.80 -0.06 -2.12 0.00 0.00 175.29 174.68 1jvo s PHE 15 N -0.82 3.48 -0.44 0.91 0.08 -1.26 -2.42 117.98 117.51 1jvo s PHE 15 Ca -0.07 0.74 0.01 0.00 0.12 0.00 0.00 56.93 57.73 1jvo s PHE 15 Cb -0.06 -2.39 0.45 0.00 -0.57 0.00 0.00 43.02 40.46 1jvo s PHE 15 CO -0.00 -0.39 1.87 0.27 -0.10 0.00 0.00 175.22 176.87 1jvo n ASN 16 N -2.31 5.30 0.00 1.36 6.94 -0.78 -4.87 115.26 120.90 1jvo n ASN 16 Ca 0.01 -3.39 0.00 0.00 -0.02 0.00 0.00 54.58 51.18 1jvo n ASN 16 Cb 0.56 -0.88 0.00 0.00 -2.36 0.00 0.00 39.78 37.09 1jvo n ASN 16 CO 0.00 0.00 0.00 1.07 -1.03 0.00 0.00 177.26 177.30 1jvo n THR 17 N -0.64 0.00 -0.73 5.53 5.66 -1.26 -4.90 114.28 117.93 1jvo n THR 17 Ca 0.49 0.00 0.02 0.00 -3.05 0.00 0.00 64.05 61.51 1jvo n THR 17 Cb 1.06 0.00 0.03 0.00 -1.55 0.00 0.00 70.33 69.87 1jvo n THR 17 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1jvo n ASN 18 N 0.00 1.32 -3.73 1.09 0.23 -1.26 -4.88 115.26 108.02 1jvo n ASN 18 Ca 0.00 -1.98 -0.13 0.00 -0.53 0.00 0.00 54.58 51.93 1jvo n ASN 18 Cb 0.00 -0.12 -0.14 0.00 -2.08 0.00 0.00 39.78 37.44 1jvo n ASN 18 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1jvo s ALA 19 N -1.02 -0.39 -0.04 -2.53 0.00 -1.26 -1.27 121.76 115.25 1jvo s ALA 19 Ca 0.07 0.82 0.05 0.00 0.00 0.00 0.00 51.96 52.89 1jvo s ALA 19 Cb 0.06 -0.56 -0.01 0.00 0.00 0.00 0.00 23.12 22.61 1jvo s ALA 19 CO 0.01 -0.20 -0.18 0.42 0.00 0.00 0.00 175.76 175.81 1jvo s ILE 20 N 1.29 1.47 -0.15 0.00 1.01 -0.14 -4.98 121.20 119.70 1jvo s ILE 20 Ca -0.09 -0.75 0.01 0.00 0.00 0.00 0.00 60.65 59.82 1jvo s ILE 20 Cb -0.11 -1.25 -0.00 0.00 0.01 0.00 0.00 42.46 41.10 1jvo s ILE 20 CO -0.07 0.42 -0.16 -0.89 0.00 0.00 0.00 174.94 174.24 1jvo s THR 21 N -0.06 2.61 -0.31 2.92 2.01 -1.26 -0.74 115.64 120.80 1jvo s THR 21 Ca -0.02 -0.79 -0.09 0.00 0.31 0.00 0.00 61.69 61.10 1jvo s THR 21 Cb -0.11 -2.09 -0.00 0.00 0.01 0.00 0.00 72.50 70.31 1jvo s THR 21 CO 0.02 0.52 0.13 -0.69 -0.69 0.00 0.00 174.62 173.91 1jvo s VAL 22 N 0.74 4.42 0.21 3.82 1.01 0.11 -4.96 120.40 125.75 1jvo s VAL 22 Ca -0.07 -0.51 -0.31 0.00 0.00 0.00 0.00 61.98 61.10 1jvo s VAL 22 Cb -0.16 -3.27 -0.10 0.00 0.00 0.00 0.00 36.38 32.86 1jvo s VAL 22 CO 0.01 0.06 1.47 -0.62 0.00 0.00 0.00 175.10 176.02 1jvo s ASP 23 N 1.58 6.66 0.52 3.32 -1.08 -1.26 -2.34 116.67 124.06 1jvo s ASP 23 Ca 0.04 2.61 0.20 0.00 -0.52 0.00 0.00 52.55 54.89 1jvo s ASP 23 Cb -0.17 -2.61 1.36 0.00 -1.46 0.00 0.00 42.92 40.04 1jvo s ASP 23 CO 0.05 -0.73 2.12 0.11 0.52 0.00 0.00 175.17 177.25 1jvo h LYS 24 N 5.72 0.00 0.00 4.34 1.57 -1.42 -2.42 116.57 124.35 1jvo h LYS 24 Ca -0.45 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.33 1jvo h LYS 24 Cb 1.21 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.52 1jvo h LYS 24 CO 0.82 0.07 -0.02 0.66 -0.57 0.00 0.00 179.45 180.41 1jvo h SER 25 N 0.00 0.00 -3.69 0.86 4.64 -1.91 -3.44 113.55 110.01 1jvo h SER 25 Ca -0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 1jvo h SER 25 Cb 0.13 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.27 1jvo h SER 25 CO 0.01 0.02 0.64 0.00 -0.87 0.00 0.00 176.83 176.63 1jvo h LYS 27 N 4.09 0.29 -4.51 0.00 6.56 -1.89 -3.43 116.57 117.68 1jvo h LYS 27 Ca -0.47 -0.44 -0.20 0.00 -1.06 0.00 0.00 60.65 58.47 1jvo h LYS 27 Cb 1.22 0.16 -0.16 0.00 -0.57 0.00 0.00 32.23 32.88 1jvo h LYS 27 CO 0.70 1.18 -0.70 1.14 -2.06 0.00 0.00 179.45 179.71 1jvo s GLN 28 N -2.59 0.71 0.07 3.15 -2.07 -1.26 -0.77 119.66 116.90 1jvo s GLN 28 Ca -0.14 -1.19 0.09 0.00 -1.82 0.00 0.00 55.36 52.31 1jvo s GLN 28 Cb 0.01 -0.10 -0.03 0.00 -1.09 0.00 0.00 33.01 31.79 1jvo s GLN 28 CO 0.81 -0.03 -0.25 0.12 -1.32 0.00 0.00 175.29 174.62 1jvo s PHE 29 N -3.25 2.22 -0.02 9.60 5.36 0.25 -4.83 117.98 127.30 1jvo s PHE 29 Ca 0.06 -0.40 0.06 0.00 -0.96 0.00 0.00 56.93 55.69 1jvo s PHE 29 Cb 0.03 -1.28 -0.01 0.00 -0.34 0.00 0.00 43.02 41.41 1jvo s PHE 29 CO -0.05 0.19 -0.21 0.99 -1.46 0.00 0.00 175.22 174.68 1jvo s THR 30 N -0.90 1.64 -0.11 0.12 2.01 -0.89 -1.17 115.64 116.33 1jvo s THR 30 Ca 0.11 -0.87 0.03 0.00 0.31 0.00 0.00 61.69 61.27 1jvo s THR 30 Cb -0.10 -1.37 0.00 0.00 0.01 0.00 0.00 72.50 71.05 1jvo s THR 30 CO 0.03 0.46 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.51 1jvo s VAL 31 N -0.39 2.09 -0.28 3.82 1.01 0.12 -1.61 120.40 125.16 1jvo s VAL 31 Ca 0.05 -0.99 -0.02 0.00 0.00 0.00 0.00 61.98 61.02 1jvo s VAL 31 Cb -0.09 -1.81 0.04 0.00 0.00 0.00 0.00 36.38 34.52 1jvo s VAL 31 CO -0.00 0.56 -0.02 0.20 0.00 0.00 0.00 175.10 175.84 1jvo s ASN 32 N 0.50 4.73 -0.13 3.32 0.01 -0.63 -1.68 114.94 121.06 1jvo s ASN 32 Ca -0.15 -1.15 -0.08 0.00 -0.71 0.00 0.00 52.86 50.77 1jvo s ASN 32 Cb -0.17 -1.70 -0.04 0.00 0.41 0.00 0.00 41.25 39.75 1jvo s ASN 32 CO 0.05 -0.22 0.15 -0.22 -1.51 0.00 0.00 177.10 175.36 1jvo s LEU 33 N 1.28 4.36 0.02 0.60 2.96 0.62 -1.40 118.68 127.11 1jvo s LEU 33 Ca -0.04 0.45 -0.01 0.00 -0.22 0.00 0.00 54.13 54.31 1jvo s LEU 33 Cb -0.19 -2.10 -0.02 0.00 0.50 0.00 0.00 46.19 44.38 1jvo s LEU 33 CO -0.02 0.36 -0.00 -0.94 -1.32 0.00 0.00 176.35 174.43 1jvo s SER 34 N -0.76 0.19 -0.49 3.68 1.04 -0.98 -1.22 113.70 115.16 1jvo s SER 34 Ca 0.14 -0.42 0.01 0.00 0.48 0.00 0.00 55.95 56.17 1jvo s SER 34 Cb -0.12 0.11 0.13 0.00 0.10 0.00 0.00 66.02 66.24 1jvo s SER 34 CO 0.03 -0.29 0.25 -2.28 0.98 0.00 0.00 173.24 171.94 1jvo s HIS 35 N -1.35 3.43 -1.87 5.02 2.46 -1.14 -1.83 115.29 120.02 1jvo s HIS 35 Ca -0.15 -2.90 0.00 0.00 0.47 0.00 0.00 55.06 52.48 1jvo s HIS 35 Cb -0.09 -3.01 0.00 0.00 -0.13 0.00 0.00 32.58 29.35 1jvo s HIS 35 CO -0.01 -0.85 0.87 -0.35 -2.47 0.00 0.00 174.74 171.94 1jvo n PRO 36 N 3.69 0.93 -0.02 2.88 -0.04 -1.25 -0.83 135.00 140.36 1jvo n PRO 36 Ca 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1jvo n PRO 36 Cb 0.37 -1.06 0.00 0.00 -0.04 0.00 0.00 33.50 32.77 1jvo n PRO 36 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1jvo n GLY 37 N 0.38 -0.49 0.00 0.55 0.00 -1.26 -4.90 105.19 99.46 1jvo n GLY 37 Ca 0.00 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.34 1jvo n GLY 37 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1jvo n ASN 38 N -0.44 3.74 -4.76 1.61 5.03 -1.26 -4.23 115.26 114.95 1jvo n ASN 38 Ca 0.00 0.00 -0.40 0.00 0.87 0.00 0.00 54.58 55.05 1jvo n ASN 38 Cb 0.00 0.56 -0.03 0.00 -1.02 0.00 0.00 39.78 39.29 1jvo n ASN 38 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1jvo s LEU 39 N -2.74 4.47 0.79 3.41 1.43 -1.26 -4.75 118.68 120.03 1jvo s LEU 39 Ca 0.00 2.47 -0.11 0.00 -1.03 0.00 0.00 54.13 55.46 1jvo s LEU 39 Cb 0.00 -3.67 0.07 0.00 0.03 0.00 0.00 46.19 42.62 1jvo s LEU 39 CO 0.00 -0.36 1.09 -2.16 0.23 0.00 0.00 176.35 175.15 1jvo s PRO 40 N -1.67 2.10 0.47 1.29 0.04 -1.26 -2.09 135.00 133.88 1jvo s PRO 40 Ca 0.47 0.92 0.34 0.00 0.04 0.00 0.00 61.00 62.77 1jvo s PRO 40 Cb -0.35 -1.90 1.47 0.00 0.04 0.00 0.00 34.50 33.76 1jvo s PRO 40 CO 0.46 -1.68 1.65 -0.22 0.04 0.00 0.00 177.00 177.25 1jvo h LYS 41 N -1.15 0.09 0.45 4.56 3.64 -1.88 -1.96 116.57 120.32 1jvo h LYS 41 Ca -0.46 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 58.90 1jvo h LYS 41 Cb 1.25 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.03 1jvo h LYS 41 CO 0.55 0.06 -0.42 0.00 -2.27 0.00 0.00 179.45 177.36 1jvo h VAL 43 N -0.86 1.23 -0.51 0.00 2.07 -1.80 -3.41 116.25 112.97 1jvo h VAL 43 Ca -0.06 -2.71 -0.33 0.00 0.82 0.00 0.00 66.70 64.42 1jvo h VAL 43 Cb 0.74 2.96 -0.40 0.00 -1.52 0.00 0.00 31.29 33.07 1jvo h VAL 43 CO -0.04 0.83 -1.01 0.80 0.02 0.00 0.00 177.57 178.17 1jvo n MET 44 N -3.65 2.28 -2.46 1.57 0.00 -0.79 -5.04 117.12 109.03 1jvo n MET 44 Ca -0.17 -3.67 -0.34 0.00 -0.00 0.00 0.00 57.70 53.51 1jvo n MET 44 Cb 1.09 -1.78 -0.02 0.00 0.00 0.00 0.00 33.22 32.51 1jvo n MET 44 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 1jvo s GLY 45 N -3.68 2.55 0.06 -5.12 0.00 -1.02 -4.81 107.32 95.30 1jvo s GLY 45 Ca 0.35 0.67 -0.00 0.00 0.00 0.00 0.00 44.72 45.74 1jvo s GLY 45 CO -0.02 1.00 -0.04 0.30 0.00 0.00 0.00 173.10 174.34 1jvo s HIS 46 N -1.92 0.57 0.27 1.90 3.76 -0.65 -4.70 115.29 114.53 1jvo s HIS 46 Ca 0.69 -0.91 -0.04 0.00 -0.15 0.00 0.00 55.06 54.65 1jvo s HIS 46 Cb -0.19 -0.39 -0.02 0.00 1.11 0.00 0.00 32.58 33.10 1jvo s HIS 46 CO 0.22 -0.28 0.35 0.54 -0.85 0.00 0.00 174.74 174.72 1jvo s ASN 47 N -2.62 0.50 -0.21 1.40 2.20 -1.26 0.68 114.94 115.63 1jvo s ASN 47 Ca 0.03 -1.34 0.01 0.00 -0.94 0.00 0.00 52.86 50.62 1jvo s ASN 47 Cb 0.03 0.55 0.05 0.00 -2.00 0.00 0.00 41.25 39.88 1jvo s ASN 47 CO -0.07 -1.10 -0.08 0.86 -2.94 0.00 0.00 177.10 173.78 1jvo s TRP 48 N -3.68 2.36 -0.10 1.54 -0.00 -1.26 -4.15 118.94 113.64 1jvo s TRP 48 Ca 0.32 -1.61 0.03 0.00 -0.00 0.00 0.00 56.10 54.84 1jvo s TRP 48 Cb 0.02 -1.59 -0.00 0.00 -0.00 0.00 0.00 33.47 31.89 1jvo s TRP 48 CO 0.16 -0.74 -0.22 0.08 -0.00 0.00 0.00 176.95 176.22 1jvo s VAL 49 N 1.41 2.24 -0.08 5.86 1.01 -0.04 -1.95 120.40 128.84 1jvo s VAL 49 Ca -0.03 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.01 1jvo s VAL 49 Cb -0.17 -1.87 -0.03 0.00 0.00 0.00 0.00 36.38 34.32 1jvo s VAL 49 CO -0.07 0.55 -0.11 -0.22 0.00 0.00 0.00 175.10 175.25 1jvo s LEU 50 N 0.32 2.92 0.29 3.92 2.96 -0.82 -1.07 118.68 127.20 1jvo s LEU 50 Ca -0.17 -0.15 -0.19 0.00 -0.22 0.00 0.00 54.13 53.39 1jvo s LEU 50 Cb -0.18 -1.63 0.06 0.00 0.50 0.00 0.00 46.19 44.95 1jvo s LEU 50 CO 0.08 0.31 0.89 -0.94 -1.32 0.00 0.00 176.35 175.37 1jvo s SER 51 N -0.48 -0.03 0.53 3.68 1.04 -0.59 -1.12 113.70 116.73 1jvo s SER 51 Ca 0.07 -0.88 -0.19 0.00 0.48 0.00 0.00 55.95 55.43 1jvo s SER 51 Cb -0.12 0.69 -0.07 0.00 0.10 0.00 0.00 66.02 66.62 1jvo s SER 51 CO 0.02 -1.35 1.06 0.42 0.98 0.00 0.00 173.24 174.37 1jvo s THR 52 N -2.44 3.68 0.34 2.02 -4.23 -1.26 -0.57 115.64 113.19 1jvo s THR 52 Ca 0.17 0.97 0.10 0.00 -1.18 0.00 0.00 61.69 61.75 1jvo s THR 52 Cb -0.04 -3.40 0.33 0.00 1.34 0.00 0.00 72.50 70.73 1jvo s THR 52 CO 0.08 -0.30 1.80 0.00 -0.54 0.00 0.00 174.62 175.66 1jvo h ALA 53 N 1.15 1.85 -0.29 3.99 0.00 -1.66 -0.74 119.26 123.57 1jvo h ALA 53 Ca -0.49 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 1jvo h ALA 53 Cb 1.23 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1jvo h ALA 53 CO 0.58 -0.20 -0.04 0.00 0.00 0.00 0.00 179.25 179.59 1jvo h ALA 54 N 1.63 1.38 -0.00 0.00 0.00 -1.91 -3.04 119.26 117.32 1jvo h ALA 54 Ca 0.55 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1jvo h ALA 54 Cb 1.00 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1jvo h ALA 54 CO -0.31 0.43 -0.53 -0.25 0.00 0.00 0.00 179.25 178.58 1jvo n ASP 55 N -4.27 0.54 0.03 0.00 8.00 -0.32 -4.51 116.55 116.02 1jvo n ASP 55 Ca 0.01 -0.30 -0.16 0.00 0.71 0.00 0.00 54.79 55.05 1jvo n ASP 55 Cb 0.26 0.30 -0.10 0.00 -0.02 0.00 0.00 41.12 41.56 1jvo n ASP 55 CO 0.00 0.00 0.00 -0.03 -0.39 0.00 0.00 177.20 176.78 1jvo h MET 56 N 0.01 -0.62 -0.75 -1.24 4.05 -1.34 0.11 114.93 115.15 1jvo h MET 56 Ca 0.00 0.04 0.17 0.00 -0.28 0.00 0.00 59.70 59.63 1jvo h MET 56 Cb 0.50 0.14 -0.11 0.00 -0.80 0.00 0.00 31.60 31.33 1jvo h MET 56 CO 0.00 -0.41 0.20 0.37 0.23 0.00 0.00 176.91 177.29 1jvo h GLN 57 N -0.65 0.28 0.14 0.39 5.75 -1.80 0.80 115.11 120.02 1jvo h GLN 57 Ca 0.02 -0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.50 1jvo h GLN 57 Cb 0.71 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.20 1jvo h GLN 57 CO -0.38 0.18 -0.07 0.78 -2.65 0.00 0.00 178.83 176.69 1jvo h GLY 58 N 0.28 -0.19 0.86 2.39 0.00 -1.60 -1.71 103.07 103.10 1jvo h GLY 58 Ca 0.43 0.07 0.02 0.00 0.00 0.00 0.00 47.33 47.85 1jvo h GLY 58 CO -0.51 -0.07 0.19 -2.08 0.00 0.00 0.00 176.54 174.07 1jvo h VAL 59 N -0.19 1.00 -0.22 4.60 2.07 0.63 -2.04 116.25 122.10 1jvo h VAL 59 Ca -0.02 -0.13 0.02 0.00 0.82 0.00 0.00 66.70 67.39 1jvo h VAL 59 Cb 0.15 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 1jvo h VAL 59 CO 0.03 0.07 0.06 0.58 0.02 0.00 0.00 177.57 178.33 1jvo h VAL 60 N 0.39 0.93 0.06 2.57 2.07 -0.85 0.19 116.25 121.61 1jvo h VAL 60 Ca 0.15 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.61 1jvo h VAL 60 Cb 0.04 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 1jvo h VAL 60 CO -0.09 0.03 -0.03 0.74 0.02 0.00 0.00 177.57 178.24 1jvo h THR 61 N 0.16 0.96 -0.20 2.57 2.02 -1.09 -1.53 112.91 115.79 1jvo h THR 61 Ca 0.10 -0.04 -0.11 0.00 0.77 0.00 0.00 66.41 67.12 1jvo h THR 61 Cb 0.08 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 1jvo h THR 61 CO -0.11 0.01 -0.35 0.44 0.37 0.00 0.00 175.52 175.88 1jvo h ASP 62 N -0.10 0.44 -0.69 4.18 3.32 -1.28 -2.84 116.42 119.46 1jvo h ASP 62 Ca -0.01 -0.17 -0.00 0.00 0.02 0.00 0.00 57.03 56.87 1jvo h ASP 62 Cb 0.08 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 1jvo h ASP 62 CO 0.01 0.76 0.43 1.23 -1.72 0.00 0.00 179.24 179.95 1jvo h GLY 63 N 1.09 0.99 0.72 2.75 0.00 -0.46 -1.72 103.07 106.45 1jvo h GLY 63 Ca 0.04 -0.40 0.06 0.00 0.00 0.00 0.00 47.33 47.03 1jvo h GLY 63 CO 0.06 0.39 0.51 1.98 0.00 0.00 0.00 176.54 179.48 1jvo h MET 64 N 0.94 0.90 0.00 4.80 1.85 -1.04 -2.32 114.93 120.05 1jvo h MET 64 Ca 0.25 -0.05 -0.08 0.00 -0.61 0.00 0.00 59.70 59.20 1jvo h MET 64 Cb -0.05 -0.20 -0.01 0.00 0.43 0.00 0.00 31.60 31.76 1jvo h MET 64 CO -0.05 0.59 -0.38 0.00 -0.40 0.00 0.00 176.91 176.67 1jvo h ALA 65 N 1.39 1.10 0.00 0.39 0.00 -1.21 -3.06 119.26 117.88 1jvo h ALA 65 Ca 0.36 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1jvo h ALA 65 Cb 0.17 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1jvo h ALA 65 CO -0.17 0.48 -0.12 0.77 0.00 0.00 0.00 179.25 180.21 1jvo h SER 66 N 0.00 0.00 -4.04 0.00 0.02 -0.75 -3.49 113.55 105.29 1jvo h SER 66 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1jvo h SER 66 Cb 0.82 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.36 1jvo h SER 66 CO 0.05 0.12 0.00 0.61 -1.14 0.00 0.00 176.83 176.47 1jvo n GLY 67 N -0.26 -2.43 0.33 -3.77 0.00 -1.16 -4.23 105.19 93.67 1jvo n GLY 67 Ca -0.01 -1.46 0.19 0.00 0.00 0.00 0.00 46.02 44.74 1jvo n GLY 67 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1jvo h LEU 68 N 0.00 0.36 -1.67 0.99 5.85 -1.91 0.27 115.31 119.20 1jvo h LEU 68 Ca 0.00 0.18 0.16 0.00 0.84 0.00 0.00 57.88 59.07 1jvo h LEU 68 Cb 0.00 0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.15 1jvo h LEU 68 CO 0.00 -0.10 0.50 0.44 -0.34 0.00 0.00 178.44 178.94 1jvo h ASP 69 N 0.33 0.30 -0.57 1.25 3.32 -2.01 0.57 116.42 119.61 1jvo h ASP 69 Ca 0.65 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.72 1jvo h ASP 69 Cb 1.39 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.90 1jvo h ASP 69 CO -0.60 0.15 0.00 0.29 -1.72 0.00 0.00 179.24 177.36 1jvo n LYS 70 N -4.45 3.78 -2.02 3.56 4.76 0.06 -4.91 118.16 118.95 1jvo n LYS 70 Ca 0.14 -2.66 -0.18 0.00 -2.87 0.00 0.00 58.31 52.74 1jvo n LYS 70 Cb 0.59 -1.94 -0.04 0.00 -1.84 0.00 0.00 35.03 31.81 1jvo n LYS 70 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1jvo n ASP 71 N 0.89 -5.18 -3.78 4.39 9.92 0.19 -2.32 116.55 120.66 1jvo n ASP 71 Ca 0.24 0.16 -0.23 0.00 -0.53 0.00 0.00 54.79 54.44 1jvo n ASP 71 Cb 0.90 -4.25 0.02 0.00 -0.64 0.00 0.00 41.12 37.15 1jvo n ASP 71 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1jvo n TYR 72 N -3.41 -1.84 -3.76 1.24 4.01 -1.07 -4.71 117.16 107.62 1jvo n TYR 72 Ca -0.20 0.82 -0.13 0.00 -0.16 0.00 0.00 57.90 58.23 1jvo n TYR 72 Cb 0.63 -4.20 -0.13 0.00 -0.31 0.00 0.00 39.34 35.33 1jvo n TYR 72 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1jvo s LEU 73 N -6.77 0.77 0.17 7.72 1.43 -0.98 -4.38 118.68 116.65 1jvo s LEU 73 Ca 0.02 0.39 -0.31 0.00 -1.03 0.00 0.00 54.13 53.20 1jvo s LEU 73 Cb -0.01 0.55 -0.09 0.00 0.03 0.00 0.00 46.19 46.66 1jvo s LEU 73 CO 0.83 -0.13 1.41 -0.75 0.23 0.00 0.00 176.35 177.94 1jvo s LYS 74 N 0.93 4.31 0.23 1.70 2.20 -1.26 -4.83 119.74 123.02 1jvo s LYS 74 Ca -0.07 2.17 -0.32 0.00 -0.36 0.00 0.00 55.97 57.39 1jvo s LYS 74 Cb -0.09 -3.19 -0.13 0.00 -1.51 0.00 0.00 37.83 32.92 1jvo s LYS 74 CO -0.05 -0.41 1.56 -2.30 -0.36 0.00 0.00 175.35 173.79 1jvo n PRO 75 N 3.25 2.42 -3.92 4.03 -0.02 -1.26 -2.59 135.00 136.90 1jvo n PRO 75 Ca 0.09 0.86 -0.30 0.00 -2.02 0.00 0.00 63.50 62.14 1jvo n PRO 75 Cb 0.41 -2.62 0.02 0.00 -0.02 0.00 0.00 33.50 31.29 1jvo n PRO 75 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1jvo n ASP 76 N 2.77 -4.26 -4.64 2.55 8.00 -1.26 -4.89 116.55 114.82 1jvo n ASP 76 Ca 0.13 -0.81 -0.43 0.00 0.71 0.00 0.00 54.79 54.39 1jvo n ASP 76 Cb 0.33 -3.79 -0.02 0.00 -0.02 0.00 0.00 41.12 37.61 1jvo n ASP 76 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1jvo s ASP 77 N -3.43 6.50 0.58 -2.24 -1.08 -1.07 -4.87 116.67 111.06 1jvo s ASP 77 Ca 0.59 1.68 0.36 0.00 -0.52 0.00 0.00 52.55 54.66 1jvo s ASP 77 Cb -0.30 -2.53 1.64 0.00 -1.46 0.00 0.00 42.92 40.27 1jvo s ASP 77 CO 0.84 -1.15 2.09 0.77 0.52 0.00 0.00 175.17 178.24 1jvo h SER 78 N 10.18 0.00 0.95 -0.34 4.64 -1.92 -2.60 113.55 124.46 1jvo h SER 78 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 1jvo h SER 78 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1jvo h SER 78 CO 0.99 0.02 0.00 0.54 -0.87 0.00 0.00 176.83 177.51 1jvo n ARG 79 N -3.13 0.11 -3.03 4.77 1.74 -1.26 -4.68 116.66 111.18 1jvo n ARG 79 Ca -0.01 0.21 -0.43 0.00 -0.77 0.00 0.00 57.85 56.86 1jvo n ARG 79 Cb 0.24 -1.67 -0.06 0.00 -1.02 0.00 0.00 32.46 29.96 1jvo n ARG 79 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1jvo s VAL 80 N -3.10 4.76 0.07 1.55 1.01 -0.98 -4.50 120.40 119.20 1jvo s VAL 80 Ca 0.09 0.41 -0.16 0.00 0.00 0.00 0.00 61.98 62.32 1jvo s VAL 80 Cb 0.13 -4.23 -0.14 0.00 0.00 0.00 0.00 36.38 32.14 1jvo s VAL 80 CO 0.46 -0.58 1.32 0.40 0.00 0.00 0.00 175.10 176.70 1jvo h ILE 81 N 5.87 1.33 -3.09 2.22 2.04 -1.40 -3.48 117.51 121.01 1jvo h ILE 81 Ca -0.25 -1.67 -0.01 0.00 1.00 0.00 0.00 64.86 63.92 1jvo h ILE 81 Cb 1.09 1.92 -0.11 0.00 -0.74 0.00 0.00 36.82 38.98 1jvo h ILE 81 CO 0.91 0.52 0.15 0.00 0.00 0.00 0.00 178.15 179.73 1jvo s ALA 82 N -3.98 -1.37 -0.25 1.87 0.00 -1.24 -5.02 121.76 111.76 1jvo s ALA 82 Ca -0.12 0.22 -0.27 0.00 0.00 0.00 0.00 51.96 51.79 1jvo s ALA 82 Cb 0.07 0.85 0.15 0.00 0.00 0.00 0.00 23.12 24.19 1jvo s ALA 82 CO 0.83 -0.79 1.16 -3.38 0.00 0.00 0.00 175.76 173.58 1jvo s HIS 83 N -3.80 -0.30 0.06 0.00 -3.43 -1.26 -1.94 115.29 104.63 1jvo s HIS 83 Ca 0.04 0.65 -0.00 0.00 -0.80 0.00 0.00 55.06 54.94 1jvo s HIS 83 Cb -0.01 0.43 0.01 0.00 -1.43 0.00 0.00 32.58 31.58 1jvo s HIS 83 CO -0.09 -0.19 0.08 0.25 -2.00 0.00 0.00 174.74 172.80 1jvo n THR 84 N 1.46 0.00 -3.07 -5.38 -2.24 -0.82 -4.87 114.28 99.35 1jvo n THR 84 Ca -0.10 -0.10 -0.19 0.00 -2.27 0.00 0.00 64.05 61.39 1jvo n THR 84 Cb 0.57 -1.54 0.03 0.00 -2.10 0.00 0.00 70.33 67.29 1jvo n THR 84 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1jvo s LYS 85 N -2.79 2.53 -0.17 -0.78 -2.85 -1.26 -4.58 119.74 109.84 1jvo s LYS 85 Ca 0.05 -1.48 -0.29 0.00 -1.00 0.00 0.00 55.97 53.25 1jvo s LYS 85 Cb -0.00 -2.67 -0.01 0.00 -2.06 0.00 0.00 37.83 33.09 1jvo s LYS 85 CO 0.04 -0.58 1.21 -1.17 0.10 0.00 0.00 175.35 174.94 1jvo s LEU 86 N -4.50 4.17 0.09 2.77 2.96 -1.26 -4.36 118.68 118.55 1jvo s LEU 86 Ca 0.58 1.63 0.07 0.00 -0.22 0.00 0.00 54.13 56.19 1jvo s LEU 86 Cb -0.07 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.04 1jvo s LEU 86 CO 0.35 -0.72 -0.14 0.27 -1.32 0.00 0.00 176.35 174.80 1jvo s ILE 87 N 3.30 3.12 0.27 6.68 -4.36 0.21 -4.87 121.20 125.56 1jvo s ILE 87 Ca 0.52 -1.27 0.03 0.00 -0.26 0.00 0.00 60.65 59.67 1jvo s ILE 87 Cb -0.20 -2.41 0.03 0.00 1.25 0.00 0.00 42.46 41.12 1jvo s ILE 87 CO 0.13 0.18 0.22 0.61 0.24 0.00 0.00 174.94 176.33 1jvo n GLY 88 N 0.99 2.80 3.51 6.27 0.00 -1.26 -1.63 105.19 115.87 1jvo n GLY 88 Ca -0.15 -2.23 -0.54 0.00 0.00 0.00 0.00 46.02 43.11 1jvo n GLY 88 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1jvo n SER 89 N -2.00 0.32 0.00 1.61 2.88 -0.89 -1.66 113.62 113.88 1jvo n SER 89 Ca -0.00 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.68 1jvo n SER 89 Cb 0.30 -1.04 0.00 0.00 -0.75 0.00 0.00 64.21 62.73 1jvo n SER 89 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1jvo n GLY 90 N 1.85 2.13 3.82 0.46 0.00 -0.01 -4.98 105.19 108.46 1jvo n GLY 90 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 1jvo n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jvo s GLU 91 N 0.00 0.10 -0.02 1.61 2.02 -0.66 -4.86 118.70 116.89 1jvo s GLU 91 Ca 0.00 -0.27 -0.28 0.00 0.02 0.00 0.00 54.97 54.44 1jvo s GLU 91 Cb 0.00 -1.77 0.06 0.00 0.10 0.00 0.00 34.13 32.52 1jvo s GLU 91 CO 0.00 -2.80 0.61 0.21 0.02 0.00 0.00 175.26 173.31 1jvo s LYS 92 N -5.72 1.02 0.14 1.61 2.47 -1.26 -2.87 119.74 115.13 1jvo s LYS 92 Ca 0.72 0.11 -0.22 0.00 -1.56 0.00 0.00 55.97 55.02 1jvo s LYS 92 Cb -0.06 0.48 0.06 0.00 -1.46 0.00 0.00 37.83 36.85 1jvo s LYS 92 CO 0.54 -0.33 0.57 0.34 0.16 0.00 0.00 175.35 176.63 1jvo s ASP 93 N -1.39 -0.52 0.04 1.43 2.15 -0.36 -5.02 116.67 113.01 1jvo s ASP 93 Ca -0.10 0.00 -0.02 0.00 0.43 0.00 0.00 52.55 52.86 1jvo s ASP 93 Cb -0.01 0.57 -0.03 0.00 -0.30 0.00 0.00 42.92 43.16 1jvo s ASP 93 CO 0.07 -0.92 0.01 -0.44 -0.17 0.00 0.00 175.17 173.72 1jvo s SER 94 N -2.63 0.34 -0.10 -0.34 0.01 -1.26 -0.28 113.70 109.45 1jvo s SER 94 Ca 0.00 -0.76 -0.07 0.00 1.31 0.00 0.00 55.95 56.43 1jvo s SER 94 Cb -0.00 0.19 0.04 0.00 0.21 0.00 0.00 66.02 66.45 1jvo s SER 94 CO -0.11 -0.51 0.26 0.54 0.41 0.00 0.00 173.24 173.83 1jvo s VAL 95 N -3.02 -0.02 -0.05 3.43 0.11 -0.68 -4.88 120.40 115.29 1jvo s VAL 95 Ca -0.01 0.07 0.06 0.00 -2.93 0.00 0.00 61.98 59.16 1jvo s VAL 95 Cb 0.01 -0.38 -0.01 0.00 -1.53 0.00 0.00 36.38 34.48 1jvo s VAL 95 CO -0.07 0.03 -0.23 -0.89 -3.33 0.00 0.00 175.10 170.61 1jvo s THR 96 N 0.67 1.88 0.12 5.04 2.01 -1.26 -0.70 115.64 123.40 1jvo s THR 96 Ca -0.04 -0.97 0.02 0.00 0.31 0.00 0.00 61.69 61.01 1jvo s THR 96 Cb -0.06 -1.59 -0.04 0.00 0.01 0.00 0.00 72.50 70.82 1jvo s THR 96 CO -0.04 0.53 -0.05 0.72 -0.69 0.00 0.00 174.62 175.09 1jvo s PHE 97 N -0.12 1.01 -0.17 4.92 -0.71 -0.32 -4.96 117.98 117.64 1jvo s PHE 97 Ca -0.03 -0.94 -0.29 0.00 -1.04 0.00 0.00 56.93 54.63 1jvo s PHE 97 Cb -0.13 -0.57 -0.00 0.00 -1.21 0.00 0.00 43.02 41.10 1jvo s PHE 97 CO 0.03 -0.16 1.01 -0.51 -1.34 0.00 0.00 175.22 174.26 1jvo s ASP 98 N -3.09 7.16 0.59 1.98 1.11 -1.26 -0.59 116.67 122.57 1jvo s ASP 98 Ca 0.16 1.44 0.29 0.00 0.18 0.00 0.00 52.55 54.62 1jvo s ASP 98 Cb 0.05 -2.54 1.51 0.00 1.07 0.00 0.00 42.92 43.01 1jvo s ASP 98 CO -0.02 -0.55 1.93 0.58 1.18 0.00 0.00 175.17 178.30 1jvo h VAL 99 N 5.27 0.37 -0.76 -1.27 2.07 -1.22 -0.67 116.25 120.04 1jvo h VAL 99 Ca -0.25 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.31 1jvo h VAL 99 Cb 1.11 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 31.48 1jvo h VAL 99 CO 0.91 0.00 0.47 0.77 0.02 0.00 0.00 177.57 179.74 1jvo h SER 100 N 0.00 0.76 -0.81 0.57 4.64 -1.89 -1.88 113.55 114.94 1jvo h SER 100 Ca 0.19 0.01 0.23 0.00 -0.47 0.00 0.00 61.79 61.75 1jvo h SER 100 Cb 1.04 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.94 1jvo h SER 100 CO -0.00 0.51 0.62 0.11 -0.87 0.00 0.00 176.83 177.20 1jvo h LYS 101 N 0.90 0.00 -7.02 4.77 1.57 -1.50 -3.40 116.57 111.88 1jvo h LYS 101 Ca 0.31 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.64 1jvo h LYS 101 Cb 0.07 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 1jvo h LYS 101 CO -0.13 0.00 0.31 -0.51 -0.57 0.00 0.00 179.45 178.55 1jvo s LEU 102 N -8.27 3.93 -0.23 2.94 1.43 -0.71 -5.05 118.68 112.73 1jvo s LEU 102 Ca -0.05 1.62 -0.01 0.00 -1.03 0.00 0.00 54.13 54.67 1jvo s LEU 102 Cb 0.20 -4.47 0.06 0.00 0.03 0.00 0.00 46.19 42.01 1jvo s LEU 102 CO 0.72 -0.36 0.00 -1.59 0.23 0.00 0.00 176.35 175.36 1jvo s LYS 103 N -3.22 1.10 0.21 1.70 -2.85 -1.26 -5.03 119.74 110.39 1jvo s LYS 103 Ca 0.61 -0.76 -0.25 0.00 -1.00 0.00 0.00 55.97 54.57 1jvo s LYS 103 Cb -0.09 -2.33 -0.16 0.00 -2.06 0.00 0.00 37.83 33.19 1jvo s LYS 103 CO 0.15 -0.66 0.43 -1.91 0.10 0.00 0.00 175.35 173.46 1jvo n GLU 104 N 4.85 0.00 0.00 1.78 2.13 -1.26 -2.43 120.64 125.71 1jvo n GLU 104 Ca -0.09 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.73 1jvo n GLU 104 Cb 0.45 -0.93 0.00 0.00 0.27 0.00 0.00 31.44 31.23 1jvo n GLU 104 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1jvo n GLY 105 N 1.91 3.06 3.89 8.31 0.00 -1.26 -5.05 105.19 116.04 1jvo n GLY 105 Ca 0.16 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 1jvo n GLY 105 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jvo s GLU 106 N 0.00 3.20 -0.19 1.61 2.12 -1.02 -5.05 118.70 119.37 1jvo s GLU 106 Ca 0.00 0.47 -0.14 0.00 0.36 0.00 0.00 54.97 55.65 1jvo s GLU 106 Cb 0.00 -2.12 -0.04 0.00 0.26 0.00 0.00 34.13 32.23 1jvo s GLU 106 CO 0.00 -0.74 0.32 -0.65 -0.54 0.00 0.00 175.26 173.65 1jvo s GLN 107 N -5.18 4.20 0.00 4.30 -0.21 -1.26 -4.87 119.66 116.64 1jvo s GLN 107 Ca 0.55 0.09 0.07 0.00 0.02 0.00 0.00 55.36 56.10 1jvo s GLN 107 Cb -0.11 -3.49 -0.03 0.00 1.00 0.00 0.00 33.01 30.39 1jvo s GLN 107 CO 0.51 0.10 -0.23 0.71 -2.12 0.00 0.00 175.29 174.26 1jvo s TYR 108 N 0.90 2.43 -0.02 0.91 2.02 -1.24 -1.76 117.35 120.59 1jvo s TYR 108 Ca 0.16 -0.36 0.05 0.00 -0.37 0.00 0.00 57.07 56.56 1jvo s TYR 108 Cb -0.14 -1.49 -0.01 0.00 -0.40 0.00 0.00 41.96 39.93 1jvo s TYR 108 CO 0.06 0.09 -0.16 -1.64 -1.57 0.00 0.00 175.55 172.33 1jvo s MET 109 N -0.93 1.38 0.08 -0.62 -1.94 0.27 -0.89 119.30 116.64 1jvo s MET 109 Ca 0.11 -0.58 0.10 0.00 -1.71 0.00 0.00 55.69 53.61 1jvo s MET 109 Cb -0.10 -1.30 -0.03 0.00 2.01 0.00 0.00 34.83 35.40 1jvo s MET 109 CO 0.01 0.32 -0.25 -0.59 -0.01 0.00 0.00 175.02 174.51 1jvo s PHE 110 N -0.29 2.37 0.17 -0.03 -0.12 0.29 -1.53 117.98 118.84 1jvo s PHE 110 Ca 0.04 -0.36 -0.24 0.00 -0.05 0.00 0.00 56.93 56.32 1jvo s PHE 110 Cb -0.07 -1.35 0.06 0.00 -0.63 0.00 0.00 43.02 41.03 1jvo s PHE 110 CO -0.00 0.24 0.96 -0.59 -0.05 0.00 0.00 175.22 175.79 1jvo s PHE 111 N -0.94 -0.07 -0.19 3.49 -0.71 -0.23 0.20 117.98 119.51 1jvo s PHE 111 Ca 0.14 -0.27 -0.08 0.00 -1.04 0.00 0.00 56.93 55.67 1jvo s PHE 111 Cb -0.10 0.66 -0.04 0.00 -1.21 0.00 0.00 43.02 42.33 1jvo s PHE 111 CO 0.05 -0.90 0.09 0.00 -1.34 0.00 0.00 175.22 173.12 1jvo n THR 113 N 3.65 0.21 -2.05 0.00 -2.24 -1.26 -3.42 114.28 109.17 1jvo n THR 113 Ca -0.16 -0.33 -0.42 0.00 -2.27 0.00 0.00 64.05 60.87 1jvo n THR 113 Cb 0.52 0.31 -0.03 0.00 -2.10 0.00 0.00 70.33 69.03 1jvo n THR 113 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1jvo s PHE 114 N -1.79 3.11 -0.16 4.78 2.19 -1.26 -4.46 117.98 120.40 1jvo s PHE 114 Ca 0.31 0.91 -0.34 0.00 0.33 0.00 0.00 56.93 58.14 1jvo s PHE 114 Cb 0.16 -3.79 -0.16 0.00 -1.31 0.00 0.00 43.02 37.92 1jvo s PHE 114 CO 0.25 -2.73 1.03 -2.30 1.83 0.00 0.00 175.22 173.30 1jvo n PRO 115 N 3.23 0.00 0.00 10.12 -0.02 -1.26 -1.36 135.00 145.71 1jvo n PRO 115 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 1jvo n PRO 115 Cb 0.40 -1.20 0.00 0.00 -0.02 0.00 0.00 33.50 32.68 1jvo n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jvo n GLY 116 N 2.00 2.77 0.16 -1.23 0.00 -1.26 -4.86 105.19 102.77 1jvo n GLY 116 Ca 0.20 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.15 1jvo n GLY 116 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1jvo h HIS 117 N 0.00 0.34 0.00 1.61 3.86 -1.49 -3.19 115.15 116.27 1jvo h HIS 117 Ca 0.00 -0.14 0.00 0.00 -1.16 0.00 0.00 60.37 59.07 1jvo h HIS 117 Cb 0.00 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.42 1jvo h HIS 117 CO 0.00 0.85 0.10 0.66 0.86 0.00 0.00 177.93 180.39 1jvo h SER 118 N 0.18 0.00 -0.61 2.45 4.64 -1.73 0.60 113.55 119.07 1jvo h SER 118 Ca -0.02 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.35 1jvo h SER 118 Cb 1.21 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.25 1jvo h SER 118 CO 0.11 0.00 0.35 0.00 -0.87 0.00 0.00 176.83 176.42 1jvo h ALA 119 N 1.78 0.80 0.00 5.18 0.00 -1.91 -3.31 119.26 121.80 1jvo h ALA 119 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.72 1jvo h ALA 119 Cb 0.20 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 1jvo h ALA 119 CO 0.00 0.05 -1.73 1.28 0.00 0.00 0.00 179.25 178.86 1jvo n LEU 120 N -4.78 0.50 -4.45 0.00 4.77 -0.50 -4.88 117.00 107.67 1jvo n LEU 120 Ca 0.06 -0.01 -0.44 0.00 -0.03 0.00 0.00 56.01 55.59 1jvo n LEU 120 Cb 0.12 0.14 -0.01 0.00 -2.33 0.00 0.00 43.42 41.34 1jvo n LEU 120 CO 0.31 0.34 1.20 -0.04 -1.33 0.00 0.00 177.39 177.86 1jvo s MET 121 N -2.26 3.92 0.13 3.23 -1.94 0.20 -4.81 119.30 117.77 1jvo s MET 121 Ca -0.07 -2.33 -0.24 0.00 -1.71 0.00 0.00 55.69 51.33 1jvo s MET 121 Cb 0.03 -4.97 0.07 0.00 2.01 0.00 0.00 34.83 31.97 1jvo s MET 121 CO 0.41 -1.73 0.62 -1.59 -0.01 0.00 0.00 175.02 172.72 1jvo s LYS 122 N 1.78 1.23 0.35 2.03 0.00 -1.26 -2.31 119.74 121.56 1jvo s LYS 122 Ca 0.38 -0.38 -0.17 0.00 0.00 0.00 0.00 55.97 55.80 1jvo s LYS 122 Cb -0.04 0.57 0.05 0.00 0.00 0.00 0.00 37.83 38.41 1jvo s LYS 122 CO -0.04 -0.52 0.80 0.20 0.00 0.00 0.00 175.35 175.78 1jvo s GLY 123 N -2.56 0.25 -0.09 0.59 0.00 0.13 -4.81 107.32 100.82 1jvo s GLY 123 Ca -0.00 -0.62 -0.03 0.00 0.00 0.00 0.00 44.72 44.07 1jvo s GLY 123 CO -0.10 -0.09 0.05 -0.51 0.00 0.00 0.00 173.10 172.45 1jvo s THR 124 N -2.64 4.70 -0.24 0.90 -4.23 -0.39 -0.54 115.64 113.19 1jvo s THR 124 Ca 0.15 -0.11 -0.01 0.00 -1.18 0.00 0.00 61.69 60.54 1jvo s THR 124 Cb -0.05 -3.01 0.03 0.00 1.34 0.00 0.00 72.50 70.81 1jvo s THR 124 CO 0.10 0.60 -0.08 -0.22 -0.54 0.00 0.00 174.62 174.47 1jvo s LEU 125 N -0.97 3.09 0.03 4.79 0.20 -0.07 -0.97 118.68 124.78 1jvo s LEU 125 Ca 0.14 -0.91 0.01 0.00 0.69 0.00 0.00 54.13 54.06 1jvo s LEU 125 Cb -0.12 -1.63 -0.04 0.00 -0.43 0.00 0.00 46.19 43.98 1jvo s LEU 125 CO 0.03 -0.12 0.07 -0.89 -0.29 0.00 0.00 176.35 175.16 1jvo s THR 126 N 1.29 4.61 -0.60 3.68 2.01 0.08 -3.72 115.64 123.00 1jvo s THR 126 Ca -0.00 -0.55 -0.08 0.00 0.31 0.00 0.00 61.69 61.37 1jvo s THR 126 Cb -0.17 -3.15 0.16 0.00 0.01 0.00 0.00 72.50 69.35 1jvo s THR 126 CO -0.06 0.27 0.46 -0.22 -0.69 0.00 0.00 174.62 174.39 1jvo s LEU 127 N -1.96 5.74 0.00 4.42 1.98 -1.26 0.06 118.68 127.65 1jvo s LEU 127 Ca 0.25 -2.43 0.16 0.00 -2.89 0.00 0.00 54.13 49.22 1jvo s LEU 127 Cb -0.12 -1.99 0.13 0.00 0.66 0.00 0.00 46.19 44.87 1jvo s LEU 127 CO 0.17 -0.54 1.00 2.29 -1.89 0.00 0.00 176.35 177.37