#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jvk n MET 2 N 0.00 -2.17 -3.55 0.03 -0.00 -1.26 -4.88 117.12 105.29 2jvk n MET 2 Ca 0.00 0.46 -0.28 0.00 -0.00 0.00 0.00 57.70 57.88 2jvk n MET 2 Cb 0.00 -4.95 -0.12 0.00 -0.00 0.00 0.00 33.22 28.15 2jvk n MET 2 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 2jvk s ASN 3 N -1.97 2.79 -1.07 3.17 2.47 -1.26 -5.05 114.94 114.02 2jvk s ASN 3 Ca 0.00 -2.78 -0.20 0.00 0.42 0.00 0.00 52.86 50.29 2jvk s ASN 3 Cb 0.00 -0.70 0.08 0.00 -1.45 0.00 0.00 41.25 39.18 2jvk s ASN 3 CO 0.00 -0.23 1.44 -1.61 -3.72 0.00 0.00 177.10 172.99 2jvk s GLU 4 N 0.27 3.71 0.30 0.43 8.01 -1.26 -4.08 118.70 126.08 2jvk s GLU 4 Ca 0.24 -1.55 0.08 0.00 0.01 0.00 0.00 54.97 53.75 2jvk s GLU 4 Cb -0.12 -5.28 -0.04 0.00 -4.31 0.00 0.00 34.13 24.38 2jvk s GLU 4 CO -0.08 -2.10 0.16 0.21 0.01 0.00 0.00 175.26 173.46 2jvk s LYS 5 N 4.10 2.59 0.00 1.61 2.20 -1.26 -4.32 119.74 124.65 2jvk s LYS 5 Ca 0.45 -1.32 0.06 0.00 -0.36 0.00 0.00 55.97 54.80 2jvk s LYS 5 Cb -0.00 -2.35 -0.02 0.00 -1.51 0.00 0.00 37.83 33.95 2jvk s LYS 5 CO -0.05 0.25 -0.20 0.42 -0.36 0.00 0.00 175.35 175.40 2jvk s ILE 6 N -2.29 1.60 -0.02 5.43 1.01 0.12 0.15 121.20 127.19 2jvk s ILE 6 Ca 0.36 -0.95 0.04 0.00 0.00 0.00 0.00 60.65 60.09 2jvk s ILE 6 Cb -0.06 -1.35 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 2jvk s ILE 6 CO 0.24 0.38 -0.13 -0.76 0.00 0.00 0.00 174.94 174.66 2jvk s LEU 7 N -0.68 2.80 -0.19 2.97 1.43 0.43 0.36 118.68 125.81 2jvk s LEU 7 Ca 0.08 -0.23 -0.02 0.00 -1.03 0.00 0.00 54.13 52.93 2jvk s LEU 7 Cb -0.08 -1.60 0.06 0.00 0.03 0.00 0.00 46.19 44.60 2jvk s LEU 7 CO -0.00 0.32 0.02 -0.63 0.23 0.00 0.00 176.35 176.29 2jvk s ILE 8 N -0.82 0.60 -0.42 -0.59 1.01 0.47 0.70 121.20 122.15 2jvk s ILE 8 Ca 0.13 -0.55 -0.25 0.00 0.00 0.00 0.00 60.65 59.98 2jvk s ILE 8 Cb -0.11 -1.05 0.02 0.00 0.01 0.00 0.00 42.46 41.33 2jvk s ILE 8 CO 0.03 -0.15 0.87 -0.69 0.00 0.00 0.00 174.94 175.00 2jvk s VAL 9 N 1.83 4.58 -0.16 2.92 1.01 0.09 -0.71 120.40 129.96 2jvk s VAL 9 Ca -0.01 0.81 -0.16 0.00 0.00 0.00 0.00 61.98 62.62 2jvk s VAL 9 Cb -0.17 -4.35 0.04 0.00 0.00 0.00 0.00 36.38 31.91 2jvk s VAL 9 CO -0.08 -0.67 0.45 -0.62 0.00 0.00 0.00 175.10 174.18 2jvk s ASP 10 N 2.08 -0.46 -0.01 3.32 2.15 0.26 -3.79 116.67 120.22 2jvk s ASP 10 Ca 0.35 0.86 0.18 0.00 0.43 0.00 0.00 52.55 54.37 2jvk s ASP 10 Cb -0.11 0.88 -0.24 0.00 -0.30 0.00 0.00 42.92 43.14 2jvk s ASP 10 CO 0.22 -0.18 0.54 -0.67 -0.17 0.00 0.00 175.17 174.92 2jvk n ASP 11 N 2.73 0.84 0.24 -0.34 2.03 -1.26 -3.40 116.55 117.40 2jvk n ASP 11 Ca -0.14 -0.38 0.16 0.00 0.52 0.00 0.00 54.79 54.95 2jvk n ASP 11 Cb 0.57 1.48 0.60 0.00 -0.72 0.00 0.00 41.12 43.05 2jvk n ASP 11 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 2jvk h GLN 12 N 0.00 0.00 0.00 -0.67 4.20 -1.94 -3.46 115.11 113.24 2jvk h GLN 12 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2jvk h GLN 12 Cb 0.66 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.44 2jvk h GLN 12 CO 0.00 0.00 0.00 0.98 -0.67 0.00 0.00 178.83 179.14 2jvk n TYR 13 N -2.92 0.00 0.07 2.96 9.36 -1.26 -4.67 117.16 120.71 2jvk n TYR 13 Ca 0.01 0.00 -0.21 0.00 3.32 0.00 0.00 57.90 61.02 2jvk n TYR 13 Cb 0.31 0.00 -0.15 0.00 -0.63 0.00 0.00 39.34 38.88 2jvk n TYR 13 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 2jvk h GLY 14 N 0.00 0.41 0.92 2.98 0.00 -1.93 -2.95 103.07 102.51 2jvk h GLY 14 Ca 0.00 -1.06 0.02 0.00 0.00 0.00 0.00 47.33 46.29 2jvk h GLY 14 CO 0.00 0.93 0.46 -2.22 0.00 0.00 0.00 176.54 175.71 2jvk h ILE 15 N -0.23 1.13 -0.41 2.60 1.08 -1.96 0.26 117.51 119.98 2jvk h ILE 15 Ca -0.19 -0.32 0.01 0.00 -0.39 0.00 0.00 64.86 63.98 2jvk h ILE 15 Cb 1.80 0.13 -0.02 0.00 -3.07 0.00 0.00 36.82 35.66 2jvk h ILE 15 CO 0.18 0.17 0.26 0.08 -0.69 0.00 0.00 178.15 178.15 2jvk h ARG 16 N 0.92 0.52 -0.83 2.37 0.11 -1.88 -1.95 114.38 113.63 2jvk h ARG 16 Ca 0.28 -0.03 -0.02 0.00 0.10 0.00 0.00 59.98 60.31 2jvk h ARG 16 Cb -0.03 -0.12 -0.04 0.00 1.11 0.00 0.00 29.97 30.89 2jvk h ARG 16 CO -0.09 0.35 0.46 0.82 0.10 0.00 0.00 179.97 181.60 2jvk h ILE 17 N 0.54 1.24 -0.47 0.08 1.08 -1.04 0.41 117.51 119.35 2jvk h ILE 17 Ca 0.16 -0.60 0.05 0.00 -0.39 0.00 0.00 64.86 64.08 2jvk h ILE 17 Cb -0.04 0.12 -0.05 0.00 -3.07 0.00 0.00 36.82 33.78 2jvk h ILE 17 CO -0.05 0.27 0.20 -0.07 -0.69 0.00 0.00 178.15 177.82 2jvk h LEU 18 N 1.16 0.26 -0.01 1.44 3.38 0.20 0.46 115.31 122.21 2jvk h LEU 18 Ca 0.29 0.04 -0.24 0.00 0.09 0.00 0.00 57.88 58.06 2jvk h LEU 18 Cb 0.02 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2jvk h LEU 18 CO -0.05 0.19 -1.09 -0.07 0.09 0.00 0.00 178.44 177.51 2jvk h LEU 19 N 0.41 0.31 0.19 1.67 3.38 -1.15 -2.71 115.31 117.41 2jvk h LEU 19 Ca 0.22 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2jvk h LEU 19 Cb 0.17 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2jvk h LEU 19 CO -0.19 1.20 -0.18 0.78 0.09 0.00 0.00 178.44 180.15 2jvk h ASN 20 N 0.08 -0.46 -0.23 -0.43 2.35 0.70 0.32 115.58 117.90 2jvk h ASN 20 Ca -0.09 0.04 -0.16 0.00 -0.55 0.00 0.00 56.30 55.55 2jvk h ASN 20 Cb 1.80 0.16 -0.01 0.00 0.05 0.00 0.00 38.32 40.32 2jvk h ASN 20 CO 0.17 -0.27 -0.43 1.05 -1.65 0.00 0.00 177.43 176.30 2jvk h GLU 21 N -0.39 0.79 0.12 0.81 4.11 -0.20 -1.59 114.58 118.23 2jvk h GLU 21 Ca -0.00 -0.43 -0.27 0.00 0.07 0.00 0.00 59.36 58.73 2jvk h GLU 21 Cb 0.36 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2jvk h GLU 21 CO -0.03 1.06 -1.22 0.28 0.07 0.00 0.00 179.01 179.16 2jvk h VAL 22 N 0.63 1.51 -0.23 -1.06 2.07 -1.38 0.49 116.25 118.28 2jvk h VAL 22 Ca 0.04 -3.07 -0.02 0.00 0.82 0.00 0.00 66.70 64.47 2jvk h VAL 22 Cb 1.00 2.93 -0.01 0.00 -1.52 0.00 0.00 31.29 33.69 2jvk h VAL 22 CO 0.10 0.89 0.06 -0.26 0.02 0.00 0.00 177.57 178.38 2jvk h PHE 23 N 0.07 0.39 -0.18 1.57 0.04 -0.39 -2.33 116.94 116.10 2jvk h PHE 23 Ca -0.13 -0.04 -0.04 0.00 2.80 0.00 0.00 57.97 60.56 2jvk h PHE 23 Cb 1.95 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 39.98 2jvk h PHE 23 CO 0.06 0.46 -0.05 -0.91 -0.60 0.00 0.00 178.31 177.28 2jvk h ASN 24 N 0.20 0.25 0.05 2.17 -0.26 -1.20 -0.29 115.58 116.51 2jvk h ASN 24 Ca 0.07 -0.04 -0.03 0.00 -0.56 0.00 0.00 56.30 55.74 2jvk h ASN 24 Cb 0.27 -0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 37.45 2jvk h ASN 24 CO 0.00 0.35 -0.09 0.07 -1.06 0.00 0.00 177.43 176.69 2jvk h LYS 25 N 0.27 0.11 -0.07 0.81 2.10 0.33 0.46 116.57 120.58 2jvk h LYS 25 Ca 0.06 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.69 2jvk h LYS 25 Cb 0.27 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.58 2jvk h LYS 25 CO 0.01 0.21 0.00 0.39 -2.00 0.00 0.00 179.45 178.06 2jvk n GLU 26 N -4.37 1.20 -0.46 0.07 -0.58 -0.27 -4.81 120.64 111.42 2jvk n GLU 26 Ca -0.02 -0.31 0.00 0.00 -0.42 0.00 0.00 57.16 56.41 2jvk n GLU 26 Cb 0.20 -1.18 0.00 0.00 -0.57 0.00 0.00 31.44 29.89 2jvk n GLU 26 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jvk n GLY 27 N 0.75 0.75 3.28 0.62 0.00 0.16 -3.55 105.19 107.20 2jvk n GLY 27 Ca 0.08 -0.19 -0.22 0.00 0.00 0.00 0.00 46.02 45.70 2jvk n GLY 27 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2jvk n TYR 28 N -2.46 -3.38 -4.44 1.61 4.01 -0.33 -4.94 117.16 107.23 2jvk n TYR 28 Ca 0.00 -1.30 -0.21 0.00 -0.16 0.00 0.00 57.90 56.22 2jvk n TYR 28 Cb 0.00 -0.71 -0.16 0.00 -0.31 0.00 0.00 39.34 38.16 2jvk n TYR 28 CO 0.00 0.00 0.00 1.14 -0.46 0.00 0.00 176.86 177.54 2jvk s GLN 29 N -4.98 1.14 0.42 -0.72 -2.07 -1.26 -4.21 119.66 107.98 2jvk s GLN 29 Ca 0.59 -0.32 0.04 0.00 -1.82 0.00 0.00 55.36 53.85 2jvk s GLN 29 Cb -0.03 -1.03 -0.05 0.00 -1.09 0.00 0.00 33.01 30.81 2jvk s GLN 29 CO 0.40 0.09 0.03 0.95 -1.32 0.00 0.00 175.29 175.44 2jvk s THR 30 N 0.35 1.39 0.25 3.63 -4.23 -1.26 0.14 115.64 115.91 2jvk s THR 30 Ca -0.06 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.29 2jvk s THR 30 Cb -0.11 -2.62 0.01 0.00 1.34 0.00 0.00 72.50 71.12 2jvk s THR 30 CO 0.01 0.00 0.56 0.12 -0.54 0.00 0.00 174.62 174.77 2jvk s PHE 31 N -2.95 0.10 0.05 3.99 2.19 0.16 -4.79 117.98 116.74 2jvk s PHE 31 Ca 0.25 -0.50 -0.00 0.00 0.33 0.00 0.00 56.93 57.01 2jvk s PHE 31 Cb 0.06 0.39 -0.04 0.00 -1.31 0.00 0.00 43.02 42.13 2jvk s PHE 31 CO 0.12 -1.06 -0.04 1.14 1.83 0.00 0.00 175.22 177.22 2jvk s GLN 32 N -3.96 0.60 -0.07 10.12 -2.07 -1.26 -0.40 119.66 122.61 2jvk s GLN 32 Ca 0.17 -1.12 -0.04 0.00 -1.82 0.00 0.00 55.36 52.55 2jvk s GLN 32 Cb -0.02 0.09 0.04 0.00 -1.09 0.00 0.00 33.01 32.03 2jvk s GLN 32 CO 0.06 -0.08 0.17 0.00 -1.32 0.00 0.00 175.29 174.13 2jvk s ALA 33 N -3.34 -0.37 -2.02 2.60 0.00 0.11 -4.72 121.76 114.03 2jvk s ALA 33 Ca 0.03 0.71 0.27 0.00 0.00 0.00 0.00 51.96 52.97 2jvk s ALA 33 Cb 0.04 -0.46 1.61 0.00 0.00 0.00 0.00 23.12 24.31 2jvk s ALA 33 CO -0.07 -0.15 2.04 0.00 0.00 0.00 0.00 175.76 177.58 2jvk n ALA 34 N 3.94 2.66 -3.84 0.00 0.00 -1.22 0.92 120.51 122.96 2jvk n ALA 34 Ca -0.23 -0.19 -0.07 0.00 0.00 0.00 0.00 53.44 52.95 2jvk n ALA 34 Cb 0.54 -1.43 -0.01 0.00 0.00 0.00 0.00 19.45 18.54 2jvk n ALA 34 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2jvk s ASN 35 N -1.86 -0.20 0.21 0.00 2.47 -1.26 -4.19 114.94 110.12 2jvk s ASN 35 Ca 0.41 -0.69 0.01 0.00 0.42 0.00 0.00 52.86 53.02 2jvk s ASN 35 Cb 0.19 0.72 0.18 0.00 -1.45 0.00 0.00 41.25 40.89 2jvk s ASN 35 CO 0.32 -1.35 1.52 1.23 -3.72 0.00 0.00 177.10 175.09 2jvk h GLY 36 N 2.00 0.40 2.00 1.21 0.00 -1.80 -3.02 103.07 103.85 2jvk h GLY 36 Ca -0.22 -0.49 0.00 0.00 0.00 0.00 0.00 47.33 46.62 2jvk h GLY 36 CO 0.27 0.44 0.00 1.41 0.00 0.00 0.00 176.54 178.66 2jvk h LEU 37 N 0.27 0.00 0.00 3.11 3.38 -1.93 0.28 115.31 120.41 2jvk h LEU 37 Ca -0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2jvk h LEU 37 Cb 1.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 2jvk h LEU 37 CO 0.10 0.00 -0.36 1.56 0.09 0.00 0.00 178.44 179.84 2jvk h GLN 38 N 0.00 0.00 -0.79 1.13 1.08 -1.92 -2.53 115.11 112.09 2jvk h GLN 38 Ca 0.00 0.00 0.17 0.00 -1.45 0.00 0.00 58.65 57.37 2jvk h GLN 38 Cb 0.03 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.41 2jvk h GLN 38 CO 0.00 0.45 0.53 0.00 -0.95 0.00 0.00 178.83 178.87 2jvk h ALA 39 N -0.64 2.21 0.25 3.87 0.00 -1.50 0.13 119.26 123.57 2jvk h ALA 39 Ca -0.07 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.85 2jvk h ALA 39 Cb 0.63 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 2jvk h ALA 39 CO -0.04 -0.44 -0.48 1.25 0.00 0.00 0.00 179.25 179.54 2jvk h LEU 40 N 0.36 -1.40 -1.04 0.00 6.46 -0.50 0.62 115.31 119.81 2jvk h LEU 40 Ca 0.40 0.14 0.05 0.00 -0.12 0.00 0.00 57.88 58.34 2jvk h LEU 40 Cb 1.01 0.50 -0.06 0.00 -0.73 0.00 0.00 40.66 41.38 2jvk h LEU 40 CO -0.12 -0.57 0.64 -0.78 -0.62 0.00 0.00 178.44 176.99 2jvk h ASP 41 N -0.80 1.05 0.85 1.25 1.82 -0.65 -1.79 116.42 118.14 2jvk h ASP 41 Ca -0.02 -0.00 -0.06 0.00 -0.39 0.00 0.00 57.03 56.56 2jvk h ASP 41 Cb 0.77 -0.23 -0.01 0.00 0.68 0.00 0.00 39.33 40.54 2jvk h ASP 41 CO -0.20 0.70 -0.29 0.40 -1.61 0.00 0.00 179.24 178.25 2jvk h ILE 42 N 1.21 0.71 -0.06 2.25 2.04 -0.18 0.32 117.51 123.80 2jvk h ILE 42 Ca 0.40 -1.27 -0.21 0.00 1.00 0.00 0.00 64.86 64.79 2jvk h ILE 42 Cb 0.07 1.81 0.01 0.00 -0.74 0.00 0.00 36.82 37.97 2jvk h ILE 42 CO -0.14 0.28 -0.78 0.58 0.00 0.00 0.00 178.15 178.09 2jvk h VAL 43 N 0.00 1.32 -0.10 1.67 2.07 0.10 0.55 116.25 121.86 2jvk h VAL 43 Ca -0.00 -2.06 -0.09 0.00 0.82 0.00 0.00 66.70 65.37 2jvk h VAL 43 Cb 0.79 2.28 -0.01 0.00 -1.52 0.00 0.00 31.29 32.83 2jvk h VAL 43 CO 0.04 0.63 -0.33 0.74 0.02 0.00 0.00 177.57 178.66 2jvk h THR 44 N 0.28 1.27 0.09 2.57 2.02 -0.99 0.32 112.91 118.48 2jvk h THR 44 Ca -0.08 -1.30 -0.28 0.00 0.77 0.00 0.00 66.41 65.52 2jvk h THR 44 Cb 1.44 1.57 -0.01 0.00 -1.74 0.00 0.00 68.15 69.40 2jvk h THR 44 CO 0.16 0.39 -1.45 0.07 0.37 0.00 0.00 175.52 175.05 2jvk h LYS 45 N 0.18 0.19 0.01 6.66 2.10 -0.34 -3.41 116.57 121.96 2jvk h LYS 45 Ca 0.02 -0.33 -0.38 0.00 -2.00 0.00 0.00 60.65 57.97 2jvk h LYS 45 Cb 0.68 0.12 -0.06 0.00 -0.90 0.00 0.00 32.23 32.07 2jvk h LYS 45 CO 0.05 1.16 -2.36 0.39 -2.00 0.00 0.00 179.45 176.69 2jvk n GLU 46 N -3.96 0.67 -3.20 0.07 -0.58 0.19 -5.04 120.64 108.79 2jvk n GLU 46 Ca -0.27 0.13 -0.10 0.00 -0.42 0.00 0.00 57.16 56.50 2jvk n GLU 46 Cb 0.87 -1.56 0.00 0.00 -0.57 0.00 0.00 31.44 30.19 2jvk n GLU 46 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 2jvk n ARG 47 N -3.13 -1.63 -0.19 3.49 3.00 0.11 -4.85 116.66 113.47 2jvk n ARG 47 Ca -0.39 1.47 -0.10 0.00 -0.00 0.00 0.00 57.85 58.83 2jvk n ARG 47 Cb 1.05 -4.77 0.10 0.00 0.00 0.00 0.00 32.46 28.83 2jvk n ARG 47 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 2jvk n PRO 48 N -1.53 -2.49 0.00 -0.14 -0.04 -1.26 -4.51 135.00 125.03 2jvk n PRO 48 Ca -0.05 -0.54 0.00 0.00 -0.04 0.00 0.00 63.50 62.87 2jvk n PRO 48 Cb 0.55 -0.62 0.00 0.00 -0.04 0.00 0.00 33.50 33.39 2jvk n PRO 48 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2jvk n ASP 49 N -3.84 0.77 -3.69 3.54 -0.08 0.12 -4.73 116.55 108.65 2jvk n ASP 49 Ca 0.05 -0.92 -0.12 0.00 -1.51 0.00 0.00 54.79 52.28 2jvk n ASP 49 Cb 0.21 0.13 -0.09 0.00 2.34 0.00 0.00 41.12 43.70 2jvk n ASP 49 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 2jvk s LEU 50 N -0.26 -0.15 -0.01 -2.67 2.96 0.14 -4.54 118.68 114.16 2jvk s LEU 50 Ca 0.00 1.10 0.03 0.00 -0.22 0.00 0.00 54.13 55.04 2jvk s LEU 50 Cb 0.00 1.83 -0.00 0.00 0.50 0.00 0.00 46.19 48.52 2jvk s LEU 50 CO 0.00 -0.19 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.05 2jvk s VAL 51 N 0.56 0.80 -0.15 1.68 1.01 -0.51 -0.43 120.40 123.36 2jvk s VAL 51 Ca -0.02 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 61.57 2jvk s VAL 51 Cb -0.04 -0.68 0.01 0.00 0.00 0.00 0.00 36.38 35.66 2jvk s VAL 51 CO -0.03 0.23 -0.20 -0.76 0.00 0.00 0.00 175.10 174.34 2jvk s LEU 52 N -0.09 2.18 -0.36 3.92 1.02 0.22 0.10 118.68 125.66 2jvk s LEU 52 Ca 0.02 -0.59 -0.00 0.00 0.02 0.00 0.00 54.13 53.57 2jvk s LEU 52 Cb -0.05 -1.47 0.10 0.00 0.02 0.00 0.00 46.19 44.78 2jvk s LEU 52 CO -0.00 0.07 0.11 -0.76 0.02 0.00 0.00 176.35 175.78 2jvk s LEU 53 N 0.91 4.80 -0.44 1.79 1.43 0.35 -0.73 118.68 126.78 2jvk s LEU 53 Ca -0.05 -1.93 -0.28 0.00 -1.03 0.00 0.00 54.13 50.85 2jvk s LEU 53 Cb -0.15 -1.73 -0.01 0.00 0.03 0.00 0.00 46.19 44.33 2jvk s LEU 53 CO -0.04 -0.43 1.67 -0.62 0.23 0.00 0.00 176.35 177.17 2jvk s ASP 54 N 1.40 5.89 0.00 2.29 2.15 -1.25 -0.95 116.67 126.19 2jvk s ASP 54 Ca 0.06 0.85 0.25 0.00 0.43 0.00 0.00 52.55 54.13 2jvk s ASP 54 Cb -0.21 -2.53 1.46 0.00 -0.30 0.00 0.00 42.92 41.33 2jvk s ASP 54 CO -0.05 -1.79 1.83 1.15 -0.17 0.00 0.00 175.17 176.13 2jvk n MET 55 N 8.55 0.75 0.00 4.34 0.00 0.93 -0.77 117.12 130.92 2jvk n MET 55 Ca 0.19 0.00 0.13 0.00 0.00 0.00 0.00 57.70 58.03 2jvk n MET 55 Cb 0.49 -1.50 0.37 0.00 0.00 0.00 0.00 33.22 32.57 2jvk n MET 55 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 2jvk n LYS 56 N -1.02 1.27 -1.59 3.17 3.00 -1.14 -4.55 118.16 117.31 2jvk n LYS 56 Ca 0.18 -0.81 -0.53 0.00 -0.00 0.00 0.00 58.31 57.15 2jvk n LYS 56 Cb 0.09 -1.48 -0.06 0.00 0.00 0.00 0.00 35.03 33.58 2jvk n LYS 56 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.40 178.91 2jvk n ILE 57 N -0.15 0.01 -0.45 3.15 0.13 0.05 -4.82 119.36 117.28 2jvk n ILE 57 Ca 0.14 -0.00 0.37 0.00 -1.10 0.00 0.00 62.75 62.16 2jvk n ILE 57 Cb 0.38 -0.76 0.61 0.00 -0.84 0.00 0.00 39.64 39.03 2jvk n ILE 57 CO 0.00 0.00 0.00 -2.65 2.80 0.00 0.00 176.55 176.70 2jvk n PRO 58 N 2.51 -0.03 -3.89 9.51 -0.01 -1.26 -3.88 135.00 137.95 2jvk n PRO 58 Ca 0.19 1.06 -0.30 0.00 -0.01 0.00 0.00 63.50 64.44 2jvk n PRO 58 Cb 0.18 -2.15 -0.15 0.00 -0.01 0.00 0.00 33.50 31.37 2jvk n PRO 58 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 175.50 175.69 2jvk s GLY 59 N -4.03 1.48 0.12 -1.23 0.00 -1.26 -5.06 107.32 97.34 2jvk s GLY 59 Ca -0.06 -2.00 0.00 0.00 0.00 0.00 0.00 44.72 42.66 2jvk s GLY 59 CO 0.72 1.22 0.00 1.15 0.00 0.00 0.00 173.10 176.20 2jvk n MET 60 N 4.56 -1.84 -1.64 2.90 0.00 -1.25 -4.57 117.12 115.28 2jvk n MET 60 Ca -0.01 1.32 -0.47 0.00 0.00 0.00 0.00 57.70 58.54 2jvk n MET 60 Cb 0.42 -1.78 -0.04 0.00 0.00 0.00 0.00 33.22 31.82 2jvk n MET 60 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 2jvk n ASP 61 N 0.81 2.35 -1.51 3.17 9.92 -1.26 -4.48 116.55 125.55 2jvk n ASP 61 Ca 0.00 1.13 -0.08 0.00 -0.53 0.00 0.00 54.79 55.30 2jvk n ASP 61 Cb 0.00 -1.35 0.04 0.00 -0.64 0.00 0.00 41.12 39.18 2jvk n ASP 61 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2jvk n GLY 62 N 2.46 3.02 0.39 0.44 0.00 -1.26 -4.51 105.19 105.73 2jvk n GLY 62 Ca 0.15 -0.45 -0.15 0.00 0.00 0.00 0.00 46.02 45.57 2jvk n GLY 62 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2jvk h ILE 63 N 0.57 0.00 0.00 -0.61 5.03 -1.93 -1.76 117.51 118.80 2jvk h ILE 63 Ca 0.18 -0.25 0.00 0.00 -0.12 0.00 0.00 64.86 64.67 2jvk h ILE 63 Cb 1.31 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 35.10 2jvk h ILE 63 CO 0.38 0.00 0.00 -0.62 -0.68 0.00 0.00 178.15 177.23 2jvk n GLU 64 N -5.27 0.03 -0.02 2.37 1.02 -1.26 -0.98 120.64 116.53 2jvk n GLU 64 Ca -0.12 0.23 -0.12 0.00 -0.02 0.00 0.00 57.16 57.13 2jvk n GLU 64 Cb 0.38 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 30.22 2jvk n GLU 64 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 2jvk h ILE 65 N 0.00 1.25 -0.20 -3.67 5.03 -1.74 0.12 117.51 118.29 2jvk h ILE 65 Ca 0.00 -0.77 -0.06 0.00 -0.12 0.00 0.00 64.86 63.91 2jvk h ILE 65 Cb 0.24 1.62 -0.01 0.00 -3.03 0.00 0.00 36.82 35.64 2jvk h ILE 65 CO 0.00 0.21 -0.14 0.00 -0.68 0.00 0.00 178.15 177.54 2jvk h ALA 66 N 0.73 1.40 0.13 1.87 0.00 -0.19 -0.34 119.26 122.87 2jvk h ALA 66 Ca 0.02 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.71 2jvk h ALA 66 Cb 0.33 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 2jvk h ALA 66 CO 0.00 0.41 -0.35 -0.22 0.00 0.00 0.00 179.25 179.09 2jvk h LYS 67 N 0.30 -0.57 -0.10 0.00 3.64 -0.93 0.92 116.57 119.84 2jvk h LYS 67 Ca 0.06 0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.42 2jvk h LYS 67 Cb 0.43 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.37 2jvk h LYS 67 CO 0.03 -0.38 -0.19 0.00 -2.27 0.00 0.00 179.45 176.64 2jvk h ARG 68 N -0.59 0.16 0.00 1.90 3.08 -0.61 0.31 114.38 118.64 2jvk h ARG 68 Ca 0.03 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2jvk h ARG 68 Cb 0.62 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.65 2jvk h ARG 68 CO -0.20 0.36 -0.17 -1.33 -1.07 0.00 0.00 179.97 177.56 2jvk n MET 69 N -4.24 0.12 0.05 0.04 2.81 -0.17 -0.53 117.12 115.19 2jvk n MET 69 Ca -0.01 0.07 0.11 0.00 -1.81 0.00 0.00 57.70 56.06 2jvk n MET 69 Cb 0.30 -1.61 0.02 0.00 -0.71 0.00 0.00 33.22 31.22 2jvk n MET 69 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 2jvk n LYS 70 N -1.80 0.40 0.13 0.03 2.85 0.32 -0.51 118.16 119.58 2jvk n LYS 70 Ca 0.06 0.02 -0.00 0.00 -1.05 0.00 0.00 58.31 57.34 2jvk n LYS 70 Cb 0.38 -1.66 0.13 0.00 -0.65 0.00 0.00 35.03 33.23 2jvk n LYS 70 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 2jvk h VAL 71 N 0.00 1.29 0.04 0.58 2.07 0.08 0.19 116.25 120.51 2jvk h VAL 71 Ca 0.00 -2.26 -0.30 0.00 0.82 0.00 0.00 66.70 64.96 2jvk h VAL 71 Cb 0.82 2.27 -0.04 0.00 -1.52 0.00 0.00 31.29 32.83 2jvk h VAL 71 CO 0.00 0.61 -1.68 -0.29 0.02 0.00 0.00 177.57 176.24 2jvk h ILE 72 N 0.00 0.92 0.00 4.57 6.09 -0.79 -3.43 117.51 124.86 2jvk h ILE 72 Ca -0.01 -2.71 0.00 0.00 -1.37 0.00 0.00 64.86 60.77 2jvk h ILE 72 Cb 1.22 2.51 0.00 0.00 0.47 0.00 0.00 36.82 41.02 2jvk h ILE 72 CO 0.08 0.64 0.00 -0.67 -3.07 0.00 0.00 178.15 175.13 2jvk n ASP 73 N -3.19 0.00 0.00 2.19 2.03 0.34 -5.03 116.55 112.88 2jvk n ASP 73 Ca -0.18 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.13 2jvk n ASP 73 Cb 1.04 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.44 2jvk n ASP 73 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 2jvk n GLU 74 N 0.00 0.00 -2.68 -0.67 2.13 0.67 -4.44 120.64 115.66 2jvk n GLU 74 Ca 0.00 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.78 2jvk n GLU 74 Cb 0.00 -1.06 0.05 0.00 0.27 0.00 0.00 31.44 30.70 2jvk n GLU 74 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 2jvk n ASN 75 N 0.44 -1.61 -0.96 4.31 0.23 -1.26 -3.23 115.26 113.17 2jvk n ASN 75 Ca 0.00 -1.50 -0.01 0.00 -0.53 0.00 0.00 54.58 52.54 2jvk n ASN 75 Cb 0.00 0.85 0.01 0.00 -2.08 0.00 0.00 39.78 38.56 2jvk n ASN 75 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2jvk n ILE 76 N 2.18 0.92 -3.21 1.53 0.00 -1.10 -4.79 119.36 114.89 2jvk n ILE 76 Ca 0.08 -0.06 -0.15 0.00 0.00 0.00 0.00 62.75 62.63 2jvk n ILE 76 Cb 0.66 -0.91 0.07 0.00 0.00 0.00 0.00 39.64 39.47 2jvk n ILE 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2jvk n ARG 77 N 0.38 -4.19 -2.73 9.51 5.12 -1.14 -3.29 116.66 120.33 2jvk n ARG 77 Ca 0.02 0.79 -0.41 0.00 -1.93 0.00 0.00 57.85 56.31 2jvk n ARG 77 Cb 0.50 -5.53 -0.04 0.00 -1.16 0.00 0.00 32.46 26.23 2jvk n ARG 77 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2jvk s VAL 78 N -3.34 4.62 -0.31 1.55 1.01 -1.09 -1.42 120.40 121.41 2jvk s VAL 78 Ca 0.20 2.06 0.01 0.00 0.00 0.00 0.00 61.98 64.25 2jvk s VAL 78 Cb -0.03 -4.32 0.07 0.00 0.00 0.00 0.00 36.38 32.11 2jvk s VAL 78 CO 0.67 0.27 0.01 -0.63 0.00 0.00 0.00 175.10 175.42 2jvk s ILE 79 N 0.31 2.59 -0.12 2.22 1.09 0.28 0.13 121.20 127.71 2jvk s ILE 79 Ca 0.48 -1.82 -0.13 0.00 -1.10 0.00 0.00 60.65 58.09 2jvk s ILE 79 Cb -0.23 -2.65 -0.05 0.00 -1.06 0.00 0.00 42.46 38.47 2jvk s ILE 79 CO 0.29 -0.30 0.29 -0.51 -0.10 0.00 0.00 174.94 174.61 2jvk s ILE 80 N 1.10 5.28 -0.03 2.92 2.07 -0.58 -0.50 121.20 131.45 2jvk s ILE 80 Ca -0.00 0.55 -0.00 0.00 -1.41 0.00 0.00 60.65 59.79 2jvk s ILE 80 Cb -0.20 -3.61 -0.04 0.00 0.13 0.00 0.00 42.46 38.75 2jvk s ILE 80 CO -0.05 0.48 0.01 -0.04 -1.91 0.00 0.00 174.94 173.43 2jvk s MET 81 N -0.16 2.90 0.43 3.50 -1.94 -0.13 0.87 119.30 124.77 2jvk s MET 81 Ca 0.18 -0.52 0.03 0.00 -1.71 0.00 0.00 55.69 53.68 2jvk s MET 81 Cb -0.14 -2.74 -0.01 0.00 2.01 0.00 0.00 34.83 33.95 2jvk s MET 81 CO 0.06 0.66 0.13 0.25 -0.01 0.00 0.00 175.02 176.10 2jvk n THR 82 N 1.65 0.00 -0.35 2.05 -2.24 -0.09 -0.05 114.28 115.25 2jvk n THR 82 Ca -0.16 -2.44 0.00 0.00 -2.27 0.00 0.00 64.05 59.18 2jvk n THR 82 Cb 0.53 0.81 0.00 0.00 -2.10 0.00 0.00 70.33 69.57 2jvk n THR 82 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jvk n ALA 83 N -1.07 3.54 0.00 6.98 0.00 -1.26 0.13 120.51 128.82 2jvk n ALA 83 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2jvk n ALA 83 Cb 0.63 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.93 2jvk n ALA 83 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2jvk n TYR 84 N 1.52 0.00 -1.84 0.00 9.36 -1.26 -3.99 117.16 120.96 2jvk n TYR 84 Ca 0.00 0.00 0.01 0.00 3.32 0.00 0.00 57.90 61.23 2jvk n TYR 84 Cb 0.42 -0.07 0.01 0.00 -0.63 0.00 0.00 39.34 39.07 2jvk n TYR 84 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2jvk n GLY 85 N -0.20 0.54 0.00 2.98 0.00 -1.26 -4.93 105.19 102.32 2jvk n GLY 85 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2jvk n GLY 85 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2jvk n GLU 86 N -0.11 0.00 -3.80 1.61 4.07 -1.26 -4.97 120.64 116.19 2jvk n GLU 86 Ca 0.01 0.18 -0.32 0.00 -0.06 0.00 0.00 57.16 56.98 2jvk n GLU 86 Cb 0.68 -0.82 0.02 0.00 -0.06 0.00 0.00 31.44 31.26 2jvk n GLU 86 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 2jvk n LEU 87 N -1.04 -1.99 0.00 4.31 4.32 -1.26 -4.96 117.00 116.39 2jvk n LEU 87 Ca 0.00 -1.01 0.00 0.00 -0.02 0.00 0.00 56.01 54.98 2jvk n LEU 87 Cb 0.00 -1.95 0.00 0.00 -1.62 0.00 0.00 43.42 39.85 2jvk n LEU 87 CO 0.00 0.42 0.00 -0.67 -1.22 0.00 0.00 177.39 175.92 2jvk n ASP 88 N -2.40 0.00 -1.39 -1.43 2.03 -1.26 -4.24 116.55 107.86 2jvk n ASP 88 Ca -0.17 0.20 0.00 0.00 0.52 0.00 0.00 54.79 55.35 2jvk n ASP 88 Cb 0.61 -0.21 0.21 0.00 -0.72 0.00 0.00 41.12 41.01 2jvk n ASP 88 CO 0.00 0.00 0.00 0.80 -1.92 0.00 0.00 177.20 176.08 2jvk n MET 89 N -1.13 2.93 -0.21 -0.67 1.56 -1.26 -4.45 117.12 113.89 2jvk n MET 89 Ca 0.00 -1.79 0.06 0.00 -0.27 0.00 0.00 57.70 55.69 2jvk n MET 89 Cb 0.00 -1.89 0.32 0.00 2.15 0.00 0.00 33.22 33.81 2jvk n MET 89 CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 2jvk h ILE 90 N 1.94 1.04 0.59 1.12 1.08 -1.96 -2.59 117.51 118.73 2jvk h ILE 90 Ca 0.08 -0.28 -0.03 0.00 -0.39 0.00 0.00 64.86 64.23 2jvk h ILE 90 Cb 1.51 0.15 0.01 0.00 -3.07 0.00 0.00 36.82 35.41 2jvk h ILE 90 CO 0.36 0.15 -0.29 1.56 -0.69 0.00 0.00 178.15 179.24 2jvk h GLN 91 N 0.82 -0.77 -0.48 2.37 1.08 -1.88 0.64 115.11 116.90 2jvk h GLN 91 Ca 0.32 0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.57 2jvk h GLN 91 Cb 0.22 0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 27.80 2jvk h GLN 91 CO -0.11 -0.49 0.29 1.05 -0.95 0.00 0.00 178.83 178.62 2jvk h GLU 92 N -0.85 0.65 -0.48 1.46 9.09 -1.91 -2.31 114.58 120.22 2jvk h GLU 92 Ca -0.08 -0.06 0.03 0.00 0.05 0.00 0.00 59.36 59.30 2jvk h GLU 92 Cb 0.63 -0.14 -0.04 0.00 -1.65 0.00 0.00 28.75 27.56 2jvk h GLU 92 CO 0.13 0.47 0.26 0.66 0.05 0.00 0.00 179.01 180.59 2jvk h SER 93 N 0.64 0.40 0.60 3.06 4.64 -1.18 -0.38 113.55 121.33 2jvk h SER 93 Ca 0.17 0.02 -0.08 0.00 -0.47 0.00 0.00 61.79 61.43 2jvk h SER 93 Cb -0.01 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.00 2jvk h SER 93 CO -0.03 0.28 -0.40 0.07 -0.87 0.00 0.00 176.83 175.88 2jvk h LYS 94 N 0.52 0.00 -0.17 4.77 2.10 -0.71 -1.48 116.57 121.60 2jvk h LYS 94 Ca 0.20 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.85 2jvk h LYS 94 Cb 0.07 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.40 2jvk h LYS 94 CO -0.12 0.40 0.00 -0.85 -2.00 0.00 0.00 179.45 176.87 2jvk n GLU 95 N -3.78 1.80 -2.46 0.07 0.28 -0.89 -3.99 120.64 111.68 2jvk n GLU 95 Ca -0.01 -1.20 -0.31 0.00 -0.16 0.00 0.00 57.16 55.48 2jvk n GLU 95 Cb 0.47 -1.41 0.00 0.00 1.43 0.00 0.00 31.44 31.93 2jvk n GLU 95 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2jvk n LEU 96 N 0.43 5.45 0.00 -1.84 4.32 -0.20 -4.83 117.00 120.33 2jvk n LEU 96 Ca 0.16 -5.24 0.00 0.00 -0.02 0.00 0.00 56.01 50.92 2jvk n LEU 96 Cb 0.36 -0.65 0.00 0.00 -1.62 0.00 0.00 43.42 41.50 2jvk n LEU 96 CO 0.13 2.15 0.00 0.61 -1.22 0.00 0.00 177.39 179.06 2jvk n GLY 97 N -0.42 0.93 3.74 -0.72 0.00 -1.20 -4.01 105.19 103.52 2jvk n GLY 97 Ca 0.41 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.03 2jvk n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jvk s ALA 98 N -2.70 3.35 0.08 4.61 0.00 -1.23 -2.66 121.76 123.21 2jvk s ALA 98 Ca 0.00 0.35 -0.23 0.00 0.00 0.00 0.00 51.96 52.07 2jvk s ALA 98 Cb 0.00 -3.05 -0.15 0.00 0.00 0.00 0.00 23.12 19.92 2jvk s ALA 98 CO 0.00 0.06 1.70 -0.07 0.00 0.00 0.00 175.76 177.45 2jvk h LEU 99 N 5.55 0.01 -7.87 0.00 3.38 0.88 -3.43 115.31 113.83 2jvk h LEU 99 Ca -0.44 -0.04 0.27 0.00 0.09 0.00 0.00 57.88 57.76 2jvk h LEU 99 Cb 1.21 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.89 2jvk h LEU 99 CO 0.71 0.05 0.76 0.28 0.09 0.00 0.00 178.44 180.33 2jvk s THR 100 N -6.02 0.00 0.13 0.22 -1.32 -0.64 -5.00 115.64 103.01 2jvk s THR 100 Ca -0.13 -0.35 0.02 0.00 -1.21 0.00 0.00 61.69 60.02 2jvk s THR 100 Cb 0.06 -2.80 -0.04 0.00 -1.51 0.00 0.00 72.50 68.21 2jvk s THR 100 CO 0.66 0.00 0.27 -1.38 -2.21 0.00 0.00 174.62 171.96 2jvk s HIS 101 N -2.16 3.49 0.00 9.09 -3.43 -1.26 -1.53 115.29 119.50 2jvk s HIS 101 Ca 0.24 0.14 0.00 0.00 -0.80 0.00 0.00 55.06 54.65 2jvk s HIS 101 Cb -0.01 -1.68 0.00 0.00 -1.43 0.00 0.00 32.58 29.46 2jvk s HIS 101 CO 0.01 0.53 0.00 0.34 -2.00 0.00 0.00 174.74 173.62 2jvk n PHE 102 N -0.39 0.00 -3.92 0.38 -0.00 0.25 -4.84 117.46 108.95 2jvk n PHE 102 Ca -0.07 0.00 -0.13 0.00 -0.00 0.00 0.00 57.45 57.25 2jvk n PHE 102 Cb 0.53 0.00 -0.14 0.00 -0.00 0.00 0.00 39.48 39.87 2jvk n PHE 102 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2jvk s ALA 103 N -2.00 0.10 0.25 3.13 0.00 -1.26 -0.92 121.76 121.07 2jvk s ALA 103 Ca 0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 51.96 51.92 2jvk s ALA 103 Cb 0.00 -0.06 0.43 0.00 0.00 0.00 0.00 23.12 23.48 2jvk s ALA 103 CO 0.00 0.01 1.81 -0.22 0.00 0.00 0.00 175.76 177.36 2jvk h LYS 104 N 6.29 0.80 -0.02 0.00 1.63 0.80 -2.61 116.57 123.46 2jvk h LYS 104 Ca -0.28 -0.05 0.01 0.00 -0.85 0.00 0.00 60.65 59.48 2jvk h LYS 104 Cb 1.19 -0.18 -0.02 0.00 -0.60 0.00 0.00 32.23 32.63 2jvk h LYS 104 CO 0.50 0.53 -0.14 -1.00 -3.45 0.00 0.00 179.45 175.89 2jvk h PRO 105 N 0.83 -0.16 0.00 1.90 0.13 -1.92 -3.48 132.00 129.30 2jvk h PRO 105 Ca 0.42 0.01 0.10 0.00 -0.87 0.00 0.00 66.00 65.65 2jvk h PRO 105 Cb 0.39 0.04 -0.02 0.00 0.13 0.00 0.00 31.00 31.53 2jvk h PRO 105 CO -0.25 -0.11 -0.13 1.97 -0.23 0.00 0.00 178.00 179.25 2jvk n PHE 106 N -3.31 -2.30 -4.50 1.56 1.16 -0.98 -4.92 117.46 104.17 2jvk n PHE 106 Ca -0.02 0.45 -0.21 0.00 -1.87 0.00 0.00 57.45 55.80 2jvk n PHE 106 Cb 0.10 -0.82 -0.15 0.00 -1.61 0.00 0.00 39.48 37.00 2jvk n PHE 106 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 2jvk s ASP 107 N -3.01 1.40 0.02 5.98 1.01 -1.26 -5.07 116.67 115.73 2jvk s ASP 107 Ca 0.00 -0.22 -0.26 0.00 0.71 0.00 0.00 52.55 52.78 2jvk s ASP 107 Cb 0.00 -0.28 -0.17 0.00 1.01 0.00 0.00 42.92 43.48 2jvk s ASP 107 CO 0.00 0.11 1.30 0.40 0.21 0.00 0.00 175.17 177.19 2jvk h ILE 108 N 5.14 0.55 -0.45 0.77 2.04 -1.99 0.30 117.51 123.88 2jvk h ILE 108 Ca -0.33 -0.43 0.09 0.00 1.00 0.00 0.00 64.86 65.19 2jvk h ILE 108 Cb 1.17 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.97 2jvk h ILE 108 CO 0.49 0.07 0.31 -0.78 0.00 0.00 0.00 178.15 178.24 2jvk h ASP 109 N -0.82 0.18 1.36 1.72 3.58 -1.99 0.13 116.42 120.58 2jvk h ASP 109 Ca -0.06 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.28 2jvk h ASP 109 Cb 0.54 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.54 2jvk h ASP 109 CO 0.09 0.11 -0.65 -0.08 -2.88 0.00 0.00 179.24 175.83 2jvk h GLU 110 N 0.20 0.00 -0.12 0.28 4.81 -1.90 -1.37 114.58 116.49 2jvk h GLU 110 Ca 0.21 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.27 2jvk h GLU 110 Cb 0.55 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.94 2jvk h GLU 110 CO -0.04 0.49 -0.57 0.97 -0.73 0.00 0.00 179.01 179.13 2jvk h ILE 111 N 0.00 1.34 -0.27 2.32 6.09 0.16 0.16 117.51 127.31 2jvk h ILE 111 Ca -0.03 -1.86 -0.19 0.00 -1.37 0.00 0.00 64.86 61.41 2jvk h ILE 111 Cb 1.42 2.14 0.00 0.00 0.47 0.00 0.00 36.82 40.86 2jvk h ILE 111 CO 0.06 0.57 -0.59 0.08 -3.07 0.00 0.00 178.15 175.21 2jvk h ARG 112 N 0.23 0.87 -0.19 2.19 0.11 -1.41 -2.08 114.38 114.10 2jvk h ARG 112 Ca -0.04 -0.58 -0.01 0.00 0.10 0.00 0.00 59.98 59.45 2jvk h ARG 112 Cb 1.22 0.08 -0.01 0.00 1.11 0.00 0.00 29.97 32.37 2jvk h ARG 112 CO 0.12 1.21 0.07 0.22 0.10 0.00 0.00 179.97 181.69 2jvk h ASP 113 N 0.66 0.27 0.30 0.08 3.58 -1.24 -1.33 116.42 118.74 2jvk h ASP 113 Ca 0.00 -0.18 -0.01 0.00 0.42 0.00 0.00 57.03 57.26 2jvk h ASP 113 Cb 1.20 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 42.18 2jvk h ASP 113 CO 0.13 0.38 -0.15 0.00 -2.88 0.00 0.00 179.24 176.72 2jvk h ALA 114 N 0.90 -0.41 0.00 -0.78 0.00 -0.69 -2.63 119.26 115.65 2jvk h ALA 114 Ca 0.06 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2jvk h ALA 114 Cb 0.20 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2jvk h ALA 114 CO -0.00 -0.73 -0.19 -0.39 0.00 0.00 0.00 179.25 177.93 2jvk h VAL 115 N -0.41 0.66 -0.11 0.00 -1.51 -1.33 -0.29 116.25 113.25 2jvk h VAL 115 Ca -0.04 -0.85 -0.11 0.00 -1.23 0.00 0.00 66.70 64.48 2jvk h VAL 115 Cb 0.32 1.54 -0.01 0.00 -2.13 0.00 0.00 31.29 31.01 2jvk h VAL 115 CO 0.06 0.19 -0.40 0.07 -1.23 0.00 0.00 177.57 176.26 2jvk h LYS 116 N 0.00 0.25 0.00 5.19 2.10 -1.02 0.37 116.57 123.46 2jvk h LYS 116 Ca -0.00 -0.12 -0.02 0.00 -2.00 0.00 0.00 60.65 58.51 2jvk h LYS 116 Cb 0.52 -0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.85 2jvk h LYS 116 CO 0.03 0.62 -0.16 0.87 -2.00 0.00 0.00 179.45 178.80 2jvk h LYS 117 N 0.21 0.00 0.00 0.07 1.79 -0.82 -3.24 116.57 114.58 2jvk h LYS 117 Ca 0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2jvk h LYS 117 Cb 0.81 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.46 2jvk h LYS 117 CO 0.06 0.08 -0.39 0.66 -1.08 0.00 0.00 179.45 178.78 2jvk n TYR 118 N -3.09 0.63 -3.42 -1.35 4.02 -0.26 -4.70 117.16 109.00 2jvk n TYR 118 Ca 0.03 0.28 -0.44 0.00 -0.01 0.00 0.00 57.90 57.76 2jvk n TYR 118 Cb 0.57 -0.61 -0.05 0.00 -0.02 0.00 0.00 39.34 39.22 2jvk n TYR 118 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 2jvk s LEU 119 N -7.19 6.18 -0.12 7.72 0.20 0.13 -5.06 118.68 120.55 2jvk s LEU 119 Ca -0.11 -2.26 -0.16 0.00 0.69 0.00 0.00 54.13 52.29 2jvk s LEU 119 Cb 0.02 -2.13 -0.05 0.00 -0.43 0.00 0.00 46.19 43.60 2jvk s LEU 119 CO 0.17 -0.67 0.39 -2.16 -0.29 0.00 0.00 176.35 173.79 2jvk s PRO 120 N 0.85 4.23 0.00 0.98 0.05 -1.22 -4.31 135.00 135.58 2jvk s PRO 120 Ca 0.10 0.30 0.00 0.00 0.05 0.00 0.00 61.00 61.46 2jvk s PRO 120 Cb -0.21 -3.40 0.00 0.00 0.05 0.00 0.00 34.50 30.94 2jvk s PRO 120 CO -0.03 0.28 0.00 1.47 0.05 0.00 0.00 177.00 178.77 2jvk n LEU 121 N 3.34 0.00 -3.75 -3.56 -0.00 -1.26 -5.12 117.00 106.64 2jvk n LEU 121 Ca -0.10 0.00 0.01 0.00 -0.00 0.00 0.00 56.01 55.92 2jvk n LEU 121 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 2jvk n LEU 121 CO 0.41 0.00 1.03 -1.59 -0.00 0.00 0.00 177.39 177.24 2jvk s LYS 122 N -1.00 0.52 -0.03 1.47 0.00 -1.26 -5.19 119.74 114.26 2jvk s LYS 122 Ca 0.00 -0.31 -0.30 0.00 0.00 0.00 0.00 55.97 55.36 2jvk s LYS 122 Cb 0.00 0.16 0.12 0.00 0.00 0.00 0.00 37.83 38.12 2jvk s LYS 122 CO 0.00 -0.24 1.31 -1.54 0.00 0.00 0.00 175.35 174.88 2jvk s SER 123 N -3.24 -0.05 -0.99 0.03 1.04 -1.23 -4.86 113.70 104.40 2jvk s SER 123 Ca 0.19 -0.13 -0.00 0.00 0.48 0.00 0.00 55.95 56.49 2jvk s SER 123 Cb 0.02 0.14 0.32 0.00 0.10 0.00 0.00 66.02 66.61 2jvk s SER 123 CO -0.02 -0.26 1.74 -3.20 0.98 0.00 0.00 173.24 172.48 2jvk n ASN 124 N -0.54 7.08 -4.50 7.02 5.15 -1.25 -4.95 115.26 123.27 2jvk n ASN 124 Ca -0.08 -3.69 -0.42 0.00 -0.60 0.00 0.00 54.58 49.79 2jvk n ASN 124 Cb 0.63 -1.11 -0.03 0.00 -0.53 0.00 0.00 39.78 38.73 2jvk n ASN 124 CO 0.00 0.00 0.00 -1.48 1.40 0.00 0.00 177.26 177.18 2jvk s LEU 125 N -4.25 3.87 -0.09 1.20 2.34 -1.26 -4.85 118.68 115.64 2jvk s LEU 125 Ca 0.40 -0.69 -0.26 0.00 0.06 0.00 0.00 54.13 53.64 2jvk s LEU 125 Cb 0.20 -2.54 -0.28 0.00 -0.56 0.00 0.00 46.19 43.01 2jvk s LEU 125 CO -0.13 -1.57 0.86 -0.08 -1.06 0.00 0.00 176.35 174.37 2jvk h GLU 126 N 9.71 0.14 0.00 1.48 4.57 -2.03 -3.34 114.58 125.10 2jvk h GLU 126 Ca -0.28 -0.22 -0.17 0.00 -1.18 0.00 0.00 59.36 57.52 2jvk h GLU 126 Cb 1.06 0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 29.71 2jvk h GLU 126 CO 1.21 1.08 -0.79 1.12 -1.18 0.00 0.00 179.01 180.45 2jvk h HIS 127 N -0.69 0.00 0.00 0.92 2.07 -2.04 -3.47 115.15 111.94 2jvk h HIS 127 Ca -0.06 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.46 2jvk h HIS 127 Cb 1.24 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.22 2jvk h HIS 127 CO 0.23 0.79 0.00 1.58 -3.07 0.00 0.00 177.93 177.46 2jvk n HIS 128 N -3.40 0.00 -4.03 6.12 -0.00 -1.26 -4.59 115.22 108.07 2jvk n HIS 128 Ca 0.00 0.00 -0.13 0.00 0.46 0.00 0.00 57.72 58.05 2jvk n HIS 128 Cb 0.82 0.00 -0.13 0.00 -0.12 0.00 0.00 29.99 30.55 2jvk n HIS 128 CO 0.00 0.00 0.00 -3.38 0.46 0.00 0.00 176.34 173.42 2jvk s HIS 129 N 0.00 0.33 0.02 1.57 -3.43 -1.26 -5.11 115.29 107.41 2jvk s HIS 129 Ca 0.00 -0.18 -0.24 0.00 -0.80 0.00 0.00 55.06 53.84 2jvk s HIS 129 Cb 0.00 -0.21 -0.05 0.00 -1.43 0.00 0.00 32.58 30.89 2jvk s HIS 129 CO 0.00 -0.04 0.72 -1.58 -2.00 0.00 0.00 174.74 171.84 2jvk s HIS 130 N -0.45 3.71 0.00 0.38 2.46 -1.26 -4.86 115.29 115.26 2jvk s HIS 130 Ca -0.03 1.39 0.00 0.00 0.47 0.00 0.00 55.06 56.89 2jvk s HIS 130 Cb -0.04 -2.77 0.00 0.00 -0.13 0.00 0.00 32.58 29.64 2jvk s HIS 130 CO -0.00 0.27 0.00 0.72 -2.47 0.00 0.00 174.74 173.26 2jvk n HIS 131 N 2.90 -1.53 0.13 3.88 8.25 -1.26 -5.27 115.22 122.32 2jvk n HIS 131 Ca -0.03 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.44 2jvk n HIS 131 Cb 0.50 0.22 0.01 0.00 1.12 0.00 0.00 29.99 31.85 2jvk n HIS 131 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70