#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 3.59 -1.42 0.00 2.12 -1.26 -4.52 118.70 117.21 1jvo s GLU 2 Ca 0.00 -0.55 -0.03 0.00 0.36 0.00 0.00 54.97 54.75 1jvo s GLU 2 Cb 0.00 -2.97 0.00 0.00 0.26 0.00 0.00 34.13 31.42 1jvo s GLU 2 CO 0.00 0.09 0.39 0.00 -0.54 0.00 0.00 175.26 175.19 1jvo s SER 4 N -2.59 -0.39 0.01 0.00 1.04 -1.26 -2.22 113.70 108.29 1jvo s SER 4 Ca 0.19 0.46 -0.01 0.00 0.48 0.00 0.00 55.95 57.07 1jvo s SER 4 Cb -0.08 0.37 -0.01 0.00 0.10 0.00 0.00 66.02 66.39 1jvo s SER 4 CO 0.24 -0.33 0.01 0.54 0.98 0.00 0.00 173.24 174.68 1jvo s VAL 5 N -0.98 0.07 -0.28 5.02 0.11 -0.15 -3.31 120.40 120.88 1jvo s VAL 5 Ca -0.02 -0.62 -0.07 0.00 -2.93 0.00 0.00 61.98 58.35 1jvo s VAL 5 Cb -0.01 -0.23 -0.01 0.00 -1.53 0.00 0.00 36.38 34.61 1jvo s VAL 5 CO 0.01 -0.34 0.07 -1.81 -3.33 0.00 0.00 175.10 169.70 1jvo s ASP 6 N -1.03 5.09 0.06 3.54 1.11 -1.26 -0.98 116.67 123.20 1jvo s ASP 6 Ca -0.11 -0.51 0.08 0.00 0.18 0.00 0.00 52.55 52.19 1jvo s ASP 6 Cb -0.07 -1.89 -0.03 0.00 1.07 0.00 0.00 42.92 42.00 1jvo s ASP 6 CO -0.00 -0.13 -0.22 -0.51 1.18 0.00 0.00 175.17 175.48 1jvo s ILE 7 N 1.54 1.82 0.06 0.77 2.07 -0.34 -4.98 121.20 122.14 1jvo s ILE 7 Ca 0.04 -1.35 0.06 0.00 -1.41 0.00 0.00 60.65 57.99 1jvo s ILE 7 Cb -0.16 -1.59 -0.03 0.00 0.13 0.00 0.00 42.46 40.81 1jvo s ILE 7 CO 0.03 0.18 -0.16 -1.10 -1.91 0.00 0.00 174.94 171.97 1jvo s GLN 8 N -1.40 0.99 -0.15 3.50 -0.21 -1.26 -2.11 119.66 119.01 1jvo s GLN 8 Ca 0.09 -0.92 0.00 0.00 0.02 0.00 0.00 55.36 54.55 1jvo s GLN 8 Cb -0.09 -1.06 0.03 0.00 1.00 0.00 0.00 33.01 32.88 1jvo s GLN 8 CO 0.03 0.25 -0.11 0.20 -2.12 0.00 0.00 175.29 173.54 1jvo s GLY 9 N -1.47 1.07 0.58 3.09 0.00 -0.79 -1.64 107.32 108.16 1jvo s GLY 9 Ca 0.02 -0.87 0.08 0.00 0.00 0.00 0.00 44.72 43.96 1jvo s GLY 9 CO 0.02 0.65 0.66 0.54 0.00 0.00 0.00 173.10 174.97 1jvo s ASN 10 N 1.53 4.86 0.01 1.64 2.20 -1.01 -3.86 114.94 120.32 1jvo s ASN 10 Ca 0.04 -1.06 0.16 0.00 -0.94 0.00 0.00 52.86 51.06 1jvo s ASN 10 Cb -0.13 0.46 0.67 0.00 -2.00 0.00 0.00 41.25 40.25 1jvo s ASN 10 CO -0.10 -1.31 1.50 0.47 -2.94 0.00 0.00 177.10 174.72 1jvo n ASP 11 N -2.10 0.02 -0.61 3.54 8.00 -1.26 -1.50 116.55 122.65 1jvo n ASP 11 Ca 0.09 0.50 0.04 0.00 0.71 0.00 0.00 54.79 56.14 1jvo n ASP 11 Cb 0.63 -0.51 0.13 0.00 -0.02 0.00 0.00 41.12 41.35 1jvo n ASP 11 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jvo n GLN 12 N -1.52 1.79 -3.63 -1.24 3.00 -1.26 -4.91 117.38 109.61 1jvo n GLN 12 Ca 0.04 -1.05 -0.24 0.00 -0.01 0.00 0.00 57.00 55.75 1jvo n GLN 12 Cb 0.18 -1.31 0.07 0.00 0.00 0.00 0.00 30.24 29.18 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 0.31 -6.99 -4.08 -1.09 1.56 -0.56 -5.00 117.12 101.26 1jvo n MET 13 Ca 0.10 0.77 -0.12 0.00 -0.27 0.00 0.00 57.70 58.18 1jvo n MET 13 Cb 0.30 -5.75 -0.11 0.00 2.15 0.00 0.00 33.22 29.81 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 -6.15 0.59 0.17 2.12 -0.21 -1.26 -4.29 119.66 110.64 1jvo s GLN 14 Ca 0.43 -0.92 -0.07 0.00 0.02 0.00 0.00 55.36 54.82 1jvo s GLN 14 Cb -0.20 -0.21 -0.06 0.00 1.00 0.00 0.00 33.01 33.54 1jvo s GLN 14 CO 0.76 0.01 0.45 -0.06 -2.12 0.00 0.00 175.29 174.33 1jvo s PHE 15 N -2.12 3.47 -0.14 0.91 0.08 -1.26 -2.39 117.98 116.53 1jvo s PHE 15 Ca -0.04 0.72 0.00 0.00 0.12 0.00 0.00 56.93 57.74 1jvo s PHE 15 Cb -0.05 -2.13 0.16 0.00 -0.57 0.00 0.00 43.02 40.42 1jvo s PHE 15 CO -0.02 0.37 1.55 0.27 -0.10 0.00 0.00 175.22 177.29 1jvo n ASN 16 N 0.10 4.29 0.00 1.36 6.94 -0.65 -4.79 115.26 122.50 1jvo n ASN 16 Ca -0.02 -2.57 0.00 0.00 -0.02 0.00 0.00 54.58 51.98 1jvo n ASN 16 Cb 0.52 -0.79 0.00 0.00 -2.36 0.00 0.00 39.78 37.15 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 0.37 0.00 -0.82 5.53 5.66 -1.26 -4.90 114.28 118.86 1jvo n THR 17 Ca 0.16 0.00 0.02 0.00 -3.05 0.00 0.00 64.05 61.18 1jvo n THR 17 Cb 0.71 0.00 0.02 0.00 -1.55 0.00 0.00 70.33 69.51 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 1.06 -3.62 1.09 0.23 -1.26 -4.86 115.26 107.89 1jvo n ASN 18 Ca 0.00 -1.83 -0.15 0.00 -0.53 0.00 0.00 54.58 52.07 1jvo n ASN 18 Cb 0.00 -0.10 -0.14 0.00 -2.08 0.00 0.00 39.78 37.47 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 -0.79 -0.42 -0.08 -2.53 0.00 -1.26 -0.11 121.76 116.58 1jvo s ALA 19 Ca 0.05 0.71 0.04 0.00 0.00 0.00 0.00 51.96 52.75 1jvo s ALA 19 Cb 0.04 -1.05 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 1jvo s ALA 19 CO 0.00 -0.75 -0.20 0.42 0.00 0.00 0.00 175.76 175.23 1jvo s ILE 20 N 2.37 2.44 -0.18 0.00 1.01 0.60 -4.98 121.20 122.46 1jvo s ILE 20 Ca 0.03 -0.91 -0.01 0.00 0.00 0.00 0.00 60.65 59.76 1jvo s ILE 20 Cb -0.13 -1.94 -0.00 0.00 0.01 0.00 0.00 42.46 40.40 1jvo s ILE 20 CO -0.09 0.56 -0.12 -0.89 0.00 0.00 0.00 174.94 174.41 1jvo s THR 21 N -0.03 2.89 -0.29 2.92 2.01 -1.26 0.82 115.64 122.71 1jvo s THR 21 Ca -0.06 -0.68 -0.11 0.00 0.31 0.00 0.00 61.69 61.16 1jvo s THR 21 Cb -0.15 -2.26 -0.03 0.00 0.01 0.00 0.00 72.50 70.07 1jvo s THR 21 CO 0.05 0.49 0.17 -0.69 -0.69 0.00 0.00 174.62 173.95 1jvo s VAL 22 N 1.06 5.02 0.03 3.82 1.01 0.22 -4.95 120.40 126.60 1jvo s VAL 22 Ca -0.00 -0.07 -0.30 0.00 0.00 0.00 0.00 61.98 61.60 1jvo s VAL 22 Cb -0.15 -3.45 -0.06 0.00 0.00 0.00 0.00 36.38 32.72 1jvo s VAL 22 CO -0.03 0.18 1.44 -0.62 0.00 0.00 0.00 175.10 176.07 1jvo s ASP 23 N 1.70 6.81 0.53 3.32 -1.08 -1.26 -2.03 116.67 124.66 1jvo s ASP 23 Ca 0.06 2.20 0.24 0.00 -0.52 0.00 0.00 52.55 54.53 1jvo s ASP 23 Cb -0.16 -2.56 1.38 0.00 -1.46 0.00 0.00 42.92 40.11 1jvo s ASP 23 CO 0.09 -0.74 2.01 0.11 0.52 0.00 0.00 175.17 177.16 1jvo h LYS 24 N 7.79 0.01 0.00 4.34 1.57 -1.34 -0.23 116.57 128.71 1jvo h LYS 24 Ca -0.39 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 1jvo h LYS 24 Cb 1.19 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 1jvo h LYS 24 CO 0.90 0.01 0.00 0.66 -0.57 0.00 0.00 179.45 180.45 1jvo h SER 25 N 0.01 0.00 -3.56 0.86 4.64 -1.91 -3.43 113.55 110.17 1jvo h SER 25 Ca 0.23 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 61.04 1jvo h SER 25 Cb 0.93 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 1jvo h SER 25 CO -0.01 0.00 0.46 0.00 -0.87 0.00 0.00 176.83 176.42 1jvo h LYS 27 N 5.17 0.37 -3.89 0.00 6.56 -1.88 -3.42 116.57 119.48 1jvo h LYS 27 Ca -0.44 -0.54 -0.15 0.00 -1.06 0.00 0.00 60.65 58.46 1jvo h LYS 27 Cb 1.21 0.19 -0.19 0.00 -0.57 0.00 0.00 32.23 32.87 1jvo h LYS 27 CO 0.72 1.23 -0.62 1.14 -2.06 0.00 0.00 179.45 179.86 1jvo s GLN 28 N -2.71 0.45 0.11 3.15 -2.07 -1.26 -0.80 119.66 116.52 1jvo s GLN 28 Ca -0.13 -0.68 0.08 0.00 -1.82 0.00 0.00 55.36 52.80 1jvo s GLN 28 Cb 0.02 0.17 -0.04 0.00 -1.09 0.00 0.00 33.01 32.07 1jvo s GLN 28 CO 0.84 -0.09 -0.12 0.12 -1.32 0.00 0.00 175.29 174.72 1jvo s PHE 29 N -2.04 2.68 -0.05 9.60 5.36 -0.13 -4.84 117.98 128.56 1jvo s PHE 29 Ca -0.10 -0.19 0.04 0.00 -0.96 0.00 0.00 56.93 55.72 1jvo s PHE 29 Cb -0.05 -1.40 0.00 0.00 -0.34 0.00 0.00 43.02 41.23 1jvo s PHE 29 CO -0.03 0.42 -0.15 0.99 -1.46 0.00 0.00 175.22 174.99 1jvo s THR 30 N -1.21 1.32 -0.16 0.12 2.01 -0.94 -1.31 115.64 115.47 1jvo s THR 30 Ca 0.21 -0.64 0.00 0.00 0.31 0.00 0.00 61.69 61.57 1jvo s THR 30 Cb -0.11 -1.16 0.00 0.00 0.01 0.00 0.00 72.50 71.25 1jvo s THR 30 CO 0.13 0.39 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.60 1jvo s VAL 31 N 0.22 2.60 -0.35 3.82 1.01 -0.27 -0.98 120.40 126.46 1jvo s VAL 31 Ca -0.07 -0.78 -0.08 0.00 0.00 0.00 0.00 61.98 61.05 1jvo s VAL 31 Cb -0.13 -2.10 0.03 0.00 0.00 0.00 0.00 36.38 34.18 1jvo s VAL 31 CO 0.03 0.51 0.14 0.20 0.00 0.00 0.00 175.10 175.98 1jvo s ASN 32 N 0.96 5.45 -0.10 3.32 0.01 -0.16 -1.68 114.94 122.74 1jvo s ASN 32 Ca -0.03 -1.07 -0.11 0.00 -0.71 0.00 0.00 52.86 50.95 1jvo s ASN 32 Cb -0.15 -1.92 -0.05 0.00 0.41 0.00 0.00 41.25 39.54 1jvo s ASN 32 CO -0.03 -0.34 0.25 -0.22 -1.51 0.00 0.00 177.10 175.26 1jvo s LEU 33 N 1.46 4.37 0.03 0.60 2.96 0.13 -1.20 118.68 127.02 1jvo s LEU 33 Ca -0.00 0.61 -0.00 0.00 -0.22 0.00 0.00 54.13 54.51 1jvo s LEU 33 Cb -0.19 -2.29 -0.02 0.00 0.50 0.00 0.00 46.19 44.18 1jvo s LEU 33 CO 0.04 0.30 -0.03 -0.94 -1.32 0.00 0.00 176.35 174.40 1jvo s SER 34 N -0.61 0.29 -0.49 3.68 1.04 -0.90 -1.30 113.70 115.41 1jvo s SER 34 Ca 0.17 -0.60 0.04 0.00 0.48 0.00 0.00 55.95 56.05 1jvo s SER 34 Cb -0.14 0.12 0.13 0.00 0.10 0.00 0.00 66.02 66.23 1jvo s SER 34 CO 0.06 -0.36 0.23 -2.28 0.98 0.00 0.00 173.24 171.88 1jvo s HIS 35 N -1.93 3.19 -2.00 5.02 2.46 -1.11 -1.89 115.29 119.03 1jvo s HIS 35 Ca -0.12 -3.11 0.01 0.00 0.47 0.00 0.00 55.06 52.32 1jvo s HIS 35 Cb -0.07 -2.78 0.08 0.00 -0.13 0.00 0.00 32.58 29.69 1jvo s HIS 35 CO -0.03 -0.77 0.89 -0.35 -2.47 0.00 0.00 174.74 172.01 1jvo n PRO 36 N 3.29 0.83 -0.04 2.88 -0.04 -1.25 -0.06 135.00 140.61 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 0.34 -1.03 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 0.35 -0.48 0.00 0.55 0.00 -1.26 -4.88 105.19 99.47 1jvo n GLY 37 Ca 0.01 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.33 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 -0.83 3.69 -4.77 1.61 5.03 -1.26 -4.00 115.26 114.73 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 0.64 -0.02 0.00 -1.02 0.00 0.00 39.78 39.37 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 -2.49 4.37 0.74 3.41 1.43 -1.26 -4.73 118.68 120.15 1jvo s LEU 39 Ca 0.00 2.52 -0.11 0.00 -1.03 0.00 0.00 54.13 55.51 1jvo s LEU 39 Cb 0.00 -3.77 0.04 0.00 0.03 0.00 0.00 46.19 42.49 1jvo s LEU 39 CO 0.00 -0.54 1.08 -2.16 0.23 0.00 0.00 176.35 174.97 1jvo s PRO 40 N -1.91 2.53 0.49 1.29 0.04 -1.26 -1.70 135.00 134.48 1jvo s PRO 40 Ca 0.51 0.72 0.36 0.00 0.04 0.00 0.00 61.00 62.62 1jvo s PRO 40 Cb -0.36 -1.96 1.50 0.00 0.04 0.00 0.00 34.50 33.72 1jvo s PRO 40 CO 0.47 -1.33 1.67 -0.22 0.04 0.00 0.00 177.00 177.63 1jvo h LYS 41 N -0.88 0.08 0.44 4.56 3.64 -1.86 -1.95 116.57 120.60 1jvo h LYS 41 Ca -0.46 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 58.90 1jvo h LYS 41 Cb 1.24 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1jvo h LYS 41 CO 0.59 0.05 -0.21 0.00 -2.27 0.00 0.00 179.45 177.61 1jvo h VAL 43 N -0.72 1.52 -0.97 0.00 2.07 -1.80 -3.40 116.25 112.95 1jvo h VAL 43 Ca -0.06 -2.46 -0.46 0.00 0.82 0.00 0.00 66.70 64.54 1jvo h VAL 43 Cb 0.52 3.14 -0.41 0.00 -1.52 0.00 0.00 31.29 33.01 1jvo h VAL 43 CO 0.10 0.69 -0.94 0.80 0.02 0.00 0.00 177.57 178.25 1jvo n MET 44 N -4.17 2.63 -2.53 1.57 0.00 -0.78 -5.05 117.12 108.78 1jvo n MET 44 Ca -0.13 -3.93 -0.40 0.00 -0.00 0.00 0.00 57.70 53.23 1jvo n MET 44 Cb 0.78 -1.90 -0.05 0.00 0.00 0.00 0.00 33.22 32.05 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 -3.52 3.05 0.14 -5.12 0.00 -0.95 -4.73 107.32 96.20 1jvo s GLY 45 Ca 0.40 0.83 0.06 0.00 0.00 0.00 0.00 44.72 46.01 1jvo s GLY 45 CO -0.05 1.46 -0.13 0.30 0.00 0.00 0.00 173.10 174.69 1jvo s HIS 46 N -1.04 1.42 0.29 1.90 3.76 -0.67 -4.66 115.29 116.29 1jvo s HIS 46 Ca 0.44 -0.61 -0.06 0.00 -0.15 0.00 0.00 55.06 54.68 1jvo s HIS 46 Cb -0.30 -0.72 -0.01 0.00 1.11 0.00 0.00 32.58 32.66 1jvo s HIS 46 CO 0.38 0.17 0.43 0.54 -0.85 0.00 0.00 174.74 175.41 1jvo s ASN 47 N -2.81 0.46 -0.17 1.40 2.20 -1.26 -0.02 114.94 114.73 1jvo s ASN 47 Ca 0.14 -1.28 -0.00 0.00 -0.94 0.00 0.00 52.86 50.78 1jvo s ASN 47 Cb -0.02 0.60 0.04 0.00 -2.00 0.00 0.00 41.25 39.86 1jvo s ASN 47 CO 0.03 -1.18 -0.08 0.86 -2.94 0.00 0.00 177.10 173.79 1jvo s TRP 48 N -3.54 1.91 -0.05 1.54 -0.00 -1.26 -4.10 118.94 113.44 1jvo s TRP 48 Ca 0.29 -1.19 0.05 0.00 -0.00 0.00 0.00 56.10 55.25 1jvo s TRP 48 Cb 0.01 -1.42 -0.00 0.00 -0.00 0.00 0.00 33.47 32.05 1jvo s TRP 48 CO 0.15 -0.64 -0.20 0.08 -0.00 0.00 0.00 176.95 176.34 1jvo s VAL 49 N 1.57 1.63 -0.03 5.86 1.01 -0.35 -1.54 120.40 128.55 1jvo s VAL 49 Ca 0.01 -0.82 0.05 0.00 0.00 0.00 0.00 61.98 61.22 1jvo s VAL 49 Cb -0.15 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.81 1jvo s VAL 49 CO -0.08 0.46 -0.18 -0.22 0.00 0.00 0.00 175.10 175.08 1jvo s LEU 50 N 0.01 2.52 0.09 3.92 2.96 -0.86 -0.78 118.68 126.54 1jvo s LEU 50 Ca -0.05 -0.31 -0.26 0.00 -0.22 0.00 0.00 54.13 53.30 1jvo s LEU 50 Cb -0.13 -1.49 0.09 0.00 0.50 0.00 0.00 46.19 45.17 1jvo s LEU 50 CO 0.03 0.33 1.15 -0.94 -1.32 0.00 0.00 176.35 175.59 1jvo s SER 51 N -0.80 -0.03 0.40 3.68 1.04 -0.78 -1.60 113.70 115.61 1jvo s SER 51 Ca 0.11 -0.40 -0.25 0.00 0.48 0.00 0.00 55.95 55.89 1jvo s SER 51 Cb -0.10 0.33 -0.09 0.00 0.10 0.00 0.00 66.02 66.26 1jvo s SER 51 CO 0.01 -0.65 1.17 0.42 0.98 0.00 0.00 173.24 175.16 1jvo s THR 52 N -2.32 3.17 0.50 2.02 -4.23 -1.26 -0.78 115.64 112.73 1jvo s THR 52 Ca 0.21 0.99 0.30 0.00 -1.18 0.00 0.00 61.69 62.01 1jvo s THR 52 Cb -0.00 -3.55 0.49 0.00 1.34 0.00 0.00 72.50 70.77 1jvo s THR 52 CO 0.01 0.09 1.83 0.00 -0.54 0.00 0.00 174.62 176.02 1jvo h ALA 53 N 2.68 2.80 0.00 3.99 0.00 -1.71 0.24 119.26 127.26 1jvo h ALA 53 Ca -0.49 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.34 1jvo h ALA 53 Cb 1.23 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1jvo h ALA 53 CO 0.63 -1.12 -0.35 0.00 0.00 0.00 0.00 179.25 178.40 1jvo h ALA 54 N 1.51 1.08 0.00 0.00 0.00 -1.90 -3.23 119.26 116.73 1jvo h ALA 54 Ca 0.52 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1jvo h ALA 54 Cb 1.87 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.60 1jvo h ALA 54 CO -0.08 0.44 -0.91 -0.25 0.00 0.00 0.00 179.25 178.46 1jvo n ASP 55 N -3.64 0.75 -0.02 0.00 8.00 0.82 -4.65 116.55 117.81 1jvo n ASP 55 Ca -0.01 -0.61 -0.04 0.00 0.71 0.00 0.00 54.79 54.84 1jvo n ASP 55 Cb 0.46 0.80 -0.03 0.00 -0.02 0.00 0.00 41.12 42.34 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 -0.12 -0.96 -1.24 4.05 -1.49 -0.81 114.93 114.36 1jvo h MET 56 Ca 0.00 0.01 0.24 0.00 -0.28 0.00 0.00 59.70 59.67 1jvo h MET 56 Cb 0.56 0.03 -0.18 0.00 -0.80 0.00 0.00 31.60 31.21 1jvo h MET 56 CO 0.00 -0.08 -0.04 0.37 0.23 0.00 0.00 176.91 177.39 1jvo h GLN 57 N -0.12 0.02 0.30 0.39 5.75 -1.82 0.17 115.11 119.78 1jvo h GLN 57 Ca 0.01 -0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.50 1jvo h GLN 57 Cb 0.16 -0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.71 1jvo h GLN 57 CO -0.14 0.01 -0.17 0.78 -2.65 0.00 0.00 178.83 176.66 1jvo h GLY 58 N 0.02 -0.45 0.74 2.39 0.00 -1.59 0.40 103.07 104.58 1jvo h GLY 58 Ca 0.55 0.18 0.03 0.00 0.00 0.00 0.00 47.33 48.10 1jvo h GLY 58 CO -0.92 -0.17 0.08 -2.08 0.00 0.00 0.00 176.54 173.45 1jvo h VAL 59 N -0.44 0.91 -0.52 4.60 2.07 0.51 -0.52 116.25 122.86 1jvo h VAL 59 Ca -0.03 -0.07 0.03 0.00 0.82 0.00 0.00 66.70 67.45 1jvo h VAL 59 Cb 0.36 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 1jvo h VAL 59 CO 0.04 0.04 0.31 0.58 0.02 0.00 0.00 177.57 178.56 1jvo h VAL 60 N 0.20 1.04 -0.54 2.57 2.07 -0.61 0.45 116.25 121.42 1jvo h VAL 60 Ca 0.12 -0.21 -0.10 0.00 0.82 0.00 0.00 66.70 67.34 1jvo h VAL 60 Cb 0.11 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 1jvo h VAL 60 CO -0.14 0.11 -0.06 0.74 0.02 0.00 0.00 177.57 178.24 1jvo h THR 61 N 0.60 1.27 0.01 2.57 2.02 -0.55 -2.36 112.91 116.48 1jvo h THR 61 Ca 0.21 -1.19 -0.21 0.00 0.77 0.00 0.00 66.41 65.99 1jvo h THR 61 Cb 0.04 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.39 1jvo h THR 61 CO -0.10 0.42 -0.92 0.44 0.37 0.00 0.00 175.52 175.73 1jvo h ASP 62 N 0.86 0.30 -0.24 4.18 3.32 -0.86 -3.18 116.42 120.80 1jvo h ASP 62 Ca 0.15 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1jvo h ASP 62 Cb 0.61 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.05 1jvo h ASP 62 CO 0.04 1.07 0.15 1.23 -1.72 0.00 0.00 179.24 180.01 1jvo h GLY 63 N 1.77 0.34 0.30 2.75 0.00 -0.04 -1.69 103.07 106.49 1jvo h GLY 63 Ca -0.05 -0.13 0.14 0.00 0.00 0.00 0.00 47.33 47.28 1jvo h GLY 63 CO 0.14 0.13 0.47 1.98 0.00 0.00 0.00 176.54 179.26 1jvo h MET 64 N 0.31 0.67 0.00 4.80 1.85 -1.46 0.07 114.93 121.18 1jvo h MET 64 Ca 0.09 -0.04 -0.08 0.00 -0.61 0.00 0.00 59.70 59.05 1jvo h MET 64 Cb -0.02 -0.15 -0.01 0.00 0.43 0.00 0.00 31.60 31.85 1jvo h MET 64 CO -0.02 0.44 -0.40 0.00 -0.40 0.00 0.00 176.91 176.54 1jvo h ALA 65 N 1.54 1.10 -0.61 0.39 0.00 -1.41 -3.05 119.26 117.22 1jvo h ALA 65 Ca 0.46 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1jvo h ALA 65 Cb 0.59 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1jvo h ALA 65 CO -0.33 0.50 0.38 0.77 0.00 0.00 0.00 179.25 180.57 1jvo h SER 66 N 0.00 0.72 -4.65 0.00 0.02 -0.07 -3.49 113.55 106.08 1jvo h SER 66 Ca -0.00 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1jvo h SER 66 Cb 0.84 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.20 1jvo h SER 66 CO 0.05 0.54 0.00 0.61 -1.14 0.00 0.00 176.83 176.89 1jvo n GLY 67 N -1.38 0.53 0.39 -3.77 0.00 -1.15 -4.35 105.19 95.46 1jvo n GLY 67 Ca 0.06 -1.71 0.21 0.00 0.00 0.00 0.00 46.02 44.58 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 0.51 -1.22 0.99 5.85 -1.90 -0.62 115.31 118.92 1jvo h LEU 68 Ca 0.00 0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.87 1jvo h LEU 68 Cb 0.00 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 40.99 1jvo h LEU 68 CO 0.00 0.10 0.55 0.44 -0.34 0.00 0.00 178.44 179.19 1jvo h ASP 69 N 0.45 0.85 -0.37 1.25 3.32 -2.01 -1.24 116.42 118.66 1jvo h ASP 69 Ca 0.60 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.58 1jvo h ASP 69 Cb 1.41 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 40.73 1jvo h ASP 69 CO -0.33 0.56 0.09 0.29 -1.72 0.00 0.00 179.24 178.13 1jvo n LYS 70 N -4.47 2.81 -2.22 3.56 4.76 -0.29 -4.87 118.16 117.43 1jvo n LYS 70 Ca 0.12 -1.72 -0.17 0.00 -2.87 0.00 0.00 58.31 53.67 1jvo n LYS 70 Cb 0.17 -1.86 -0.02 0.00 -1.84 0.00 0.00 35.03 31.48 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 0.16 -4.83 -3.86 4.39 9.92 -0.47 -1.65 116.55 120.21 1jvo n ASP 71 Ca 0.20 0.16 -0.26 0.00 -0.53 0.00 0.00 54.79 54.35 1jvo n ASP 71 Cb 0.87 -4.11 0.02 0.00 -0.64 0.00 0.00 41.12 37.25 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 -3.37 -2.00 -3.82 1.24 4.01 -0.88 -4.71 117.16 107.63 1jvo n TYR 72 Ca -0.19 0.85 -0.13 0.00 -0.16 0.00 0.00 57.90 58.27 1jvo n TYR 72 Cb 0.63 -4.02 -0.14 0.00 -0.31 0.00 0.00 39.34 35.50 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 -7.00 1.52 0.07 7.72 1.43 -0.66 -4.28 118.68 117.48 1jvo s LEU 73 Ca 0.31 0.14 -0.31 0.00 -1.03 0.00 0.00 54.13 53.24 1jvo s LEU 73 Cb -0.16 0.19 -0.07 0.00 0.03 0.00 0.00 46.19 46.19 1jvo s LEU 73 CO 0.84 -0.05 1.34 -0.75 0.23 0.00 0.00 176.35 177.95 1jvo s LYS 74 N 0.33 4.34 0.20 1.70 2.20 -1.26 -4.80 119.74 122.45 1jvo s LYS 74 Ca -0.02 1.95 -0.32 0.00 -0.36 0.00 0.00 55.97 57.22 1jvo s LYS 74 Cb -0.04 -3.37 -0.14 0.00 -1.51 0.00 0.00 37.83 32.77 1jvo s LYS 74 CO -0.01 -0.43 1.34 -2.30 -0.36 0.00 0.00 175.35 173.59 1jvo n PRO 75 N 4.36 1.70 -4.03 4.03 -0.02 -1.26 -2.11 135.00 137.67 1jvo n PRO 75 Ca 0.11 0.61 -0.31 0.00 -2.02 0.00 0.00 63.50 61.89 1jvo n PRO 75 Cb 0.44 -2.23 -0.00 0.00 -0.02 0.00 0.00 33.50 31.69 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 2.28 -3.21 -4.68 2.55 8.00 -1.26 -4.87 116.55 115.36 1jvo n ASP 76 Ca 0.14 -0.91 -0.42 0.00 0.71 0.00 0.00 54.79 54.30 1jvo n ASP 76 Cb 0.28 -3.31 -0.03 0.00 -0.02 0.00 0.00 41.12 38.05 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 -3.55 6.70 0.45 -2.24 -1.08 -0.90 -4.87 116.67 111.18 1jvo s ASP 77 Ca 0.54 2.28 0.23 0.00 -0.52 0.00 0.00 52.55 55.09 1jvo s ASP 77 Cb -0.28 -2.55 1.03 0.00 -1.46 0.00 0.00 42.92 39.66 1jvo s ASP 77 CO 0.88 -0.86 1.89 0.77 0.52 0.00 0.00 175.17 178.37 1jvo h SER 78 N 8.64 0.00 0.85 -0.34 4.64 -1.91 -2.96 113.55 122.47 1jvo h SER 78 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1jvo h SER 78 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1jvo h SER 78 CO 0.93 0.23 0.00 0.03 -0.87 0.00 0.00 176.83 177.15 1jvo h ARG 79 N 0.00 0.00 -5.64 4.77 3.08 -1.98 -3.42 114.38 111.19 1jvo h ARG 79 Ca -0.00 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.42 1jvo h ARG 79 Cb 0.64 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 30.55 1jvo h ARG 79 CO 0.03 0.00 0.39 0.08 -1.07 0.00 0.00 179.97 179.40 1jvo s VAL 80 N -3.32 4.57 0.19 2.04 1.01 -1.12 -4.52 120.40 119.25 1jvo s VAL 80 Ca 0.05 0.15 -0.10 0.00 0.00 0.00 0.00 61.98 62.08 1jvo s VAL 80 Cb 0.10 -4.42 0.12 0.00 0.00 0.00 0.00 36.38 32.17 1jvo s VAL 80 CO 0.43 -0.93 1.77 0.40 0.00 0.00 0.00 175.10 176.77 1jvo h ILE 81 N 5.97 1.24 -2.49 2.22 2.04 -1.56 -3.47 117.51 121.47 1jvo h ILE 81 Ca -0.26 -0.72 0.09 0.00 1.00 0.00 0.00 64.86 64.97 1jvo h ILE 81 Cb 1.08 0.40 -0.13 0.00 -0.74 0.00 0.00 36.82 37.44 1jvo h ILE 81 CO 1.02 0.29 0.41 0.00 0.00 0.00 0.00 178.15 179.88 1jvo s ALA 82 N -5.62 -1.71 -0.21 1.87 0.00 -1.25 -5.01 121.76 109.84 1jvo s ALA 82 Ca -0.13 0.65 -0.30 0.00 0.00 0.00 0.00 51.96 52.19 1jvo s ALA 82 Cb 0.14 0.59 0.15 0.00 0.00 0.00 0.00 23.12 24.00 1jvo s ALA 82 CO 0.81 -0.79 1.14 -3.38 0.00 0.00 0.00 175.76 173.54 1jvo s HIS 83 N -3.34 -0.23 0.72 0.00 -3.43 -1.26 -2.03 115.29 105.72 1jvo s HIS 83 Ca 0.06 0.37 0.01 0.00 -0.80 0.00 0.00 55.06 54.70 1jvo s HIS 83 Cb -0.01 0.47 0.14 0.00 -1.43 0.00 0.00 32.58 31.75 1jvo s HIS 83 CO -0.07 -0.22 0.99 0.25 -2.00 0.00 0.00 174.74 173.69 1jvo n THR 84 N 0.58 0.00 -2.65 -5.38 -2.24 -0.59 -4.85 114.28 99.14 1jvo n THR 84 Ca -0.06 -1.63 -0.21 0.00 -2.27 0.00 0.00 64.05 59.88 1jvo n THR 84 Cb 0.58 -0.85 0.05 0.00 -2.10 0.00 0.00 70.33 68.02 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 -5.09 2.36 -0.21 -0.78 -2.85 -1.26 -4.54 119.74 107.38 1jvo s LYS 85 Ca 0.66 -0.90 -0.29 0.00 -1.00 0.00 0.00 55.97 54.44 1jvo s LYS 85 Cb -0.04 -2.47 -0.00 0.00 -2.06 0.00 0.00 37.83 33.26 1jvo s LYS 85 CO 0.44 -0.86 1.16 -1.17 0.10 0.00 0.00 175.35 175.02 1jvo s LEU 86 N -4.83 4.11 0.25 2.77 2.96 -1.26 -4.41 118.68 118.28 1jvo s LEU 86 Ca 0.59 1.49 0.10 0.00 -0.22 0.00 0.00 54.13 56.09 1jvo s LEU 86 Cb -0.09 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.02 1jvo s LEU 86 CO 0.39 -0.75 -0.04 0.27 -1.32 0.00 0.00 176.35 174.90 1jvo s ILE 87 N 3.44 3.30 0.43 6.68 -4.36 0.97 -4.90 121.20 126.76 1jvo s ILE 87 Ca 0.50 -1.93 0.00 0.00 -0.26 0.00 0.00 60.65 58.96 1jvo s ILE 87 Cb -0.18 -2.74 0.00 0.00 1.25 0.00 0.00 42.46 40.80 1jvo s ILE 87 CO 0.12 -0.33 0.02 0.61 0.24 0.00 0.00 174.94 175.59 1jvo n GLY 88 N -0.71 3.61 2.63 6.27 0.00 -1.26 -1.66 105.19 114.06 1jvo n GLY 88 Ca -0.07 -2.34 -0.41 0.00 0.00 0.00 0.00 46.02 43.19 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 -1.30 -0.41 0.00 1.61 2.88 -0.69 -0.87 113.62 114.84 1jvo n SER 89 Ca -0.17 0.87 0.00 0.00 -1.33 0.00 0.00 58.87 58.24 1jvo n SER 89 Cb 0.54 -0.71 0.00 0.00 -0.75 0.00 0.00 64.21 63.30 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 1.30 1.48 2.84 0.46 0.00 0.91 -4.97 105.19 107.21 1jvo n GLY 90 Ca 0.15 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.79 -0.86 -3.47 1.61 1.02 -0.05 -4.86 120.64 112.25 1jvo n GLU 91 Ca 0.00 -1.56 -0.11 0.00 -0.02 0.00 0.00 57.16 55.47 1jvo n GLU 91 Cb 0.00 -0.96 -0.03 0.00 -0.02 0.00 0.00 31.44 30.44 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 -5.07 1.05 -0.01 3.49 2.20 -1.26 -2.76 119.74 117.38 1jvo s LYS 92 Ca 0.55 -0.30 -0.29 0.00 -0.36 0.00 0.00 55.97 55.57 1jvo s LYS 92 Cb -0.02 0.49 0.10 0.00 -1.51 0.00 0.00 37.83 36.89 1jvo s LYS 92 CO 0.38 -0.44 0.88 0.34 -0.36 0.00 0.00 175.35 176.15 1jvo s ASP 93 N -2.41 -0.38 0.06 1.43 2.15 -0.42 -5.02 116.67 112.09 1jvo s ASP 93 Ca 0.01 0.03 -0.03 0.00 0.43 0.00 0.00 52.55 52.99 1jvo s ASP 93 Cb -0.01 0.39 -0.03 0.00 -0.30 0.00 0.00 42.92 42.97 1jvo s ASP 93 CO -0.09 -0.62 0.04 -0.44 -0.17 0.00 0.00 175.17 173.90 1jvo s SER 94 N -2.40 0.35 -0.11 -0.34 0.01 -1.26 0.18 113.70 110.14 1jvo s SER 94 Ca 0.04 -0.85 -0.09 0.00 1.31 0.00 0.00 55.95 56.37 1jvo s SER 94 Cb -0.01 0.24 0.03 0.00 0.21 0.00 0.00 66.02 66.49 1jvo s SER 94 CO -0.08 -0.62 0.27 0.54 0.41 0.00 0.00 173.24 173.76 1jvo s VAL 95 N -3.72 -0.01 -0.01 3.43 0.11 -0.68 -4.88 120.40 114.64 1jvo s VAL 95 Ca 0.05 0.03 0.08 0.00 -2.93 0.00 0.00 61.98 59.21 1jvo s VAL 95 Cb 0.06 -0.39 -0.02 0.00 -1.53 0.00 0.00 36.38 34.49 1jvo s VAL 95 CO -0.10 0.01 -0.25 -0.89 -3.33 0.00 0.00 175.10 170.54 1jvo s THR 96 N 0.40 2.00 0.08 5.04 2.01 -1.26 -1.11 115.64 122.79 1jvo s THR 96 Ca -0.02 -1.11 -0.00 0.00 0.31 0.00 0.00 61.69 60.87 1jvo s THR 96 Cb -0.04 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.77 1jvo s THR 96 CO -0.02 0.54 -0.02 0.72 -0.69 0.00 0.00 174.62 175.15 1jvo s PHE 97 N -0.62 0.67 -0.27 4.92 -0.71 -0.42 -4.97 117.98 116.59 1jvo s PHE 97 Ca 0.10 -1.07 -0.29 0.00 -1.04 0.00 0.00 56.93 54.63 1jvo s PHE 97 Cb -0.10 -0.44 0.01 0.00 -1.21 0.00 0.00 43.02 41.28 1jvo s PHE 97 CO -0.01 -0.36 1.06 -0.51 -1.34 0.00 0.00 175.22 174.07 1jvo s ASP 98 N -2.97 7.02 0.62 1.98 1.11 -1.26 -0.96 116.67 122.21 1jvo s ASP 98 Ca 0.12 1.25 0.28 0.00 0.18 0.00 0.00 52.55 54.37 1jvo s ASP 98 Cb 0.07 -2.54 1.47 0.00 1.07 0.00 0.00 42.92 42.99 1jvo s ASP 98 CO -0.06 -0.77 1.86 0.58 1.18 0.00 0.00 175.17 177.96 1jvo h VAL 99 N 5.58 0.21 0.00 -1.27 2.07 -1.23 0.17 116.25 121.78 1jvo h VAL 99 Ca -0.20 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.30 1jvo h VAL 99 Cb 1.06 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1jvo h VAL 99 CO 1.00 0.00 -0.09 0.77 0.02 0.00 0.00 177.57 179.27 1jvo h SER 100 N 0.00 0.00 0.47 0.57 4.64 -1.88 -1.51 113.55 115.84 1jvo h SER 100 Ca 0.13 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.44 1jvo h SER 100 Cb 1.05 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1jvo h SER 100 CO -0.00 0.09 -0.07 0.11 -0.87 0.00 0.00 176.83 176.09 1jvo h LYS 101 N 0.00 0.00 -6.43 4.77 1.57 -1.04 -3.42 116.57 112.03 1jvo h LYS 101 Ca -0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 1jvo h LYS 101 Cb 0.17 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.44 1jvo h LYS 101 CO 0.01 0.07 0.10 -0.51 -0.57 0.00 0.00 179.45 178.56 1jvo s LEU 102 N -6.75 4.55 -0.22 2.94 1.43 -0.57 -5.06 118.68 115.00 1jvo s LEU 102 Ca -0.02 1.50 0.01 0.00 -1.03 0.00 0.00 54.13 54.59 1jvo s LEU 102 Cb 0.12 -3.19 0.05 0.00 0.03 0.00 0.00 46.19 43.20 1jvo s LEU 102 CO 0.54 0.22 -0.10 -1.59 0.23 0.00 0.00 176.35 175.65 1jvo s LYS 103 N -1.21 2.07 0.24 1.70 -2.85 -1.26 -5.02 119.74 113.41 1jvo s LYS 103 Ca 0.34 -1.02 -0.27 0.00 -1.00 0.00 0.00 55.97 54.02 1jvo s LYS 103 Cb -0.21 -2.60 -0.16 0.00 -2.06 0.00 0.00 37.83 32.79 1jvo s LYS 103 CO 0.23 -0.49 0.54 -1.91 0.10 0.00 0.00 175.35 173.83 1jvo n GLU 104 N 4.60 0.21 0.00 1.78 2.13 -1.26 -2.57 120.64 125.53 1jvo n GLU 104 Ca -0.14 0.07 0.00 0.00 0.66 0.00 0.00 57.16 57.75 1jvo n GLU 104 Cb 0.45 -1.14 0.00 0.00 0.27 0.00 0.00 31.44 31.02 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 1.92 2.98 3.89 8.31 0.00 -1.26 -5.06 105.19 115.98 1jvo n GLY 105 Ca 0.16 -0.61 -0.29 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 3.10 -0.19 1.61 2.12 -1.06 -5.06 118.70 119.22 1jvo s GLU 106 Ca 0.00 0.34 -0.16 0.00 0.36 0.00 0.00 54.97 55.51 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 -0.75 0.41 -0.65 -0.54 0.00 0.00 175.26 173.73 1jvo s GLN 107 N -5.14 4.20 -0.10 4.30 -0.21 -1.26 -4.89 119.66 116.55 1jvo s GLN 107 Ca 0.55 0.24 0.03 0.00 0.02 0.00 0.00 55.36 56.20 1jvo s GLN 107 Cb -0.11 -3.52 -0.01 0.00 1.00 0.00 0.00 33.01 30.37 1jvo s GLN 107 CO 0.49 -0.02 -0.20 0.71 -2.12 0.00 0.00 175.29 174.15 1jvo s TYR 108 N 1.23 2.62 -0.04 0.91 2.02 -1.24 -1.92 117.35 120.93 1jvo s TYR 108 Ca 0.20 -0.81 0.06 0.00 -0.37 0.00 0.00 57.07 56.15 1jvo s TYR 108 Cb -0.15 -1.73 -0.01 0.00 -0.40 0.00 0.00 41.96 39.67 1jvo s TYR 108 CO 0.08 -0.28 -0.24 -1.64 -1.57 0.00 0.00 175.55 171.90 1jvo s MET 109 N 0.19 2.28 0.13 -0.62 -1.94 0.04 0.02 119.30 119.40 1jvo s MET 109 Ca -0.12 -0.85 0.09 0.00 -1.71 0.00 0.00 55.69 53.10 1jvo s MET 109 Cb -0.16 -2.00 -0.04 0.00 2.01 0.00 0.00 34.83 34.63 1jvo s MET 109 CO 0.07 0.40 -0.17 -0.59 -0.01 0.00 0.00 175.02 174.72 1jvo s PHE 110 N -0.25 2.54 0.03 -0.03 -0.12 0.15 -1.86 117.98 118.45 1jvo s PHE 110 Ca 0.00 -0.26 -0.29 0.00 -0.05 0.00 0.00 56.93 56.33 1jvo s PHE 110 Cb -0.12 -1.33 0.11 0.00 -0.63 0.00 0.00 43.02 41.04 1jvo s PHE 110 CO 0.02 0.41 1.19 -0.59 -0.05 0.00 0.00 175.22 176.21 1jvo s PHE 111 N -1.24 -0.07 -0.16 3.49 -0.71 0.04 -1.29 117.98 118.05 1jvo s PHE 111 Ca 0.19 -0.09 -0.10 0.00 -1.04 0.00 0.00 56.93 55.89 1jvo s PHE 111 Cb -0.10 0.57 -0.05 0.00 -1.21 0.00 0.00 43.02 42.23 1jvo s PHE 111 CO 0.11 -0.43 0.17 0.00 -1.34 0.00 0.00 175.22 173.73 1jvo n THR 113 N 2.87 1.41 -2.25 0.00 -2.24 -1.26 -3.27 114.28 109.54 1jvo n THR 113 Ca -0.17 -0.96 -0.42 0.00 -2.27 0.00 0.00 64.05 60.24 1jvo n THR 113 Cb 0.53 0.12 -0.03 0.00 -2.10 0.00 0.00 70.33 68.85 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 -1.69 3.29 -0.39 4.78 2.19 -1.26 -4.46 117.98 120.44 1jvo s PHE 114 Ca 0.43 1.18 -0.37 0.00 0.33 0.00 0.00 56.93 58.49 1jvo s PHE 114 Cb 0.27 -3.59 -0.16 0.00 -1.31 0.00 0.00 43.02 38.23 1jvo s PHE 114 CO 0.22 -1.88 1.31 -2.30 1.83 0.00 0.00 175.22 174.40 1jvo n PRO 115 N 3.15 0.00 0.00 10.12 -0.02 -1.26 -0.94 135.00 146.04 1jvo n PRO 115 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 1jvo n PRO 115 Cb 0.43 -1.18 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 3.45 2.95 0.16 -1.23 0.00 -1.26 -4.92 105.19 104.34 1jvo n GLY 116 Ca 0.26 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.23 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 0.27 -0.05 1.61 3.86 -1.32 -3.20 115.15 116.32 1jvo h HIS 117 Ca 0.00 -0.11 0.01 0.00 -1.16 0.00 0.00 60.37 59.12 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 0.79 0.17 0.66 0.86 0.00 0.00 177.93 180.41 1jvo h SER 118 N 0.15 0.00 -0.79 2.45 4.64 -1.73 0.80 113.55 119.07 1jvo h SER 118 Ca -0.01 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.37 1jvo h SER 118 Cb 1.16 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.19 1jvo h SER 118 CO 0.10 0.00 0.47 0.00 -0.87 0.00 0.00 176.83 176.53 1jvo h ALA 119 N 1.71 1.08 0.00 5.18 0.00 -1.90 -3.32 119.26 122.00 1jvo h ALA 119 Ca 0.02 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.74 1jvo h ALA 119 Cb 0.36 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1jvo h ALA 119 CO -0.00 0.19 -1.74 1.28 0.00 0.00 0.00 179.25 178.97 1jvo n LEU 120 N -4.69 2.19 -4.47 0.00 4.77 -0.35 -4.88 117.00 109.57 1jvo n LEU 120 Ca 0.11 -0.05 -0.44 0.00 -0.03 0.00 0.00 56.01 55.60 1jvo n LEU 120 Cb 0.18 -0.27 -0.01 0.00 -2.33 0.00 0.00 43.42 40.99 1jvo n LEU 120 CO 0.30 0.60 1.33 -0.04 -1.33 0.00 0.00 177.39 178.25 1jvo s MET 121 N -2.26 3.92 0.17 3.23 -1.94 0.27 -4.82 119.30 117.86 1jvo s MET 121 Ca -0.14 -2.23 -0.18 0.00 -1.71 0.00 0.00 55.69 51.42 1jvo s MET 121 Cb 0.04 -5.07 0.04 0.00 2.01 0.00 0.00 34.83 31.85 1jvo s MET 121 CO 0.34 -1.83 0.51 -1.59 -0.01 0.00 0.00 175.02 172.44 1jvo s LYS 122 N 2.27 1.28 0.11 2.03 0.00 -1.26 -2.66 119.74 121.51 1jvo s LYS 122 Ca 0.41 -0.74 -0.26 0.00 0.00 0.00 0.00 55.97 55.38 1jvo s LYS 122 Cb -0.03 0.52 0.08 0.00 0.00 0.00 0.00 37.83 38.41 1jvo s LYS 122 CO -0.02 -0.54 1.07 0.20 0.00 0.00 0.00 175.35 176.06 1jvo s GLY 123 N -2.83 -0.23 -0.05 0.59 0.00 -0.41 -4.75 107.32 99.65 1jvo s GLY 123 Ca 0.06 0.21 -0.04 0.00 0.00 0.00 0.00 44.72 44.95 1jvo s GLY 123 CO -0.07 0.53 0.13 -0.51 0.00 0.00 0.00 173.10 173.18 1jvo s THR 124 N -2.85 5.22 -0.18 0.90 -4.23 0.85 -0.67 115.64 114.67 1jvo s THR 124 Ca 0.15 -0.10 -0.01 0.00 -1.18 0.00 0.00 61.69 60.54 1jvo s THR 124 Cb 0.00 -3.36 -0.00 0.00 1.34 0.00 0.00 72.50 70.48 1jvo s THR 124 CO 0.01 0.45 -0.11 -0.22 -0.54 0.00 0.00 174.62 174.21 1jvo s LEU 125 N -1.52 2.66 -0.04 4.79 0.20 0.10 -0.29 118.68 124.60 1jvo s LEU 125 Ca 0.21 -0.43 0.06 0.00 0.69 0.00 0.00 54.13 54.66 1jvo s LEU 125 Cb -0.12 -1.64 -0.02 0.00 -0.43 0.00 0.00 46.19 43.98 1jvo s LEU 125 CO 0.12 0.05 -0.21 -0.89 -0.29 0.00 0.00 176.35 175.13 1jvo s THR 126 N 1.05 2.52 -0.65 3.68 2.01 0.24 -3.65 115.64 120.85 1jvo s THR 126 Ca -0.00 -0.93 -0.15 0.00 0.31 0.00 0.00 61.69 60.92 1jvo s THR 126 Cb -0.15 -1.93 0.16 0.00 0.01 0.00 0.00 72.50 70.59 1jvo s THR 126 CO -0.02 0.58 0.59 -0.22 -0.69 0.00 0.00 174.62 174.87 1jvo s LEU 127 N -0.64 6.36 0.00 4.42 1.98 -1.26 0.71 118.68 130.25 1jvo s LEU 127 Ca 0.10 -2.16 0.12 0.00 -2.89 0.00 0.00 54.13 49.30 1jvo s LEU 127 Cb -0.10 -2.19 0.10 0.00 0.66 0.00 0.00 46.19 44.65 1jvo s LEU 127 CO -0.00 -0.73 0.89 2.29 -1.89 0.00 0.00 176.35 176.91