#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 0.00 -2.72 3.17 0.00 -1.26 -4.98 117.12 111.34 2jvk n MET 2 Ca 0.00 0.19 -0.04 0.00 -0.00 0.00 0.00 57.70 57.85 2jvk n MET 2 Cb 0.00 -0.64 0.03 0.00 0.00 0.00 0.00 33.22 32.61 2jvk n MET 2 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 175.97 174.26 2jvk n ASN 3 N -2.01 -2.42 -4.57 6.12 5.15 -1.26 -5.08 115.26 111.20 2jvk n ASN 3 Ca 0.00 -2.16 -0.34 0.00 -0.60 0.00 0.00 54.58 51.47 2jvk n ASN 3 Cb 0.00 1.29 -0.04 0.00 -0.53 0.00 0.00 39.78 40.50 2jvk n ASN 3 CO 0.00 0.00 0.00 -1.83 1.40 0.00 0.00 177.26 176.83 2jvk s GLU 4 N 0.78 3.11 0.27 1.20 1.03 -1.26 -3.34 118.70 120.49 2jvk s GLU 4 Ca 0.28 -0.97 0.10 0.00 0.03 0.00 0.00 54.97 54.41 2jvk s GLU 4 Cb 0.11 -5.26 -0.05 0.00 -0.80 0.00 0.00 34.13 28.13 2jvk s GLU 4 CO -0.10 -2.91 -0.08 0.21 -1.33 0.00 0.00 175.26 171.04 2jvk s LYS 5 N 5.82 2.06 -0.05 -4.83 2.20 -1.26 -4.45 119.74 119.23 2jvk s LYS 5 Ca 0.59 -1.54 0.06 0.00 -0.36 0.00 0.00 55.97 54.72 2jvk s LYS 5 Cb -0.02 -2.01 -0.01 0.00 -1.51 0.00 0.00 37.83 34.28 2jvk s LYS 5 CO -0.00 0.35 -0.23 0.42 -0.36 0.00 0.00 175.35 175.53 2jvk s ILE 6 N -2.37 1.89 -0.07 5.43 1.01 0.12 0.25 121.20 127.47 2jvk s ILE 6 Ca 0.31 -0.99 -0.01 0.00 0.00 0.00 0.00 60.65 59.96 2jvk s ILE 6 Cb -0.06 -1.60 -0.03 0.00 0.01 0.00 0.00 42.46 40.78 2jvk s ILE 6 CO 0.18 0.53 -0.00 -0.76 0.00 0.00 0.00 174.94 174.88 2jvk s LEU 7 N -0.22 3.53 -0.21 2.97 1.43 0.06 0.36 118.68 126.59 2jvk s LEU 7 Ca -0.00 0.10 -0.02 0.00 -1.03 0.00 0.00 54.13 53.18 2jvk s LEU 7 Cb -0.12 -1.85 0.06 0.00 0.03 0.00 0.00 46.19 44.31 2jvk s LEU 7 CO 0.02 0.36 0.00 -0.63 0.23 0.00 0.00 176.35 176.33 2jvk s ILE 8 N -0.92 0.89 -0.45 -0.59 1.01 0.59 0.67 121.20 122.40 2jvk s ILE 8 Ca 0.14 -0.81 -0.21 0.00 0.00 0.00 0.00 60.65 59.77 2jvk s ILE 8 Cb -0.11 -1.31 0.03 0.00 0.01 0.00 0.00 42.46 41.07 2jvk s ILE 8 CO 0.04 -0.18 0.69 -0.69 0.00 0.00 0.00 174.94 174.80 2jvk s VAL 9 N 1.69 4.77 -0.05 2.92 1.01 -0.10 -0.43 120.40 130.21 2jvk s VAL 9 Ca -0.03 0.18 -0.09 0.00 0.00 0.00 0.00 61.98 62.04 2jvk s VAL 9 Cb -0.18 -4.25 0.02 0.00 0.00 0.00 0.00 36.38 31.97 2jvk s VAL 9 CO -0.07 -0.65 0.23 -0.62 0.00 0.00 0.00 175.10 173.99 2jvk s ASP 10 N 2.07 -0.17 -0.04 3.32 2.15 0.30 -2.95 116.67 121.34 2jvk s ASP 10 Ca 0.24 0.23 0.20 0.00 0.43 0.00 0.00 52.55 53.65 2jvk s ASP 10 Cb -0.14 0.39 -0.24 0.00 -0.30 0.00 0.00 42.92 42.63 2jvk s ASP 10 CO 0.20 -0.23 0.47 -0.67 -0.17 0.00 0.00 175.17 174.77 2jvk n ASP 11 N 2.22 0.25 0.12 -0.34 2.03 -1.26 -3.60 116.55 115.97 2jvk n ASP 11 Ca -0.17 0.11 0.12 0.00 0.52 0.00 0.00 54.79 55.37 2jvk n ASP 11 Cb 0.57 1.19 0.47 0.00 -0.72 0.00 0.00 41.12 42.62 2jvk n ASP 11 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jvk n GLN 12 N -2.57 0.22 0.00 -0.67 1.13 -1.26 -4.87 117.38 109.35 2jvk n GLN 12 Ca -0.14 0.36 0.00 0.00 -1.94 0.00 0.00 57.00 55.28 2jvk n GLN 12 Cb 0.81 -1.85 0.00 0.00 0.11 0.00 0.00 30.24 29.30 2jvk n GLN 12 CO 0.00 0.00 0.00 0.98 -1.44 0.00 0.00 177.06 176.60 2jvk n TYR 13 N -2.24 0.00 -0.07 1.08 9.36 -1.26 -4.58 117.16 119.45 2jvk n TYR 13 Ca 0.03 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.11 2jvk n TYR 13 Cb 0.29 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 38.98 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 0.91 0.97 2.98 0.00 -1.94 -2.15 103.07 103.84 2jvk h GLY 14 Ca 0.00 -1.07 -0.02 0.00 0.00 0.00 0.00 47.33 46.24 2jvk h GLY 14 CO 0.00 0.96 0.23 -2.22 0.00 0.00 0.00 176.54 175.51 2jvk h ILE 15 N 0.64 1.20 -0.48 2.60 1.08 -1.96 0.34 117.51 120.93 2jvk h ILE 15 Ca 0.01 -0.56 0.01 0.00 -0.39 0.00 0.00 64.86 63.93 2jvk h ILE 15 Cb 1.15 0.66 -0.03 0.00 -3.07 0.00 0.00 36.82 35.53 2jvk h ILE 15 CO 0.12 0.22 0.30 0.08 -0.69 0.00 0.00 178.15 178.18 2jvk h ARG 16 N 0.65 0.58 -0.67 2.37 0.11 -1.87 -1.54 114.38 114.02 2jvk h ARG 16 Ca 0.17 -0.04 -0.02 0.00 0.10 0.00 0.00 59.98 60.19 2jvk h ARG 16 Cb 0.13 -0.13 -0.03 0.00 1.11 0.00 0.00 29.97 31.05 2jvk h ARG 16 CO -0.02 0.39 0.32 0.82 0.10 0.00 0.00 179.97 181.58 2jvk h ILE 17 N 0.60 1.22 -0.45 0.08 1.08 -0.78 0.38 117.51 119.64 2jvk h ILE 17 Ca 0.18 -0.61 0.05 0.00 -0.39 0.00 0.00 64.86 64.10 2jvk h ILE 17 Cb -0.03 0.36 -0.04 0.00 -3.07 0.00 0.00 36.82 34.04 2jvk h ILE 17 CO -0.06 0.25 0.20 -0.07 -0.69 0.00 0.00 178.15 177.78 2jvk h LEU 18 N 0.94 0.25 -0.20 1.44 3.38 0.61 0.46 115.31 122.20 2jvk h LEU 18 Ca 0.23 0.04 -0.22 0.00 0.09 0.00 0.00 57.88 58.02 2jvk h LEU 18 Cb 0.10 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 2jvk h LEU 18 CO -0.03 0.18 -0.93 -0.07 0.09 0.00 0.00 178.44 177.68 2jvk h LEU 19 N 0.40 0.39 0.05 1.67 3.38 -1.00 -2.08 115.31 118.12 2jvk h LEU 19 Ca 0.21 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 57.86 2jvk h LEU 19 Cb 0.16 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2jvk h LEU 19 CO -0.18 1.13 -0.10 0.78 0.09 0.00 0.00 178.44 180.16 2jvk h ASN 20 N 0.16 -0.29 0.78 -0.43 2.35 0.63 0.40 115.58 119.18 2jvk h ASN 20 Ca -0.07 0.04 -0.15 0.00 -0.55 0.00 0.00 56.30 55.57 2jvk h ASN 20 Cb 1.58 0.11 -0.02 0.00 0.05 0.00 0.00 38.32 40.04 2jvk h ASN 20 CO 0.15 -0.16 -0.70 1.05 -1.65 0.00 0.00 177.43 176.13 2jvk h GLU 21 N -0.20 0.00 0.12 0.81 4.11 -0.14 -1.34 114.58 117.94 2jvk h GLU 21 Ca 0.02 0.00 -0.32 0.00 0.07 0.00 0.00 59.36 59.13 2jvk h GLU 21 Cb 0.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2jvk h GLU 21 CO -0.07 0.70 -1.68 0.28 0.07 0.00 0.00 179.01 178.32 2jvk h VAL 22 N 0.00 0.98 0.12 -1.06 2.07 -1.23 0.13 116.25 117.26 2jvk h VAL 22 Ca -0.01 -2.65 -0.01 0.00 0.82 0.00 0.00 66.70 64.86 2jvk h VAL 22 Cb 1.28 2.68 0.00 0.00 -1.52 0.00 0.00 31.29 33.73 2jvk h VAL 22 CO 0.09 0.81 -0.06 -0.26 0.02 0.00 0.00 177.57 178.17 2jvk h PHE 23 N 0.07 -0.14 0.00 1.57 0.04 -0.26 -2.18 116.94 116.05 2jvk h PHE 23 Ca -0.30 -0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.44 2jvk h PHE 23 Cb 2.04 0.05 -0.00 0.00 2.20 0.00 0.00 35.95 40.23 2jvk h PHE 23 CO 0.07 0.04 -0.11 -0.91 -0.60 0.00 0.00 178.31 176.79 2jvk h ASN 24 N -0.30 0.00 0.21 2.17 -0.26 -1.32 0.11 115.58 116.18 2jvk h ASN 24 Ca -0.02 0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.68 2jvk h ASN 24 Cb 0.24 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.50 2jvk h ASN 24 CO 0.03 0.11 -0.22 0.07 -1.06 0.00 0.00 177.43 176.36 2jvk h LYS 25 N 0.00 0.01 -0.17 0.81 2.10 -0.32 0.33 116.57 119.33 2jvk h LYS 25 Ca -0.00 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2jvk h LYS 25 Cb 0.23 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.56 2jvk h LYS 25 CO 0.01 0.23 0.00 0.39 -2.00 0.00 0.00 179.45 178.08 2jvk n GLU 26 N -4.28 1.42 -0.31 0.07 -0.58 0.26 -4.82 120.64 112.40 2jvk n GLU 26 Ca -0.02 -0.65 0.00 0.00 -0.42 0.00 0.00 57.16 56.07 2jvk n GLU 26 Cb 0.28 -1.18 0.00 0.00 -0.57 0.00 0.00 31.44 29.97 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 0.82 0.81 1.24 0.62 0.00 0.11 -1.08 105.19 107.72 2jvk n GLY 27 Ca 0.08 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.25 -3.65 -4.11 1.61 4.02 -0.53 -4.92 117.16 107.33 2jvk n TYR 28 Ca 0.00 -0.46 -0.19 0.00 -0.01 0.00 0.00 57.90 57.24 2jvk n TYR 28 Cb 0.00 -0.29 -0.16 0.00 -0.02 0.00 0.00 39.34 38.87 2jvk n TYR 28 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 176.86 176.99 2jvk s GLN 29 N -3.62 0.65 0.21 -0.72 -2.07 -1.26 -4.27 119.66 108.58 2jvk s GLN 29 Ca 0.23 -0.07 0.06 0.00 -1.82 0.00 0.00 55.36 53.76 2jvk s GLN 29 Cb -0.01 -0.69 -0.05 0.00 -1.09 0.00 0.00 33.01 31.17 2jvk s GLN 29 CO 0.16 -0.07 -0.10 0.95 -1.32 0.00 0.00 175.29 174.91 2jvk s THR 30 N 0.79 1.53 0.30 3.63 -4.23 -1.26 0.12 115.64 116.53 2jvk s THR 30 Ca -0.10 -2.15 0.02 0.00 -1.18 0.00 0.00 61.69 58.29 2jvk s THR 30 Cb -0.13 -2.12 -0.02 0.00 1.34 0.00 0.00 72.50 71.56 2jvk s THR 30 CO -0.00 -0.53 0.30 -0.36 -0.54 0.00 0.00 174.62 173.48 2jvk s PHE 31 N -3.10 1.40 0.15 3.99 0.40 0.16 -4.89 117.98 116.09 2jvk s PHE 31 Ca 0.23 -1.47 -0.08 0.00 -0.60 0.00 0.00 56.93 55.01 2jvk s PHE 31 Cb 0.02 -0.49 -0.01 0.00 0.51 0.00 0.00 43.02 43.04 2jvk s PHE 31 CO 0.07 -0.88 0.26 1.14 0.70 0.00 0.00 175.22 176.50 2jvk s GLN 32 N -3.55 1.11 -0.17 0.44 -2.07 -1.26 -0.30 119.66 113.86 2jvk s GLN 32 Ca 0.37 -1.17 -0.23 0.00 -1.82 0.00 0.00 55.36 52.51 2jvk s GLN 32 Cb 0.03 0.36 0.06 0.00 -1.09 0.00 0.00 33.01 32.37 2jvk s GLN 32 CO 0.22 -0.39 0.61 0.00 -1.32 0.00 0.00 175.29 174.41 2jvk s ALA 33 N -3.96 -1.54 -0.45 2.60 0.00 0.42 -4.57 121.76 114.26 2jvk s ALA 33 Ca 0.16 1.55 0.04 0.00 0.00 0.00 0.00 51.96 53.72 2jvk s ALA 33 Cb 0.04 -0.70 0.53 0.00 0.00 0.00 0.00 23.12 22.99 2jvk s ALA 33 CO -0.01 -0.31 1.73 0.00 0.00 0.00 0.00 175.76 177.17 2jvk n ALA 34 N 2.20 5.38 0.00 0.00 0.00 -1.24 0.11 120.51 126.97 2jvk n ALA 34 Ca -0.16 -3.26 0.00 0.00 0.00 0.00 0.00 53.44 50.02 2jvk n ALA 34 Cb 0.56 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.82 2jvk n ALA 34 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2jvk n ASN 35 N -1.02 0.00 0.00 0.00 4.05 -1.26 -4.69 115.26 112.34 2jvk n ASN 35 Ca 0.51 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.54 2jvk n ASN 35 Cb 1.11 0.14 0.00 0.00 1.23 0.00 0.00 39.78 42.26 2jvk n ASN 35 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2jvk n GLY 36 N -1.27 3.34 0.31 8.20 0.00 -1.26 -3.85 105.19 110.65 2jvk n GLY 36 Ca 0.00 -0.94 0.13 0.00 0.00 0.00 0.00 46.02 45.22 2jvk n GLY 36 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2jvk h LEU 37 N 0.00 0.00 0.00 0.99 3.38 -1.93 0.46 115.31 118.21 2jvk h LEU 37 Ca 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 2jvk h LEU 37 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2jvk h LEU 37 CO 0.00 0.00 -0.58 1.56 0.09 0.00 0.00 178.44 179.51 2jvk h GLN 38 N 0.00 0.00 -0.33 1.13 1.08 -1.95 -2.60 115.11 112.44 2jvk h GLN 38 Ca 0.00 0.00 0.09 0.00 -1.45 0.00 0.00 58.65 57.29 2jvk h GLN 38 Cb 0.69 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.11 2jvk h GLN 38 CO 0.00 0.49 0.26 0.00 -0.95 0.00 0.00 178.83 178.63 2jvk h ALA 39 N -0.67 2.19 0.33 3.87 0.00 -1.63 -0.83 119.26 122.52 2jvk h ALA 39 Ca -0.11 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2jvk h ALA 39 Cb 0.76 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2jvk h ALA 39 CO -0.07 -0.43 -0.16 1.25 0.00 0.00 0.00 179.25 179.85 2jvk h LEU 40 N 0.00 -0.37 -1.08 0.00 6.46 -0.13 0.56 115.31 120.75 2jvk h LEU 40 Ca 0.15 0.00 0.08 0.00 -0.12 0.00 0.00 57.88 58.00 2jvk h LEU 40 Cb 0.68 0.10 -0.07 0.00 -0.73 0.00 0.00 40.66 40.63 2jvk h LEU 40 CO -0.00 -0.25 0.62 -0.78 -0.62 0.00 0.00 178.44 177.41 2jvk h ASP 41 N -0.46 0.95 0.68 1.25 3.58 -0.84 0.43 116.42 122.01 2jvk h ASP 41 Ca -0.04 0.02 -0.11 0.00 0.42 0.00 0.00 57.03 57.31 2jvk h ASP 41 Cb 0.35 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.20 2jvk h ASP 41 CO 0.07 0.58 -0.53 0.40 -2.88 0.00 0.00 179.24 176.88 2jvk h ILE 42 N 1.06 1.25 -0.19 2.25 2.04 -0.60 0.10 117.51 123.42 2jvk h ILE 42 Ca 0.43 -1.89 -0.11 0.00 1.00 0.00 0.00 64.86 64.29 2jvk h ILE 42 Cb 0.28 2.06 -0.00 0.00 -0.74 0.00 0.00 36.82 38.41 2jvk h ILE 42 CO -0.18 0.52 -0.30 0.58 0.00 0.00 0.00 178.15 178.77 2jvk h VAL 43 N 0.00 1.34 -0.38 1.67 2.07 0.13 0.69 116.25 121.77 2jvk h VAL 43 Ca -0.01 -1.51 -0.01 0.00 0.82 0.00 0.00 66.70 65.99 2jvk h VAL 43 Cb 1.01 1.84 -0.02 0.00 -1.52 0.00 0.00 31.29 32.61 2jvk h VAL 43 CO 0.07 0.46 0.19 0.74 0.02 0.00 0.00 177.57 179.05 2jvk h THR 44 N 0.21 1.13 0.01 2.57 2.02 -0.66 0.40 112.91 118.59 2jvk h THR 44 Ca 0.02 -0.36 -0.33 0.00 0.77 0.00 0.00 66.41 66.51 2jvk h THR 44 Cb 0.88 0.64 -0.06 0.00 -1.74 0.00 0.00 68.15 67.87 2jvk h THR 44 CO 0.07 0.15 -2.05 2.29 0.37 0.00 0.00 175.52 176.35 2jvk n LYS 45 N -4.42 0.67 -0.07 6.66 2.85 0.34 -4.62 118.16 119.56 2jvk n LYS 45 Ca 0.02 0.17 -0.09 0.00 -1.05 0.00 0.00 58.31 57.36 2jvk n LYS 45 Cb 0.11 -1.66 -0.08 0.00 -0.65 0.00 0.00 35.03 32.75 2jvk n LYS 45 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2jvk n GLU 46 N -2.98 0.96 -3.28 -1.58 -0.58 0.24 -5.05 120.64 108.36 2jvk n GLU 46 Ca -0.26 0.06 -0.09 0.00 -0.42 0.00 0.00 57.16 56.44 2jvk n GLU 46 Cb 1.09 -1.30 0.00 0.00 -0.57 0.00 0.00 31.44 30.66 2jvk n GLU 46 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2jvk n ARG 47 N -2.77 -1.47 -0.56 3.49 3.00 0.14 -5.01 116.66 113.49 2jvk n ARG 47 Ca -0.24 1.31 -0.30 0.00 -0.01 0.00 0.00 57.85 58.61 2jvk n ARG 47 Cb 0.82 -4.62 0.27 0.00 0.00 0.00 0.00 32.46 28.94 2jvk n ARG 47 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2jvk s PRO 48 N -3.54 -2.40 0.00 5.56 0.04 -1.26 -4.87 135.00 128.53 2jvk s PRO 48 Ca 0.03 0.13 0.03 0.00 0.04 0.00 0.00 61.00 61.22 2jvk s PRO 48 Cb -0.01 -1.44 0.06 0.00 0.04 0.00 0.00 34.50 33.15 2jvk s PRO 48 CO 0.80 -4.53 0.87 -3.47 0.04 0.00 0.00 177.00 170.71 2jvk n ASP 49 N -5.38 1.83 -3.64 6.66 -0.08 -0.05 -4.77 116.55 111.12 2jvk n ASP 49 Ca 0.12 -1.64 -0.13 0.00 -1.51 0.00 0.00 54.79 51.63 2jvk n ASP 49 Cb 0.59 -0.04 -0.07 0.00 2.34 0.00 0.00 41.12 43.95 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 -0.69 -0.75 0.01 -2.67 0.20 0.14 -4.73 118.68 110.20 2jvk s LEU 50 Ca 0.05 1.44 0.03 0.00 0.69 0.00 0.00 54.13 56.34 2jvk s LEU 50 Cb 0.03 2.41 -0.01 0.00 -0.43 0.00 0.00 46.19 48.19 2jvk s LEU 50 CO 0.04 -0.24 -0.11 -0.69 -0.29 0.00 0.00 176.35 175.06 2jvk s VAL 51 N 0.62 0.83 -0.06 1.68 1.01 0.19 -0.76 120.40 123.91 2jvk s VAL 51 Ca -0.02 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.32 2jvk s VAL 51 Cb -0.05 -0.74 0.00 0.00 0.00 0.00 0.00 36.38 35.59 2jvk s VAL 51 CO -0.03 0.07 -0.17 -0.76 0.00 0.00 0.00 175.10 174.21 2jvk s LEU 52 N -0.69 1.85 -0.25 3.92 1.02 0.21 0.11 118.68 124.84 2jvk s LEU 52 Ca 0.01 -0.38 0.02 0.00 0.02 0.00 0.00 54.13 53.81 2jvk s LEU 52 Cb -0.06 -1.01 0.05 0.00 0.02 0.00 0.00 46.19 45.20 2jvk s LEU 52 CO 0.00 0.11 -0.11 -0.76 0.02 0.00 0.00 176.35 175.61 2jvk s LEU 53 N 0.34 3.33 -0.62 1.79 1.43 0.11 -0.92 118.68 124.13 2jvk s LEU 53 Ca -0.11 -1.30 -0.26 0.00 -1.03 0.00 0.00 54.13 51.43 2jvk s LEU 53 Cb -0.15 -1.56 0.04 0.00 0.03 0.00 0.00 46.19 44.56 2jvk s LEU 53 CO 0.04 -0.17 1.11 -0.62 0.23 0.00 0.00 176.35 176.94 2jvk s ASP 54 N 1.14 6.31 0.00 2.29 2.15 -1.15 -0.80 116.67 126.61 2jvk s ASP 54 Ca -0.07 -0.31 0.19 0.00 0.43 0.00 0.00 52.55 52.79 2jvk s ASP 54 Cb -0.19 -2.50 1.13 0.00 -0.30 0.00 0.00 42.92 41.06 2jvk s ASP 54 CO -0.06 -1.49 1.71 1.15 -0.17 0.00 0.00 175.17 176.31 2jvk n MET 55 N 8.28 0.97 0.00 4.34 0.00 -0.18 -1.14 117.12 129.40 2jvk n MET 55 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 57.70 57.86 2jvk n MET 55 Cb 0.48 -1.30 0.19 0.00 0.00 0.00 0.00 33.22 32.58 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 -0.80 1.10 -1.63 3.17 3.00 -1.21 -4.65 118.16 117.14 2jvk n LYS 56 Ca 0.14 -0.81 -0.45 0.00 -0.00 0.00 0.00 58.31 57.20 2jvk n LYS 56 Cb 0.07 -1.48 -0.02 0.00 0.00 0.00 0.00 35.03 33.59 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 -0.24 1.59 0.04 3.15 3.06 -0.29 -4.82 119.36 121.84 2jvk n ILE 57 Ca 0.11 -0.40 0.02 0.00 -2.50 0.00 0.00 62.75 59.98 2jvk n ILE 57 Cb 0.42 -1.19 0.09 0.00 0.54 0.00 0.00 39.64 39.49 2jvk n ILE 57 CO 0.00 0.00 0.00 -2.65 -2.50 0.00 0.00 176.55 171.40 2jvk n PRO 58 N 1.14 0.02 0.00 9.51 -0.02 -1.26 -4.37 135.00 140.02 2jvk n PRO 58 Ca 0.10 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2jvk n PRO 58 Cb 0.31 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 2jvk n PRO 58 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jvk n GLY 59 N -1.31 0.56 3.61 -1.23 0.00 -1.26 -5.08 105.19 100.47 2jvk n GLY 59 Ca -0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 2jvk n GLY 59 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2jvk s MET 60 N 2.83 2.02 0.71 1.61 -1.94 -1.26 -5.06 119.30 118.20 2jvk s MET 60 Ca 0.00 -1.79 -0.15 0.00 -1.71 0.00 0.00 55.69 52.05 2jvk s MET 60 Cb 0.00 -1.88 0.03 0.00 2.01 0.00 0.00 34.83 34.99 2jvk s MET 60 CO 0.00 0.14 1.15 0.16 -0.01 0.00 0.00 175.02 176.46 2jvk s ASP 61 N -3.69 4.59 -0.45 3.03 1.47 -1.26 -4.73 116.67 115.63 2jvk s ASP 61 Ca 0.34 2.15 0.04 0.00 1.18 0.00 0.00 52.55 56.26 2jvk s ASP 61 Cb 0.00 -2.57 0.64 0.00 -0.34 0.00 0.00 42.92 40.66 2jvk s ASP 61 CO 0.19 -1.99 1.91 0.61 0.68 0.00 0.00 175.17 176.57 2jvk n GLY 62 N -0.12 4.53 0.16 2.12 0.00 -1.25 -4.66 105.19 105.97 2jvk n GLY 62 Ca 0.12 -1.14 -0.11 0.00 0.00 0.00 0.00 46.02 44.88 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 0.98 0.72 0.00 -0.61 1.08 -1.92 0.30 117.51 118.06 2jvk h ILE 63 Ca 0.63 -0.94 0.00 0.00 -0.39 0.00 0.00 64.86 64.16 2jvk h ILE 63 Cb 2.72 1.17 0.00 0.00 -3.07 0.00 0.00 36.82 37.63 2jvk h ILE 63 CO 1.12 0.17 0.11 -0.33 -0.69 0.00 0.00 178.15 178.52 2jvk h GLU 64 N -0.86 0.00 -0.01 2.37 4.39 -1.96 0.16 114.58 118.67 2jvk h GLU 64 Ca -0.03 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 2jvk h GLU 64 Cb 0.51 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 2jvk h GLU 64 CO 0.05 0.00 -0.06 0.82 -1.16 0.00 0.00 179.01 178.66 2jvk h ILE 65 N 0.00 1.55 0.00 3.13 1.08 -1.62 -0.02 117.51 121.62 2jvk h ILE 65 Ca 0.00 -1.69 -0.02 0.00 -0.39 0.00 0.00 64.86 62.76 2jvk h ILE 65 Cb 0.21 2.66 -0.00 0.00 -3.07 0.00 0.00 36.82 36.62 2jvk h ILE 65 CO 0.00 0.45 -0.09 0.00 -0.69 0.00 0.00 178.15 177.82 2jvk h ALA 66 N 0.31 1.19 -0.37 1.87 0.00 0.57 0.64 119.26 123.47 2jvk h ALA 66 Ca -0.01 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 2jvk h ALA 66 Cb 0.76 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2jvk h ALA 66 CO 0.01 0.11 -0.01 -0.22 0.00 0.00 0.00 179.25 179.15 2jvk h LYS 67 N 0.00 0.65 0.00 0.00 1.63 -0.58 0.73 116.57 119.00 2jvk h LYS 67 Ca -0.00 -0.21 -0.05 0.00 -0.85 0.00 0.00 60.65 59.54 2jvk h LYS 67 Cb 0.33 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.90 2jvk h LYS 67 CO 0.01 0.76 -0.25 0.00 -3.45 0.00 0.00 179.45 176.52 2jvk h ARG 68 N 0.47 0.00 -0.01 1.90 3.08 0.15 -0.92 114.38 119.05 2jvk h ARG 68 Ca 0.10 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.00 2jvk h ARG 68 Cb 0.47 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.50 2jvk h ARG 68 CO 0.02 0.22 -0.71 0.52 -1.07 0.00 0.00 179.97 178.95 2jvk h MET 69 N 0.00 0.06 0.00 0.04 2.86 0.40 0.28 114.93 118.57 2jvk h MET 69 Ca -0.00 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.51 2jvk h MET 69 Cb 1.17 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.83 2jvk h MET 69 CO 0.03 0.74 -0.37 1.57 1.06 0.00 0.00 176.91 179.94 2jvk h LYS 70 N 0.04 0.00 0.00 1.72 2.10 0.86 0.66 116.57 121.95 2jvk h LYS 70 Ca -0.01 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.51 2jvk h LYS 70 Cb 1.26 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.57 2jvk h LYS 70 CO 0.10 0.37 -0.61 0.28 -2.00 0.00 0.00 179.45 177.59 2jvk h VAL 71 N 0.00 1.19 0.00 0.07 2.07 -0.88 0.55 116.25 119.25 2jvk h VAL 71 Ca -0.00 -2.28 -0.14 0.00 0.82 0.00 0.00 66.70 65.10 2jvk h VAL 71 Cb 1.08 2.32 -0.02 0.00 -1.52 0.00 0.00 31.29 33.15 2jvk h VAL 71 CO 0.05 0.59 -1.43 0.00 0.02 0.00 0.00 177.57 176.80 2jvk n ILE 72 N -3.46 1.04 -0.39 4.57 0.13 0.97 -4.71 119.36 117.51 2jvk n ILE 72 Ca 0.00 -0.67 0.00 0.00 -1.10 0.00 0.00 62.75 60.99 2jvk n ILE 72 Cb 0.69 -0.62 0.00 0.00 -0.84 0.00 0.00 39.64 38.87 2jvk n ILE 72 CO 0.00 0.00 0.00 -0.67 2.80 0.00 0.00 176.55 178.68 2jvk n ASP 73 N -2.81 0.00 0.00 9.51 -0.08 0.22 -5.04 116.55 118.35 2jvk n ASP 73 Ca -0.09 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.19 2jvk n ASP 73 Cb 0.79 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.25 2jvk n ASP 73 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 2jvk n GLU 74 N 0.00 0.00 -2.98 -0.67 2.13 0.19 -4.40 120.64 114.91 2jvk n GLU 74 Ca 0.00 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.57 2jvk n GLU 74 Cb 0.00 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 31.67 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 3.46 3.80 -0.96 4.31 0.23 -1.26 -3.59 115.26 121.25 2jvk n ASN 75 Ca 0.00 -3.56 0.00 0.00 -0.53 0.00 0.00 54.58 50.49 2jvk n ASN 75 Cb 0.00 -0.57 0.00 0.00 -2.08 0.00 0.00 39.78 37.13 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 -0.15 0.59 -3.18 1.53 0.00 -1.26 -4.71 119.36 112.17 2jvk n ILE 76 Ca 0.30 0.00 -0.15 0.00 0.00 0.00 0.00 62.75 62.90 2jvk n ILE 76 Cb 0.44 -0.78 0.06 0.00 0.00 0.00 0.00 39.64 39.37 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 0.64 -5.40 -2.62 9.51 5.12 -1.26 -3.68 116.66 118.97 2jvk n ARG 77 Ca 0.00 0.62 -0.41 0.00 -1.93 0.00 0.00 57.85 56.13 2jvk n ARG 77 Cb 0.31 -4.99 -0.05 0.00 -1.16 0.00 0.00 32.46 26.57 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 -3.25 4.01 -0.23 1.55 1.01 -1.25 -0.64 120.40 121.60 2jvk s VAL 78 Ca 0.22 1.84 0.01 0.00 0.00 0.00 0.00 61.98 64.04 2jvk s VAL 78 Cb -0.09 -4.17 0.06 0.00 0.00 0.00 0.00 36.38 32.17 2jvk s VAL 78 CO 0.54 0.36 -0.06 -0.63 0.00 0.00 0.00 175.10 175.31 2jvk s ILE 79 N -0.58 1.58 -0.19 2.22 1.09 0.29 0.96 121.20 126.56 2jvk s ILE 79 Ca 0.46 -1.23 -0.10 0.00 -1.10 0.00 0.00 60.65 58.68 2jvk s ILE 79 Cb -0.27 -1.82 -0.05 0.00 -1.06 0.00 0.00 42.46 39.26 2jvk s ILE 79 CO 0.34 -0.08 0.13 -0.51 -0.10 0.00 0.00 174.94 174.72 2jvk s ILE 80 N 1.38 5.40 -0.09 2.92 2.07 -0.88 -0.72 121.20 131.29 2jvk s ILE 80 Ca -0.06 0.19 -0.02 0.00 -1.41 0.00 0.00 60.65 59.34 2jvk s ILE 80 Cb -0.19 -3.46 -0.03 0.00 0.13 0.00 0.00 42.46 38.91 2jvk s ILE 80 CO -0.06 0.45 0.02 0.00 -1.91 0.00 0.00 174.94 173.44 2jvk s MET 81 N 0.28 3.03 0.21 3.50 0.00 0.02 0.89 119.30 127.23 2jvk s MET 81 Ca 0.08 -0.38 0.00 0.00 0.00 0.00 0.00 55.69 55.40 2jvk s MET 81 Cb -0.11 -2.84 -0.00 0.00 0.00 0.00 0.00 34.83 31.88 2jvk s MET 81 CO -0.02 0.71 0.01 0.25 0.00 0.00 0.00 175.02 175.98 2jvk n THR 82 N 2.10 0.00 0.35 3.16 -2.24 -0.46 -1.01 114.28 116.19 2jvk n THR 82 Ca -0.19 -1.01 0.00 0.00 -2.27 0.00 0.00 64.05 60.58 2jvk n THR 82 Cb 0.54 0.23 0.00 0.00 -2.10 0.00 0.00 70.33 69.00 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 -2.29 2.71 0.00 6.98 0.00 -1.26 1.00 120.51 127.64 2jvk n ALA 83 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2jvk n ALA 83 Cb 0.27 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.64 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 0.97 0.00 -1.73 0.00 9.36 -1.26 -4.17 117.16 120.32 2jvk n TYR 84 Ca 0.00 0.00 0.05 0.00 3.32 0.00 0.00 57.90 61.27 2jvk n TYR 84 Cb 0.39 0.00 0.08 0.00 -0.63 0.00 0.00 39.34 39.18 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 0.00 2.62 0.00 2.98 0.00 -1.26 -4.87 105.19 104.66 2jvk n GLY 85 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.33 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 -0.53 0.00 -2.82 1.61 4.07 -1.26 -4.96 120.64 116.75 2jvk n GLU 86 Ca 0.09 0.17 -0.21 0.00 -0.06 0.00 0.00 57.16 57.15 2jvk n GLU 86 Cb 0.75 -0.59 0.01 0.00 -0.06 0.00 0.00 31.44 31.56 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 -1.43 -2.09 -4.63 4.31 4.32 -1.26 -4.92 117.00 111.29 2jvk n LEU 87 Ca 0.00 -0.16 -0.43 0.00 -0.02 0.00 0.00 56.01 55.40 2jvk n LEU 87 Cb 0.00 -2.72 -0.03 0.00 -1.62 0.00 0.00 43.42 39.06 2jvk n LEU 87 CO 0.00 0.05 1.35 -1.81 -1.22 0.00 0.00 177.39 175.75 2jvk s ASP 88 N -2.43 6.44 -0.55 -1.43 1.01 -1.26 -2.56 116.67 115.89 2jvk s ASP 88 Ca 0.19 1.66 0.00 0.00 0.71 0.00 0.00 52.55 55.11 2jvk s ASP 88 Cb -0.09 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.31 2jvk s ASP 88 CO 0.24 -1.20 0.00 0.80 0.21 0.00 0.00 175.17 175.22 2jvk n MET 89 N 7.55 -1.14 -0.07 8.23 0.00 -1.26 -4.85 117.12 125.58 2jvk n MET 89 Ca 0.18 0.57 0.06 0.00 0.00 0.00 0.00 57.70 58.51 2jvk n MET 89 Cb 0.45 -4.57 0.41 0.00 0.00 0.00 0.00 33.22 29.52 2jvk n MET 89 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 175.97 176.79 2jvk h ILE 90 N 0.00 1.05 0.24 1.12 1.08 -1.89 -2.30 117.51 116.81 2jvk h ILE 90 Ca -0.11 -0.20 -0.01 0.00 -0.39 0.00 0.00 64.86 64.15 2jvk h ILE 90 Cb 0.73 0.40 0.00 0.00 -3.07 0.00 0.00 36.82 34.88 2jvk h ILE 90 CO 0.15 0.11 -0.11 1.56 -0.69 0.00 0.00 178.15 179.17 2jvk h GLN 91 N 0.60 -0.30 -0.56 2.37 4.20 -1.89 0.88 115.11 120.41 2jvk h GLN 91 Ca 0.22 0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.91 2jvk h GLN 91 Cb 0.12 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.95 2jvk h GLN 91 CO -0.06 -0.05 0.20 1.05 -0.67 0.00 0.00 178.83 179.30 2jvk h GLU 92 N -0.53 0.85 -0.47 1.46 9.09 -1.97 -1.55 114.58 121.45 2jvk h GLU 92 Ca -0.03 -0.17 0.09 0.00 0.05 0.00 0.00 59.36 59.30 2jvk h GLU 92 Cb 0.40 -0.13 -0.07 0.00 -1.65 0.00 0.00 28.75 27.29 2jvk h GLU 92 CO 0.05 0.76 0.04 1.03 0.05 0.00 0.00 179.01 180.94 2jvk h SER 93 N 0.77 -0.12 -0.09 3.06 0.87 -1.09 0.68 113.55 117.63 2jvk h SER 93 Ca 0.18 0.10 -0.21 0.00 -1.23 0.00 0.00 61.79 60.63 2jvk h SER 93 Cb 0.24 0.17 0.01 0.00 -0.44 0.00 0.00 62.40 62.38 2jvk h SER 93 CO -0.01 -0.03 -0.77 0.07 -0.53 0.00 0.00 176.83 175.56 2jvk h LYS 94 N 0.16 0.69 0.00 2.24 2.10 -0.71 -3.28 116.57 117.77 2jvk h LYS 94 Ca 0.24 -0.62 -0.06 0.00 -2.00 0.00 0.00 60.65 58.21 2jvk h LYS 94 Cb 0.34 0.14 -0.01 0.00 -0.90 0.00 0.00 32.23 31.81 2jvk h LYS 94 CO -0.36 1.22 -0.27 1.05 -2.00 0.00 0.00 179.45 179.09 2jvk h GLU 95 N 0.37 0.00 -0.48 0.07 4.11 -1.03 -3.22 114.58 114.41 2jvk h GLU 95 Ca -0.07 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.31 2jvk h GLU 95 Cb 1.42 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.65 2jvk h GLU 95 CO 0.16 0.27 0.09 -0.07 0.07 0.00 0.00 179.01 179.53 2jvk h LEU 96 N 0.00 0.69 0.00 3.06 4.07 -0.92 -3.44 115.31 118.76 2jvk h LEU 96 Ca -0.00 -0.12 0.00 0.00 0.08 0.00 0.00 57.88 57.83 2jvk h LEU 96 Cb 1.00 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 42.56 2jvk h LEU 96 CO 0.04 0.70 0.00 0.61 -1.08 0.00 0.00 178.44 178.71 2jvk n GLY 97 N -0.87 0.04 3.60 0.83 0.00 -1.23 -4.69 105.19 102.88 2jvk n GLY 97 Ca 0.03 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.58 2jvk n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jvk n ALA 98 N 0.00 -0.27 -0.27 4.61 0.00 -1.22 -4.12 120.51 119.24 2jvk n ALA 98 Ca 0.00 0.43 -0.05 0.00 0.00 0.00 0.00 53.44 53.82 2jvk n ALA 98 Cb 0.00 -2.07 0.06 0.00 0.00 0.00 0.00 19.45 17.44 2jvk n ALA 98 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2jvk h LEU 99 N 3.10 0.89 0.00 0.00 3.38 0.37 -3.44 115.31 119.61 2jvk h LEU 99 Ca -0.42 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2jvk h LEU 99 Cb 1.33 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2jvk h LEU 99 CO 0.68 0.68 0.00 1.07 0.09 0.00 0.00 178.44 180.97 2jvk n THR 100 N -4.52 0.00 -4.24 0.22 5.66 -0.61 -5.02 114.28 105.78 2jvk n THR 100 Ca 0.07 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.93 2jvk n THR 100 Cb 0.05 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 68.73 2jvk n THR 100 CO 0.00 0.00 0.00 -1.38 -3.05 0.00 0.00 175.07 170.64 2jvk s HIS 101 N -2.62 1.19 0.00 1.09 -3.43 -1.26 -2.06 115.29 108.20 2jvk s HIS 101 Ca 0.00 -0.85 0.00 0.00 -0.80 0.00 0.00 55.06 53.41 2jvk s HIS 101 Cb 0.00 -0.64 0.00 0.00 -1.43 0.00 0.00 32.58 30.51 2jvk s HIS 101 CO 0.00 -0.02 0.00 0.34 -2.00 0.00 0.00 174.74 173.06 2jvk n PHE 102 N -0.18 0.00 -3.80 0.38 7.35 0.26 -4.80 117.46 116.66 2jvk n PHE 102 Ca -0.10 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.46 2jvk n PHE 102 Cb 0.61 0.00 -0.14 0.00 0.35 0.00 0.00 39.48 40.31 2jvk n PHE 102 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2jvk s ALA 103 N -2.00 -0.23 0.30 3.13 0.00 -1.26 -1.35 121.76 120.35 2jvk s ALA 103 Ca 0.00 0.42 0.03 0.00 0.00 0.00 0.00 51.96 52.41 2jvk s ALA 103 Cb 0.00 -0.27 0.62 0.00 0.00 0.00 0.00 23.12 23.47 2jvk s ALA 103 CO 0.00 -0.09 1.83 -0.22 0.00 0.00 0.00 175.76 177.29 2jvk h LYS 104 N 6.50 0.90 0.00 0.00 1.63 0.40 0.33 116.57 126.33 2jvk h LYS 104 Ca -0.32 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.42 2jvk h LYS 104 Cb 1.18 -0.20 0.00 0.00 -0.60 0.00 0.00 32.23 32.60 2jvk h LYS 104 CO 0.44 0.59 0.00 -0.35 -3.45 0.00 0.00 179.45 176.68 2jvk n PRO 105 N -4.63 0.00 -1.05 1.90 -0.04 -1.26 -4.88 135.00 125.04 2jvk n PRO 105 Ca 0.19 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.30 2jvk n PRO 105 Cb 0.40 -1.44 0.07 0.00 -0.04 0.00 0.00 33.50 32.49 2jvk n PRO 105 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2jvk n PHE 106 N -0.90 -2.70 -2.99 0.54 1.16 0.11 -4.99 117.46 107.70 2jvk n PHE 106 Ca 0.00 0.21 -0.40 0.00 -1.87 0.00 0.00 57.45 55.39 2jvk n PHE 106 Cb 0.00 -1.69 -0.04 0.00 -1.61 0.00 0.00 39.48 36.13 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 -1.40 7.02 0.20 5.98 1.11 -1.26 -4.98 116.67 123.34 2jvk s ASP 107 Ca 0.54 1.23 -0.11 0.00 0.18 0.00 0.00 52.55 54.39 2jvk s ASP 107 Cb -0.28 -2.43 0.15 0.00 1.07 0.00 0.00 42.92 41.43 2jvk s ASP 107 CO 0.70 -0.16 1.85 0.40 1.18 0.00 0.00 175.17 179.13 2jvk h ILE 108 N 4.81 1.11 -0.77 0.77 2.04 -1.98 -0.46 117.51 123.04 2jvk h ILE 108 Ca -0.40 -0.28 0.06 0.00 1.00 0.00 0.00 64.86 65.24 2jvk h ILE 108 Cb 1.19 0.21 -0.05 0.00 -0.74 0.00 0.00 36.82 37.44 2jvk h ILE 108 CO 0.76 0.15 0.50 -0.78 0.00 0.00 0.00 178.15 178.78 2jvk h ASP 109 N 0.83 0.72 1.30 1.72 3.58 -1.99 0.61 116.42 123.19 2jvk h ASP 109 Ca 0.26 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.71 2jvk h ASP 109 Cb -0.02 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 40.88 2jvk h ASP 109 CO -0.09 0.47 -0.15 1.21 -2.88 0.00 0.00 179.24 177.80 2jvk n GLU 110 N -4.48 0.25 0.01 0.28 2.13 -0.44 -1.26 120.64 117.12 2jvk n GLU 110 Ca 0.11 0.17 -0.18 0.00 0.66 0.00 0.00 57.16 57.93 2jvk n GLU 110 Cb 0.22 -1.76 -0.14 0.00 0.27 0.00 0.00 31.44 30.03 2jvk n GLU 110 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 2jvk h ILE 111 N 0.00 1.60 -0.44 6.31 1.08 0.59 0.27 117.51 126.92 2jvk h ILE 111 Ca 0.00 -2.47 -0.06 0.00 -0.39 0.00 0.00 64.86 61.94 2jvk h ILE 111 Cb 0.72 3.26 -0.02 0.00 -3.07 0.00 0.00 36.82 37.72 2jvk h ILE 111 CO 0.00 0.68 0.03 0.08 -0.69 0.00 0.00 178.15 178.25 2jvk h ARG 112 N -0.59 0.69 -0.02 2.37 0.11 -1.19 -1.94 114.38 113.81 2jvk h ARG 112 Ca -0.10 -0.16 -0.00 0.00 0.10 0.00 0.00 59.98 59.82 2jvk h ARG 112 Cb 1.42 -0.09 -0.00 0.00 1.11 0.00 0.00 29.97 32.41 2jvk h ARG 112 CO 0.10 0.68 0.00 0.22 0.10 0.00 0.00 179.97 181.07 2jvk h ASP 113 N 0.66 0.03 -0.52 0.08 3.58 -1.21 -1.40 116.42 117.64 2jvk h ASP 113 Ca 0.14 -0.23 0.03 0.00 0.42 0.00 0.00 57.03 57.39 2jvk h ASP 113 Cb 0.36 -0.01 -0.04 0.00 1.72 0.00 0.00 39.33 41.37 2jvk h ASP 113 CO 0.01 0.25 0.30 0.00 -2.88 0.00 0.00 179.24 176.92 2jvk h ALA 114 N 0.78 0.67 0.00 -0.78 0.00 -0.26 -0.69 119.26 118.98 2jvk h ALA 114 Ca 0.01 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 2jvk h ALA 114 Cb 0.23 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2jvk h ALA 114 CO 0.00 -0.01 -0.56 -0.39 0.00 0.00 0.00 179.25 178.29 2jvk h VAL 115 N 0.59 1.25 0.00 0.00 -1.51 -1.36 -2.28 116.25 112.94 2jvk h VAL 115 Ca 0.22 -2.02 -0.06 0.00 -1.23 0.00 0.00 66.70 63.61 2jvk h VAL 115 Cb 0.06 2.13 -0.01 0.00 -2.13 0.00 0.00 31.29 31.34 2jvk h VAL 115 CO -0.11 0.55 -0.28 0.07 -1.23 0.00 0.00 177.57 176.56 2jvk h LYS 116 N 0.00 0.00 0.00 5.19 2.10 -0.54 0.65 116.57 123.97 2jvk h LYS 116 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 2jvk h LYS 116 Cb 1.09 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.42 2jvk h LYS 116 CO 0.07 0.28 0.00 0.87 -2.00 0.00 0.00 179.45 178.67 2jvk h LYS 117 N 0.00 0.00 0.00 0.07 1.79 -0.75 -3.31 116.57 114.38 2jvk h LYS 117 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2jvk h LYS 117 Cb 0.93 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.58 2jvk h LYS 117 CO 0.04 0.00 0.00 0.66 -1.08 0.00 0.00 179.45 179.07 2jvk n TYR 118 N -2.65 0.00 -3.45 -1.35 4.02 -0.89 -4.81 117.16 108.03 2jvk n TYR 118 Ca 0.04 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.50 2jvk n TYR 118 Cb 0.45 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.71 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 -4.47 6.06 0.20 7.72 1.98 0.22 -5.07 118.68 125.32 2jvk s LEU 119 Ca 0.00 -2.23 0.04 0.00 -2.89 0.00 0.00 54.13 49.05 2jvk s LEU 119 Cb 0.00 -2.10 -0.03 0.00 0.66 0.00 0.00 46.19 44.72 2jvk s LEU 119 CO 0.00 -0.66 0.31 -2.16 -1.89 0.00 0.00 176.35 171.95 2jvk s PRO 120 N 0.89 3.38 0.00 0.98 0.04 -1.25 -4.16 135.00 134.88 2jvk s PRO 120 Ca 0.10 -0.71 0.00 0.00 0.04 0.00 0.00 61.00 60.43 2jvk s PRO 120 Cb -0.22 -2.89 0.00 0.00 0.04 0.00 0.00 34.50 31.43 2jvk s PRO 120 CO -0.02 0.47 0.00 1.47 0.04 0.00 0.00 177.00 178.96 2jvk n LEU 121 N -0.97 0.00 0.00 -3.56 -0.00 -1.26 -5.07 117.00 106.14 2jvk n LEU 121 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.93 2jvk n LEU 121 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.98 2jvk n LEU 121 CO 0.46 0.00 0.00 2.29 -0.00 0.00 0.00 177.39 180.14 2jvk n LYS 122 N 0.00 0.00 -0.41 1.47 2.85 -1.26 -5.13 118.16 115.68 2jvk n LYS 122 Ca 0.00 0.00 0.06 0.00 -1.05 0.00 0.00 58.31 57.32 2jvk n LYS 122 Cb 0.00 0.00 -0.01 0.00 -0.65 0.00 0.00 35.03 34.37 2jvk n LYS 122 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 2jvk n SER 123 N -0.64 -6.28 0.07 -5.58 7.64 -0.24 -3.45 113.62 105.14 2jvk n SER 123 Ca 0.00 0.44 0.09 0.00 1.01 0.00 0.00 58.87 60.41 2jvk n SER 123 Cb 0.00 -1.24 0.39 0.00 -1.01 0.00 0.00 64.21 62.35 2jvk n SER 123 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2jvk n ASN 124 N -3.09 0.35 -3.02 6.43 0.23 -1.26 -4.85 115.26 110.05 2jvk n ASN 124 Ca 0.00 0.59 -0.17 0.00 -0.53 0.00 0.00 54.58 54.47 2jvk n ASN 124 Cb 0.19 -0.66 0.07 0.00 -2.08 0.00 0.00 39.78 37.29 2jvk n ASN 124 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 2jvk n LEU 125 N -1.89 -3.37 -4.61 -4.53 7.94 -1.22 -4.92 117.00 104.39 2jvk n LEU 125 Ca 0.02 -0.47 -0.43 0.00 -1.11 0.00 0.00 56.01 54.03 2jvk n LEU 125 Cb 0.18 -2.61 -0.03 0.00 0.53 0.00 0.00 43.42 41.49 2jvk n LEU 125 CO 0.15 0.44 1.76 -0.70 -1.11 0.00 0.00 177.39 177.94 2jvk s GLU 126 N -5.67 3.36 -1.03 1.96 2.56 -1.26 -4.87 118.70 113.75 2jvk s GLU 126 Ca 0.28 2.09 -0.23 0.00 0.00 0.00 0.00 54.97 57.11 2jvk s GLU 126 Cb -0.12 -4.31 0.03 0.00 2.00 0.00 0.00 34.13 31.73 2jvk s GLU 126 CO 0.60 -1.84 1.57 -3.38 -0.56 0.00 0.00 175.26 171.65 2jvk s HIS 127 N 7.37 2.41 0.00 5.30 -3.43 -1.26 -4.70 115.29 120.98 2jvk s HIS 127 Ca 0.96 -0.62 0.00 0.00 -0.80 0.00 0.00 55.06 54.60 2jvk s HIS 127 Cb -0.34 -4.57 0.00 0.00 -1.43 0.00 0.00 32.58 26.24 2jvk s HIS 127 CO 0.36 -1.88 0.00 0.72 -2.00 0.00 0.00 174.74 171.94 2jvk n HIS 128 N 9.87 0.00 0.00 0.38 8.25 -1.26 -5.17 115.22 127.29 2jvk n HIS 128 Ca 0.36 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.82 2jvk n HIS 128 Cb 0.50 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.61 2jvk n HIS 128 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2jvk n HIS 129 N 0.00 0.00 -2.01 4.41 -0.00 -1.26 -5.07 115.22 111.29 2jvk n HIS 129 Ca 0.00 0.00 -0.29 0.00 0.46 0.00 0.00 57.72 57.89 2jvk n HIS 129 Cb 0.00 0.00 -0.05 0.00 -0.12 0.00 0.00 29.99 29.82 2jvk n HIS 129 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2jvk s HIS 130 N -0.59 1.72 0.35 1.57 2.46 -1.26 -4.94 115.29 114.61 2jvk s HIS 130 Ca 0.00 0.76 0.08 0.00 0.47 0.00 0.00 55.06 56.37 2jvk s HIS 130 Cb 0.00 -4.02 -0.05 0.00 -0.13 0.00 0.00 32.58 28.38 2jvk s HIS 130 CO 0.00 -1.91 0.07 -3.38 -2.47 0.00 0.00 174.74 167.05 2jvk s HIS 131 N 10.08 2.59 -2.40 3.88 -3.43 -1.26 -5.17 115.29 119.58 2jvk s HIS 131 Ca 0.71 -0.46 0.19 0.00 -0.80 0.00 0.00 55.06 54.70 2jvk s HIS 131 Cb -0.09 -1.61 0.15 0.00 -1.43 0.00 0.00 32.58 29.61 2jvk s HIS 131 CO 0.06 0.40 1.11 0.72 -2.00 0.00 0.00 174.74 175.03