#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 3.08 -0.50 0.00 2.12 -1.26 -4.59 118.70 117.56 1jvo s GLU 2 Ca 0.00 -0.82 0.00 0.00 0.36 0.00 0.00 54.97 54.51 1jvo s GLU 2 Cb 0.00 -2.98 0.00 0.00 0.26 0.00 0.00 34.13 31.41 1jvo s GLU 2 CO 0.00 -0.30 0.00 0.00 -0.54 0.00 0.00 175.26 174.42 1jvo s SER 4 N -2.87 -0.55 -0.01 0.00 1.04 -1.26 -1.29 113.70 108.76 1jvo s SER 4 Ca 0.00 0.44 -0.07 0.00 0.48 0.00 0.00 55.95 56.81 1jvo s SER 4 Cb 0.00 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.61 1jvo s SER 4 CO 0.00 -0.62 0.13 0.54 0.98 0.00 0.00 173.24 174.27 1jvo s VAL 5 N -1.86 0.06 -0.23 5.02 0.11 -0.44 -3.40 120.40 119.66 1jvo s VAL 5 Ca -0.05 -0.53 -0.06 0.00 -2.93 0.00 0.00 61.98 58.41 1jvo s VAL 5 Cb -0.00 -0.38 -0.02 0.00 -1.53 0.00 0.00 36.38 34.45 1jvo s VAL 5 CO 0.02 -0.29 0.03 -1.81 -3.33 0.00 0.00 175.10 169.71 1jvo s ASP 6 N -1.03 4.88 0.08 3.54 1.11 -1.26 -1.33 116.67 122.66 1jvo s ASP 6 Ca -0.11 -0.24 0.07 0.00 0.18 0.00 0.00 52.55 52.45 1jvo s ASP 6 Cb -0.06 -1.86 -0.03 0.00 1.07 0.00 0.00 42.92 42.04 1jvo s ASP 6 CO 0.01 0.00 -0.18 -0.51 1.18 0.00 0.00 175.17 175.67 1jvo s ILE 7 N 1.38 1.44 0.12 0.77 2.07 -0.47 -4.98 121.20 121.53 1jvo s ILE 7 Ca 0.05 -1.37 0.06 0.00 -1.41 0.00 0.00 60.65 57.98 1jvo s ILE 7 Cb -0.15 -1.33 -0.04 0.00 0.13 0.00 0.00 42.46 41.08 1jvo s ILE 7 CO 0.02 -0.08 -0.15 -1.10 -1.91 0.00 0.00 174.94 171.71 1jvo s GLN 8 N -1.70 1.02 -0.15 3.50 -0.21 -1.26 -2.32 119.66 118.53 1jvo s GLN 8 Ca 0.03 -1.20 -0.00 0.00 0.02 0.00 0.00 55.36 54.21 1jvo s GLN 8 Cb -0.10 -0.97 0.03 0.00 1.00 0.00 0.00 33.01 32.98 1jvo s GLN 8 CO 0.03 0.20 -0.08 0.20 -2.12 0.00 0.00 175.29 173.51 1jvo s GLY 9 N -2.30 0.99 0.52 3.09 0.00 -0.77 -2.28 107.32 106.56 1jvo s GLY 9 Ca 0.07 -0.80 0.08 0.00 0.00 0.00 0.00 44.72 44.07 1jvo s GLY 9 CO 0.03 0.79 0.71 1.16 0.00 0.00 0.00 173.10 175.79 1jvo n ASN 10 N 4.85 1.85 0.26 1.64 0.23 -1.04 -3.79 115.26 119.26 1jvo n ASN 10 Ca -0.13 -2.35 0.16 0.00 -0.53 0.00 0.00 54.58 51.73 1jvo n ASN 10 Cb 0.49 -0.38 0.56 0.00 -2.08 0.00 0.00 39.78 38.37 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 0.07 0.00 0.00 0.53 3.32 -1.91 -2.82 116.42 115.61 1jvo h ASP 11 Ca -0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.81 1jvo h ASP 11 Cb 1.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.65 1jvo h ASP 11 CO 0.34 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.86 1jvo n GLN 12 N -3.09 0.92 -3.23 3.56 3.00 -1.26 -4.87 117.38 112.40 1jvo n GLN 12 Ca 0.01 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.86 1jvo n GLN 12 Cb 0.36 -1.07 0.08 0.00 0.00 0.00 0.00 30.24 29.61 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 -0.57 -5.72 -3.86 -1.09 1.56 -1.06 -5.04 117.12 101.35 1jvo n MET 13 Ca 0.03 0.73 -0.11 0.00 -0.27 0.00 0.00 57.70 58.08 1jvo n MET 13 Cb 0.01 -5.41 -0.10 0.00 2.15 0.00 0.00 33.22 29.88 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 -5.17 0.52 0.16 2.12 -0.21 -1.26 -4.41 119.66 111.40 1jvo s GLN 14 Ca 0.00 -0.39 -0.09 0.00 0.02 0.00 0.00 55.36 54.90 1jvo s GLN 14 Cb -0.00 0.22 -0.06 0.00 1.00 0.00 0.00 33.01 34.16 1jvo s GLN 14 CO 0.63 -0.13 0.46 -0.06 -2.12 0.00 0.00 175.29 174.07 1jvo s PHE 15 N -1.44 3.50 -0.19 0.91 0.08 -1.26 -2.51 117.98 117.07 1jvo s PHE 15 Ca -0.14 0.78 -0.00 0.00 0.12 0.00 0.00 56.93 57.68 1jvo s PHE 15 Cb -0.07 -2.17 0.15 0.00 -0.57 0.00 0.00 43.02 40.35 1jvo s PHE 15 CO 0.02 0.40 1.88 0.27 -0.10 0.00 0.00 175.22 177.69 1jvo n ASN 16 N 0.30 5.55 0.00 1.36 6.94 -0.97 -4.79 115.26 123.66 1jvo n ASN 16 Ca -0.03 -2.76 0.00 0.00 -0.02 0.00 0.00 54.58 51.77 1jvo n ASN 16 Cb 0.52 -1.00 0.00 0.00 -2.36 0.00 0.00 39.78 36.94 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 -0.88 5.53 5.66 -1.26 -4.89 114.28 119.08 1jvo n THR 17 Ca 0.19 0.00 0.03 0.00 -3.05 0.00 0.00 64.05 61.22 1jvo n THR 17 Cb 0.60 0.00 0.04 0.00 -1.55 0.00 0.00 70.33 69.42 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 1.34 -3.67 1.09 0.23 -1.26 -4.87 115.26 108.11 1jvo n ASN 18 Ca 0.00 -2.12 -0.10 0.00 -0.53 0.00 0.00 54.58 51.82 1jvo n ASN 18 Cb 0.00 -0.16 -0.11 0.00 -2.08 0.00 0.00 39.78 37.43 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 -1.17 -0.95 -0.05 -2.53 0.00 -1.25 -0.73 121.76 115.07 1jvo s ALA 19 Ca 0.09 1.34 0.06 0.00 0.00 0.00 0.00 51.96 53.45 1jvo s ALA 19 Cb 0.08 -1.12 -0.01 0.00 0.00 0.00 0.00 23.12 22.07 1jvo s ALA 19 CO 0.01 -0.58 -0.23 0.42 0.00 0.00 0.00 175.76 175.38 1jvo s ILE 20 N 2.20 2.25 -0.16 0.00 1.01 0.11 -4.98 121.20 121.63 1jvo s ILE 20 Ca -0.03 -1.01 0.01 0.00 0.00 0.00 0.00 60.65 59.62 1jvo s ILE 20 Cb -0.11 -1.82 0.01 0.00 0.01 0.00 0.00 42.46 40.54 1jvo s ILE 20 CO -0.11 0.57 -0.18 -0.89 0.00 0.00 0.00 174.94 174.33 1jvo s THR 21 N -0.29 2.39 -0.26 2.92 2.01 -1.26 0.47 115.64 121.63 1jvo s THR 21 Ca 0.01 -0.85 -0.10 0.00 0.31 0.00 0.00 61.69 61.06 1jvo s THR 21 Cb -0.13 -2.00 -0.04 0.00 0.01 0.00 0.00 72.50 70.34 1jvo s THR 21 CO 0.02 0.52 0.14 -0.69 -0.69 0.00 0.00 174.62 173.93 1jvo s VAL 22 N 0.99 5.05 0.14 3.82 1.01 0.23 -4.95 120.40 126.68 1jvo s VAL 22 Ca -0.02 0.08 -0.31 0.00 0.00 0.00 0.00 61.98 61.72 1jvo s VAL 22 Cb -0.15 -3.37 -0.08 0.00 0.00 0.00 0.00 36.38 32.78 1jvo s VAL 22 CO -0.04 0.31 1.38 -0.62 0.00 0.00 0.00 175.10 176.13 1jvo s ASP 23 N 1.45 6.82 0.53 3.32 -1.08 -1.26 -2.24 116.67 124.21 1jvo s ASP 23 Ca 0.07 2.37 0.18 0.00 -0.52 0.00 0.00 52.55 54.65 1jvo s ASP 23 Cb -0.15 -2.59 1.35 0.00 -1.46 0.00 0.00 42.92 40.07 1jvo s ASP 23 CO 0.07 -0.64 2.16 0.11 0.52 0.00 0.00 175.17 177.40 1jvo h LYS 24 N 6.43 0.00 0.00 4.34 1.57 -1.42 -1.85 116.57 125.64 1jvo h LYS 24 Ca -0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 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 0.84 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 180.38 1jvo h SER 25 N 0.00 0.00 -3.57 0.86 4.64 -1.90 -3.43 113.55 110.14 1jvo h SER 25 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 1jvo h SER 25 Cb 0.01 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1jvo h SER 25 CO -0.00 0.00 0.45 0.00 -0.87 0.00 0.00 176.83 176.41 1jvo h LYS 27 N 5.14 0.35 -4.19 0.00 6.56 -1.88 -3.42 116.57 119.13 1jvo h LYS 27 Ca -0.44 -0.47 -0.12 0.00 -1.06 0.00 0.00 60.65 58.55 1jvo h LYS 27 Cb 1.21 0.16 -0.16 0.00 -0.57 0.00 0.00 32.23 32.87 1jvo h LYS 27 CO 0.72 1.17 -0.67 1.14 -2.06 0.00 0.00 179.45 179.75 1jvo s GLN 28 N -2.81 0.59 0.13 3.15 -2.07 -1.26 -0.43 119.66 116.96 1jvo s GLN 28 Ca -0.13 -1.14 0.11 0.00 -1.82 0.00 0.00 55.36 52.38 1jvo s GLN 28 Cb 0.02 0.20 -0.04 0.00 -1.09 0.00 0.00 33.01 32.11 1jvo s GLN 28 CO 0.82 -0.11 -0.26 0.12 -1.32 0.00 0.00 175.29 174.55 1jvo s PHE 29 N -3.63 2.23 -0.06 9.60 5.36 0.78 -4.79 117.98 127.47 1jvo s PHE 29 Ca 0.04 -0.38 0.03 0.00 -0.96 0.00 0.00 56.93 55.66 1jvo s PHE 29 Cb 0.06 -1.20 0.01 0.00 -0.34 0.00 0.00 43.02 41.55 1jvo s PHE 29 CO -0.09 0.34 -0.14 0.99 -1.46 0.00 0.00 175.22 174.86 1jvo s THR 30 N -1.16 1.25 -0.14 0.12 2.01 -0.41 -0.94 115.64 116.37 1jvo s THR 30 Ca 0.14 -0.57 -0.01 0.00 0.31 0.00 0.00 61.69 61.56 1jvo s THR 30 Cb -0.10 -1.12 -0.02 0.00 0.01 0.00 0.00 72.50 71.28 1jvo s THR 30 CO 0.06 0.38 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.57 1jvo s VAL 31 N 0.47 3.25 -0.33 3.82 1.01 -0.55 -1.33 120.40 126.75 1jvo s VAL 31 Ca -0.12 -0.58 -0.05 0.00 0.00 0.00 0.00 61.98 61.23 1jvo s VAL 31 Cb -0.15 -2.39 0.04 0.00 0.00 0.00 0.00 36.38 33.89 1jvo s VAL 31 CO 0.04 0.51 0.07 0.20 0.00 0.00 0.00 175.10 175.92 1jvo s ASN 32 N 0.43 5.18 -0.14 3.32 0.01 -0.44 -2.09 114.94 121.19 1jvo s ASN 32 Ca -0.08 -1.17 -0.11 0.00 -0.71 0.00 0.00 52.86 50.79 1jvo s ASN 32 Cb -0.15 -1.82 -0.05 0.00 0.41 0.00 0.00 41.25 39.64 1jvo s ASN 32 CO 0.04 -0.30 0.21 -0.22 -1.51 0.00 0.00 177.10 175.32 1jvo s LEU 33 N 1.36 4.30 0.02 0.60 2.96 0.02 -1.36 118.68 126.58 1jvo s LEU 33 Ca -0.03 0.46 0.01 0.00 -0.22 0.00 0.00 54.13 54.35 1jvo s LEU 33 Cb -0.20 -2.21 -0.01 0.00 0.50 0.00 0.00 46.19 44.27 1jvo s LEU 33 CO 0.02 0.25 -0.04 -0.94 -1.32 0.00 0.00 176.35 174.31 1jvo s SER 34 N -0.20 0.44 -0.54 3.68 1.04 -0.98 -1.93 113.70 115.21 1jvo s SER 34 Ca 0.14 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.26 1jvo s SER 34 Cb -0.12 0.02 0.14 0.00 0.10 0.00 0.00 66.02 66.16 1jvo s SER 34 CO 0.03 -0.13 0.32 -2.28 0.98 0.00 0.00 173.24 172.16 1jvo s HIS 35 N -0.81 3.39 -2.00 5.02 2.46 -1.18 -1.85 115.29 120.31 1jvo s HIS 35 Ca -0.07 -2.86 0.10 0.00 0.47 0.00 0.00 55.06 52.70 1jvo s HIS 35 Cb -0.06 -3.05 0.61 0.00 -0.13 0.00 0.00 32.58 29.95 1jvo s HIS 35 CO -0.00 -0.83 1.31 -0.35 -2.47 0.00 0.00 174.74 172.39 1jvo n PRO 36 N 3.56 0.89 0.00 2.88 -0.04 -1.25 -0.14 135.00 140.91 1jvo n PRO 36 Ca 0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.51 1jvo n PRO 36 Cb 0.37 -1.18 0.00 0.00 -0.04 0.00 0.00 33.50 32.65 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 0.54 -1.15 0.00 0.55 0.00 -1.26 -4.88 105.19 98.98 1jvo n GLY 37 Ca 0.08 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.46 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 -2.23 4.80 -4.77 1.61 5.03 -1.26 -4.04 115.26 114.40 1jvo n ASN 38 Ca 0.00 0.00 -0.38 0.00 0.87 0.00 0.00 54.58 55.07 1jvo n ASN 38 Cb 0.00 0.74 -0.02 0.00 -1.02 0.00 0.00 39.78 39.48 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 -3.34 4.12 0.77 3.41 1.43 -1.26 -4.74 118.68 119.07 1jvo s LEU 39 Ca 0.00 2.30 -0.12 0.00 -1.03 0.00 0.00 54.13 55.29 1jvo s LEU 39 Cb 0.00 -4.12 0.05 0.00 0.03 0.00 0.00 46.19 42.15 1jvo s LEU 39 CO 0.00 -0.75 1.11 -2.16 0.23 0.00 0.00 176.35 174.78 1jvo s PRO 40 N -2.47 2.31 0.53 1.29 0.04 -1.26 -1.40 135.00 134.05 1jvo s PRO 40 Ca 0.60 0.46 0.39 0.00 0.04 0.00 0.00 61.00 62.49 1jvo s PRO 40 Cb -0.29 -1.96 1.58 0.00 0.04 0.00 0.00 34.50 33.87 1jvo s PRO 40 CO 0.36 -1.42 1.71 -0.22 0.04 0.00 0.00 177.00 177.47 1jvo h LYS 41 N -0.94 0.03 0.63 4.56 3.64 -1.89 -2.13 116.57 120.47 1jvo h LYS 41 Ca -0.46 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 58.89 1jvo h LYS 41 Cb 1.28 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 1jvo h LYS 41 CO 0.62 0.02 -0.33 0.00 -2.27 0.00 0.00 179.45 177.50 1jvo h VAL 43 N -0.88 0.07 -0.67 0.00 2.07 -1.78 -3.41 116.25 111.65 1jvo h VAL 43 Ca -0.08 -1.06 -0.41 0.00 0.82 0.00 0.00 66.70 65.97 1jvo h VAL 43 Cb 0.69 0.14 -0.24 0.00 -1.52 0.00 0.00 31.29 30.35 1jvo h VAL 43 CO 0.12 0.02 0.09 0.80 0.02 0.00 0.00 177.57 178.63 1jvo n MET 44 N -4.75 2.43 -1.90 1.57 0.00 -0.89 -5.04 117.12 108.54 1jvo n MET 44 Ca -0.02 -3.38 -0.40 0.00 -0.00 0.00 0.00 57.70 53.90 1jvo n MET 44 Cb 0.06 -2.07 0.00 0.00 0.00 0.00 0.00 33.22 31.22 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 -2.41 2.94 0.10 -5.12 0.00 -1.09 -4.86 107.32 96.88 1jvo s GLY 45 Ca 0.52 1.42 0.05 0.00 0.00 0.00 0.00 44.72 46.71 1jvo s GLY 45 CO 0.02 2.06 -0.12 0.30 0.00 0.00 0.00 173.10 175.36 1jvo s HIS 46 N -1.18 1.20 0.18 1.90 3.76 -0.70 -4.70 115.29 115.76 1jvo s HIS 46 Ca 0.55 -0.58 -0.10 0.00 -0.15 0.00 0.00 55.06 54.78 1jvo s HIS 46 Cb -0.43 -0.65 -0.01 0.00 1.11 0.00 0.00 32.58 32.61 1jvo s HIS 46 CO 0.57 0.06 0.32 0.54 -0.85 0.00 0.00 174.74 175.38 1jvo s ASN 47 N -2.32 0.00 -0.24 1.40 2.20 -1.26 -0.26 114.94 114.46 1jvo s ASN 47 Ca 0.05 -0.88 0.02 0.00 -0.94 0.00 0.00 52.86 51.11 1jvo s ASN 47 Cb -0.05 0.47 0.05 0.00 -2.00 0.00 0.00 41.25 39.72 1jvo s ASN 47 CO 0.01 -0.94 -0.11 0.86 -2.94 0.00 0.00 177.10 173.98 1jvo s TRP 48 N -3.98 3.01 -0.05 1.54 -0.00 -1.26 -3.97 118.94 114.22 1jvo s TRP 48 Ca 0.19 -2.09 0.05 0.00 -0.00 0.00 0.00 56.10 54.24 1jvo s TRP 48 Cb 0.03 -1.85 -0.02 0.00 -0.00 0.00 0.00 33.47 31.62 1jvo s TRP 48 CO 0.02 -0.84 -0.19 0.08 -0.00 0.00 0.00 176.95 176.01 1jvo s VAL 49 N 1.19 2.59 -0.06 5.86 1.01 0.05 -1.52 120.40 129.51 1jvo s VAL 49 Ca -0.06 -0.89 0.05 0.00 0.00 0.00 0.00 61.98 61.08 1jvo s VAL 49 Cb -0.19 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.21 1jvo s VAL 49 CO -0.07 0.58 -0.22 -0.22 0.00 0.00 0.00 175.10 175.17 1jvo s LEU 50 N -0.44 2.02 0.26 3.92 2.96 -0.38 -1.18 118.68 125.85 1jvo s LEU 50 Ca 0.05 -0.48 -0.20 0.00 -0.22 0.00 0.00 54.13 53.28 1jvo s LEU 50 Cb -0.12 -1.27 0.06 0.00 0.50 0.00 0.00 46.19 45.37 1jvo s LEU 50 CO 0.02 0.19 0.91 -0.94 -1.32 0.00 0.00 176.35 175.21 1jvo s SER 51 N 0.04 -0.04 0.42 3.68 1.04 -0.56 -0.80 113.70 117.47 1jvo s SER 51 Ca -0.08 -0.81 -0.24 0.00 0.48 0.00 0.00 55.95 55.30 1jvo s SER 51 Cb -0.14 0.65 -0.08 0.00 0.10 0.00 0.00 66.02 66.54 1jvo s SER 51 CO 0.05 -1.27 1.14 0.42 0.98 0.00 0.00 173.24 174.55 1jvo s THR 52 N -2.50 3.29 0.54 2.02 -4.23 -1.26 -0.07 115.64 113.42 1jvo s THR 52 Ca 0.17 1.02 0.33 0.00 -1.18 0.00 0.00 61.69 62.03 1jvo s THR 52 Cb -0.04 -3.55 0.50 0.00 1.34 0.00 0.00 72.50 70.75 1jvo s THR 52 CO 0.07 0.04 1.87 0.00 -0.54 0.00 0.00 174.62 176.07 1jvo h ALA 53 N 2.45 2.90 0.00 3.99 0.00 -1.77 0.31 119.26 127.13 1jvo h ALA 53 Ca -0.49 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.31 1jvo h ALA 53 Cb 1.23 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1jvo h ALA 53 CO 0.62 -1.18 -0.40 0.00 0.00 0.00 0.00 179.25 178.29 1jvo h ALA 54 N 1.51 0.91 0.00 0.00 0.00 -1.90 -3.23 119.26 116.55 1jvo h ALA 54 Ca 0.45 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1jvo h ALA 54 Cb 1.82 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.55 1jvo h ALA 54 CO -0.00 0.50 -0.99 -0.25 0.00 0.00 0.00 179.25 178.50 1jvo n ASP 55 N -3.43 0.68 -0.07 0.00 8.00 0.10 -4.61 116.55 117.23 1jvo n ASP 55 Ca 0.00 -0.48 -0.11 0.00 0.71 0.00 0.00 54.79 54.91 1jvo n ASP 55 Cb 0.56 0.85 -0.07 0.00 -0.02 0.00 0.00 41.12 42.44 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 0.00 -0.33 -0.68 -1.24 1.85 -1.44 -0.43 114.93 112.66 1jvo h MET 56 Ca 0.00 0.02 0.15 0.00 -0.61 0.00 0.00 59.70 59.26 1jvo h MET 56 Cb 0.62 0.08 -0.11 0.00 0.43 0.00 0.00 31.60 32.62 1jvo h MET 56 CO 0.00 -0.22 0.06 0.37 -0.40 0.00 0.00 176.91 176.72 1jvo h GLN 57 N -0.34 0.16 0.11 0.39 5.75 -1.81 0.13 115.11 119.49 1jvo h GLN 57 Ca 0.04 -0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.55 1jvo h GLN 57 Cb 0.46 -0.04 -0.04 0.00 1.07 0.00 0.00 27.48 28.94 1jvo h GLN 57 CO -0.40 0.10 -0.27 0.78 -2.65 0.00 0.00 178.83 176.40 1jvo h GLY 58 N 0.16 -0.50 1.00 2.39 0.00 -1.58 -0.11 103.07 104.43 1jvo h GLY 58 Ca 0.37 0.32 0.00 0.00 0.00 0.00 0.00 47.33 48.02 1jvo h GLY 58 CO -0.54 -0.23 0.34 -2.08 0.00 0.00 0.00 176.54 174.03 1jvo h VAL 59 N -0.48 1.15 -0.34 4.60 2.07 -0.24 -1.94 116.25 121.07 1jvo h VAL 59 Ca 0.03 -0.31 0.02 0.00 0.82 0.00 0.00 66.70 67.25 1jvo h VAL 59 Cb 0.51 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1jvo h VAL 59 CO -0.16 0.15 0.20 0.58 0.02 0.00 0.00 177.57 178.35 1jvo h VAL 60 N 0.72 1.03 -0.22 2.57 2.07 -0.49 0.31 116.25 122.25 1jvo h VAL 60 Ca 0.19 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 1jvo h VAL 60 Cb -0.04 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1jvo h VAL 60 CO -0.04 0.07 0.12 0.74 0.02 0.00 0.00 177.57 178.49 1jvo h THR 61 N 0.40 1.11 -0.04 2.57 2.02 -0.84 -2.38 112.91 115.75 1jvo h THR 61 Ca 0.14 -0.29 -0.17 0.00 0.77 0.00 0.00 66.41 66.86 1jvo h THR 61 Cb 0.01 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 1jvo h THR 61 CO -0.07 0.10 -0.72 0.44 0.37 0.00 0.00 175.52 175.65 1jvo h ASP 62 N 0.25 0.27 -0.33 4.18 3.32 -1.22 -3.12 116.42 119.77 1jvo h ASP 62 Ca 0.08 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 56.94 1jvo h ASP 62 Cb 0.06 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 1jvo h ASP 62 CO -0.01 0.90 0.17 1.23 -1.72 0.00 0.00 179.24 179.81 1jvo h GLY 63 N 1.62 0.50 0.52 2.75 0.00 -0.29 -1.71 103.07 106.47 1jvo h GLY 63 Ca -0.02 -0.23 0.09 0.00 0.00 0.00 0.00 47.33 47.17 1jvo h GLY 63 CO 0.11 0.22 0.42 1.98 0.00 0.00 0.00 176.54 179.27 1jvo h MET 64 N 0.41 0.69 0.00 4.80 1.85 -1.43 -0.96 114.93 120.28 1jvo h MET 64 Ca 0.12 -0.04 -0.08 0.00 -0.61 0.00 0.00 59.70 59.08 1jvo h MET 64 Cb 0.08 -0.16 -0.01 0.00 0.43 0.00 0.00 31.60 31.94 1jvo h MET 64 CO -0.02 0.46 -0.40 0.00 -0.40 0.00 0.00 176.91 176.55 1jvo h ALA 65 N 1.43 1.33 -0.30 0.39 0.00 -1.43 -2.95 119.26 117.72 1jvo h ALA 65 Ca 0.37 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1jvo h ALA 65 Cb 0.35 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1jvo h ALA 65 CO -0.25 0.50 0.20 0.77 0.00 0.00 0.00 179.25 180.48 1jvo h SER 66 N 0.00 0.28 -4.48 0.00 0.02 -0.23 -3.49 113.55 105.65 1jvo h SER 66 Ca -0.00 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1jvo h SER 66 Cb 0.72 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1jvo h SER 66 CO 0.05 0.20 0.00 0.61 -1.14 0.00 0.00 176.83 176.55 1jvo n GLY 67 N -1.51 -0.32 0.45 -3.77 0.00 -1.12 -4.26 105.19 94.67 1jvo n GLY 67 Ca 0.02 -1.60 0.29 0.00 0.00 0.00 0.00 46.02 44.73 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 0.30 -1.50 0.99 5.85 -1.90 0.34 115.31 119.39 1jvo h LEU 68 Ca 0.00 0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.76 1jvo h LEU 68 Cb 0.00 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1jvo h LEU 68 CO 0.00 0.02 -0.17 0.44 -0.34 0.00 0.00 178.44 178.39 1jvo h ASP 69 N 0.24 0.00 -0.51 1.25 3.32 -2.00 -1.91 116.42 116.81 1jvo h ASP 69 Ca 0.63 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.68 1jvo h ASP 69 Cb 1.91 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.46 1jvo h ASP 69 CO -0.25 0.17 0.00 0.29 -1.72 0.00 0.00 179.24 177.73 1jvo n LYS 70 N -3.47 3.14 -2.17 3.56 4.76 0.12 -4.88 118.16 119.23 1jvo n LYS 70 Ca -0.01 -2.24 -0.19 0.00 -2.87 0.00 0.00 58.31 53.00 1jvo n LYS 70 Cb 0.34 -1.76 -0.03 0.00 -1.84 0.00 0.00 35.03 31.74 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 0.84 -5.37 -3.70 4.39 9.92 -0.72 -1.76 116.55 120.16 1jvo n ASP 71 Ca 0.20 0.15 -0.23 0.00 -0.53 0.00 0.00 54.79 54.38 1jvo n ASP 71 Cb 0.72 -4.56 0.05 0.00 -0.64 0.00 0.00 41.12 36.68 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 -3.43 -2.17 -3.72 1.24 4.01 -1.03 -4.74 117.16 107.32 1jvo n TYR 72 Ca -0.22 0.89 -0.12 0.00 -0.16 0.00 0.00 57.90 58.29 1jvo n TYR 72 Cb 0.66 -4.48 -0.13 0.00 -0.31 0.00 0.00 39.34 35.08 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 -6.85 0.30 0.13 7.72 1.43 -0.72 -4.21 118.68 116.48 1jvo s LEU 73 Ca 0.23 0.55 -0.31 0.00 -1.03 0.00 0.00 54.13 53.57 1jvo s LEU 73 Cb -0.11 0.76 -0.10 0.00 0.03 0.00 0.00 46.19 46.77 1jvo s LEU 73 CO 0.79 -0.18 1.68 -0.75 0.23 0.00 0.00 176.35 178.13 1jvo s LYS 74 N 1.40 4.18 0.16 1.70 2.20 -1.26 -4.84 119.74 123.28 1jvo s LYS 74 Ca -0.08 2.45 -0.34 0.00 -0.36 0.00 0.00 55.97 57.64 1jvo s LYS 74 Cb -0.10 -3.38 -0.15 0.00 -1.51 0.00 0.00 37.83 32.69 1jvo s LYS 74 CO -0.09 -0.72 1.40 -2.30 -0.36 0.00 0.00 175.35 173.28 1jvo n PRO 75 N 4.87 1.67 -4.00 4.03 -0.02 -1.26 -2.07 135.00 138.22 1jvo n PRO 75 Ca 0.16 0.60 -0.30 0.00 -2.02 0.00 0.00 63.50 61.94 1jvo n PRO 75 Cb 0.38 -2.26 -0.00 0.00 -0.02 0.00 0.00 33.50 31.60 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 2.66 -2.84 -4.66 2.55 8.00 -1.26 -4.89 116.55 116.10 1jvo n ASP 76 Ca 0.16 -0.91 -0.43 0.00 0.71 0.00 0.00 54.79 54.32 1jvo n ASP 76 Cb 0.26 -3.35 -0.02 0.00 -0.02 0.00 0.00 41.12 37.99 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 -3.68 6.85 0.53 -2.24 -1.08 -0.88 -4.88 116.67 111.28 1jvo s ASP 77 Ca 0.46 1.90 0.31 0.00 -0.52 0.00 0.00 52.55 54.70 1jvo s ASP 77 Cb -0.24 -2.54 1.36 0.00 -1.46 0.00 0.00 42.92 40.04 1jvo s ASP 77 CO 0.87 -0.81 1.99 0.77 0.52 0.00 0.00 175.17 178.51 1jvo h SER 78 N 8.65 0.00 0.57 -0.34 4.64 -1.91 -2.90 113.55 122.25 1jvo h SER 78 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1jvo h SER 78 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1jvo h SER 78 CO 0.96 0.08 0.00 0.54 -0.87 0.00 0.00 176.83 177.54 1jvo n ARG 79 N -3.26 0.14 -3.29 4.77 1.74 -1.26 -4.65 116.66 110.84 1jvo n ARG 79 Ca -0.00 0.12 -0.42 0.00 -0.77 0.00 0.00 57.85 56.77 1jvo n ARG 79 Cb 0.31 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.16 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 -2.80 5.06 0.14 1.55 1.01 -1.10 -4.53 120.40 119.73 1jvo s VAL 80 Ca 0.15 -0.10 -0.10 0.00 0.00 0.00 0.00 61.98 61.93 1jvo s VAL 80 Cb 0.14 -4.01 -0.08 0.00 0.00 0.00 0.00 36.38 32.43 1jvo s VAL 80 CO 0.35 -0.35 1.43 0.40 0.00 0.00 0.00 175.10 176.94 1jvo h ILE 81 N 5.69 1.28 -2.36 2.22 2.04 -1.24 -3.47 117.51 121.67 1jvo h ILE 81 Ca -0.27 -1.73 0.04 0.00 1.00 0.00 0.00 64.86 63.90 1jvo h ILE 81 Cb 1.12 1.63 -0.16 0.00 -0.74 0.00 0.00 36.82 38.67 1jvo h ILE 81 CO 0.78 0.56 0.37 0.00 0.00 0.00 0.00 178.15 179.86 1jvo s ALA 82 N -4.13 -1.76 -0.11 1.87 0.00 -1.23 -5.01 121.76 111.40 1jvo s ALA 82 Ca -0.10 0.98 -0.30 0.00 0.00 0.00 0.00 51.96 52.54 1jvo s ALA 82 Cb 0.10 0.35 0.12 0.00 0.00 0.00 0.00 23.12 23.69 1jvo s ALA 82 CO 0.88 -0.61 0.95 -3.38 0.00 0.00 0.00 175.76 173.60 1jvo s HIS 83 N -2.75 -0.37 0.51 0.00 -3.43 -1.26 -1.25 115.29 106.74 1jvo s HIS 83 Ca 0.00 0.51 0.08 0.00 -0.80 0.00 0.00 55.06 54.86 1jvo s HIS 83 Cb -0.01 0.48 0.08 0.00 -1.43 0.00 0.00 32.58 31.70 1jvo s HIS 83 CO -0.06 -0.41 0.67 0.25 -2.00 0.00 0.00 174.74 173.19 1jvo n THR 84 N 0.42 0.00 -2.26 -5.38 -2.24 -0.57 -4.81 114.28 99.43 1jvo n THR 84 Ca -0.10 -1.71 -0.26 0.00 -2.27 0.00 0.00 64.05 59.71 1jvo n THR 84 Cb 0.59 -0.54 0.12 0.00 -2.10 0.00 0.00 70.33 68.40 1jvo n THR 84 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1jvo s LYS 85 N -4.27 1.54 -0.30 -0.78 1.02 -1.26 -4.53 119.74 111.16 1jvo s LYS 85 Ca 0.51 -0.61 -0.23 0.00 0.02 0.00 0.00 55.97 55.66 1jvo s LYS 85 Cb -0.04 -2.13 -0.00 0.00 -0.52 0.00 0.00 37.83 35.14 1jvo s LYS 85 CO 0.32 -1.66 0.78 -1.17 -0.92 0.00 0.00 175.35 172.70 1jvo s LEU 86 N -5.40 4.09 0.07 3.17 2.96 -1.26 -4.36 118.68 117.95 1jvo s LEU 86 Ca 0.66 0.70 0.06 0.00 -0.22 0.00 0.00 54.13 55.33 1jvo s LEU 86 Cb -0.07 -3.07 -0.04 0.00 0.50 0.00 0.00 46.19 43.51 1jvo s LEU 86 CO 0.47 -0.59 -0.08 0.27 -1.32 0.00 0.00 176.35 175.10 1jvo s ILE 87 N 2.92 3.50 0.00 6.68 -4.36 0.64 -4.88 121.20 125.69 1jvo s ILE 87 Ca 0.32 -1.09 0.00 0.00 -0.26 0.00 0.00 60.65 59.62 1jvo s ILE 87 Cb -0.14 -2.60 0.00 0.00 1.25 0.00 0.00 42.46 40.97 1jvo s ILE 87 CO 0.12 0.20 0.00 0.61 0.24 0.00 0.00 174.94 176.11 1jvo n GLY 88 N 0.96 2.23 3.64 6.27 0.00 -1.26 -1.71 105.19 115.32 1jvo n GLY 88 Ca -0.14 -2.14 -0.45 0.00 0.00 0.00 0.00 46.02 43.29 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 -2.72 2.24 0.00 1.61 2.88 -0.49 -2.08 113.62 115.05 1jvo n SER 89 Ca 0.00 1.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.70 1jvo n SER 89 Cb 0.00 -1.38 0.00 0.00 -0.75 0.00 0.00 64.21 62.08 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 1.68 1.94 3.04 0.46 0.00 0.81 -4.97 105.19 108.15 1jvo n GLY 90 Ca 0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 1jvo n GLY 90 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jvo n GLU 91 N -1.76 -1.60 -3.43 1.61 1.02 -0.89 -4.85 120.64 110.74 1jvo n GLU 91 Ca 0.00 -1.59 -0.12 0.00 -0.02 0.00 0.00 57.16 55.43 1jvo n GLU 91 Cb 0.00 -1.18 -0.02 0.00 -0.02 0.00 0.00 31.44 30.21 1jvo n GLU 91 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1jvo s LYS 92 N -5.25 1.25 -0.02 3.49 2.47 -1.26 -3.09 119.74 117.32 1jvo s LYS 92 Ca 0.60 -0.41 -0.30 0.00 -1.56 0.00 0.00 55.97 54.31 1jvo s LYS 92 Cb -0.03 0.57 0.11 0.00 -1.46 0.00 0.00 37.83 37.02 1jvo s LYS 92 CO 0.43 -0.53 1.00 0.34 0.16 0.00 0.00 175.35 176.75 1jvo s ASP 93 N -2.61 -0.26 0.05 1.43 2.15 -0.81 -5.04 116.67 111.58 1jvo s ASP 93 Ca 0.00 -0.07 -0.08 0.00 0.43 0.00 0.00 52.55 52.84 1jvo s ASP 93 Cb -0.01 0.33 -0.01 0.00 -0.30 0.00 0.00 42.92 42.93 1jvo s ASP 93 CO -0.11 -0.55 0.15 -0.44 -0.17 0.00 0.00 175.17 174.05 1jvo s SER 94 N -2.52 0.13 -0.09 -0.34 0.01 -1.26 -0.80 113.70 108.83 1jvo s SER 94 Ca 0.08 -0.55 -0.04 0.00 1.31 0.00 0.00 55.95 56.75 1jvo s SER 94 Cb -0.01 0.28 0.05 0.00 0.21 0.00 0.00 66.02 66.55 1jvo s SER 94 CO -0.06 -0.60 0.22 0.54 0.41 0.00 0.00 173.24 173.74 1jvo s VAL 95 N -3.08 -0.08 -0.06 3.43 0.11 -0.89 -4.92 120.40 114.92 1jvo s VAL 95 Ca -0.01 0.18 0.04 0.00 -2.93 0.00 0.00 61.98 59.25 1jvo s VAL 95 Cb 0.01 -0.34 -0.02 0.00 -1.53 0.00 0.00 36.38 34.50 1jvo s VAL 95 CO -0.07 0.07 -0.17 -0.89 -3.33 0.00 0.00 175.10 170.71 1jvo s THR 96 N 1.36 2.79 0.07 5.04 2.01 -1.26 -1.48 115.64 124.19 1jvo s THR 96 Ca -0.08 -0.81 0.00 0.00 0.31 0.00 0.00 61.69 61.11 1jvo s THR 96 Cb -0.11 -2.08 -0.04 0.00 0.01 0.00 0.00 72.50 70.28 1jvo s THR 96 CO -0.08 0.58 -0.05 0.72 -0.69 0.00 0.00 174.62 175.10 1jvo s PHE 97 N -0.48 0.69 -0.04 4.92 -0.71 -0.12 -4.95 117.98 117.29 1jvo s PHE 97 Ca 0.06 -0.96 -0.30 0.00 -1.04 0.00 0.00 56.93 54.69 1jvo s PHE 97 Cb -0.12 -0.44 -0.03 0.00 -1.21 0.00 0.00 43.02 41.22 1jvo s PHE 97 CO 0.01 -0.26 1.16 -0.51 -1.34 0.00 0.00 175.22 174.29 1jvo s ASP 98 N -2.87 7.10 0.55 1.98 1.11 -1.26 -0.15 116.67 123.12 1jvo s ASP 98 Ca 0.08 1.81 0.25 0.00 0.18 0.00 0.00 52.55 54.87 1jvo s ASP 98 Cb 0.05 -2.56 1.45 0.00 1.07 0.00 0.00 42.92 42.94 1jvo s ASP 98 CO -0.07 -0.53 2.04 0.58 1.18 0.00 0.00 175.17 178.38 1jvo h VAL 99 N 4.92 0.68 -0.88 -1.27 2.07 -0.99 -1.91 116.25 118.86 1jvo h VAL 99 Ca -0.36 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.29 1jvo h VAL 99 Cb 1.17 0.80 -0.07 0.00 -1.52 0.00 0.00 31.29 31.68 1jvo h VAL 99 CO 0.86 0.00 0.57 0.77 0.02 0.00 0.00 177.57 179.78 1jvo h SER 100 N 0.00 0.70 -0.27 0.57 4.64 -1.87 -0.18 113.55 117.14 1jvo h SER 100 Ca 0.16 0.03 0.08 0.00 -0.47 0.00 0.00 61.79 61.59 1jvo h SER 100 Cb 0.72 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.69 1jvo h SER 100 CO -0.00 0.38 0.25 0.11 -0.87 0.00 0.00 176.83 176.70 1jvo h LYS 101 N 0.76 0.00 -6.59 4.77 1.57 -1.72 -3.40 116.57 111.96 1jvo h LYS 101 Ca 0.43 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.69 1jvo h LYS 101 Cb 0.58 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.86 1jvo h LYS 101 CO -0.19 0.00 0.19 -0.51 -0.57 0.00 0.00 179.45 178.37 1jvo s LEU 102 N -8.01 4.50 -0.23 2.94 1.43 -0.08 -5.05 118.68 114.17 1jvo s LEU 102 Ca -0.05 1.62 0.01 0.00 -1.03 0.00 0.00 54.13 54.68 1jvo s LEU 102 Cb 0.17 -3.47 0.06 0.00 0.03 0.00 0.00 46.19 42.97 1jvo s LEU 102 CO 0.61 0.13 -0.07 -1.59 0.23 0.00 0.00 176.35 175.65 1jvo s LYS 103 N -1.49 1.79 0.36 1.70 -2.85 -1.26 -5.02 119.74 112.97 1jvo s LYS 103 Ca 0.40 -1.03 -0.23 0.00 -1.00 0.00 0.00 55.97 54.11 1jvo s LYS 103 Cb -0.21 -2.62 -0.15 0.00 -2.06 0.00 0.00 37.83 32.79 1jvo s LYS 103 CO 0.25 -0.57 0.24 -1.91 0.10 0.00 0.00 175.35 173.46 1jvo n GLU 104 N 4.63 0.09 0.00 1.78 2.13 -1.26 -2.67 120.64 125.34 1jvo n GLU 104 Ca -0.13 0.03 0.00 0.00 0.66 0.00 0.00 57.16 57.73 1jvo n GLU 104 Cb 0.44 -1.08 0.00 0.00 0.27 0.00 0.00 31.44 31.07 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 2.19 2.90 3.88 8.31 0.00 -1.26 -5.04 105.19 116.16 1jvo n GLY 105 Ca 0.13 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 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 3.40 -0.12 1.61 2.12 -1.09 -5.05 118.70 119.57 1jvo s GLU 106 Ca 0.00 0.52 -0.18 0.00 0.36 0.00 0.00 54.97 55.67 1jvo s GLU 106 Cb 0.00 -2.15 -0.04 0.00 0.26 0.00 0.00 34.13 32.20 1jvo s GLU 106 CO 0.00 -0.59 0.48 -0.65 -0.54 0.00 0.00 175.26 173.96 1jvo s GLN 107 N -5.10 4.34 -0.04 4.30 -0.21 -1.26 -4.90 119.66 116.78 1jvo s GLN 107 Ca 0.54 0.45 0.06 0.00 0.02 0.00 0.00 55.36 56.43 1jvo s GLN 107 Cb -0.11 -3.43 -0.01 0.00 1.00 0.00 0.00 33.01 30.46 1jvo s GLN 107 CO 0.51 0.16 -0.24 0.71 -2.12 0.00 0.00 175.29 174.32 1jvo s TYR 108 N 0.61 2.23 -0.03 0.91 2.02 -1.25 -2.31 117.35 119.53 1jvo s TYR 108 Ca 0.26 -0.58 0.06 0.00 -0.37 0.00 0.00 57.07 56.44 1jvo s TYR 108 Cb -0.15 -1.46 -0.01 0.00 -0.40 0.00 0.00 41.96 39.94 1jvo s TYR 108 CO 0.10 -0.15 -0.20 -1.64 -1.57 0.00 0.00 175.55 172.10 1jvo s MET 109 N -0.27 1.79 0.21 -0.62 -1.94 0.89 -1.13 119.30 118.22 1jvo s MET 109 Ca 0.01 -0.71 0.10 0.00 -1.71 0.00 0.00 55.69 53.39 1jvo s MET 109 Cb -0.12 -1.64 -0.04 0.00 2.01 0.00 0.00 34.83 35.04 1jvo s MET 109 CO 0.02 0.37 -0.16 -0.59 -0.01 0.00 0.00 175.02 174.65 1jvo s PHE 110 N -0.27 2.47 -0.02 -0.03 -0.12 -0.49 -1.50 117.98 118.02 1jvo s PHE 110 Ca 0.03 -0.29 -0.30 0.00 -0.05 0.00 0.00 56.93 56.32 1jvo s PHE 110 Cb -0.10 -1.18 0.12 0.00 -0.63 0.00 0.00 43.02 41.23 1jvo s PHE 110 CO 0.01 0.54 1.30 -0.59 -0.05 0.00 0.00 175.22 176.43 1jvo s PHE 111 N -1.85 -0.02 -0.21 3.49 -0.71 -0.32 -1.31 117.98 117.05 1jvo s PHE 111 Ca 0.25 -0.08 -0.09 0.00 -1.04 0.00 0.00 56.93 55.96 1jvo s PHE 111 Cb -0.08 0.55 -0.05 0.00 -1.21 0.00 0.00 43.02 42.23 1jvo s PHE 111 CO 0.14 -0.26 0.12 0.00 -1.34 0.00 0.00 175.22 173.88 1jvo n THR 113 N 3.77 1.05 -2.47 0.00 -2.24 -1.26 -3.22 114.28 109.90 1jvo n THR 113 Ca -0.16 -0.63 -0.41 0.00 -2.27 0.00 0.00 64.05 60.58 1jvo n THR 113 Cb 0.52 -0.12 -0.04 0.00 -2.10 0.00 0.00 70.33 68.59 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 -1.73 3.54 -0.40 4.78 2.19 -1.26 -4.48 117.98 120.62 1jvo s PHE 114 Ca 0.27 1.54 -0.37 0.00 0.33 0.00 0.00 56.93 58.71 1jvo s PHE 114 Cb 0.18 -3.32 -0.16 0.00 -1.31 0.00 0.00 43.02 38.41 1jvo s PHE 114 CO 0.12 -0.79 1.46 -2.30 1.83 0.00 0.00 175.22 175.54 1jvo n PRO 115 N 2.47 0.00 0.00 10.12 -0.02 -1.26 -0.54 135.00 145.77 1jvo n PRO 115 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 1jvo n PRO 115 Cb 0.46 -1.20 0.00 0.00 -0.02 0.00 0.00 33.50 32.73 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 4.35 2.86 0.20 -1.23 0.00 -1.26 -4.88 105.19 105.23 1jvo n GLY 116 Ca 0.33 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.31 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 0.37 0.00 1.61 3.86 -1.07 -2.90 115.15 117.02 1jvo h HIS 117 Ca 0.00 -0.11 0.00 0.00 -1.16 0.00 0.00 60.37 59.10 1jvo h HIS 117 Cb 0.00 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.39 1jvo h HIS 117 CO 0.00 0.70 0.19 0.66 0.86 0.00 0.00 177.93 180.34 1jvo h SER 118 N 0.25 0.00 0.11 2.45 4.64 -1.70 0.36 113.55 119.66 1jvo h SER 118 Ca 0.02 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.33 1jvo h SER 118 Cb 0.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 1jvo h SER 118 CO 0.07 0.00 -0.05 0.00 -0.87 0.00 0.00 176.83 175.98 1jvo h ALA 119 N 1.51 -0.15 0.00 5.18 0.00 -1.86 -3.37 119.26 120.56 1jvo h ALA 119 Ca 0.00 -0.08 -0.34 0.00 0.00 0.00 0.00 54.91 54.49 1jvo h ALA 119 Cb 0.38 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 1jvo h ALA 119 CO 0.00 -0.53 -2.30 1.28 0.00 0.00 0.00 179.25 177.70 1jvo n LEU 120 N -5.11 2.26 -4.51 0.00 4.77 -0.03 -4.82 117.00 109.57 1jvo n LEU 120 Ca -0.08 -0.09 -0.43 0.00 -0.03 0.00 0.00 56.01 55.37 1jvo n LEU 120 Cb 0.13 -0.51 -0.01 0.00 -2.33 0.00 0.00 43.42 40.70 1jvo n LEU 120 CO 0.34 0.78 1.53 -0.04 -1.33 0.00 0.00 177.39 178.67 1jvo s MET 121 N -2.46 3.95 0.03 3.23 -1.94 0.11 -4.83 119.30 117.39 1jvo s MET 121 Ca -0.26 -2.15 -0.28 0.00 -1.71 0.00 0.00 55.69 51.29 1jvo s MET 121 Cb 0.07 -5.22 0.07 0.00 2.01 0.00 0.00 34.83 31.77 1jvo s MET 121 CO 0.58 -1.96 0.67 -1.59 -0.01 0.00 0.00 175.02 172.71 1jvo s LYS 122 N 2.88 1.11 0.15 2.03 0.00 -1.26 -2.08 119.74 122.57 1jvo s LYS 122 Ca 0.45 -0.07 -0.06 0.00 0.00 0.00 0.00 55.97 56.29 1jvo s LYS 122 Cb -0.01 0.52 0.02 0.00 0.00 0.00 0.00 37.83 38.37 1jvo s LYS 122 CO 0.00 -0.42 0.30 0.41 0.00 0.00 0.00 175.35 175.65 1jvo n GLY 123 N 0.32 1.61 3.56 0.59 0.00 -0.43 -4.83 105.19 106.00 1jvo n GLY 123 Ca -0.17 -1.10 -0.32 0.00 0.00 0.00 0.00 46.02 44.42 1jvo n GLY 123 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jvo s THR 124 N -2.66 3.46 -0.16 2.61 -4.23 0.09 -1.39 115.64 113.37 1jvo s THR 124 Ca 0.06 -0.79 0.00 0.00 -1.18 0.00 0.00 61.69 59.79 1jvo s THR 124 Cb -0.02 -2.47 0.00 0.00 1.34 0.00 0.00 72.50 71.35 1jvo s THR 124 CO 0.05 0.44 -0.16 -0.22 -0.54 0.00 0.00 174.62 174.18 1jvo s LEU 125 N -1.26 2.42 0.01 4.79 0.20 -0.28 -0.71 118.68 123.86 1jvo s LEU 125 Ca 0.15 -0.49 0.07 0.00 0.69 0.00 0.00 54.13 54.55 1jvo s LEU 125 Cb -0.11 -1.55 -0.03 0.00 -0.43 0.00 0.00 46.19 44.07 1jvo s LEU 125 CO 0.06 0.08 -0.20 -0.89 -0.29 0.00 0.00 176.35 175.10 1jvo s THR 126 N 0.87 2.63 -0.69 3.68 2.01 0.18 -3.80 115.64 120.52 1jvo s THR 126 Ca -0.04 -1.11 -0.12 0.00 0.31 0.00 0.00 61.69 60.73 1jvo s THR 126 Cb -0.15 -2.05 0.18 0.00 0.01 0.00 0.00 72.50 70.48 1jvo s THR 126 CO -0.01 0.43 0.60 -0.22 -0.69 0.00 0.00 174.62 174.73 1jvo s LEU 127 N -1.13 6.22 0.00 4.42 1.98 -1.26 0.74 118.68 129.64 1jvo s LEU 127 Ca 0.13 -2.45 0.16 0.00 -2.89 0.00 0.00 54.13 49.08 1jvo s LEU 127 Cb -0.10 -2.11 0.13 0.00 0.66 0.00 0.00 46.19 44.76 1jvo s LEU 127 CO 0.03 -0.60 1.01 2.29 -1.89 0.00 0.00 176.35 177.18