#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 3.17 2.81 -1.26 -4.93 117.12 116.91 2jvj n MET 2 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2jvj n MET 2 Cb 0.00 -0.26 0.00 0.00 -0.71 0.00 0.00 33.22 32.25 2jvj n MET 2 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 2jvj n ASN 3 N -2.37 0.89 -4.61 7.83 0.23 -1.26 -5.02 115.26 110.94 2jvj n ASN 3 Ca 0.00 -0.23 -0.43 0.00 -0.53 0.00 0.00 54.58 53.39 2jvj n ASN 3 Cb 0.00 0.64 -0.03 0.00 -2.08 0.00 0.00 39.78 38.31 2jvj n ASN 3 CO 0.00 0.00 0.00 -1.83 -0.93 0.00 0.00 177.26 174.50 2jvj s GLU 4 N -0.82 3.92 -0.15 -3.83 1.03 -1.26 -4.91 118.70 112.68 2jvj s GLU 4 Ca 0.00 0.71 -0.07 0.00 0.03 0.00 0.00 54.97 55.63 2jvj s GLU 4 Cb 0.00 -3.78 0.06 0.00 -0.80 0.00 0.00 34.13 29.61 2jvj s GLU 4 CO 0.00 -0.90 0.34 0.15 -1.33 0.00 0.00 175.26 173.52 2jvj s LYS 5 N 3.46 0.31 -0.01 -4.83 1.02 -1.26 -1.12 119.74 117.31 2jvj s LYS 5 Ca 0.39 0.72 -0.08 0.00 0.02 0.00 0.00 55.97 57.02 2jvj s LYS 5 Cb -0.12 -0.03 0.01 0.00 -0.52 0.00 0.00 37.83 37.16 2jvj s LYS 5 CO 0.17 -0.18 0.16 0.42 -0.92 0.00 0.00 175.35 175.01 2jvj s ILE 6 N 1.52 0.07 0.01 2.17 1.01 -1.19 -1.31 121.20 123.47 2jvj s ILE 6 Ca -0.08 -0.55 0.04 0.00 0.00 0.00 0.00 60.65 60.06 2jvj s ILE 6 Cb -0.10 -0.42 -0.03 0.00 0.01 0.00 0.00 42.46 41.92 2jvj s ILE 6 CO -0.11 -0.30 -0.11 -0.22 0.00 0.00 0.00 174.94 174.20 2jvj s LEU 7 N -1.12 2.95 -0.28 2.97 1.98 0.18 -1.06 118.68 124.30 2jvj s LEU 7 Ca -0.12 -0.23 0.02 0.00 -2.89 0.00 0.00 54.13 50.91 2jvj s LEU 7 Cb -0.06 -1.69 0.08 0.00 0.66 0.00 0.00 46.19 45.17 2jvj s LEU 7 CO 0.02 0.29 -0.01 -0.63 -1.89 0.00 0.00 176.35 174.12 2jvj s ILE 8 N -0.94 1.79 -0.39 6.68 1.09 0.48 0.14 121.20 130.06 2jvj s ILE 8 Ca 0.16 -1.68 -0.09 0.00 -1.10 0.00 0.00 60.65 57.94 2jvj s ILE 8 Cb -0.11 -2.15 0.06 0.00 -1.06 0.00 0.00 42.46 39.20 2jvj s ILE 8 CO 0.06 -0.33 0.21 -0.69 -0.10 0.00 0.00 174.94 174.09 2jvj s VAL 9 N 1.22 4.18 0.00 2.92 1.01 0.19 -0.66 120.40 129.26 2jvj s VAL 9 Ca 0.01 -1.21 0.00 0.00 0.00 0.00 0.00 61.98 60.78 2jvj s VAL 9 Cb -0.19 -3.46 0.00 0.00 0.00 0.00 0.00 36.38 32.73 2jvj s VAL 9 CO -0.09 -0.36 0.00 -0.67 0.00 0.00 0.00 175.10 173.98 2jvj n ASP 10 N 4.90 0.00 -4.06 3.32 -0.08 -0.51 -0.66 116.55 119.47 2jvj n ASP 10 Ca -0.11 0.00 -0.38 0.00 -1.51 0.00 0.00 54.79 52.80 2jvj n ASP 10 Cb 0.44 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.85 2jvj n ASP 10 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 2jvj n ASP 11 N 0.00 2.96 -4.84 1.67 2.03 -1.26 -4.81 116.55 112.30 2jvj n ASP 11 Ca 0.00 -2.71 -0.37 0.00 0.52 0.00 0.00 54.79 52.23 2jvj n ASP 11 Cb 0.00 -1.42 -0.06 0.00 -0.72 0.00 0.00 41.12 38.92 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 5.41 3.96 0.14 -0.67 -0.21 -1.26 -5.01 119.66 122.02 2jvj s GLN 12 Ca 0.61 0.45 -0.18 0.00 0.02 0.00 0.00 55.36 56.26 2jvj s GLN 12 Cb 0.08 -3.12 -0.03 0.00 1.00 0.00 0.00 33.01 30.95 2jvj s GLN 12 CO 0.11 0.61 1.79 1.88 -2.12 0.00 0.00 175.29 177.56 2jvj h TYR 13 N 4.23 0.34 0.00 0.91 0.05 -2.04 -3.39 116.97 117.07 2jvj h TYR 13 Ca -0.50 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.29 2jvj h TYR 13 Cb 1.21 -0.11 0.00 0.00 1.01 0.00 0.00 36.73 38.83 2jvj h TYR 13 CO 0.68 0.21 -0.13 0.41 -1.05 0.00 0.00 178.16 178.29 2jvj n GLY 14 N -1.17 0.46 0.10 3.88 0.00 -1.26 -4.91 105.19 102.29 2jvj n GLY 14 Ca -0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.86 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 4.93 1.51 -0.35 -0.61 2.04 -1.97 -1.78 117.51 121.29 2jvj h ILE 15 Ca 0.00 -3.10 0.06 0.00 1.00 0.00 0.00 64.86 62.82 2jvj h ILE 15 Cb 1.10 2.93 -0.02 0.00 -0.74 0.00 0.00 36.82 40.09 2jvj h ILE 15 CO 0.00 0.90 0.24 0.03 0.00 0.00 0.00 178.15 179.32 2jvj h ARG 16 N 0.06 0.19 0.00 2.37 3.08 -1.88 -1.14 114.38 117.07 2jvj h ARG 16 Ca -0.12 -0.01 -0.29 0.00 0.07 0.00 0.00 59.98 59.62 2jvj h ARG 16 Cb 1.95 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 31.90 2jvj h ARG 16 CO 0.19 0.13 -2.11 1.51 -1.07 0.00 0.00 179.97 178.62 2jvj n ILE 17 N -4.47 1.25 0.20 2.04 0.13 -1.20 -3.85 119.36 113.45 2jvj n ILE 17 Ca 0.04 -0.79 0.04 0.00 -1.10 0.00 0.00 62.75 60.94 2jvj n ILE 17 Cb 0.28 -0.55 0.41 0.00 -0.84 0.00 0.00 39.64 38.94 2jvj n ILE 17 CO 0.00 0.00 0.00 0.17 2.80 0.00 0.00 176.55 179.52 2jvj h LEU 18 N 0.00 0.00 -1.75 9.51 8.10 -0.91 0.79 115.31 131.05 2jvj h LEU 18 Ca -0.39 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.57 2jvj h LEU 18 Cb 1.99 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 42.20 2jvj h LEU 18 CO 0.04 0.31 -0.08 -0.07 -4.11 0.00 0.00 178.44 174.53 2jvj h LEU 19 N 0.00 0.05 -0.00 0.17 -0.00 -1.35 0.23 115.31 114.41 2jvj h LEU 19 Ca -0.00 -0.01 -0.00 0.00 -0.00 0.00 0.00 57.88 57.87 2jvj h LEU 19 Cb 0.55 -0.01 -0.00 0.00 -0.00 0.00 0.00 40.66 41.19 2jvj h LEU 19 CO 0.04 0.14 -0.00 0.78 -0.00 0.00 0.00 178.44 179.40 2jvj h ASN 20 N 0.06 0.00 -0.07 -0.43 -0.26 -0.99 0.81 115.58 114.71 2jvj h ASN 20 Ca 0.01 -0.39 0.02 0.00 -0.56 0.00 0.00 56.30 55.39 2jvj h ASN 20 Cb 0.18 -0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.43 2jvj h ASN 20 CO 0.01 0.39 0.05 -0.33 -1.06 0.00 0.00 177.43 176.49 2jvj h GLU 21 N -0.38 0.00 0.15 0.81 5.08 -0.76 0.45 114.58 119.93 2jvj h GLU 21 Ca 0.00 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.07 2jvj h GLU 21 Cb 0.39 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.65 2jvj h GLU 21 CO 0.00 0.00 -1.44 -0.24 -1.00 0.00 0.00 179.01 176.33 2jvj h VAL 22 N 0.00 1.09 0.00 3.13 3.04 -0.79 -3.44 116.25 119.27 2jvj h VAL 22 Ca 0.03 -2.48 -0.06 0.00 -1.01 0.00 0.00 66.70 63.19 2jvj h VAL 22 Cb 0.13 2.82 -0.01 0.00 -2.01 0.00 0.00 31.29 32.22 2jvj h VAL 22 CO -0.00 0.76 -1.21 0.49 -1.01 0.00 0.00 177.57 176.60 2jvj n PHE 23 N -3.83 0.00 -0.30 3.17 3.72 0.26 -4.45 117.46 116.03 2jvj n PHE 23 Ca -0.23 0.00 0.35 0.00 -0.05 0.00 0.00 57.45 57.52 2jvj n PHE 23 Cb 0.96 -0.14 0.74 0.00 -0.94 0.00 0.00 39.48 40.10 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 -0.06 0.00 0.44 4.37 -0.73 0.14 0.81 115.58 120.54 2jvj h ASN 24 Ca -0.09 0.00 -0.31 0.00 1.87 0.00 0.00 56.30 57.77 2jvj h ASN 24 Cb 1.11 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.70 2jvj h ASN 24 CO -0.03 0.00 -1.50 0.07 -0.37 0.00 0.00 177.43 175.60 2jvj h LYS 25 N 0.00 0.30 0.00 6.67 -0.00 -1.68 -3.41 116.57 118.45 2jvj h LYS 25 Ca 0.55 -0.51 0.00 0.00 -0.00 0.00 0.00 60.65 60.68 2jvj h LYS 25 Cb 2.24 0.19 0.00 0.00 -0.00 0.00 0.00 32.23 34.66 2jvj h LYS 25 CO -0.01 1.19 -0.25 -0.85 -0.00 0.00 0.00 179.45 179.53 2jvj n GLU 26 N -3.51 0.00 0.13 0.07 0.28 0.85 -4.83 120.64 113.63 2jvj n GLU 26 Ca -0.16 0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.71 2jvj n GLU 26 Cb 1.05 -0.36 -0.08 0.00 1.43 0.00 0.00 31.44 33.48 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 -0.36 0.00 -1.84 0.00 0.21 -3.47 103.07 97.61 2jvj h GLY 27 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.46 2jvj h GLY 27 CO 0.00 -0.13 0.00 -1.72 0.00 0.00 0.00 176.54 174.69 2jvj n TYR 28 N -5.09 -0.45 -2.16 5.60 4.01 0.05 -4.72 117.16 114.40 2jvj n TYR 28 Ca -0.09 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.32 2jvj n TYR 28 Cb 0.25 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.31 2jvj n TYR 28 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 2jvj n GLN 29 N 0.00 3.10 -2.09 -0.72 -0.06 -0.27 -2.66 117.38 114.68 2jvj n GLN 29 Ca 0.00 -4.00 -0.43 0.00 -2.00 0.00 0.00 57.00 50.57 2jvj n GLN 29 Cb 0.00 -2.26 -0.03 0.00 -4.06 0.00 0.00 30.24 23.89 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 -5.27 3.59 0.47 1.69 -4.23 -1.15 -3.15 115.64 107.59 2jvj s THR 30 Ca 0.51 0.61 0.06 0.00 -1.18 0.00 0.00 61.69 61.68 2jvj s THR 30 Cb 0.42 -3.78 -0.01 0.00 1.34 0.00 0.00 72.50 70.47 2jvj s THR 30 CO -0.28 -0.48 0.28 0.12 -0.54 0.00 0.00 174.62 173.71 2jvj s PHE 31 N 6.40 2.23 -0.07 3.99 5.36 -0.22 -4.18 117.98 131.49 2jvj s PHE 31 Ca 0.75 -0.69 0.00 0.00 -0.96 0.00 0.00 56.93 56.03 2jvj s PHE 31 Cb -0.21 -1.96 -0.03 0.00 -0.34 0.00 0.00 43.02 40.49 2jvj s PHE 31 CO 0.33 -0.09 -0.05 1.14 -1.46 0.00 0.00 175.22 175.09 2jvj s GLN 32 N -4.07 2.81 -0.02 10.12 0.00 -1.26 -0.39 119.66 126.84 2jvj s GLN 32 Ca 0.37 -0.51 0.01 0.00 -0.00 0.00 0.00 55.36 55.23 2jvj s GLN 32 Cb 0.00 -2.64 0.01 0.00 0.00 0.00 0.00 33.01 30.39 2jvj s GLN 32 CO 0.21 0.67 -0.03 0.00 0.00 0.00 0.00 175.29 176.15 2jvj s ALA 33 N -0.83 0.43 -0.60 2.60 0.00 0.16 -4.87 121.76 118.65 2jvj s ALA 33 Ca 0.13 -0.03 0.22 0.00 0.00 0.00 0.00 51.96 52.28 2jvj s ALA 33 Cb -0.11 -0.25 -0.05 0.00 0.00 0.00 0.00 23.12 22.72 2jvj s ALA 33 CO 0.02 0.02 0.94 0.00 0.00 0.00 0.00 175.76 176.73 2jvj n ALA 34 N 3.62 3.54 -2.77 0.00 0.00 -1.26 -1.42 120.51 122.22 2jvj n ALA 34 Ca -0.21 -0.45 -0.09 0.00 0.00 0.00 0.00 53.44 52.69 2jvj n ALA 34 Cb 0.54 -0.91 -0.10 0.00 0.00 0.00 0.00 19.45 18.98 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 -3.86 0.21 0.53 0.00 0.01 -1.26 -4.36 114.94 106.21 2jvj s ASN 35 Ca 0.03 -0.54 0.25 0.00 -0.71 0.00 0.00 52.86 51.89 2jvj s ASN 35 Cb 0.15 0.18 1.48 0.00 0.41 0.00 0.00 41.25 43.47 2jvj s ASN 35 CO 0.83 -0.44 2.13 1.23 -1.51 0.00 0.00 177.10 179.34 2jvj h GLY 36 N 3.97 0.00 1.57 0.66 0.00 -1.89 0.40 103.07 107.78 2jvj h GLY 36 Ca -0.32 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 46.81 2jvj h GLY 36 CO 0.48 0.00 -0.80 0.17 0.00 0.00 0.00 176.54 176.39 2jvj h LEU 37 N 0.00 0.50 -0.76 3.11 8.10 -1.95 0.10 115.31 124.43 2jvj h LEU 37 Ca -0.00 -0.36 -0.00 0.00 0.11 0.00 0.00 57.88 57.63 2jvj h LEU 37 Cb 0.18 -0.15 -0.04 0.00 -0.44 0.00 0.00 40.66 40.22 2jvj h LEU 37 CO 0.01 1.12 0.46 -0.61 -4.11 0.00 0.00 178.44 175.32 2jvj h GLN 38 N 0.26 1.02 -0.82 0.17 -0.00 -1.62 0.14 115.11 114.25 2jvj h GLN 38 Ca -0.05 -0.09 -0.02 0.00 -0.00 0.00 0.00 58.65 58.50 2jvj h GLN 38 Cb 1.40 -0.22 -0.04 0.00 0.00 0.00 0.00 27.48 28.63 2jvj h GLN 38 CO 0.14 0.71 0.45 0.00 0.00 0.00 0.00 178.83 180.13 2jvj h ALA 39 N 1.25 1.24 -0.22 3.38 0.00 -0.49 -1.81 119.26 122.61 2jvj h ALA 39 Ca 0.27 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 2jvj h ALA 39 Cb -0.05 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 2jvj h ALA 39 CO -0.05 0.61 -0.29 1.25 0.00 0.00 0.00 179.25 180.78 2jvj h LEU 40 N 1.15 0.44 -0.16 0.00 5.85 -0.01 0.42 115.31 123.01 2jvj h LEU 40 Ca 0.29 -0.16 0.05 0.00 0.84 0.00 0.00 57.88 58.90 2jvj h LEU 40 Cb 0.03 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 40.88 2jvj h LEU 40 CO -0.05 0.72 -0.22 0.44 -0.34 0.00 0.00 178.44 178.99 2jvj h ASP 41 N 0.38 -0.68 -0.14 1.25 3.32 0.00 0.23 116.42 120.79 2jvj h ASP 41 Ca 0.05 0.12 -0.08 0.00 0.02 0.00 0.00 57.03 57.14 2jvj h ASP 41 Cb 0.70 0.31 -0.02 0.00 0.22 0.00 0.00 39.33 40.54 2jvj h ASP 41 CO 0.05 -0.26 -0.15 0.40 -1.72 0.00 0.00 179.24 177.56 2jvj h ILE 42 N -0.26 1.24 0.00 0.35 1.08 -0.56 0.56 117.51 119.91 2jvj h ILE 42 Ca 0.11 -1.09 -0.02 0.00 -0.39 0.00 0.00 64.86 63.47 2jvj h ILE 42 Cb 0.42 1.18 -0.00 0.00 -3.07 0.00 0.00 36.82 35.35 2jvj h ILE 42 CO -0.31 0.36 -0.09 0.58 -0.69 0.00 0.00 178.15 178.00 2jvj h VAL 43 N 0.48 0.99 0.00 1.67 2.07 0.73 0.95 116.25 123.13 2jvj h VAL 43 Ca 0.08 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.29 2jvj h VAL 43 Cb 0.54 1.18 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 2jvj h VAL 43 CO 0.03 0.09 -1.25 1.07 0.02 0.00 0.00 177.57 177.53 2jvj n THR 44 N -4.32 0.45 -0.05 2.57 5.66 -0.02 -3.15 114.28 115.42 2jvj n THR 44 Ca -0.03 -0.52 -0.04 0.00 -3.05 0.00 0.00 64.05 60.41 2jvj n THR 44 Cb 0.17 -0.23 -0.01 0.00 -1.55 0.00 0.00 70.33 68.70 2jvj n THR 44 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2jvj n LYS 45 N -2.55 0.31 -0.01 1.09 5.02 0.14 -4.65 118.16 117.51 2jvj n LYS 45 Ca -0.01 0.39 -0.03 0.00 -2.02 0.00 0.00 58.31 56.65 2jvj n LYS 45 Cb 0.55 -1.35 -0.12 0.00 -0.02 0.00 0.00 35.03 34.09 2jvj n LYS 45 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2jvj n GLU 46 N -3.85 0.64 -3.00 1.97 1.02 0.29 -5.03 120.64 112.68 2jvj n GLU 46 Ca -0.05 0.13 -0.03 0.00 -0.02 0.00 0.00 57.16 57.18 2jvj n GLU 46 Cb 0.20 -1.70 0.02 0.00 -0.02 0.00 0.00 31.44 29.94 2jvj n GLU 46 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 2jvj n ARG 47 N -2.81 -1.44 -1.23 3.49 0.00 0.10 -4.99 116.66 109.79 2jvj n ARG 47 Ca -0.16 1.29 -0.31 0.00 -0.00 0.00 0.00 57.85 58.67 2jvj n ARG 47 Cb 0.92 -5.51 0.10 0.00 0.00 0.00 0.00 32.46 27.98 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 -3.30 2.03 -0.10 -0.14 0.02 -1.26 -4.91 135.00 127.33 2jvj s PRO 48 Ca 0.10 1.11 0.15 0.00 0.02 0.00 0.00 61.00 62.38 2jvj s PRO 48 Cb -0.01 -1.87 -0.22 0.00 0.02 0.00 0.00 34.50 32.42 2jvj s PRO 48 CO 0.70 -1.79 0.18 -0.25 -0.33 0.00 0.00 177.00 175.51 2jvj n ASP 49 N -3.61 1.24 -4.62 2.53 9.92 -0.43 -4.89 116.55 116.69 2jvj n ASP 49 Ca 0.09 0.00 -0.34 0.00 -0.53 0.00 0.00 54.79 54.00 2jvj n ASP 49 Cb 0.53 1.24 -0.10 0.00 -0.64 0.00 0.00 41.12 42.15 2jvj n ASP 49 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2jvj s LEU 50 N -4.72 3.38 -0.26 0.64 2.01 -0.44 -0.95 118.68 118.35 2jvj s LEU 50 Ca -0.07 0.05 0.01 0.00 0.01 0.00 0.00 54.13 54.13 2jvj s LEU 50 Cb 0.07 -1.76 0.07 0.00 0.01 0.00 0.00 46.19 44.58 2jvj s LEU 50 CO 0.65 0.35 -0.01 -0.69 1.01 0.00 0.00 176.35 177.66 2jvj s VAL 51 N -0.71 1.51 -0.27 -1.59 1.01 -0.55 0.47 120.40 120.27 2jvj s VAL 51 Ca 0.11 -1.40 -0.29 0.00 0.00 0.00 0.00 61.98 60.40 2jvj s VAL 51 Cb -0.11 -1.89 -0.00 0.00 0.00 0.00 0.00 36.38 34.37 2jvj s VAL 51 CO 0.02 -0.28 1.27 -0.76 0.00 0.00 0.00 175.10 175.36 2jvj s LEU 52 N 1.37 3.96 -0.04 3.92 1.02 0.37 0.77 118.68 130.05 2jvj s LEU 52 Ca -0.01 1.32 0.01 0.00 0.02 0.00 0.00 54.13 55.48 2jvj s LEU 52 Cb -0.19 -3.54 0.02 0.00 0.02 0.00 0.00 46.19 42.50 2jvj s LEU 52 CO -0.10 -0.98 -0.05 -0.22 0.02 0.00 0.00 176.35 175.02 2jvj s LEU 53 N 4.10 1.44 -0.10 1.79 2.96 -0.31 0.56 118.68 129.13 2jvj s LEU 53 Ca 0.55 -0.14 -0.01 0.00 -0.22 0.00 0.00 54.13 54.31 2jvj s LEU 53 Cb -0.18 -0.47 -0.03 0.00 0.50 0.00 0.00 46.19 46.02 2jvj s LEU 53 CO 0.20 -0.03 -0.03 -0.62 -1.32 0.00 0.00 176.35 174.55 2jvj s ASP 54 N 0.75 4.93 0.22 3.68 2.15 0.16 -1.72 116.67 126.84 2jvj s ASP 54 Ca -0.11 0.02 0.19 0.00 0.43 0.00 0.00 52.55 53.09 2jvj s ASP 54 Cb -0.13 -1.43 0.03 0.00 -0.30 0.00 0.00 42.92 41.09 2jvj s ASP 54 CO 0.01 0.33 1.16 -0.03 -0.17 0.00 0.00 175.17 176.46 2jvj h MET 55 N 5.54 0.00 -0.65 4.34 1.85 -1.88 -3.29 114.93 120.84 2jvj h MET 55 Ca -0.46 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.63 2jvj h MET 55 Cb 1.18 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.21 2jvj h MET 55 CO 0.56 0.19 0.00 1.63 -0.40 0.00 0.00 176.91 178.88 2jvj n LYS 56 N -2.93 1.84 -2.62 0.39 4.01 -1.26 -3.94 118.16 113.65 2jvj n LYS 56 Ca -0.02 -0.79 -0.42 0.00 -0.51 0.00 0.00 58.31 56.56 2jvj n LYS 56 Cb 0.67 -1.52 -0.03 0.00 -0.51 0.00 0.00 35.03 33.65 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 -1.56 4.64 -0.07 -0.18 -1.16 -1.24 -4.95 121.20 116.67 2jvj s ILE 57 Ca 0.14 1.92 -0.30 0.00 -0.51 0.00 0.00 60.65 61.90 2jvj s ILE 57 Cb 0.10 -4.23 -0.06 0.00 0.61 0.00 0.00 42.46 38.88 2jvj s ILE 57 CO 0.06 0.00 1.75 -2.84 -2.81 0.00 0.00 174.94 171.10 2jvj s PRO 58 N 2.05 4.04 0.00 3.50 0.02 -1.26 -3.81 135.00 139.54 2jvj s PRO 58 Ca 0.50 2.18 0.00 0.00 0.02 0.00 0.00 61.00 63.70 2jvj s PRO 58 Cb -0.20 -4.06 0.00 0.00 0.02 0.00 0.00 34.50 30.26 2jvj s PRO 58 CO 0.19 -1.03 0.00 0.41 -0.33 0.00 0.00 177.00 176.24 2jvj n GLY 59 N 4.41 1.19 3.32 0.52 0.00 -1.26 -4.62 105.19 108.75 2jvj n GLY 59 Ca 0.19 -0.26 -0.17 0.00 0.00 0.00 0.00 46.02 45.78 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 1.32 -0.88 1.61 -1.94 -1.25 -5.06 119.30 113.10 2jvj s MET 60 Ca 0.00 -1.67 -0.25 0.00 -1.71 0.00 0.00 55.69 52.06 2jvj s MET 60 Cb 0.00 -0.55 0.04 0.00 2.01 0.00 0.00 34.83 36.33 2jvj s MET 60 CO 0.00 -0.12 1.35 -0.51 -0.01 0.00 0.00 175.02 175.73 2jvj s ASP 61 N -3.29 6.34 0.55 3.03 1.01 -1.26 -4.57 116.67 118.47 2jvj s ASP 61 Ca 0.29 -0.99 0.28 0.00 0.71 0.00 0.00 52.55 52.84 2jvj s ASP 61 Cb 0.06 -2.56 1.46 0.00 1.01 0.00 0.00 42.92 42.89 2jvj s ASP 61 CO 0.09 -1.65 1.94 1.23 0.21 0.00 0.00 175.17 176.99 2jvj h GLY 62 N 12.81 0.00 0.50 0.21 0.00 -1.68 -0.37 103.07 114.53 2jvj h GLY 62 Ca -0.04 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.31 2jvj h GLY 62 CO 1.35 0.00 -0.30 1.19 0.00 0.00 0.00 176.54 178.78 2jvj h ILE 63 N 0.00 0.36 -0.79 2.60 2.10 -1.83 -0.44 117.51 119.51 2jvj h ILE 63 Ca 0.28 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.23 2jvj h ILE 63 Cb 1.24 0.36 -0.04 0.00 -1.09 0.00 0.00 36.82 37.29 2jvj h ILE 63 CO -0.00 0.00 0.51 -0.33 -1.08 0.00 0.00 178.15 177.25 2jvj h GLU 64 N -0.53 1.04 -0.38 2.19 4.39 -1.48 -1.68 114.58 118.14 2jvj h GLU 64 Ca 0.03 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.64 2jvj h GLU 64 Cb 0.55 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 2jvj h GLU 64 CO -0.16 0.70 0.17 0.82 -1.16 0.00 0.00 179.01 179.38 2jvj h ILE 65 N 1.07 1.17 -0.94 3.13 5.03 -1.30 -1.51 117.51 124.16 2jvj h ILE 65 Ca 0.29 -0.51 0.00 0.00 -0.12 0.00 0.00 64.86 64.52 2jvj h ILE 65 Cb -0.10 0.81 -0.05 0.00 -3.03 0.00 0.00 36.82 34.45 2jvj h ILE 65 CO -0.06 0.19 0.60 0.25 -0.68 0.00 0.00 178.15 178.44 2jvj h LEU 66 N 0.47 1.11 -0.22 1.44 5.85 -0.38 0.54 115.31 124.11 2jvj h LEU 66 Ca 0.13 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 2jvj h LEU 66 Cb 0.13 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 2jvj h LEU 66 CO -0.01 0.83 0.08 0.11 -0.34 0.00 0.00 178.44 179.10 2jvj h LYS 67 N 1.29 0.34 -0.53 1.25 1.57 -1.18 -2.16 116.57 117.16 2jvj h LYS 67 Ca 0.34 -0.07 0.03 0.00 -1.87 0.00 0.00 60.65 59.08 2jvj h LYS 67 Cb -0.10 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.13 2jvj h LYS 67 CO -0.07 0.42 0.35 -0.09 -0.57 0.00 0.00 179.45 179.50 2jvj h ARG 68 N 0.20 0.60 0.26 3.15 9.65 -0.19 -0.69 114.38 127.35 2jvj h ARG 68 Ca 0.07 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 58.90 2jvj h ARG 68 Cb 0.22 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.66 2jvj h ARG 68 CO -0.00 0.40 -0.12 0.52 2.80 0.00 0.00 179.97 183.56 2jvj h MET 69 N 0.62 -0.33 0.00 0.20 2.86 0.52 0.59 114.93 119.39 2jvj h MET 69 Ca 0.21 0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.87 2jvj h MET 69 Cb 0.08 0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.81 2jvj h MET 69 CO -0.05 -0.12 -0.03 1.57 1.06 0.00 0.00 176.91 179.33 2jvj h LYS 70 N -0.48 0.00 -0.20 1.72 2.10 -1.18 0.61 116.57 119.14 2jvj h LYS 70 Ca -0.04 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.44 2jvj h LYS 70 Cb 0.36 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.69 2jvj h LYS 70 CO 0.06 0.03 -0.60 0.28 -2.00 0.00 0.00 179.45 177.22 2jvj h VAL 71 N 0.00 1.31 -0.41 0.07 2.07 0.20 -1.46 116.25 118.03 2jvj h VAL 71 Ca -0.00 -1.84 -0.09 0.00 0.82 0.00 0.00 66.70 65.59 2jvj h VAL 71 Cb 0.14 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 2jvj h VAL 71 CO 0.00 0.58 -0.10 0.40 0.02 0.00 0.00 177.57 178.47 2jvj h ILE 72 N 0.50 1.27 0.00 4.57 1.08 0.24 -3.41 117.51 121.77 2jvj h ILE 72 Ca -0.00 -1.20 -0.03 0.00 -0.39 0.00 0.00 64.86 63.24 2jvj h ILE 72 Cb 1.17 1.21 -0.00 0.00 -3.07 0.00 0.00 36.82 36.13 2jvj h ILE 72 CO 0.12 0.40 -0.56 -0.67 -0.69 0.00 0.00 178.15 176.75 2jvj n ASP 73 N -4.32 1.17 0.00 1.72 -0.08 -0.77 -5.00 116.55 109.27 2jvj n ASP 73 Ca -0.01 0.17 0.00 0.00 -1.51 0.00 0.00 54.79 53.44 2jvj n ASP 73 Cb 0.37 -0.41 0.00 0.00 2.34 0.00 0.00 41.12 43.42 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 -3.68 0.00 0.00 -0.67 1.02 -0.55 -4.67 120.64 112.09 2jvj n GLU 74 Ca -0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 2jvj n GLU 74 Cb 0.26 -1.33 0.00 0.00 -0.02 0.00 0.00 31.44 30.35 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 2.91 -4.74 1.62 5.03 -1.26 -5.06 115.26 113.76 2jvj n ASN 75 Ca 0.00 -0.08 -0.42 0.00 0.87 0.00 0.00 54.58 54.95 2jvj n ASN 75 Cb 0.00 0.74 -0.02 0.00 -1.02 0.00 0.00 39.78 39.47 2jvj n ASN 75 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2jvj n ILE 76 N -1.03 0.61 -2.76 2.41 3.06 -1.26 -4.89 119.36 115.50 2jvj n ILE 76 Ca 0.00 -0.15 -0.43 0.00 -2.50 0.00 0.00 62.75 59.67 2jvj n ILE 76 Cb 0.00 -1.98 -0.03 0.00 0.54 0.00 0.00 39.64 38.17 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 0.17 3.61 0.11 9.51 1.81 -0.13 -4.89 118.95 129.14 2jvj s ARG 77 Ca 0.68 -1.49 -0.18 0.00 -1.72 0.00 0.00 55.73 53.02 2jvj s ARG 77 Cb -0.50 -5.13 -0.07 0.00 -0.45 0.00 0.00 34.95 28.80 2jvj s ARG 77 CO 0.42 -1.98 0.58 0.14 -0.68 0.00 0.00 175.30 173.78 2jvj s VAL 78 N 3.72 4.74 -0.04 3.52 -7.23 -1.26 -1.48 120.40 122.37 2jvj s VAL 78 Ca 0.39 1.14 0.04 0.00 -1.81 0.00 0.00 61.98 61.74 2jvj s VAL 78 Cb -0.02 -3.86 -0.00 0.00 0.56 0.00 0.00 36.38 33.05 2jvj s VAL 78 CO -0.09 0.45 -0.15 -0.63 -0.31 0.00 0.00 175.10 174.36 2jvj s ILE 79 N -1.23 1.27 -0.31 -0.62 -1.09 0.23 0.62 121.20 120.07 2jvj s ILE 79 Ca 0.32 -0.64 -0.09 0.00 -2.23 0.00 0.00 60.65 58.01 2jvj s ILE 79 Cb -0.18 -1.10 -0.00 0.00 -1.58 0.00 0.00 42.46 39.60 2jvj s ILE 79 CO 0.19 0.37 0.15 -0.51 -1.23 0.00 0.00 174.94 173.91 2jvj s ILE 80 N 0.01 4.53 -0.17 2.92 2.07 -0.31 -1.16 121.20 129.09 2jvj s ILE 80 Ca -0.02 -0.49 0.16 0.00 -1.41 0.00 0.00 60.65 58.89 2jvj s ILE 80 Cb -0.10 -3.33 0.40 0.00 0.13 0.00 0.00 42.46 39.56 2jvj s ILE 80 CO 0.01 0.04 1.27 1.15 -1.91 0.00 0.00 174.94 175.51 2jvj n MET 81 N 4.97 1.86 0.00 3.50 0.00 -0.70 -2.58 117.12 124.17 2jvj n MET 81 Ca -0.14 -2.81 0.00 0.00 0.00 0.00 0.00 57.70 54.76 2jvj n MET 81 Cb 0.49 -1.65 0.00 0.00 0.00 0.00 0.00 33.22 32.06 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 -1.09 0.00 -1.49 3.17 5.66 -1.15 -4.37 114.28 115.01 2jvj n THR 82 Ca 0.20 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.77 2jvj n THR 82 Cb 0.76 -1.10 -0.10 0.00 -1.55 0.00 0.00 70.33 68.34 2jvj n THR 82 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2jvj n ALA 83 N -3.00 0.54 0.32 1.79 0.00 -1.26 -3.48 120.51 115.41 2jvj n ALA 83 Ca 0.00 -0.40 0.15 0.00 0.00 0.00 0.00 53.44 53.20 2jvj n ALA 83 Cb 0.00 -2.56 0.62 0.00 0.00 0.00 0.00 19.45 17.51 2jvj n ALA 83 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 2jvj h TYR 84 N 13.96 0.00 -0.01 0.00 -0.00 -1.91 1.00 116.97 130.01 2jvj h TYR 84 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.59 2jvj h TYR 84 Cb 1.31 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.04 2jvj h TYR 84 CO 1.03 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 179.60 2jvj n GLY 85 N 0.01 -0.88 0.86 0.10 0.00 -1.26 -3.29 105.19 100.73 2jvj n GLY 85 Ca 0.01 -0.21 0.11 0.00 0.00 0.00 0.00 46.02 45.94 2jvj n GLY 85 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2jvj n GLU 86 N -0.82 2.14 0.29 1.61 4.07 0.35 -3.07 120.64 125.20 2jvj n GLU 86 Ca 0.21 -1.70 0.20 0.00 -0.06 0.00 0.00 57.16 55.80 2jvj n GLU 86 Cb 0.13 -1.46 1.02 0.00 -0.06 0.00 0.00 31.44 31.06 2jvj n GLU 86 CO 0.00 0.00 0.00 1.37 -0.06 0.00 0.00 177.13 178.44 2jvj h LEU 87 N 3.49 0.00 0.48 4.31 8.10 -1.68 0.74 115.31 130.74 2jvj h LEU 87 Ca 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.97 2jvj h LEU 87 Cb 0.76 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.99 2jvj h LEU 87 CO 0.00 0.00 -0.23 -0.78 -4.11 0.00 0.00 178.44 173.32 2jvj h ASP 88 N 0.00 -0.54 0.00 0.17 1.82 -1.82 -3.39 116.42 112.65 2jvj h ASP 88 Ca 0.00 0.01 -0.12 0.00 -0.39 0.00 0.00 57.03 56.53 2jvj h ASP 88 Cb 0.07 0.14 -0.02 0.00 0.68 0.00 0.00 39.33 40.21 2jvj h ASP 88 CO 0.00 -0.12 -1.26 0.80 -1.61 0.00 0.00 179.24 177.04 2jvj n MET 89 N -5.20 0.53 -0.33 0.28 1.56 -0.88 -4.29 117.12 108.79 2jvj n MET 89 Ca -0.08 0.31 -0.03 0.00 -0.27 0.00 0.00 57.70 57.63 2jvj n MET 89 Cb 0.26 -1.52 0.09 0.00 2.15 0.00 0.00 33.22 34.20 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 -0.96 1.12 0.66 -5.12 0.00 0.17 0.40 119.26 115.53 2jvj h ALA 90 Ca -0.18 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 2jvj h ALA 90 Cb 1.06 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 2jvj h ALA 90 CO -0.11 0.52 -0.40 0.37 0.00 0.00 0.00 179.25 179.63 2jvj h GLN 91 N 1.20 -0.96 0.00 0.00 4.15 -1.55 -2.90 115.11 115.05 2jvj h GLN 91 Ca 0.32 0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.81 2jvj h GLN 91 Cb -0.14 0.22 0.00 0.00 0.21 0.00 0.00 27.48 27.77 2jvj h GLN 91 CO -0.07 -0.64 0.00 0.93 -1.93 0.00 0.00 178.83 177.12 2jvj h GLU 92 N -1.00 0.00 0.00 1.69 5.08 -1.66 -2.71 114.58 115.98 2jvj h GLU 92 Ca -0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2jvj h GLU 92 Cb 0.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.06 2jvj h GLU 92 CO 0.09 0.00 0.29 0.77 -1.00 0.00 0.00 179.01 179.16 2jvj h SER 93 N 0.00 0.00 0.00 1.42 0.02 0.01 -3.38 113.55 111.62 2jvj h SER 93 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2jvj h SER 93 Cb 0.55 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.09 2jvj h SER 93 CO 0.00 0.00 0.00 1.17 -1.14 0.00 0.00 176.83 176.86 2jvj n LYS 94 N -2.73 0.00 0.00 3.45 3.00 -1.15 -5.08 118.16 115.64 2jvj n LYS 94 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.29 2jvj n LYS 94 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.37 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 -1.79 0.00 -0.01 1.64 2.13 -1.03 -5.02 120.64 116.55 2jvj n GLU 95 Ca 0.00 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.61 2jvj n GLU 95 Cb 0.00 0.00 -0.14 0.00 0.27 0.00 0.00 31.44 31.57 2jvj n GLU 95 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2jvj n LEU 96 N -1.94 2.55 -1.99 4.31 4.77 -1.25 -4.54 117.00 118.91 2jvj n LEU 96 Ca 0.00 0.22 -0.20 0.00 -0.03 0.00 0.00 56.01 56.00 2jvj n LEU 96 Cb 0.00 -1.09 -0.04 0.00 -2.33 0.00 0.00 43.42 39.96 2jvj n LEU 96 CO 0.00 0.78 -0.23 0.61 -1.33 0.00 0.00 177.39 177.22 2jvj n GLY 97 N 1.93 0.52 0.20 -0.72 0.00 -1.20 -4.75 105.19 101.17 2jvj n GLY 97 Ca -0.33 -0.04 0.03 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.60 -0.51 -1.35 4.61 0.00 -1.26 -4.62 120.51 116.78 2jvj n ALA 98 Ca -0.22 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2jvj n ALA 98 Cb 0.67 -0.19 0.00 0.00 0.00 0.00 0.00 19.45 19.93 2jvj n ALA 98 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2jvj n LEU 99 N -2.36 0.00 -4.78 0.00 4.77 0.20 -4.86 117.00 109.98 2jvj n LEU 99 Ca -0.00 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.66 2jvj n LEU 99 Cb 0.09 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.24 2jvj n LEU 99 CO 0.00 0.00 0.72 0.28 -1.33 0.00 0.00 177.39 177.06 2jvj s THR 100 N 0.74 3.38 0.07 -5.08 -1.32 -0.51 -4.60 115.64 108.32 2jvj s THR 100 Ca 0.00 0.54 -0.12 0.00 -1.21 0.00 0.00 61.69 60.90 2jvj s THR 100 Cb 0.00 -3.06 0.01 0.00 -1.51 0.00 0.00 72.50 67.94 2jvj s THR 100 CO 0.00 -0.50 0.27 -1.38 -2.21 0.00 0.00 174.62 170.80 2jvj s HIS 101 N -2.65 -0.02 0.00 9.09 -3.43 -1.24 -1.17 115.29 115.88 2jvj s HIS 101 Ca 0.63 -0.25 0.00 0.00 -0.80 0.00 0.00 55.06 54.64 2jvj s HIS 101 Cb -0.18 0.06 0.00 0.00 -1.43 0.00 0.00 32.58 31.02 2jvj s HIS 101 CO 0.49 -0.54 0.00 0.34 -2.00 0.00 0.00 174.74 173.03 2jvj n PHE 102 N 0.26 0.00 1.21 0.38 7.35 -1.07 -5.01 117.46 120.58 2jvj n PHE 102 Ca -0.17 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 56.64 2jvj n PHE 102 Cb 0.61 0.00 0.37 0.00 0.35 0.00 0.00 39.48 40.81 2jvj n PHE 102 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2jvj n ALA 103 N 0.00 2.52 -2.87 3.13 0.00 -1.23 -4.38 120.51 117.68 2jvj n ALA 103 Ca 0.00 -0.57 -0.35 0.00 0.00 0.00 0.00 53.44 52.52 2jvj n ALA 103 Cb 0.00 -1.05 -0.05 0.00 0.00 0.00 0.00 19.45 18.35 2jvj n ALA 103 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2jvj s LYS 104 N -1.89 3.46 -0.50 0.00 2.20 -1.26 -4.94 119.74 116.81 2jvj s LYS 104 Ca 0.35 -0.21 -0.26 0.00 -0.36 0.00 0.00 55.97 55.49 2jvj s LYS 104 Cb 0.20 -3.13 -0.07 0.00 -1.51 0.00 0.00 37.83 33.31 2jvj s LYS 104 CO 0.31 0.71 2.43 -2.30 -0.36 0.00 0.00 175.35 176.14 2jvj n PRO 105 N 1.39 1.01 -0.37 4.03 -0.02 -1.26 -4.92 135.00 134.85 2jvj n PRO 105 Ca -0.15 -0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 2jvj n PRO 105 Cb 0.54 -3.43 0.00 0.00 -0.02 0.00 0.00 33.50 30.59 2jvj n PRO 105 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 2jvj n PHE 106 N 15.94 -3.35 -3.94 6.00 1.16 -1.26 -5.08 117.46 126.93 2jvj n PHE 106 Ca 0.38 0.00 -0.36 0.00 -1.87 0.00 0.00 57.45 55.60 2jvj n PHE 106 Cb 0.54 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.33 2jvj n PHE 106 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 2jvj s ASP 107 N -1.00 6.08 0.29 5.98 2.15 -1.26 -5.00 116.67 123.91 2jvj s ASP 107 Ca 0.00 0.32 -0.02 0.00 0.43 0.00 0.00 52.55 53.28 2jvj s ASP 107 Cb 0.00 -1.97 0.43 0.00 -0.30 0.00 0.00 42.92 41.08 2jvj s ASP 107 CO 0.00 0.33 1.92 0.16 -0.17 0.00 0.00 175.17 177.41 2jvj h ILE 108 N 4.27 1.21 -0.93 4.11 -2.65 -1.99 -1.85 117.51 119.67 2jvj h ILE 108 Ca -0.49 -0.51 0.02 0.00 1.03 0.00 0.00 64.86 64.91 2jvj h ILE 108 Cb 1.20 0.20 -0.05 0.00 -2.05 0.00 0.00 36.82 36.12 2jvj h ILE 108 CO 0.63 0.23 0.61 0.44 0.03 0.00 0.00 178.15 180.09 2jvj h ASP 109 N 1.02 1.03 0.26 2.16 5.19 -1.99 -0.03 116.42 124.06 2jvj h ASP 109 Ca 0.26 -0.02 -0.06 0.00 -0.62 0.00 0.00 57.03 56.60 2jvj h ASP 109 Cb 0.00 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.26 2jvj h ASP 109 CO -0.04 0.73 -0.26 -0.08 -3.12 0.00 0.00 179.24 176.46 2jvj h GLU 110 N 1.21 0.01 -0.01 3.56 4.57 -1.77 0.17 114.58 122.32 2jvj h GLU 110 Ca 0.36 -0.00 -0.26 0.00 -1.18 0.00 0.00 59.36 58.28 2jvj h GLU 110 Cb -0.06 -0.00 0.02 0.00 -0.16 0.00 0.00 28.75 28.55 2jvj h GLU 110 CO -0.10 0.27 -1.01 0.97 -1.18 0.00 0.00 179.01 177.96 2jvj h ILE 111 N 0.01 1.30 -0.04 2.32 -0.00 -0.52 0.39 117.51 120.97 2jvj h ILE 111 Ca -0.00 -2.26 -0.18 0.00 -0.00 0.00 0.00 64.86 62.42 2jvj h ILE 111 Cb 0.47 2.36 -0.01 0.00 -0.00 0.00 0.00 36.82 39.64 2jvj h ILE 111 CO 0.03 0.70 -0.76 0.08 -0.00 0.00 0.00 178.15 178.21 2jvj h ARG 112 N 0.38 0.27 -0.30 2.19 0.11 -1.09 -0.58 114.38 115.37 2jvj h ARG 112 Ca -0.12 -0.24 -0.09 0.00 0.10 0.00 0.00 59.98 59.64 2jvj h ARG 112 Cb 1.66 0.06 -0.01 0.00 1.11 0.00 0.00 29.97 32.78 2jvj h ARG 112 CO 0.19 0.91 -0.15 0.22 0.10 0.00 0.00 179.97 181.24 2jvj h ASP 113 N 0.18 0.65 0.55 0.08 3.58 -0.92 -1.65 116.42 118.89 2jvj h ASP 113 Ca -0.03 -0.41 -0.09 0.00 0.42 0.00 0.00 57.03 56.92 2jvj h ASP 113 Cb 1.33 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 42.19 2jvj h ASP 113 CO 0.12 0.91 -0.45 0.00 -2.88 0.00 0.00 179.24 176.95 2jvj h ALA 114 N 0.75 1.16 0.08 -0.78 0.00 -0.09 0.50 119.26 120.87 2jvj h ALA 114 Ca 0.07 -0.41 -0.25 0.00 0.00 0.00 0.00 54.91 54.31 2jvj h ALA 114 Cb 0.67 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2jvj h ALA 114 CO 0.04 0.56 -1.18 -0.24 0.00 0.00 0.00 179.25 178.43 2jvj h VAL 115 N 0.00 1.55 0.02 0.00 3.04 -1.09 0.57 116.25 120.34 2jvj h VAL 115 Ca -0.00 -3.17 -0.21 0.00 -1.01 0.00 0.00 66.70 62.30 2jvj h VAL 115 Cb 0.85 2.90 -0.01 0.00 -2.01 0.00 0.00 31.29 33.01 2jvj h VAL 115 CO 0.06 0.91 -0.96 0.50 -1.01 0.00 0.00 177.57 177.07 2jvj h LYS 116 N 0.05 0.21 0.00 4.17 3.64 -1.04 -3.05 116.57 120.54 2jvj h LYS 116 Ca -0.10 -0.26 -0.11 0.00 -1.27 0.00 0.00 60.65 58.91 2jvj h LYS 116 Cb 1.91 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.79 2jvj h LYS 116 CO 0.17 1.02 -0.56 -0.22 -2.27 0.00 0.00 179.45 177.59 2jvj h LYS 117 N 0.10 0.00 -5.17 1.90 3.64 -0.07 -3.50 116.57 113.48 2jvj h LYS 117 Ca -0.06 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2jvj h LYS 117 Cb 1.62 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.44 2jvj h LYS 117 CO 0.15 0.50 -0.90 0.98 -2.27 0.00 0.00 179.45 177.91 2jvj n TYR 118 N -3.21 -3.93 -3.03 1.91 4.19 0.19 -4.97 117.16 108.31 2jvj n TYR 118 Ca 0.01 1.72 -0.42 0.00 3.31 0.00 0.00 57.90 62.52 2jvj n TYR 118 Cb 0.75 -4.05 -0.06 0.00 0.49 0.00 0.00 39.34 36.47 2jvj n TYR 118 CO 0.00 0.00 0.00 -0.51 0.91 0.00 0.00 176.86 177.26 2jvj s LEU 119 N -1.83 4.15 0.00 2.98 1.43 -0.76 -5.01 118.68 119.64 2jvj s LEU 119 Ca 0.05 0.41 0.00 0.00 -1.03 0.00 0.00 54.13 53.56 2jvj s LEU 119 Cb -0.01 -2.93 0.00 0.00 0.03 0.00 0.00 46.19 43.28 2jvj s LEU 119 CO 0.79 -0.60 0.35 -0.81 0.23 0.00 0.00 176.35 176.30 2jvj n PRO 120 N 6.13 0.00 0.00 1.29 -0.04 -1.26 -4.18 135.00 136.94 2jvj n PRO 120 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 2jvj n PRO 120 Cb 0.48 -0.84 0.00 0.00 -0.04 0.00 0.00 33.50 33.11 2jvj n PRO 120 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 2jvj n LEU 121 N -0.37 0.00 0.00 1.53 -0.00 -1.26 -1.43 117.00 115.47 2jvj n LEU 121 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2jvj n LEU 121 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2jvj n LEU 121 CO 0.00 0.00 0.20 1.17 -0.00 0.00 0.00 177.39 178.76 2jvj n LYS 122 N -0.01 0.00 -0.95 1.47 3.00 -1.26 -4.83 118.16 115.57 2jvj n LYS 122 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2jvj n LYS 122 Cb 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 35.03 34.14 2jvj n LYS 122 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2jvj n SER 123 N -0.47 -5.07 -2.86 3.14 3.41 -1.26 -3.86 113.62 106.65 2jvj n SER 123 Ca 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.59 2jvj n SER 123 Cb 0.00 -3.06 -0.02 0.00 -0.26 0.00 0.00 64.21 60.87 2jvj n SER 123 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2jvj n ASN 124 N -0.79 -4.67 0.00 4.04 5.15 -1.26 -4.94 115.26 112.78 2jvj n ASN 124 Ca 0.00 1.12 0.00 0.00 -0.60 0.00 0.00 54.58 55.10 2jvj n ASN 124 Cb 0.40 -3.57 0.00 0.00 -0.53 0.00 0.00 39.78 36.08 2jvj n ASN 124 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 2jvj n LEU 125 N 1.80 0.00 0.00 1.20 7.94 -1.25 -4.91 117.00 121.78 2jvj n LEU 125 Ca -0.17 0.99 0.00 0.00 -1.11 0.00 0.00 56.01 55.72 2jvj n LEU 125 Cb 0.33 -0.49 0.00 0.00 0.53 0.00 0.00 43.42 43.79 2jvj n LEU 125 CO 0.22 -0.49 0.00 1.21 -1.11 0.00 0.00 177.39 177.22 2jvj n GLU 126 N -2.25 0.00 -0.58 1.96 2.13 -1.26 -5.16 120.64 115.48 2jvj n GLU 126 Ca 0.00 0.00 0.08 0.00 0.66 0.00 0.00 57.16 57.90 2jvj n GLU 126 Cb 0.00 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 31.69 2jvj n GLU 126 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 2jvj n HIS 127 N 0.00 -1.45 -3.83 4.31 8.25 -1.26 -4.83 115.22 116.42 2jvj n HIS 127 Ca 0.00 0.72 -0.35 0.00 -0.26 0.00 0.00 57.72 57.83 2jvj n HIS 127 Cb 0.00 -1.31 -0.08 0.00 1.12 0.00 0.00 29.99 29.72 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 -1.56 3.40 0.00 4.41 -3.43 -1.26 -5.03 115.29 111.83 2jvj s HIS 128 Ca 0.00 0.31 0.00 0.00 -0.80 0.00 0.00 55.06 54.57 2jvj s HIS 128 Cb 0.00 -2.10 0.00 0.00 -1.43 0.00 0.00 32.58 29.05 2jvj s HIS 128 CO 0.00 0.35 0.00 0.72 -2.00 0.00 0.00 174.74 173.81 2jvj n HIS 129 N 3.22 0.00 -2.96 0.38 8.25 -1.26 -4.98 115.22 117.87 2jvj n HIS 129 Ca -0.17 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.08 2jvj n HIS 129 Cb 0.53 -0.03 0.03 0.00 1.12 0.00 0.00 29.99 31.64 2jvj n HIS 129 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2jvj n HIS 130 N -2.34 -1.85 -3.75 4.41 8.25 -1.26 -4.99 115.22 113.69 2jvj n HIS 130 Ca 0.00 0.48 -0.35 0.00 -0.26 0.00 0.00 57.72 57.59 2jvj n HIS 130 Cb 0.00 -4.38 -0.05 0.00 1.12 0.00 0.00 29.99 26.68 2jvj n HIS 130 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2jvj s HIS 131 N -3.15 3.60 -2.64 4.41 5.04 -1.26 -5.37 115.29 115.91 2jvj s HIS 131 Ca 0.28 0.61 0.27 0.00 -1.54 0.00 0.00 55.06 54.68 2jvj s HIS 131 Cb -0.12 -2.02 0.81 0.00 0.04 0.00 0.00 32.58 31.29 2jvj s HIS 131 CO 0.34 0.63 1.61 0.72 -2.34 0.00 0.00 174.74 175.70