#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jvj n MET 2 N 0.00 0.00 0.00 2.12 2.00 -1.26 -4.49 117.12 115.49 2jvj n MET 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 2jvj n MET 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 2jvj n MET 2 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 175.97 176.24 2jvj n ASN 3 N -2.22 0.89 -4.64 7.83 2.04 -1.26 -4.99 115.26 112.92 2jvj n ASN 3 Ca 0.00 -0.17 -0.43 0.00 -0.44 0.00 0.00 54.58 53.54 2jvj n ASN 3 Cb 0.00 0.52 -0.03 0.00 -2.53 0.00 0.00 39.78 37.74 2jvj n ASN 3 CO 0.00 0.00 0.00 -1.83 -0.44 0.00 0.00 177.26 174.99 2jvj s GLU 4 N -0.70 4.08 -0.16 -3.83 1.03 -1.26 -4.90 118.70 112.96 2jvj s GLU 4 Ca 0.00 1.01 -0.10 0.00 0.03 0.00 0.00 54.97 55.91 2jvj s GLU 4 Cb 0.00 -3.72 0.05 0.00 -0.80 0.00 0.00 34.13 29.67 2jvj s GLU 4 CO 0.00 -0.80 0.40 -1.59 -1.33 0.00 0.00 175.26 171.94 2jvj s LYS 5 N 3.41 0.40 -0.00 -4.83 -2.85 -1.26 0.66 119.74 115.26 2jvj s LYS 5 Ca 0.42 0.73 -0.06 0.00 -1.00 0.00 0.00 55.97 56.06 2jvj s LYS 5 Cb -0.13 0.02 0.00 0.00 -2.06 0.00 0.00 37.83 35.66 2jvj s LYS 5 CO 0.13 -0.14 0.13 0.42 0.10 0.00 0.00 175.35 175.99 2jvj s ILE 6 N 1.16 0.07 0.00 3.79 1.01 -0.76 -0.66 121.20 125.82 2jvj s ILE 6 Ca -0.08 -0.61 0.04 0.00 0.00 0.00 0.00 60.65 60.00 2jvj s ILE 6 Cb -0.07 -0.39 -0.03 0.00 0.01 0.00 0.00 42.46 41.98 2jvj s ILE 6 CO -0.10 -0.33 -0.08 -0.22 0.00 0.00 0.00 174.94 174.20 2jvj s LEU 7 N -1.18 3.08 -0.29 2.97 1.98 0.26 -0.70 118.68 124.81 2jvj s LEU 7 Ca -0.13 -0.17 0.02 0.00 -2.89 0.00 0.00 54.13 50.96 2jvj s LEU 7 Cb -0.07 -1.76 0.08 0.00 0.66 0.00 0.00 46.19 45.11 2jvj s LEU 7 CO 0.01 0.29 0.02 -0.63 -1.89 0.00 0.00 176.35 174.15 2jvj s ILE 8 N -0.96 1.63 -0.43 6.68 1.09 0.43 0.14 121.20 129.79 2jvj s ILE 8 Ca 0.16 -1.66 -0.14 0.00 -1.10 0.00 0.00 60.65 57.91 2jvj s ILE 8 Cb -0.11 -2.08 0.05 0.00 -1.06 0.00 0.00 42.46 39.26 2jvj s ILE 8 CO 0.06 -0.42 0.32 -0.69 -0.10 0.00 0.00 174.94 174.12 2jvj s VAL 9 N 1.28 5.04 0.00 2.92 1.01 0.11 -0.50 120.40 130.26 2jvj s VAL 9 Ca 0.04 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.08 2jvj s VAL 9 Cb -0.19 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.27 2jvj s VAL 9 CO -0.12 -0.43 0.00 -0.67 0.00 0.00 0.00 175.10 173.88 2jvj n ASP 10 N 5.13 0.00 -4.30 3.32 2.03 -0.57 -0.69 116.55 121.47 2jvj n ASP 10 Ca -0.12 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.77 2jvj n ASP 10 Cb 0.45 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.85 2jvj n ASP 10 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2jvj n ASP 11 N 0.00 4.67 -4.64 1.67 2.03 -1.26 -4.71 116.55 114.30 2jvj n ASP 11 Ca 0.00 -2.91 -0.33 0.00 0.52 0.00 0.00 54.79 52.08 2jvj n ASP 11 Cb 0.00 -1.70 -0.10 0.00 -0.72 0.00 0.00 41.12 38.60 2jvj n ASP 11 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 2jvj s GLN 12 N 3.58 2.69 0.24 -0.67 -1.52 -1.26 -4.99 119.66 117.73 2jvj s GLN 12 Ca 0.51 -0.65 -0.06 0.00 -1.95 0.00 0.00 55.36 53.21 2jvj s GLN 12 Cb 0.07 -2.60 0.43 0.00 -0.22 0.00 0.00 33.01 30.69 2jvj s GLN 12 CO 0.02 0.62 1.68 -0.92 -0.25 0.00 0.00 175.29 176.44 2jvj h TYR 13 N 4.50 0.19 0.00 0.91 3.20 -2.05 -3.33 116.97 120.39 2jvj h TYR 13 Ca -0.49 0.04 -0.14 0.00 3.14 0.00 0.00 58.73 61.28 2jvj h TYR 13 Cb 1.17 0.03 -0.27 0.00 1.54 0.00 0.00 36.73 39.20 2jvj h TYR 13 CO 0.60 -0.11 -0.73 0.41 -1.64 0.00 0.00 178.16 176.68 2jvj n GLY 14 N -1.36 0.81 0.12 1.82 0.00 -1.26 -4.86 105.19 100.47 2jvj n GLY 14 Ca 0.13 -0.50 -0.21 0.00 0.00 0.00 0.00 46.02 45.44 2jvj n GLY 14 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2jvj h ILE 15 N 6.33 1.03 -1.00 -0.61 1.08 -1.93 -2.75 117.51 119.67 2jvj h ILE 15 Ca -0.30 -2.36 0.14 0.00 -0.39 0.00 0.00 64.86 61.95 2jvj h ILE 15 Cb 1.68 2.66 -0.09 0.00 -3.07 0.00 0.00 36.82 38.00 2jvj h ILE 15 CO -0.03 0.65 0.62 0.03 -0.69 0.00 0.00 178.15 178.73 2jvj h ARG 16 N -0.44 0.90 0.00 2.37 3.08 -1.84 -1.27 114.38 117.18 2jvj h ARG 16 Ca -0.30 -0.05 -0.24 0.00 0.07 0.00 0.00 59.98 59.45 2jvj h ARG 16 Cb 1.65 -0.20 -0.04 0.00 0.08 0.00 0.00 29.97 31.46 2jvj h ARG 16 CO 0.01 0.60 -1.33 0.97 -1.07 0.00 0.00 179.97 179.15 2jvj h ILE 17 N 0.93 1.25 -0.29 2.04 6.09 -1.89 -3.01 117.51 122.63 2jvj h ILE 17 Ca 0.51 -3.01 -0.05 0.00 -1.37 0.00 0.00 64.86 60.94 2jvj h ILE 17 Cb 0.58 2.61 -0.02 0.00 0.47 0.00 0.00 36.82 40.47 2jvj h ILE 17 CO -0.29 0.71 -0.05 0.17 -3.07 0.00 0.00 178.15 175.62 2jvj h LEU 18 N 0.00 0.43 -1.24 2.19 8.10 -1.10 0.04 115.31 123.72 2jvj h LEU 18 Ca -0.14 -0.09 -0.02 0.00 0.11 0.00 0.00 57.88 57.74 2jvj h LEU 18 Cb 1.87 -0.11 -0.00 0.00 -0.44 0.00 0.00 40.66 41.98 2jvj h LEU 18 CO 0.10 0.53 -0.07 -0.07 -4.11 0.00 0.00 178.44 174.82 2jvj h LEU 19 N 0.43 0.00 -0.01 0.17 3.38 -1.20 -1.19 115.31 116.89 2jvj h LEU 19 Ca 0.09 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2jvj h LEU 19 Cb 0.36 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2jvj h LEU 19 CO 0.02 0.07 -0.00 0.78 0.09 0.00 0.00 178.44 179.39 2jvj h ASN 20 N 0.00 0.02 -0.94 -0.43 -0.26 -0.89 -0.78 115.58 112.30 2jvj h ASN 20 Ca -0.00 -0.40 0.07 0.00 -0.56 0.00 0.00 56.30 55.41 2jvj h ASN 20 Cb 0.62 -0.01 -0.06 0.00 -1.06 0.00 0.00 38.32 37.82 2jvj h ASN 20 CO 0.01 0.42 0.61 -0.33 -1.06 0.00 0.00 177.43 177.08 2jvj h GLU 21 N -0.37 1.04 -0.10 0.81 5.08 -0.74 0.34 114.58 120.63 2jvj h GLU 21 Ca 0.00 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.24 2jvj h GLU 21 Cb 0.41 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 2jvj h GLU 21 CO 0.00 0.69 -0.17 0.28 -1.00 0.00 0.00 179.01 178.81 2jvj h VAL 22 N 1.07 1.39 0.00 3.13 2.07 -1.21 -3.43 116.25 119.26 2jvj h VAL 22 Ca 0.41 -1.42 -0.16 0.00 0.82 0.00 0.00 66.70 66.34 2jvj h VAL 22 Cb 0.20 2.08 -0.03 0.00 -1.52 0.00 0.00 31.29 32.02 2jvj h VAL 22 CO -0.16 0.41 -1.55 0.49 0.02 0.00 0.00 177.57 176.78 2jvj n PHE 23 N -4.56 0.00 -0.28 1.57 3.72 -0.30 -4.21 117.46 113.39 2jvj n PHE 23 Ca -0.07 0.00 0.34 0.00 -0.05 0.00 0.00 57.45 57.67 2jvj n PHE 23 Cb 0.39 -0.36 0.73 0.00 -0.94 0.00 0.00 39.48 39.30 2jvj n PHE 23 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 176.76 175.74 2jvj h ASN 24 N -0.21 0.00 0.44 4.37 -0.73 0.27 1.01 115.58 120.74 2jvj h ASN 24 Ca -0.24 0.00 -0.31 0.00 1.87 0.00 0.00 56.30 57.63 2jvj h ASN 24 Cb 1.26 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 39.85 2jvj h ASN 24 CO -0.11 0.00 -1.53 0.11 -0.37 0.00 0.00 177.43 175.54 2jvj h LYS 25 N 0.00 0.26 0.00 6.67 1.79 -1.77 -3.41 116.57 120.11 2jvj h LYS 25 Ca 0.53 -0.45 0.00 0.00 -2.18 0.00 0.00 60.65 58.55 2jvj h LYS 25 Cb 2.23 0.17 0.00 0.00 -1.58 0.00 0.00 32.23 33.05 2jvj h LYS 25 CO -0.01 1.14 -0.22 -0.85 -1.08 0.00 0.00 179.45 178.43 2jvj n GLU 26 N -3.47 0.00 0.01 3.15 0.28 0.12 -4.96 120.64 115.76 2jvj n GLU 26 Ca -0.16 0.00 -0.00 0.00 -0.16 0.00 0.00 57.16 56.83 2jvj n GLU 26 Cb 1.05 -0.24 -0.00 0.00 1.43 0.00 0.00 31.44 33.67 2jvj n GLU 26 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 2jvj h GLY 27 N 0.00 -0.03 -2.91 -1.84 0.00 0.66 -3.49 103.07 95.45 2jvj h GLY 27 Ca 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.31 2jvj h GLY 27 CO 0.00 -0.01 0.05 -0.19 0.00 0.00 0.00 176.54 176.39 2jvj s TYR 28 N -1.86 -0.29 -0.96 5.60 2.02 0.38 -4.74 117.35 117.50 2jvj s TYR 28 Ca -0.00 -0.00 -0.09 0.00 -0.37 0.00 0.00 57.07 56.60 2jvj s TYR 28 Cb 0.00 0.40 -0.07 0.00 -0.40 0.00 0.00 41.96 41.89 2jvj s TYR 28 CO 0.01 -0.82 2.14 0.94 -1.57 0.00 0.00 175.55 176.26 2jvj n GLN 29 N -0.31 2.12 -2.57 -0.62 -0.06 0.21 -0.31 117.38 115.84 2jvj n GLN 29 Ca -0.15 -1.61 -0.43 0.00 -2.00 0.00 0.00 57.00 52.82 2jvj n GLN 29 Cb 0.64 -2.58 -0.02 0.00 -4.06 0.00 0.00 30.24 24.22 2jvj n GLN 29 CO 0.00 0.00 0.00 0.95 -0.20 0.00 0.00 177.06 177.81 2jvj s THR 30 N 3.59 4.38 0.42 1.69 -4.23 -1.17 -1.82 115.64 118.49 2jvj s THR 30 Ca 0.45 1.57 0.07 0.00 -1.18 0.00 0.00 61.69 62.60 2jvj s THR 30 Cb 0.12 -4.34 -0.04 0.00 1.34 0.00 0.00 72.50 69.57 2jvj s THR 30 CO -0.01 -0.50 0.22 0.12 -0.54 0.00 0.00 174.62 173.91 2jvj s PHE 31 N 3.90 2.54 -0.13 3.99 2.19 0.12 -4.41 117.98 126.19 2jvj s PHE 31 Ca 0.49 -0.60 -0.03 0.00 0.33 0.00 0.00 56.93 57.12 2jvj s PHE 31 Cb -0.13 -1.98 -0.03 0.00 -1.31 0.00 0.00 43.02 39.56 2jvj s PHE 31 CO 0.19 0.09 -0.03 -0.65 1.83 0.00 0.00 175.22 176.65 2jvj s GLN 32 N -3.96 3.40 -0.07 10.12 1.11 -1.26 -0.43 119.66 128.57 2jvj s GLN 32 Ca 0.41 -0.50 0.03 0.00 0.01 0.00 0.00 55.36 55.31 2jvj s GLN 32 Cb 0.02 -2.85 0.01 0.00 -1.01 0.00 0.00 33.01 29.19 2jvj s GLN 32 CO 0.23 0.40 -0.15 0.00 0.01 0.00 0.00 175.29 175.78 2jvj s ALA 33 N -0.07 1.43 -0.51 6.09 0.00 0.35 -4.88 121.76 124.17 2jvj s ALA 33 Ca 0.02 -0.54 0.22 0.00 0.00 0.00 0.00 51.96 51.67 2jvj s ALA 33 Cb -0.13 -0.59 -0.07 0.00 0.00 0.00 0.00 23.12 22.32 2jvj s ALA 33 CO 0.02 0.16 0.90 0.00 0.00 0.00 0.00 175.76 176.85 2jvj n ALA 34 N 3.67 3.39 -2.55 0.00 0.00 -1.26 -1.51 120.51 122.24 2jvj n ALA 34 Ca -0.22 -0.44 -0.08 0.00 0.00 0.00 0.00 53.44 52.70 2jvj n ALA 34 Cb 0.52 -0.91 -0.10 0.00 0.00 0.00 0.00 19.45 18.96 2jvj n ALA 34 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2jvj s ASN 35 N -4.03 0.35 0.54 0.00 0.01 -1.26 -4.29 114.94 106.25 2jvj s ASN 35 Ca 0.02 -0.73 0.26 0.00 -0.71 0.00 0.00 52.86 51.69 2jvj s ASN 35 Cb 0.14 0.16 1.54 0.00 0.41 0.00 0.00 41.25 43.49 2jvj s ASN 35 CO 0.83 -0.45 2.15 1.23 -1.51 0.00 0.00 177.10 179.35 2jvj h GLY 36 N 3.89 0.00 1.92 0.66 0.00 -1.90 -0.21 103.07 107.43 2jvj h GLY 36 Ca -0.33 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 46.84 2jvj h GLY 36 CO 0.53 0.00 -0.74 1.41 0.00 0.00 0.00 176.54 177.74 2jvj h LEU 37 N 0.00 0.10 -0.69 3.11 3.38 -1.96 0.19 115.31 119.44 2jvj h LEU 37 Ca -0.00 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 2jvj h LEU 37 Cb 0.16 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2jvj h LEU 37 CO 0.01 0.80 -0.13 -0.61 0.09 0.00 0.00 178.44 178.61 2jvj h GLN 38 N 0.05 0.88 -0.48 1.13 -0.00 -1.55 0.31 115.11 115.45 2jvj h GLN 38 Ca -0.02 -0.32 -0.01 0.00 -0.00 0.00 0.00 58.65 58.31 2jvj h GLN 38 Cb 1.31 -0.06 -0.02 0.00 0.00 0.00 0.00 27.48 28.71 2jvj h GLN 38 CO 0.10 0.96 0.25 0.00 0.00 0.00 0.00 178.83 180.14 2jvj h ALA 39 N 1.06 0.62 -0.29 3.38 0.00 -0.61 -1.39 119.26 122.04 2jvj h ALA 39 Ca 0.12 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 2jvj h ALA 39 Cb 0.65 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2jvj h ALA 39 CO 0.05 0.15 -0.10 1.25 0.00 0.00 0.00 179.25 180.60 2jvj h LEU 40 N 0.63 0.46 -0.26 0.00 6.46 -0.32 0.42 115.31 122.70 2jvj h LEU 40 Ca 0.17 -0.11 0.05 0.00 -0.12 0.00 0.00 57.88 57.87 2jvj h LEU 40 Cb 0.07 -0.12 -0.05 0.00 -0.73 0.00 0.00 40.66 39.83 2jvj h LEU 40 CO -0.03 0.60 -0.08 -0.78 -0.62 0.00 0.00 178.44 177.54 2jvj h ASP 41 N 0.45 -0.29 0.83 1.25 3.58 0.28 0.87 116.42 123.39 2jvj h ASP 41 Ca 0.09 0.08 -0.15 0.00 0.42 0.00 0.00 57.03 57.47 2jvj h ASP 41 Cb 0.45 0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.66 2jvj h ASP 41 CO 0.02 -0.11 -0.69 0.40 -2.88 0.00 0.00 179.24 175.99 2jvj h ILE 42 N -0.03 1.41 0.00 2.25 1.08 -0.60 0.40 117.51 122.02 2jvj h ILE 42 Ca 0.13 -2.44 -0.04 0.00 -0.39 0.00 0.00 64.86 62.12 2jvj h ILE 42 Cb 0.22 2.35 -0.01 0.00 -3.07 0.00 0.00 36.82 36.31 2jvj h ILE 42 CO -0.28 0.68 -0.20 0.58 -0.69 0.00 0.00 178.15 178.24 2jvj h VAL 43 N 0.00 0.94 0.00 1.67 2.07 0.62 0.87 116.25 122.42 2jvj h VAL 43 Ca -0.01 -0.73 -0.12 0.00 0.82 0.00 0.00 66.70 66.67 2jvj h VAL 43 Cb 1.29 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 32.46 2jvj h VAL 43 CO 0.09 0.19 -1.52 1.07 0.02 0.00 0.00 177.57 177.43 2jvj n THR 44 N -4.01 0.85 -0.04 2.57 5.66 0.23 -3.16 114.28 116.37 2jvj n THR 44 Ca -0.02 -0.64 -0.02 0.00 -3.05 0.00 0.00 64.05 60.32 2jvj n THR 44 Cb 0.28 -0.48 -0.01 0.00 -1.55 0.00 0.00 70.33 68.57 2jvj n THR 44 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 2jvj h LYS 45 N 0.00 0.00 0.00 1.09 1.57 -0.10 -3.42 116.57 115.72 2jvj h LYS 45 Ca -0.13 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.54 2jvj h LYS 45 Cb 1.40 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.69 2jvj h LYS 45 CO 0.02 0.00 -1.89 0.39 -0.57 0.00 0.00 179.45 177.40 2jvj n GLU 46 N -3.92 0.66 -3.26 3.15 -0.58 0.27 -5.01 120.64 111.96 2jvj n GLU 46 Ca -0.03 -0.06 -0.15 0.00 -0.42 0.00 0.00 57.16 56.50 2jvj n GLU 46 Cb 0.10 -1.60 0.07 0.00 -0.57 0.00 0.00 31.44 29.44 2jvj n GLU 46 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2jvj n ARG 47 N -2.51 -2.71 -1.93 3.49 3.00 0.55 -4.68 116.66 111.88 2jvj n ARG 47 Ca -0.11 0.86 -0.40 0.00 -0.01 0.00 0.00 57.85 58.19 2jvj n ARG 47 Cb 0.74 -5.81 0.00 0.00 0.00 0.00 0.00 32.46 27.39 2jvj n ARG 47 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.63 175.49 2jvj s PRO 48 N -4.49 3.87 0.10 5.56 0.02 -1.26 -4.92 135.00 133.88 2jvj s PRO 48 Ca 0.41 2.29 0.14 0.00 0.02 0.00 0.00 61.00 63.86 2jvj s PRO 48 Cb -0.05 -2.74 -0.12 0.00 0.02 0.00 0.00 34.50 31.61 2jvj s PRO 48 CO 0.73 -0.62 1.00 0.22 -0.33 0.00 0.00 177.00 178.00 2jvj h ASP 49 N 2.57 0.00 -3.85 2.53 3.58 -1.23 -3.45 116.42 116.57 2jvj h ASP 49 Ca -0.50 0.00 -0.68 0.00 0.42 0.00 0.00 57.03 56.27 2jvj h ASP 49 Cb 1.25 0.00 -0.24 0.00 1.72 0.00 0.00 39.33 42.06 2jvj h ASP 49 CO 0.62 0.72 -0.77 -0.76 -2.88 0.00 0.00 179.24 176.17 2jvj s LEU 50 N -6.14 2.72 -0.23 2.28 1.02 -0.52 -0.24 118.68 117.57 2jvj s LEU 50 Ca -0.01 -0.23 -0.00 0.00 0.02 0.00 0.00 54.13 53.91 2jvj s LEU 50 Cb 0.08 -1.57 0.06 0.00 0.02 0.00 0.00 46.19 44.79 2jvj s LEU 50 CO 0.80 0.30 -0.02 -0.69 0.02 0.00 0.00 176.35 176.76 2jvj s VAL 51 N -0.45 1.28 -0.02 -1.59 1.01 0.13 0.93 120.40 121.69 2jvj s VAL 51 Ca 0.05 -1.11 -0.30 0.00 0.00 0.00 0.00 61.98 60.62 2jvj s VAL 51 Cb -0.12 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.58 2jvj s VAL 51 CO 0.02 -0.18 1.28 -0.76 0.00 0.00 0.00 175.10 175.46 2jvj s LEU 52 N 1.50 4.30 -0.02 3.92 1.02 0.38 0.31 118.68 130.09 2jvj s LEU 52 Ca -0.03 1.95 -0.00 0.00 0.02 0.00 0.00 54.13 56.06 2jvj s LEU 52 Cb -0.18 -3.56 0.03 0.00 0.02 0.00 0.00 46.19 42.50 2jvj s LEU 52 CO -0.08 -0.63 0.03 -0.22 0.02 0.00 0.00 176.35 175.48 2jvj s LEU 53 N 2.19 0.99 -0.03 1.79 2.96 -0.18 0.07 118.68 126.47 2jvj s LEU 53 Ca 0.59 0.04 0.02 0.00 -0.22 0.00 0.00 54.13 54.56 2jvj s LEU 53 Cb -0.28 -0.08 -0.03 0.00 0.50 0.00 0.00 46.19 46.30 2jvj s LEU 53 CO 0.24 -0.14 -0.05 -0.62 -1.32 0.00 0.00 176.35 174.46 2jvj s ASP 54 N 1.18 4.75 0.10 3.68 2.15 0.14 -1.49 116.67 127.17 2jvj s ASP 54 Ca -0.08 -0.07 0.20 0.00 0.43 0.00 0.00 52.55 53.04 2jvj s ASP 54 Cb -0.13 -1.17 -0.11 0.00 -0.30 0.00 0.00 42.92 41.21 2jvj s ASP 54 CO -0.03 0.31 0.84 0.80 -0.17 0.00 0.00 175.17 176.92 2jvj n MET 55 N 1.78 0.62 -0.10 4.34 0.00 -1.26 -3.81 117.12 118.69 2jvj n MET 55 Ca -0.16 0.10 0.01 0.00 -0.00 0.00 0.00 57.70 57.65 2jvj n MET 55 Cb 0.53 -1.76 0.05 0.00 0.00 0.00 0.00 33.22 32.04 2jvj n MET 55 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 2jvj n LYS 56 N -2.68 1.44 -2.62 2.12 4.01 -1.26 -3.89 118.16 115.28 2jvj n LYS 56 Ca -0.05 -0.41 -0.43 0.00 -0.51 0.00 0.00 58.31 56.91 2jvj n LYS 56 Cb 0.67 -1.43 -0.02 0.00 -0.51 0.00 0.00 35.03 33.73 2jvj n LYS 56 CO 0.00 0.00 0.00 -1.50 -1.11 0.00 0.00 177.40 174.79 2jvj s ILE 57 N -1.45 4.62 -0.04 -0.18 -1.16 -1.25 -4.93 121.20 116.82 2jvj s ILE 57 Ca 0.07 1.93 -0.30 0.00 -0.51 0.00 0.00 60.65 61.84 2jvj s ILE 57 Cb 0.05 -4.24 -0.07 0.00 0.61 0.00 0.00 42.46 38.81 2jvj s ILE 57 CO 0.03 -0.08 1.88 -2.84 -2.81 0.00 0.00 174.94 171.12 2jvj s PRO 58 N 2.61 4.02 0.00 3.50 0.02 -1.26 -3.74 135.00 140.15 2jvj s PRO 58 Ca 0.49 2.36 0.00 0.00 0.02 0.00 0.00 61.00 63.86 2jvj s PRO 58 Cb -0.18 -4.12 0.00 0.00 0.02 0.00 0.00 34.50 30.21 2jvj s PRO 58 CO 0.14 -1.07 0.00 0.41 -0.33 0.00 0.00 177.00 176.15 2jvj n GLY 59 N 4.56 1.27 3.35 0.52 0.00 -1.26 -4.56 105.19 109.07 2jvj n GLY 59 Ca 0.20 -0.29 -0.18 0.00 0.00 0.00 0.00 46.02 45.75 2jvj n GLY 59 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2jvj s MET 60 N 0.00 1.39 -0.85 1.61 -1.94 -1.25 -5.07 119.30 113.20 2jvj s MET 60 Ca 0.00 -1.71 -0.25 0.00 -1.71 0.00 0.00 55.69 52.02 2jvj s MET 60 Cb 0.00 -0.70 0.02 0.00 2.01 0.00 0.00 34.83 36.15 2jvj s MET 60 CO 0.00 -0.09 1.54 -0.51 -0.01 0.00 0.00 175.02 175.95 2jvj s ASP 61 N -3.34 5.98 0.54 3.03 1.11 -1.26 -4.58 116.67 118.15 2jvj s ASP 61 Ca 0.29 -0.73 0.31 0.00 0.18 0.00 0.00 52.55 52.60 2jvj s ASP 61 Cb 0.06 -2.56 1.47 0.00 1.07 0.00 0.00 42.92 42.96 2jvj s ASP 61 CO 0.10 -1.95 1.91 1.23 1.18 0.00 0.00 175.17 177.63 2jvj h GLY 62 N 14.27 0.00 0.06 0.21 0.00 -1.68 -0.09 103.07 115.84 2jvj h GLY 62 Ca -0.04 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.33 2jvj h GLY 62 CO 1.31 0.00 -0.40 1.19 0.00 0.00 0.00 176.54 178.64 2jvj h ILE 63 N 0.00 0.17 -0.66 2.60 2.10 -1.85 -0.90 117.51 118.97 2jvj h ILE 63 Ca 0.39 0.00 0.04 0.00 1.08 0.00 0.00 64.86 66.37 2jvj h ILE 63 Cb 1.58 0.17 -0.05 0.00 -1.09 0.00 0.00 36.82 37.44 2jvj h ILE 63 CO -0.00 0.00 0.39 -0.33 -1.08 0.00 0.00 178.15 177.13 2jvj h GLU 64 N -0.48 0.74 -0.79 2.19 4.39 -1.39 -1.48 114.58 117.75 2jvj h GLU 64 Ca 0.08 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 2jvj h GLU 64 Cb 0.61 -0.17 -0.04 0.00 -0.10 0.00 0.00 28.75 29.06 2jvj h GLU 64 CO -0.38 0.49 0.40 0.82 -1.16 0.00 0.00 179.01 179.18 2jvj h ILE 65 N 0.76 1.24 -0.27 3.13 5.03 -1.38 0.35 117.51 126.38 2jvj h ILE 65 Ca 0.27 -0.66 0.02 0.00 -0.12 0.00 0.00 64.86 64.37 2jvj h ILE 65 Cb 0.07 0.22 -0.02 0.00 -3.03 0.00 0.00 36.82 34.06 2jvj h ILE 65 CO -0.13 0.28 0.14 0.25 -0.68 0.00 0.00 178.15 178.01 2jvj h LEU 66 N 1.11 0.21 -0.35 1.44 6.46 -0.18 0.41 115.31 124.41 2jvj h LEU 66 Ca 0.27 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 58.03 2jvj h LEU 66 Cb 0.09 -0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 39.97 2jvj h LEU 66 CO -0.04 0.16 0.17 0.11 -0.62 0.00 0.00 178.44 178.22 2jvj h LYS 67 N 0.29 0.50 -0.75 1.25 1.57 -1.00 -1.74 116.57 116.70 2jvj h LYS 67 Ca 0.11 -0.07 0.09 0.00 -1.87 0.00 0.00 60.65 58.90 2jvj h LYS 67 Cb 0.03 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.20 2jvj h LYS 67 CO -0.07 0.45 0.49 -0.09 -0.57 0.00 0.00 179.45 179.66 2jvj h ARG 68 N 0.42 0.68 -0.13 3.15 9.65 -0.34 -0.15 114.38 127.66 2jvj h ARG 68 Ca 0.12 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 58.95 2jvj h ARG 68 Cb 0.12 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 28.54 2jvj h ARG 68 CO -0.02 0.45 0.04 0.52 2.80 0.00 0.00 179.97 183.76 2jvj h MET 69 N 0.70 0.20 -0.02 0.20 2.86 0.62 0.74 114.93 120.22 2jvj h MET 69 Ca 0.34 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.94 2jvj h MET 69 Cb 0.40 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.03 2jvj h MET 69 CO -0.12 0.34 0.03 0.87 1.06 0.00 0.00 176.91 179.09 2jvj h LYS 70 N 0.02 0.00 0.16 1.72 1.79 -0.63 0.37 116.57 120.00 2jvj h LYS 70 Ca 0.04 0.00 -0.30 0.00 -2.18 0.00 0.00 60.65 58.21 2jvj h LYS 70 Cb 0.22 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 30.89 2jvj h LYS 70 CO -0.00 0.00 -1.31 0.28 -1.08 0.00 0.00 179.45 177.34 2jvj h VAL 71 N 0.00 1.40 -0.71 0.50 2.07 0.87 -2.36 116.25 118.02 2jvj h VAL 71 Ca 0.01 -2.83 -0.07 0.00 0.82 0.00 0.00 66.70 64.62 2jvj h VAL 71 Cb 0.07 2.92 -0.03 0.00 -1.52 0.00 0.00 31.29 32.73 2jvj h VAL 71 CO -0.00 0.84 0.16 0.40 0.02 0.00 0.00 177.57 178.99 2jvj h ILE 72 N 0.13 1.26 0.00 4.57 2.04 0.25 -3.42 117.51 122.35 2jvj h ILE 72 Ca -0.18 -0.98 0.00 0.00 1.00 0.00 0.00 64.86 64.70 2jvj h ILE 72 Cb 2.01 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 38.64 2jvj h ILE 72 CO 0.23 0.38 -0.30 -0.67 0.00 0.00 0.00 178.15 177.79 2jvj n ASP 73 N -4.24 0.16 0.00 1.72 -0.08 -0.77 -5.02 116.55 108.32 2jvj n ASP 73 Ca 0.05 0.12 0.00 0.00 -1.51 0.00 0.00 54.79 53.45 2jvj n ASP 73 Cb 0.26 0.02 0.00 0.00 2.34 0.00 0.00 41.12 43.75 2jvj n ASP 73 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2jvj n GLU 74 N -3.01 0.00 -0.02 -0.67 1.02 -0.89 -4.75 120.64 112.32 2jvj n GLU 74 Ca 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.15 2jvj n GLU 74 Cb 0.15 -0.84 -0.05 0.00 -0.02 0.00 0.00 31.44 30.67 2jvj n GLU 74 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2jvj n ASN 75 N 0.00 3.41 -4.67 1.62 3.02 -1.26 -5.00 115.26 112.38 2jvj n ASN 75 Ca 0.00 0.00 -0.58 0.00 -0.03 0.00 0.00 54.58 53.97 2jvj n ASN 75 Cb 0.00 1.03 -0.07 0.00 -0.61 0.00 0.00 39.78 40.12 2jvj n ASN 75 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jvj n ILE 76 N -1.96 0.15 -2.67 2.41 3.06 -1.26 -4.83 119.36 114.25 2jvj n ILE 76 Ca -0.05 -0.03 -0.42 0.00 -2.50 0.00 0.00 62.75 59.75 2jvj n ILE 76 Cb 0.42 -0.87 -0.02 0.00 0.54 0.00 0.00 39.64 39.70 2jvj n ILE 76 CO 0.00 0.00 0.00 -0.13 -2.50 0.00 0.00 176.55 173.92 2jvj s ARG 77 N 2.37 3.68 0.06 9.51 1.81 0.67 -4.87 118.95 132.16 2jvj s ARG 77 Ca 0.96 -1.48 -0.13 0.00 -1.72 0.00 0.00 55.73 53.35 2jvj s ARG 77 Cb -1.14 -5.26 -0.06 0.00 -0.45 0.00 0.00 34.95 28.04 2jvj s ARG 77 CO 0.63 -2.08 0.43 0.08 -0.68 0.00 0.00 175.30 173.68 2jvj s VAL 78 N 4.12 5.02 -0.03 3.52 1.01 -1.26 0.19 120.40 132.97 2jvj s VAL 78 Ca 0.44 0.70 0.03 0.00 0.00 0.00 0.00 61.98 63.15 2jvj s VAL 78 Cb -0.01 -3.69 -0.00 0.00 0.00 0.00 0.00 36.38 32.68 2jvj s VAL 78 CO -0.07 0.41 -0.12 -0.63 0.00 0.00 0.00 175.10 174.69 2jvj s ILE 79 N -1.26 1.03 -0.36 2.22 -1.09 0.15 0.57 121.20 122.47 2jvj s ILE 79 Ca 0.30 -0.51 -0.15 0.00 -2.23 0.00 0.00 60.65 58.06 2jvj s ILE 79 Cb -0.15 -0.90 -0.01 0.00 -1.58 0.00 0.00 42.46 39.82 2jvj s ILE 79 CO 0.16 0.31 0.34 -0.51 -1.23 0.00 0.00 174.94 174.00 2jvj s ILE 80 N 0.04 5.20 -1.10 2.92 2.07 -0.21 -1.01 121.20 129.10 2jvj s ILE 80 Ca -0.01 -0.12 0.15 0.00 -1.41 0.00 0.00 60.65 59.26 2jvj s ILE 80 Cb -0.09 -3.83 0.45 0.00 0.13 0.00 0.00 42.46 39.12 2jvj s ILE 80 CO 0.01 -0.13 1.38 1.15 -1.91 0.00 0.00 174.94 175.44 2jvj n MET 81 N 5.32 2.95 -0.40 3.50 0.00 -0.56 -0.02 117.12 127.92 2jvj n MET 81 Ca -0.10 -2.36 0.00 0.00 0.00 0.00 0.00 57.70 55.24 2jvj n MET 81 Cb 0.49 -1.46 0.00 0.00 0.00 0.00 0.00 33.22 32.25 2jvj n MET 81 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 175.97 173.60 2jvj n THR 82 N 0.73 0.00 -1.82 3.17 5.66 -1.18 -4.30 114.28 116.54 2jvj n THR 82 Ca 0.17 0.00 -0.43 0.00 -3.05 0.00 0.00 64.05 60.74 2jvj n THR 82 Cb 0.57 -1.60 -0.03 0.00 -1.55 0.00 0.00 70.33 67.72 2jvj n THR 82 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2jvj s ALA 83 N -3.21 3.03 0.22 1.79 0.00 -1.26 -4.30 121.76 118.03 2jvj s ALA 83 Ca 0.00 0.69 0.15 0.00 0.00 0.00 0.00 51.96 52.80 2jvj s ALA 83 Cb 0.00 -3.97 0.76 0.00 0.00 0.00 0.00 23.12 19.91 2jvj s ALA 83 CO 0.00 -2.35 0.83 0.66 0.00 0.00 0.00 175.76 174.90 2jvj n TYR 84 N 9.92 0.48 0.04 0.00 4.02 -1.26 0.36 117.16 130.71 2jvj n TYR 84 Ca 0.24 0.48 0.00 0.00 -0.01 0.00 0.00 57.90 58.61 2jvj n TYR 84 Cb 0.45 -0.89 0.02 0.00 -0.02 0.00 0.00 39.34 38.90 2jvj n TYR 84 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2jvj n GLY 85 N -1.22 -0.30 0.24 2.72 0.00 -1.26 -0.79 105.19 104.58 2jvj n GLY 85 Ca 0.21 -0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.37 2jvj n GLY 85 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jvj n GLU 86 N -1.28 1.08 0.31 1.61 4.71 0.16 -2.36 120.64 124.87 2jvj n GLU 86 Ca 0.00 -0.47 0.20 0.00 -0.01 0.00 0.00 57.16 56.88 2jvj n GLU 86 Cb 0.01 -1.49 1.00 0.00 -1.01 0.00 0.00 31.44 29.95 2jvj n GLU 86 CO 0.00 0.00 0.00 1.37 0.09 0.00 0.00 177.13 178.59 2jvj h LEU 87 N 1.16 0.00 0.00 -4.62 8.10 -1.16 0.72 115.31 119.51 2jvj h LEU 87 Ca 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 57.88 57.93 2jvj h LEU 87 Cb 0.37 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.58 2jvj h LEU 87 CO 0.00 0.01 -0.32 -0.78 -4.11 0.00 0.00 178.44 173.23 2jvj h ASP 88 N 0.00 0.00 0.00 0.17 3.58 -1.69 -3.37 116.42 115.11 2jvj h ASP 88 Ca -0.00 -0.78 -0.16 0.00 0.42 0.00 0.00 57.03 56.50 2jvj h ASP 88 Cb 0.20 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.22 2jvj h ASP 88 CO 0.00 1.08 -1.37 0.80 -2.88 0.00 0.00 179.24 176.87 2jvj n MET 89 N -4.58 0.54 -0.15 0.28 1.56 -1.04 -3.84 117.12 109.89 2jvj n MET 89 Ca -0.15 0.35 -0.06 0.00 -0.27 0.00 0.00 57.70 57.57 2jvj n MET 89 Cb 0.49 -1.55 0.03 0.00 2.15 0.00 0.00 33.22 34.34 2jvj n MET 89 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2jvj h ALA 90 N -0.92 0.59 0.37 -5.12 0.00 0.11 0.77 119.26 115.06 2jvj h ALA 90 Ca -0.25 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 2jvj h ALA 90 Cb 1.12 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2jvj h ALA 90 CO -0.15 -0.07 -0.18 0.37 0.00 0.00 0.00 179.25 179.22 2jvj h GLN 91 N 0.52 -0.49 0.00 0.00 4.15 -1.37 -3.32 115.11 114.61 2jvj h GLN 91 Ca 0.19 0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.65 2jvj h GLN 91 Cb 0.06 0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.86 2jvj h GLN 91 CO -0.11 -0.19 0.00 0.93 -1.93 0.00 0.00 178.83 177.53 2jvj h GLU 92 N -1.00 0.00 0.00 1.69 5.08 -1.65 -3.14 114.58 115.56 2jvj h GLU 92 Ca -0.05 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2jvj h GLU 92 Cb 0.52 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 2jvj h GLU 92 CO 0.08 0.00 -0.02 1.03 -1.00 0.00 0.00 179.01 179.10 2jvj h SER 93 N 0.00 0.00 0.00 1.42 0.87 -0.93 -3.43 113.55 111.48 2jvj h SER 93 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2jvj h SER 93 Cb 0.60 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2jvj h SER 93 CO 0.00 0.02 0.00 1.17 -0.53 0.00 0.00 176.83 177.49 2jvj n LYS 94 N -3.63 0.00 0.00 2.24 3.00 -1.19 -5.11 118.16 113.47 2jvj n LYS 94 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.28 2jvj n LYS 94 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.14 2jvj n LYS 94 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2jvj n GLU 95 N -0.20 0.00 -0.08 1.64 4.07 -1.23 -5.04 120.64 119.80 2jvj n GLU 95 Ca 0.00 0.00 -0.11 0.00 -0.06 0.00 0.00 57.16 56.99 2jvj n GLU 95 Cb 0.00 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.31 2jvj n GLU 95 CO 0.00 0.00 0.00 -0.11 -0.06 0.00 0.00 177.13 176.96 2jvj n LEU 96 N -0.70 2.96 -0.53 4.31 7.94 -1.26 -4.81 117.00 124.91 2jvj n LEU 96 Ca 0.00 -0.08 -0.01 0.00 -1.11 0.00 0.00 56.01 54.81 2jvj n LEU 96 Cb 0.00 -0.54 0.00 0.00 0.53 0.00 0.00 43.42 43.41 2jvj n LEU 96 CO 0.00 0.76 0.01 0.61 -1.11 0.00 0.00 177.39 177.65 2jvj n GLY 97 N 2.74 0.82 3.36 -3.96 0.00 -1.26 -4.77 105.19 102.12 2jvj n GLY 97 Ca -0.28 -0.68 0.03 0.00 0.00 0.00 0.00 46.02 45.09 2jvj n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jvj n ALA 98 N -2.36 -0.48 0.07 4.61 0.00 -1.26 -4.56 120.51 116.53 2jvj n ALA 98 Ca -0.00 0.06 -0.21 0.00 0.00 0.00 0.00 53.44 53.29 2jvj n ALA 98 Cb 0.50 -0.17 -0.13 0.00 0.00 0.00 0.00 19.45 19.66 2jvj n ALA 98 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2jvj h LEU 99 N 0.00 0.73 -7.60 0.00 3.38 -0.22 -3.48 115.31 108.12 2jvj h LEU 99 Ca 0.00 -0.83 0.21 0.00 0.09 0.00 0.00 57.88 57.35 2jvj h LEU 99 Cb 0.17 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 40.60 2jvj h LEU 99 CO 0.00 1.49 0.58 0.28 0.09 0.00 0.00 178.44 180.88 2jvj s THR 100 N -2.93 0.00 0.28 0.22 -1.32 -1.26 -4.77 115.64 105.86 2jvj s THR 100 Ca -0.11 -0.56 0.11 0.00 -1.21 0.00 0.00 61.69 59.92 2jvj s THR 100 Cb 0.04 -2.11 -0.05 0.00 -1.51 0.00 0.00 72.50 68.88 2jvj s THR 100 CO 0.89 0.00 -0.12 -1.38 -2.21 0.00 0.00 174.62 171.80 2jvj s HIS 101 N -2.96 2.44 -0.31 9.09 -3.43 -1.26 -1.04 115.29 117.82 2jvj s HIS 101 Ca 0.14 -0.31 -0.08 0.00 -0.80 0.00 0.00 55.06 54.02 2jvj s HIS 101 Cb -0.00 -1.10 0.19 0.00 -1.43 0.00 0.00 32.58 30.24 2jvj s HIS 101 CO 0.01 0.67 0.96 0.12 -2.00 0.00 0.00 174.74 174.51 2jvj s PHE 102 N -2.45 -0.70 -0.39 0.38 5.36 0.97 -4.93 117.98 116.22 2jvj s PHE 102 Ca 0.31 0.33 0.10 0.00 -0.96 0.00 0.00 56.93 56.71 2jvj s PHE 102 Cb -0.05 0.12 -0.11 0.00 -0.34 0.00 0.00 43.02 42.64 2jvj s PHE 102 CO 0.17 -0.42 0.38 0.00 -1.46 0.00 0.00 175.22 173.89 2jvj n ALA 103 N 4.83 3.13 -2.50 11.12 0.00 -1.26 -4.05 120.51 131.78 2jvj n ALA 103 Ca 0.08 -0.27 -0.42 0.00 0.00 0.00 0.00 53.44 52.83 2jvj n ALA 103 Cb 0.58 -0.35 -0.09 0.00 0.00 0.00 0.00 19.45 19.59 2jvj n ALA 103 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2jvj s LYS 104 N -2.05 3.20 -0.43 0.00 1.02 -1.26 -5.00 119.74 115.22 2jvj s LYS 104 Ca 0.02 -0.71 -0.27 0.00 0.02 0.00 0.00 55.97 55.04 2jvj s LYS 104 Cb 0.07 -3.93 -0.05 0.00 -0.52 0.00 0.00 37.83 33.41 2jvj s LYS 104 CO 0.41 -0.75 2.15 -2.14 -0.92 0.00 0.00 175.35 174.09 2jvj s PRO 105 N 2.04 2.64 -0.05 -1.68 0.02 -1.26 -4.85 135.00 131.86 2jvj s PRO 105 Ca 0.11 1.38 -0.02 0.00 0.02 0.00 0.00 61.00 62.49 2jvj s PRO 105 Cb -0.17 -4.43 -0.01 0.00 0.02 0.00 0.00 34.50 29.91 2jvj s PRO 105 CO 0.13 -2.67 -0.03 0.35 -0.33 0.00 0.00 177.00 174.44 2jvj h PHE 106 N 16.52 0.00 0.00 6.54 3.57 -1.99 -3.51 116.94 138.07 2jvj h PHE 106 Ca -0.30 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.20 2jvj h PHE 106 Cb 1.22 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.96 2jvj h PHE 106 CO 0.97 0.00 0.00 -3.47 -2.23 0.00 0.00 178.31 173.58 2jvj n ASP 107 N -3.11 0.00 0.32 0.41 2.03 -1.26 -5.01 116.55 109.93 2jvj n ASP 107 Ca -0.01 0.00 0.14 0.00 0.52 0.00 0.00 54.79 55.44 2jvj n ASP 107 Cb 0.05 0.00 0.77 0.00 -0.72 0.00 0.00 41.12 41.22 2jvj n ASP 107 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 2jvj h ILE 108 N 0.42 0.00 -0.55 5.18 -2.65 -1.99 0.43 117.51 118.35 2jvj h ILE 108 Ca 0.00 0.00 0.08 0.00 1.03 0.00 0.00 64.86 65.97 2jvj h ILE 108 Cb 0.00 0.63 -0.06 0.00 -2.05 0.00 0.00 36.82 35.33 2jvj h ILE 108 CO 0.00 0.00 0.19 -0.78 0.03 0.00 0.00 178.15 177.59 2jvj h ASP 109 N 0.00 0.19 -0.46 2.16 3.58 -1.99 0.19 116.42 120.08 2jvj h ASP 109 Ca 0.00 0.07 0.01 0.00 0.42 0.00 0.00 57.03 57.53 2jvj h ASP 109 Cb 0.68 0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.76 2jvj h ASP 109 CO 0.00 0.13 0.31 -0.08 -2.88 0.00 0.00 179.24 176.71 2jvj h GLU 110 N 0.37 0.59 0.07 0.28 4.57 -1.31 -0.87 114.58 118.28 2jvj h GLU 110 Ca 0.27 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.41 2jvj h GLU 110 Cb 0.31 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 2jvj h GLU 110 CO -0.28 0.39 -0.03 0.82 -1.18 0.00 0.00 179.01 178.73 2jvj h ILE 111 N 0.61 1.20 -0.32 2.32 5.03 -0.79 0.24 117.51 125.80 2jvj h ILE 111 Ca 0.17 -1.03 -0.08 0.00 -0.12 0.00 0.00 64.86 63.80 2jvj h ILE 111 Cb -0.04 1.87 -0.02 0.00 -3.03 0.00 0.00 36.82 35.60 2jvj h ILE 111 CO -0.04 0.25 -0.14 0.08 -0.68 0.00 0.00 178.15 177.63 2jvj h ARG 112 N -0.57 0.55 0.24 2.37 -0.00 -0.63 -0.95 114.38 115.39 2jvj h ARG 112 Ca -0.01 -0.17 -0.01 0.00 -0.00 0.00 0.00 59.98 59.79 2jvj h ARG 112 Cb 0.48 -0.05 0.00 0.00 -0.00 0.00 0.00 29.97 30.40 2jvj h ARG 112 CO 0.02 0.67 -0.11 0.22 -0.00 0.00 0.00 179.97 180.77 2jvj h ASP 113 N 0.50 -0.27 1.22 0.08 3.58 -1.10 -2.16 116.42 118.27 2jvj h ASP 113 Ca 0.09 -0.22 0.00 0.00 0.42 0.00 0.00 57.03 57.32 2jvj h ASP 113 Cb 0.53 0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.65 2jvj h ASP 113 CO 0.03 0.09 0.00 0.00 -2.88 0.00 0.00 179.24 176.49 2jvj h ALA 114 N -0.02 1.00 0.15 -0.78 0.00 -0.82 0.47 119.26 119.26 2jvj h ALA 114 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.59 2jvj h ALA 114 Cb 0.47 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.27 2jvj h ALA 114 CO 0.05 0.00 -1.31 -0.39 0.00 0.00 0.00 179.25 177.61 2jvj h VAL 115 N 0.00 1.44 0.00 0.00 -1.51 -1.18 0.30 116.25 115.30 2jvj h VAL 115 Ca 0.00 -2.98 -0.14 0.00 -1.23 0.00 0.00 66.70 62.35 2jvj h VAL 115 Cb 0.61 2.96 -0.02 0.00 -2.13 0.00 0.00 31.29 32.71 2jvj h VAL 115 CO 0.00 0.87 -0.66 0.11 -1.23 0.00 0.00 177.57 176.67 2jvj h LYS 116 N 0.09 0.00 0.00 5.19 1.79 -0.89 -3.33 116.57 119.43 2jvj h LYS 116 Ca -0.16 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 57.97 2jvj h LYS 116 Cb 2.01 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 32.60 2jvj h LYS 116 CO 0.22 0.66 -2.11 1.17 -1.08 0.00 0.00 179.45 178.30 2jvj n LYS 117 N -3.27 0.67 -1.83 3.15 0.00 0.16 -5.07 118.16 111.97 2jvj n LYS 117 Ca 0.01 0.13 -0.02 0.00 0.00 0.00 0.00 58.31 58.43 2jvj n LYS 117 Cb 0.80 -1.64 -0.01 0.00 0.00 0.00 0.00 35.03 34.18 2jvj n LYS 117 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2jvj n TYR 118 N -2.91 -1.70 0.12 5.64 4.02 0.10 -4.95 117.16 117.48 2jvj n TYR 118 Ca -0.27 0.99 -0.13 0.00 -0.01 0.00 0.00 57.90 58.49 2jvj n TYR 118 Cb 1.11 -2.46 -0.06 0.00 -0.02 0.00 0.00 39.34 37.91 2jvj n TYR 118 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 2jvj h LEU 119 N 1.53 -0.79 0.00 7.72 6.46 -1.77 -3.37 115.31 125.09 2jvj h LEU 119 Ca -0.17 0.09 0.00 0.00 -0.12 0.00 0.00 57.88 57.68 2jvj h LEU 119 Cb 0.39 0.30 0.00 0.00 -0.73 0.00 0.00 40.66 40.62 2jvj h LEU 119 CO 0.00 -0.37 0.00 -0.81 -0.62 0.00 0.00 178.44 176.65 2jvj n PRO 120 N -5.39 0.00 -1.25 5.25 -0.04 -1.26 -5.09 135.00 127.22 2jvj n PRO 120 Ca -0.07 0.43 -0.00 0.00 -0.04 0.00 0.00 63.50 63.83 2jvj n PRO 120 Cb 0.30 -0.93 -0.00 0.00 -0.04 0.00 0.00 33.50 32.83 2jvj n PRO 120 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2jvj n LEU 121 N -1.98 -2.41 0.00 1.53 0.00 -1.26 -5.04 117.00 107.83 2jvj n LEU 121 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 56.01 56.26 2jvj n LEU 121 Cb 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 43.42 42.21 2jvj n LEU 121 CO 0.00 -0.30 0.00 1.17 0.00 0.00 0.00 177.39 178.26 2jvj n LYS 122 N 0.16 0.00 0.00 1.96 4.81 -1.26 -4.98 118.16 118.85 2jvj n LYS 122 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.43 2jvj n LYS 122 Cb 0.02 -0.30 0.00 0.00 0.02 0.00 0.00 35.03 34.77 2jvj n LYS 122 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 2jvj n SER 123 N 0.00 0.00 -0.34 3.14 7.64 -1.26 -4.90 113.62 117.90 2jvj n SER 123 Ca 0.00 0.00 0.20 0.00 1.01 0.00 0.00 58.87 60.08 2jvj n SER 123 Cb 0.00 0.00 0.44 0.00 -1.01 0.00 0.00 64.21 63.64 2jvj n SER 123 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2jvj h ASN 124 N 0.00 0.57 -4.28 6.43 -1.07 -2.05 -3.48 115.58 111.71 2jvj h ASN 124 Ca 0.00 0.11 0.00 0.00 0.07 0.00 0.00 56.30 56.49 2jvj h ASN 124 Cb 0.00 0.02 -0.06 0.00 -2.07 0.00 0.00 38.32 36.21 2jvj h ASN 124 CO 0.00 0.10 -0.95 0.18 0.07 0.00 0.00 177.43 176.82 2jvj n LEU 125 N -4.77 -4.90 -4.51 6.14 4.32 -1.26 -4.73 117.00 107.30 2jvj n LEU 125 Ca 0.26 1.69 -0.41 0.00 -0.02 0.00 0.00 56.01 57.53 2jvj n LEU 125 Cb 0.81 -2.54 -0.08 0.00 -1.62 0.00 0.00 43.42 39.99 2jvj n LEU 125 CO 0.20 -2.50 2.04 -0.62 -1.22 0.00 0.00 177.39 175.29 2jvj n GLU 126 N 1.18 0.71 -3.16 3.23 -0.58 -1.26 -2.90 120.64 117.86 2jvj n GLU 126 Ca -0.20 0.07 -0.14 0.00 -0.42 0.00 0.00 57.16 56.48 2jvj n GLU 126 Cb 0.31 -2.55 0.01 0.00 -0.57 0.00 0.00 31.44 28.63 2jvj n GLU 126 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2jvj n HIS 127 N 12.59 -3.01 -4.30 -0.32 8.25 -1.26 -5.02 115.22 122.15 2jvj n HIS 127 Ca 0.48 1.21 -0.26 0.00 -0.26 0.00 0.00 57.72 58.89 2jvj n HIS 127 Cb 0.29 -3.49 -0.09 0.00 1.12 0.00 0.00 29.99 27.82 2jvj n HIS 127 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2jvj s HIS 128 N -2.56 2.63 -0.16 4.41 -3.43 -1.14 -5.12 115.29 109.92 2jvj s HIS 128 Ca 0.17 -0.23 -0.04 0.00 -0.80 0.00 0.00 55.06 54.17 2jvj s HIS 128 Cb -0.04 -1.25 0.06 0.00 -1.43 0.00 0.00 32.58 29.92 2jvj s HIS 128 CO 0.80 0.55 0.07 -1.01 -2.00 0.00 0.00 174.74 173.15 2jvj s HIS 129 N -1.88 0.42 -0.15 0.38 3.76 -1.26 -5.01 115.29 111.55 2jvj s HIS 129 Ca 0.27 -0.39 0.18 0.00 -0.15 0.00 0.00 55.06 54.96 2jvj s HIS 129 Cb -0.08 -0.76 -0.09 0.00 1.11 0.00 0.00 32.58 32.75 2jvj s HIS 129 CO 0.16 -0.50 0.91 1.25 -0.85 0.00 0.00 174.74 175.71 2jvj h HIS 130 N 8.37 0.00 -3.35 1.40 2.76 -2.03 -3.42 115.15 118.88 2jvj h HIS 130 Ca -0.15 0.00 -0.72 0.00 -2.20 0.00 0.00 60.37 57.30 2jvj h HIS 130 Cb 1.14 0.00 -0.30 0.00 1.55 0.00 0.00 27.41 29.80 2jvj h HIS 130 CO 0.23 0.43 -0.43 -1.58 -1.30 0.00 0.00 177.93 175.28 2jvj s HIS 131 N -3.04 3.44 -2.93 5.26 5.04 -1.26 -5.39 115.29 116.41 2jvj s HIS 131 Ca -0.02 -1.91 0.23 0.00 -1.54 0.00 0.00 55.06 51.83 2jvj s HIS 131 Cb 0.09 -3.37 0.19 0.00 0.04 0.00 0.00 32.58 29.52 2jvj s HIS 131 CO 0.80 -0.97 1.24 0.72 -2.34 0.00 0.00 174.74 174.19