#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jvk h MET 2 N 0.00 -0.04 -0.00 2.12 2.07 -2.06 -3.47 114.93 113.55 2jvk h MET 2 Ca 0.00 0.00 -0.04 0.00 -2.07 0.00 0.00 59.70 57.59 2jvk h MET 2 Cb 0.00 0.01 -0.13 0.00 -1.87 0.00 0.00 31.60 29.61 2jvk h MET 2 CO 0.00 -0.02 0.01 -1.71 1.07 0.00 0.00 176.91 176.26 2jvk n ASN 3 N -2.25 -1.08 -4.54 1.22 5.15 -1.26 -5.08 115.26 107.43 2jvk n ASN 3 Ca -0.00 -1.49 -0.42 0.00 -0.60 0.00 0.00 54.58 52.06 2jvk n ASN 3 Cb 0.01 0.55 -0.02 0.00 -0.53 0.00 0.00 39.78 39.80 2jvk n ASN 3 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2jvk s GLU 4 N 0.10 3.76 0.10 1.20 8.01 -1.26 -4.09 118.70 126.52 2jvk s GLU 4 Ca 0.25 -1.61 0.05 0.00 0.01 0.00 0.00 54.97 53.67 2jvk s GLU 4 Cb 0.20 -5.32 -0.04 0.00 -4.31 0.00 0.00 34.13 24.66 2jvk s GLU 4 CO -0.06 -2.12 -0.02 0.21 0.01 0.00 0.00 175.26 173.28 2jvk s LYS 5 N 4.11 2.47 -0.10 1.61 2.20 -1.26 -2.50 119.74 126.27 2jvk s LYS 5 Ca 0.46 -0.88 0.01 0.00 -0.36 0.00 0.00 55.97 55.20 2jvk s LYS 5 Cb 0.00 -2.49 0.02 0.00 -1.51 0.00 0.00 37.83 33.85 2jvk s LYS 5 CO -0.04 0.53 -0.11 0.42 -0.36 0.00 0.00 175.35 175.79 2jvk s ILE 6 N -1.32 1.20 0.01 5.43 1.01 0.18 -0.06 121.20 127.65 2jvk s ILE 6 Ca 0.25 -0.45 -0.17 0.00 0.00 0.00 0.00 60.65 60.28 2jvk s ILE 6 Cb -0.11 -1.14 -0.06 0.00 0.01 0.00 0.00 42.46 41.16 2jvk s ILE 6 CO 0.18 0.39 0.49 -0.76 0.00 0.00 0.00 174.94 175.23 2jvk s LEU 7 N 1.20 4.47 -0.23 2.97 1.43 -0.33 0.31 118.68 128.51 2jvk s LEU 7 Ca -0.04 1.07 -0.01 0.00 -1.03 0.00 0.00 54.13 54.13 2jvk s LEU 7 Cb -0.14 -2.73 0.06 0.00 0.03 0.00 0.00 46.19 43.41 2jvk s LEU 7 CO -0.03 0.26 -0.01 -0.63 0.23 0.00 0.00 176.35 176.17 2jvk s ILE 8 N -0.84 1.15 -0.48 -0.59 1.01 0.31 0.11 121.20 121.87 2jvk s ILE 8 Ca 0.26 -1.03 -0.24 0.00 0.00 0.00 0.00 60.65 59.64 2jvk s ILE 8 Cb -0.18 -1.54 0.03 0.00 0.01 0.00 0.00 42.46 40.78 2jvk s ILE 8 CO 0.15 -0.19 0.89 -0.69 0.00 0.00 0.00 174.94 175.10 2jvk s VAL 9 N 1.56 4.50 -0.16 2.92 1.01 -0.27 -0.55 120.40 129.41 2jvk s VAL 9 Ca -0.03 0.55 -0.10 0.00 0.00 0.00 0.00 61.98 62.40 2jvk s VAL 9 Cb -0.18 -4.43 0.05 0.00 0.00 0.00 0.00 36.38 31.82 2jvk s VAL 9 CO -0.08 -0.87 0.39 -0.62 0.00 0.00 0.00 175.10 173.92 2jvk s ASP 10 N 2.37 -0.46 -0.00 3.32 2.15 0.27 -3.50 116.67 120.81 2jvk s ASP 10 Ca 0.34 0.82 0.17 0.00 0.43 0.00 0.00 52.55 54.30 2jvk s ASP 10 Cb -0.11 0.74 -0.18 0.00 -0.30 0.00 0.00 42.92 43.07 2jvk s ASP 10 CO 0.24 -0.17 0.66 -0.67 -0.17 0.00 0.00 175.17 175.05 2jvk n ASP 11 N 3.82 0.67 0.28 -0.34 2.03 -1.26 -3.52 116.55 118.23 2jvk n ASP 11 Ca -0.20 0.30 0.12 0.00 0.52 0.00 0.00 54.79 55.53 2jvk n ASP 11 Cb 0.56 0.39 0.80 0.00 -0.72 0.00 0.00 41.12 42.15 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 1.08 -1.94 -3.45 115.11 110.13 2jvk h GLN 12 Ca -0.23 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.97 2jvk h GLN 12 Cb 1.71 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.14 2jvk h GLN 12 CO 0.05 0.01 0.00 0.98 -0.95 0.00 0.00 178.83 178.91 2jvk n TYR 13 N -4.11 0.00 0.06 2.96 9.36 -1.26 -4.71 117.16 119.46 2jvk n TYR 13 Ca -0.03 0.00 -0.23 0.00 3.32 0.00 0.00 57.90 60.96 2jvk n TYR 13 Cb 0.09 0.00 -0.15 0.00 -0.63 0.00 0.00 39.34 38.65 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 0.89 2.98 0.00 -1.93 -3.24 103.07 102.18 2jvk h GLY 14 Ca 0.00 -1.06 0.03 0.00 0.00 0.00 0.00 47.33 46.30 2jvk h GLY 14 CO 0.00 0.93 0.38 -2.22 0.00 0.00 0.00 176.54 175.63 2jvk h ILE 15 N -0.05 1.08 -0.35 2.60 1.08 -1.95 0.25 117.51 120.17 2jvk h ILE 15 Ca -0.31 -0.26 0.04 0.00 -0.39 0.00 0.00 64.86 63.94 2jvk h ILE 15 Cb 1.97 0.26 -0.04 0.00 -3.07 0.00 0.00 36.82 35.94 2jvk h ILE 15 CO 0.15 0.14 0.11 0.08 -0.69 0.00 0.00 178.15 177.94 2jvk h ARG 16 N 0.76 0.25 -0.63 2.37 0.11 -1.87 -1.49 114.38 113.87 2jvk h ARG 16 Ca 0.25 -0.01 -0.04 0.00 0.10 0.00 0.00 59.98 60.28 2jvk h ARG 16 Cb 0.01 -0.06 -0.03 0.00 1.11 0.00 0.00 29.97 31.00 2jvk h ARG 16 CO -0.10 0.16 0.25 0.82 0.10 0.00 0.00 179.97 181.21 2jvk h ILE 17 N 0.26 1.22 -0.49 0.08 1.08 -1.29 0.43 117.51 118.80 2jvk h ILE 17 Ca 0.16 -0.70 0.04 0.00 -0.39 0.00 0.00 64.86 63.97 2jvk h ILE 17 Cb 0.15 0.47 -0.04 0.00 -3.07 0.00 0.00 36.82 34.32 2jvk h ILE 17 CO -0.17 0.28 0.25 -0.07 -0.69 0.00 0.00 178.15 177.75 2jvk h LEU 18 N 0.91 0.37 -0.01 1.44 3.38 0.42 0.40 115.31 122.22 2jvk h LEU 18 Ca 0.21 0.02 -0.24 0.00 0.09 0.00 0.00 57.88 57.97 2jvk h LEU 18 Cb 0.18 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2jvk h LEU 18 CO -0.02 0.26 -1.09 -0.07 0.09 0.00 0.00 178.44 177.61 2jvk h LEU 19 N 0.50 0.34 -0.13 1.67 3.38 -1.00 -2.37 115.31 117.69 2jvk h LEU 19 Ca 0.21 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 57.87 2jvk h LEU 19 Cb 0.10 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2jvk h LEU 19 CO -0.14 1.21 -0.02 0.78 0.09 0.00 0.00 178.44 180.37 2jvk h ASN 20 N 0.09 -0.09 0.64 -0.43 2.35 0.52 0.35 115.58 119.01 2jvk h ASN 20 Ca -0.09 0.03 -0.16 0.00 -0.55 0.00 0.00 56.30 55.53 2jvk h ASN 20 Cb 1.80 0.07 -0.02 0.00 0.05 0.00 0.00 38.32 40.22 2jvk h ASN 20 CO 0.17 -0.03 -0.74 1.05 -1.65 0.00 0.00 177.43 176.23 2jvk h GLU 21 N 0.02 0.08 0.06 0.81 4.11 -0.29 -1.36 114.58 118.00 2jvk h GLU 21 Ca 0.06 -0.07 -0.27 0.00 0.07 0.00 0.00 59.36 59.15 2jvk h GLU 21 Cb 0.09 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2jvk h GLU 21 CO -0.12 0.78 -1.37 0.28 0.07 0.00 0.00 179.01 178.65 2jvk h VAL 22 N 0.05 1.30 -0.06 -1.06 2.07 -1.18 0.56 116.25 117.93 2jvk h VAL 22 Ca -0.02 -3.00 -0.02 0.00 0.82 0.00 0.00 66.70 64.49 2jvk h VAL 22 Cb 1.31 2.74 -0.00 0.00 -1.52 0.00 0.00 31.29 33.82 2jvk h VAL 22 CO 0.10 0.81 -0.03 -0.26 0.02 0.00 0.00 177.57 178.22 2jvk h PHE 23 N 0.03 0.14 -0.16 1.57 0.04 -0.35 -2.78 116.94 115.43 2jvk h PHE 23 Ca -0.17 -0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.54 2jvk h PHE 23 Cb 1.93 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 40.04 2jvk h PHE 23 CO 0.03 0.50 -0.02 -0.91 -0.60 0.00 0.00 178.31 177.30 2jvk h ASN 24 N -0.26 0.22 -0.78 2.17 -0.26 -1.28 -0.78 115.58 114.61 2jvk h ASN 24 Ca 0.01 -0.03 0.10 0.00 -0.56 0.00 0.00 56.30 55.83 2jvk h ASN 24 Cb 0.46 -0.06 -0.05 0.00 -1.06 0.00 0.00 38.32 37.61 2jvk h ASN 24 CO 0.01 0.28 0.51 0.07 -1.06 0.00 0.00 177.43 177.24 2jvk h LYS 25 N 0.23 0.66 -0.03 0.81 2.10 0.33 0.54 116.57 121.22 2jvk h LYS 25 Ca 0.06 -0.04 -0.14 0.00 -2.00 0.00 0.00 60.65 58.52 2jvk h LYS 25 Cb 0.20 -0.15 -0.02 0.00 -0.90 0.00 0.00 32.23 31.37 2jvk h LYS 25 CO 0.01 0.44 -0.64 0.93 -2.00 0.00 0.00 179.45 178.19 2jvk h GLU 26 N 0.68 0.12 0.00 0.07 4.39 -0.95 -3.46 114.58 115.42 2jvk h GLU 26 Ca 0.36 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.98 2jvk h GLU 26 Cb 0.49 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 2jvk h GLU 26 CO -0.14 0.71 0.00 0.41 -1.16 0.00 0.00 179.01 178.84 2jvk n GLY 27 N 0.32 1.70 1.79 -3.84 0.00 0.19 -4.83 105.19 100.53 2jvk n GLY 27 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 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 0.00 -2.95 -4.52 1.61 4.02 -0.42 -4.95 117.16 109.96 2jvk n TYR 28 Ca 0.00 -0.89 -0.22 0.00 -0.01 0.00 0.00 57.90 56.78 2jvk n TYR 28 Cb 0.00 -0.30 -0.16 0.00 -0.02 0.00 0.00 39.34 38.86 2jvk n TYR 28 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 176.86 174.71 2jvk s GLN 29 N -3.44 1.21 0.31 -0.72 0.74 -1.04 -4.29 119.66 112.43 2jvk s GLN 29 Ca 0.29 -0.39 0.05 0.00 0.05 0.00 0.00 55.36 55.37 2jvk s GLN 29 Cb -0.02 -1.10 -0.06 0.00 1.10 0.00 0.00 33.01 32.93 2jvk s GLN 29 CO 0.19 0.14 0.00 0.95 -0.55 0.00 0.00 175.29 176.02 2jvk s THR 30 N 0.19 1.44 0.29 -0.34 -4.23 -1.26 0.47 115.64 112.20 2jvk s THR 30 Ca -0.04 -2.05 -0.06 0.00 -1.18 0.00 0.00 61.69 58.36 2jvk s THR 30 Cb -0.10 -2.64 -0.00 0.00 1.34 0.00 0.00 72.50 71.10 2jvk s THR 30 CO 0.01 -0.15 0.43 -0.36 -0.54 0.00 0.00 174.62 174.01 2jvk s PHE 31 N -3.13 0.84 0.10 3.99 0.40 0.15 -4.80 117.98 115.53 2jvk s PHE 31 Ca 0.33 -1.12 -0.04 0.00 -0.60 0.00 0.00 56.93 55.49 2jvk s PHE 31 Cb 0.07 -0.05 -0.02 0.00 0.51 0.00 0.00 43.02 43.52 2jvk s PHE 31 CO 0.14 -1.03 0.10 1.14 0.70 0.00 0.00 175.22 176.27 2jvk s GLN 32 N -3.51 0.84 -0.15 0.44 -2.07 -1.26 -0.53 119.66 113.42 2jvk s GLN 32 Ca 0.29 -1.19 -0.08 0.00 -1.82 0.00 0.00 55.36 52.56 2jvk s GLN 32 Cb 0.00 0.28 0.06 0.00 -1.09 0.00 0.00 33.01 32.26 2jvk s GLN 32 CO 0.15 -0.24 0.37 0.00 -1.32 0.00 0.00 175.29 174.25 2jvk s ALA 33 N -3.94 -0.92 -1.84 2.60 0.00 0.29 -4.65 121.76 113.29 2jvk s ALA 33 Ca 0.12 1.39 0.02 0.00 0.00 0.00 0.00 51.96 53.50 2jvk s ALA 33 Cb 0.06 -0.86 0.07 0.00 0.00 0.00 0.00 23.12 22.39 2jvk s ALA 33 CO -0.06 -0.25 0.99 0.00 0.00 0.00 0.00 175.76 176.44 2jvk n ALA 34 N 4.27 2.51 -3.63 0.00 0.00 -1.23 0.93 120.51 123.36 2jvk n ALA 34 Ca -0.24 -0.14 0.02 0.00 0.00 0.00 0.00 53.44 53.08 2jvk n ALA 34 Cb 0.55 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 -0.87 -0.05 0.15 0.00 2.47 -1.26 -4.23 114.94 111.14 2jvk s ASN 35 Ca 0.05 -0.14 -0.10 0.00 0.42 0.00 0.00 52.86 53.10 2jvk s ASN 35 Cb 0.03 0.16 -0.02 0.00 -1.45 0.00 0.00 41.25 39.97 2jvk s ASN 35 CO 0.03 -0.30 1.48 1.23 -3.72 0.00 0.00 177.10 175.83 2jvk h GLY 36 N 2.00 0.98 1.55 1.21 0.00 -1.83 -3.06 103.07 103.92 2jvk h GLY 36 Ca -0.30 -1.02 0.00 0.00 0.00 0.00 0.00 47.33 46.01 2jvk h GLY 36 CO 0.29 0.92 0.23 1.41 0.00 0.00 0.00 176.54 179.38 2jvk h LEU 37 N 0.73 0.00 0.06 3.11 3.38 -1.95 0.27 115.31 120.91 2jvk h LEU 37 Ca 0.06 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.71 2jvk h LEU 37 Cb 0.99 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.71 2jvk h LEU 37 CO 0.10 0.00 -1.74 0.00 0.09 0.00 0.00 178.44 176.88 2jvk n GLN 38 N -2.96 0.66 0.20 1.13 6.02 -1.16 -2.59 117.38 118.69 2jvk n GLN 38 Ca -0.02 0.39 0.07 0.00 -0.01 0.00 0.00 57.00 57.43 2jvk n GLN 38 Cb 0.28 -1.70 0.58 0.00 1.02 0.00 0.00 30.24 30.42 2jvk n GLN 38 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2jvk h ALA 39 N -0.25 1.91 0.29 -1.58 0.00 -1.40 -1.06 119.26 117.17 2jvk h ALA 39 Ca -0.42 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2jvk h ALA 39 Cb 1.69 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.41 2jvk h ALA 39 CO -0.08 0.08 -0.42 1.25 0.00 0.00 0.00 179.25 180.08 2jvk h LEU 40 N 0.12 -1.17 -1.13 0.00 6.46 -0.52 0.54 115.31 119.62 2jvk h LEU 40 Ca 0.03 0.11 0.07 0.00 -0.12 0.00 0.00 57.88 57.98 2jvk h LEU 40 Cb 0.02 0.41 -0.06 0.00 -0.73 0.00 0.00 40.66 40.30 2jvk h LEU 40 CO -0.00 -0.53 0.60 -0.78 -0.62 0.00 0.00 178.44 177.10 2jvk h ASP 41 N -0.77 0.91 0.80 1.25 1.82 -1.17 -0.16 116.42 119.11 2jvk h ASP 41 Ca -0.01 0.01 -0.05 0.00 -0.39 0.00 0.00 57.03 56.58 2jvk h ASP 41 Cb 0.72 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 40.54 2jvk h ASP 41 CO -0.14 0.57 -0.25 0.40 -1.61 0.00 0.00 179.24 178.21 2jvk h ILE 42 N 1.03 0.67 -0.10 2.25 2.04 -0.43 0.10 117.51 123.07 2jvk h ILE 42 Ca 0.41 -1.15 -0.21 0.00 1.00 0.00 0.00 64.86 64.91 2jvk h ILE 42 Cb 0.24 1.74 0.01 0.00 -0.74 0.00 0.00 36.82 38.08 2jvk h ILE 42 CO -0.16 0.25 -0.77 0.58 0.00 0.00 0.00 178.15 178.05 2jvk h VAL 43 N 0.00 1.31 0.00 1.67 2.07 0.18 0.54 116.25 122.02 2jvk h VAL 43 Ca -0.00 -2.01 0.00 0.00 0.82 0.00 0.00 66.70 65.51 2jvk h VAL 43 Cb 0.72 2.16 0.00 0.00 -1.52 0.00 0.00 31.29 32.65 2jvk h VAL 43 CO 0.03 0.62 0.00 0.00 0.02 0.00 0.00 177.57 178.25 2jvk h THR 44 N 0.38 0.00 0.00 2.57 1.03 -0.95 0.20 112.91 116.13 2jvk h THR 44 Ca -0.07 -0.75 -0.37 0.00 -0.01 0.00 0.00 66.41 65.21 2jvk h THR 44 Cb 1.42 1.73 -0.07 0.00 -1.07 0.00 0.00 68.15 70.16 2jvk h THR 44 CO 0.16 0.00 -2.41 2.29 -0.01 0.00 0.00 175.52 175.55 2jvk n LYS 45 N -2.92 0.70 -0.08 0.00 2.85 0.32 -4.71 118.16 114.32 2jvk n LYS 45 Ca 0.03 0.07 -0.09 0.00 -1.05 0.00 0.00 58.31 57.27 2jvk n LYS 45 Cb 0.44 -1.51 -0.09 0.00 -0.65 0.00 0.00 35.03 33.22 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 -3.00 1.10 -3.34 -1.58 -0.58 0.19 -5.05 120.64 108.38 2jvk n GLU 46 Ca -0.39 0.05 -0.12 0.00 -0.42 0.00 0.00 57.16 56.28 2jvk n GLU 46 Cb 1.06 -1.34 0.00 0.00 -0.57 0.00 0.00 31.44 30.59 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 -2.75 -1.53 -0.63 3.49 5.12 0.70 -4.96 116.66 116.09 2jvk n ARG 47 Ca -0.26 1.27 -0.31 0.00 -1.93 0.00 0.00 57.85 56.62 2jvk n ARG 47 Cb 0.87 -4.24 0.19 0.00 -1.16 0.00 0.00 32.46 28.12 2jvk n ARG 47 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 2jvk n PRO 48 N -1.88 -1.18 0.08 5.56 -0.02 -1.26 -4.89 135.00 131.41 2jvk n PRO 48 Ca -0.12 -0.30 0.12 0.00 -2.02 0.00 0.00 63.50 61.19 2jvk n PRO 48 Cb 0.58 -2.15 0.20 0.00 -0.02 0.00 0.00 33.50 32.11 2jvk n PRO 48 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2jvk h ASP 49 N -2.11 0.00 -4.93 2.55 3.32 -0.62 -3.46 116.42 111.16 2jvk h ASP 49 Ca -0.50 -0.14 -0.07 0.00 0.02 0.00 0.00 57.03 56.35 2jvk h ASP 49 Cb 1.30 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.66 2jvk h ASP 49 CO 0.42 0.07 0.13 -0.22 -1.72 0.00 0.00 179.24 177.92 2jvk s LEU 50 N -4.53 -0.48 0.05 1.55 0.20 0.06 -4.65 118.68 110.89 2jvk s LEU 50 Ca 0.07 0.69 0.04 0.00 0.69 0.00 0.00 54.13 55.61 2jvk s LEU 50 Cb 0.12 2.38 -0.02 0.00 -0.43 0.00 0.00 46.19 48.24 2jvk s LEU 50 CO 0.70 -0.57 -0.11 0.68 -0.29 0.00 0.00 176.35 176.76 2jvk s VAL 51 N -1.11 0.87 -0.10 1.68 -7.23 0.13 -1.18 120.40 113.45 2jvk s VAL 51 Ca -0.11 -1.10 0.01 0.00 -1.81 0.00 0.00 61.98 58.98 2jvk s VAL 51 Cb -0.01 -0.85 0.02 0.00 0.56 0.00 0.00 36.38 36.10 2jvk s VAL 51 CO 0.09 -0.21 -0.13 -0.76 -0.31 0.00 0.00 175.10 173.77 2jvk s LEU 52 N -1.46 1.60 -0.32 1.32 1.02 0.30 0.96 118.68 122.10 2jvk s LEU 52 Ca -0.04 -0.38 -0.04 0.00 0.02 0.00 0.00 54.13 53.69 2jvk s LEU 52 Cb -0.09 -0.99 0.05 0.00 0.02 0.00 0.00 46.19 45.18 2jvk s LEU 52 CO 0.01 -0.01 0.05 -0.76 0.02 0.00 0.00 176.35 175.66 2jvk s LEU 53 N 1.08 4.10 -0.61 1.79 1.43 0.17 -1.12 118.68 125.52 2jvk s LEU 53 Ca -0.05 -1.23 -0.26 0.00 -1.03 0.00 0.00 54.13 51.56 2jvk s LEU 53 Cb -0.15 -1.78 0.04 0.00 0.03 0.00 0.00 46.19 44.33 2jvk s LEU 53 CO -0.02 -0.29 1.09 -0.62 0.23 0.00 0.00 176.35 176.73 2jvk s ASP 54 N 1.33 6.31 0.00 2.29 2.15 -1.23 0.32 116.67 127.84 2jvk s ASP 54 Ca -0.04 -0.33 0.22 0.00 0.43 0.00 0.00 52.55 52.84 2jvk s ASP 54 Cb -0.20 -2.49 1.33 0.00 -0.30 0.00 0.00 42.92 41.26 2jvk s ASP 54 CO 0.01 -1.45 1.72 1.15 -0.17 0.00 0.00 175.17 176.42 2jvk n MET 55 N 8.17 0.73 -0.02 4.34 0.00 0.17 -1.05 117.12 129.46 2jvk n MET 55 Ca 0.03 0.00 0.12 0.00 0.00 0.00 0.00 57.70 57.85 2jvk n MET 55 Cb 0.48 -1.48 0.11 0.00 0.00 0.00 0.00 33.22 32.33 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 -0.98 2.26 -1.70 3.17 3.00 -1.15 -4.62 118.16 118.16 2jvk n LYS 56 Ca 0.17 -1.93 -0.42 0.00 -0.00 0.00 0.00 58.31 56.14 2jvk n LYS 56 Cb 0.08 -1.45 0.00 0.00 0.00 0.00 0.00 35.03 33.66 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 1.33 2.29 -0.26 3.15 3.06 -0.21 -4.88 119.36 123.85 2jvk n ILE 57 Ca 0.14 -0.50 0.11 0.00 -2.50 0.00 0.00 62.75 60.00 2jvk n ILE 57 Cb 0.59 -1.55 0.22 0.00 0.54 0.00 0.00 39.64 39.44 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 0.28 -0.06 -4.04 9.51 -0.01 -1.26 -4.23 135.00 135.19 2jvk n PRO 58 Ca 0.06 1.12 -0.33 0.00 -0.01 0.00 0.00 63.50 64.33 2jvk n PRO 58 Cb 0.38 -1.78 -0.15 0.00 -0.01 0.00 0.00 33.50 31.94 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 -4.17 1.56 0.00 -1.23 0.00 -1.26 -5.06 107.32 97.16 2jvk s GLY 59 Ca -0.10 -1.46 0.00 0.00 0.00 0.00 0.00 44.72 43.16 2jvk s GLY 59 CO 0.58 0.46 0.00 1.03 0.00 0.00 0.00 173.10 175.18 2jvk n MET 60 N 4.59 0.00 0.03 2.90 2.81 -1.26 -4.68 117.12 121.50 2jvk n MET 60 Ca -0.17 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.71 2jvk n MET 60 Cb 0.47 0.00 -0.00 0.00 -0.71 0.00 0.00 33.22 32.98 2jvk n MET 60 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 2jvk n ASP 61 N -2.15 0.73 0.00 7.83 5.68 -1.26 -4.37 116.55 123.02 2jvk n ASP 61 Ca 0.00 0.09 0.00 0.00 -0.50 0.00 0.00 54.79 54.38 2jvk n ASP 61 Cb 0.00 -0.23 0.00 0.00 -1.14 0.00 0.00 41.12 39.75 2jvk n ASP 61 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jvk n GLY 62 N 3.25 1.13 0.30 6.12 0.00 -1.26 -3.97 105.19 110.75 2jvk n GLY 62 Ca -0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.86 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 0.00 0.41 0.00 -0.61 1.08 -1.95 -0.21 117.51 116.23 2jvk h ILE 63 Ca 0.00 -0.33 0.00 0.00 -0.39 0.00 0.00 64.86 64.14 2jvk h ILE 63 Cb 0.00 0.54 0.00 0.00 -3.07 0.00 0.00 36.82 34.29 2jvk h ILE 63 CO 0.00 0.05 0.00 -0.62 -0.69 0.00 0.00 178.15 176.89 2jvk n GLU 64 N -5.31 0.13 -0.03 2.37 1.02 -1.26 -1.38 120.64 116.18 2jvk n GLU 64 Ca -0.11 0.58 -0.14 0.00 -0.02 0.00 0.00 57.16 57.47 2jvk n GLU 64 Cb 0.32 -1.90 -0.11 0.00 -0.02 0.00 0.00 31.44 29.74 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 1.53 0.00 -3.67 1.08 -1.64 -0.18 117.51 114.64 2jvk h ILE 65 Ca 0.00 -1.69 -0.01 0.00 -0.39 0.00 0.00 64.86 62.77 2jvk h ILE 65 Cb 0.06 2.62 -0.00 0.00 -3.07 0.00 0.00 36.82 36.43 2jvk h ILE 65 CO 0.00 0.45 -0.06 0.00 -0.69 0.00 0.00 178.15 177.85 2jvk h ALA 66 N 0.32 1.70 -0.57 1.87 0.00 -0.06 0.49 119.26 123.00 2jvk h ALA 66 Ca -0.01 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 2jvk h ALA 66 Cb 0.78 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 2jvk h ALA 66 CO 0.02 0.07 0.10 -0.22 0.00 0.00 0.00 179.25 179.22 2jvk h LYS 67 N 0.00 0.94 0.00 0.00 1.63 -1.04 1.09 116.57 119.19 2jvk h LYS 67 Ca -0.00 -0.25 -0.11 0.00 -0.85 0.00 0.00 60.65 59.44 2jvk h LYS 67 Cb 0.12 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.62 2jvk h LYS 67 CO 0.01 0.89 -0.55 0.00 -3.45 0.00 0.00 179.45 176.36 2jvk h ARG 68 N 0.84 0.00 0.00 1.90 3.08 0.36 -0.18 114.38 120.39 2jvk h ARG 68 Ca 0.18 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.12 2jvk h ARG 68 Cb 0.40 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 2jvk h ARG 68 CO 0.01 0.55 -0.49 0.52 -1.07 0.00 0.00 179.97 179.48 2jvk h MET 69 N 0.00 0.00 0.00 0.04 2.86 0.15 0.18 114.93 118.16 2jvk h MET 69 Ca -0.01 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2jvk h MET 69 Cb 1.39 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.05 2jvk h MET 69 CO 0.07 0.49 -0.22 1.57 1.06 0.00 0.00 176.91 179.88 2jvk h LYS 70 N 0.00 0.00 -0.00 1.72 2.10 0.15 0.32 116.57 120.86 2jvk h LYS 70 Ca -0.00 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.48 2jvk h LYS 70 Cb 1.20 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.51 2jvk h LYS 70 CO 0.06 0.08 -0.76 0.28 -2.00 0.00 0.00 179.45 177.11 2jvk h VAL 71 N 0.00 1.52 0.15 0.07 2.07 -0.65 0.45 116.25 119.85 2jvk h VAL 71 Ca -0.00 -2.54 -0.32 0.00 0.82 0.00 0.00 66.70 64.66 2jvk h VAL 71 Cb 1.07 2.37 0.00 0.00 -1.52 0.00 0.00 31.29 33.21 2jvk h VAL 71 CO 0.01 0.73 -1.57 -0.29 0.02 0.00 0.00 177.57 176.47 2jvk h ILE 72 N 0.03 1.12 0.00 4.57 6.09 -0.29 -3.42 117.51 125.61 2jvk h ILE 72 Ca -0.01 -2.73 0.00 0.00 -1.37 0.00 0.00 64.86 60.75 2jvk h ILE 72 Cb 1.34 2.79 0.00 0.00 0.47 0.00 0.00 36.82 41.42 2jvk h ILE 72 CO 0.10 0.83 0.00 -0.67 -3.07 0.00 0.00 178.15 175.34 2jvk n ASP 73 N -3.51 0.00 0.00 2.19 2.03 0.11 -5.06 116.55 112.31 2jvk n ASP 73 Ca -0.18 -0.20 0.00 0.00 0.52 0.00 0.00 54.79 54.93 2jvk n ASP 73 Cb 1.06 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.46 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 -2.67 -0.67 2.13 0.15 -4.32 120.64 115.26 2jvk n GLU 74 Ca 0.00 0.00 -0.32 0.00 0.66 0.00 0.00 57.16 57.50 2jvk n GLU 74 Cb 0.05 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 31.75 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 1.98 5.52 -0.45 4.31 0.23 -1.26 -3.68 115.26 121.91 2jvk n ASN 75 Ca 0.00 -3.71 0.00 0.00 -0.53 0.00 0.00 54.58 50.34 2jvk n ASN 75 Cb 0.00 -0.73 0.00 0.00 -2.08 0.00 0.00 39.78 36.97 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 -0.28 0.00 -2.74 1.53 0.13 -1.26 -4.74 119.36 112.00 2jvk n ILE 76 Ca 0.39 0.00 -0.10 0.00 -1.10 0.00 0.00 62.75 61.94 2jvk n ILE 76 Cb 0.40 -0.21 0.05 0.00 -0.84 0.00 0.00 39.64 39.04 2jvk n ILE 76 CO 0.00 0.00 0.00 0.54 2.80 0.00 0.00 176.55 179.89 2jvk n ARG 77 N 0.23 -3.11 -2.92 9.51 5.12 -1.26 -3.54 116.66 120.70 2jvk n ARG 77 Ca 0.00 0.50 -0.36 0.00 -1.93 0.00 0.00 57.85 56.06 2jvk n ARG 77 Cb 0.09 -4.33 -0.06 0.00 -1.16 0.00 0.00 32.46 27.00 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 -3.21 4.38 -0.20 1.55 1.01 -1.26 -0.69 120.40 121.97 2jvk s VAL 78 Ca 0.08 1.55 -0.00 0.00 0.00 0.00 0.00 61.98 63.60 2jvk s VAL 78 Cb -0.01 -3.89 0.05 0.00 0.00 0.00 0.00 36.38 32.53 2jvk s VAL 78 CO 0.42 0.10 -0.05 -0.63 0.00 0.00 0.00 175.10 174.94 2jvk s ILE 79 N -1.66 1.30 -0.24 2.22 1.09 0.27 0.11 121.20 124.29 2jvk s ILE 79 Ca 0.49 -0.93 -0.15 0.00 -1.10 0.00 0.00 60.65 58.96 2jvk s ILE 79 Cb -0.16 -1.54 -0.04 0.00 -1.06 0.00 0.00 42.46 39.66 2jvk s ILE 79 CO 0.21 -0.01 0.36 -0.51 -0.10 0.00 0.00 174.94 174.89 2jvk s ILE 80 N 1.52 5.21 -0.03 2.92 2.07 -0.70 0.45 121.20 132.64 2jvk s ILE 80 Ca -0.03 0.58 -0.15 0.00 -1.41 0.00 0.00 60.65 59.64 2jvk s ILE 80 Cb -0.17 -3.68 -0.05 0.00 0.13 0.00 0.00 42.46 38.68 2jvk s ILE 80 CO -0.07 0.22 0.41 -0.04 -1.91 0.00 0.00 174.94 173.55 2jvk s MET 81 N 1.62 4.00 0.22 3.50 -1.94 0.15 -0.21 119.30 126.64 2jvk s MET 81 Ca 0.16 0.40 0.03 0.00 -1.71 0.00 0.00 55.69 54.57 2jvk s MET 81 Cb -0.15 -3.26 -0.01 0.00 2.01 0.00 0.00 34.83 33.41 2jvk s MET 81 CO 0.08 0.59 0.12 -2.37 -0.01 0.00 0.00 175.02 173.43 2jvk n THR 82 N 2.18 0.00 0.91 2.05 5.66 -0.39 0.44 114.28 125.13 2jvk n THR 82 Ca -0.13 -1.38 0.00 0.00 -3.05 0.00 0.00 64.05 59.49 2jvk n THR 82 Cb 0.52 0.58 0.00 0.00 -1.55 0.00 0.00 70.33 69.88 2jvk n THR 82 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2jvk n ALA 83 N -1.81 2.38 0.00 1.79 0.00 -1.26 0.60 120.51 122.22 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 0.35 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.80 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 0.32 0.00 -0.91 0.00 9.36 -1.26 -4.08 117.16 120.59 2jvk n TYR 84 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2jvk n TYR 84 Cb 0.35 -0.16 0.00 0.00 -0.63 0.00 0.00 39.34 38.90 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 -0.76 -0.67 0.00 2.98 0.00 -1.26 -4.90 105.19 100.57 2jvk n GLY 85 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.02 0.00 -3.87 1.61 4.07 -1.26 -4.95 120.64 116.22 2jvk n GLU 86 Ca 0.00 0.36 -0.37 0.00 -0.06 0.00 0.00 57.16 57.09 2jvk n GLU 86 Cb 0.34 -1.09 0.02 0.00 -0.06 0.00 0.00 31.44 30.65 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 -1.58 -1.58 0.00 4.31 4.32 -1.26 -4.94 117.00 116.27 2jvk n LEU 87 Ca 0.00 -1.11 0.00 0.00 -0.02 0.00 0.00 56.01 54.88 2jvk n LEU 87 Cb 0.00 -1.93 0.00 0.00 -1.62 0.00 0.00 43.42 39.87 2jvk n LEU 87 CO 0.00 0.56 0.10 -0.67 -1.22 0.00 0.00 177.39 176.16 2jvk n ASP 88 N -2.38 0.00 -1.72 -1.43 2.03 -1.26 -4.26 116.55 107.53 2jvk n ASP 88 Ca -0.14 0.58 -0.11 0.00 0.52 0.00 0.00 54.79 55.65 2jvk n ASP 88 Cb 0.59 -0.47 0.22 0.00 -0.72 0.00 0.00 41.12 40.74 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 -1.92 2.52 -0.23 -0.67 1.56 -1.26 -4.69 117.12 112.43 2jvk n MET 89 Ca 0.00 -3.07 -0.06 0.00 -0.27 0.00 0.00 57.70 54.30 2jvk n MET 89 Cb 0.00 -2.04 0.05 0.00 2.15 0.00 0.00 33.22 33.37 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 1.46 1.18 0.90 1.12 1.08 -1.96 -2.01 117.51 119.28 2jvk h ILE 90 Ca 0.36 -0.35 -0.04 0.00 -0.39 0.00 0.00 64.86 64.44 2jvk h ILE 90 Cb 2.24 0.23 0.00 0.00 -3.07 0.00 0.00 36.82 36.22 2jvk h ILE 90 CO 0.71 0.18 -0.47 1.56 -0.69 0.00 0.00 178.15 179.44 2jvk h GLN 91 N 0.89 -1.22 -0.80 2.37 4.20 -1.88 0.18 115.11 118.86 2jvk h GLN 91 Ca 0.24 0.08 0.04 0.00 0.06 0.00 0.00 58.65 59.08 2jvk h GLN 91 Cb -0.08 0.28 -0.05 0.00 0.30 0.00 0.00 27.48 27.93 2jvk h GLN 91 CO -0.05 -0.81 0.50 1.05 -0.67 0.00 0.00 178.83 178.85 2jvk h GLU 92 N -1.26 0.93 -0.34 1.46 9.09 -1.94 -1.78 114.58 120.73 2jvk h GLU 92 Ca -0.12 -0.06 0.04 0.00 0.05 0.00 0.00 59.36 59.27 2jvk h GLU 92 Cb 0.98 -0.21 -0.04 0.00 -1.65 0.00 0.00 28.75 27.84 2jvk h GLU 92 CO 0.18 0.61 0.13 1.03 0.05 0.00 0.00 179.01 181.01 2jvk h SER 93 N 0.96 0.14 0.14 3.06 0.87 -0.89 -0.09 113.55 117.74 2jvk h SER 93 Ca 0.33 0.04 -0.15 0.00 -1.23 0.00 0.00 61.79 60.78 2jvk h SER 93 Cb 0.07 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.04 2jvk h SER 93 CO -0.14 0.12 -0.55 0.07 -0.53 0.00 0.00 176.83 175.80 2jvk h LYS 94 N 0.28 0.44 -0.01 2.24 2.10 -0.36 -2.79 116.57 118.47 2jvk h LYS 94 Ca 0.15 -0.28 0.00 0.00 -2.00 0.00 0.00 60.65 58.53 2jvk h LYS 94 Cb 0.12 0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.48 2jvk h LYS 94 CO -0.15 0.88 -0.01 -0.85 -2.00 0.00 0.00 179.45 177.32 2jvk n GLU 95 N -3.94 1.27 -1.74 0.07 0.28 -0.69 -3.65 120.64 112.23 2jvk n GLU 95 Ca -0.03 -0.45 -0.36 0.00 -0.16 0.00 0.00 57.16 56.17 2jvk n GLU 95 Cb 0.60 -1.49 0.02 0.00 1.43 0.00 0.00 31.44 31.99 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 -0.48 7.23 0.00 -1.84 4.32 -0.07 -4.82 117.00 121.35 2jvk n LEU 96 Ca 0.21 -4.56 0.00 0.00 -0.02 0.00 0.00 56.01 51.64 2jvk n LEU 96 Cb 0.23 -1.11 0.00 0.00 -1.62 0.00 0.00 43.42 40.92 2jvk n LEU 96 CO 0.18 1.72 0.00 0.61 -1.22 0.00 0.00 177.39 178.68 2jvk n GLY 97 N -0.16 2.70 3.65 -0.72 0.00 -1.24 -4.33 105.19 105.09 2jvk n GLY 97 Ca 0.53 -0.13 -0.53 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.15 0.23 4.61 0.00 -1.24 -4.03 120.51 119.93 2jvk n ALA 98 Ca 0.00 0.43 0.11 0.00 0.00 0.00 0.00 53.44 53.98 2jvk n ALA 98 Cb 0.00 -2.22 0.54 0.00 0.00 0.00 0.00 19.45 17.77 2jvk n ALA 98 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 2jvk h LEU 99 N 6.26 0.00 0.00 0.00 8.10 0.51 -3.43 115.31 126.75 2jvk h LEU 99 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.52 2jvk h LEU 99 Cb 1.31 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.53 2jvk h LEU 99 CO 0.88 0.19 0.00 1.07 -4.11 0.00 0.00 178.44 176.47 2jvk n THR 100 N -3.42 0.00 -4.08 0.15 5.66 -0.48 -5.00 114.28 107.12 2jvk n THR 100 Ca -0.00 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.86 2jvk n THR 100 Cb 0.38 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 69.03 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 -3.36 0.54 0.00 1.09 -3.43 -1.26 -1.72 115.29 107.15 2jvk s HIS 101 Ca 0.00 -0.34 0.00 0.00 -0.80 0.00 0.00 55.06 53.92 2jvk s HIS 101 Cb 0.00 -0.33 0.00 0.00 -1.43 0.00 0.00 32.58 30.82 2jvk s HIS 101 CO 0.00 -0.06 0.00 1.19 -2.00 0.00 0.00 174.74 173.87 2jvk n PHE 102 N 2.06 -0.01 -4.12 0.38 3.72 0.71 -4.85 117.46 115.35 2jvk n PHE 102 Ca -0.19 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.06 2jvk n PHE 102 Cb 0.56 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.96 2jvk n PHE 102 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2jvk s ALA 103 N -2.00 0.41 0.12 4.37 0.00 -1.26 -1.26 121.76 122.14 2jvk s ALA 103 Ca 0.00 -0.29 -0.24 0.00 0.00 0.00 0.00 51.96 51.44 2jvk s ALA 103 Cb 0.00 -0.08 -0.07 0.00 0.00 0.00 0.00 23.12 22.98 2jvk s ALA 103 CO 0.00 0.08 1.67 -0.22 0.00 0.00 0.00 175.76 177.29 2jvk h LYS 104 N 5.80 -0.23 -0.99 0.00 3.11 -0.12 -1.47 116.57 122.67 2jvk h LYS 104 Ca -0.29 0.02 0.40 0.00 -2.81 0.00 0.00 60.65 57.97 2jvk h LYS 104 Cb 1.19 0.05 -0.18 0.00 -1.00 0.00 0.00 32.23 32.30 2jvk h LYS 104 CO 0.49 -0.16 0.49 -2.30 -2.81 0.00 0.00 179.45 175.16 2jvk n PRO 105 N -5.28 -0.06 -0.61 1.90 -0.01 -1.26 -4.77 135.00 124.91 2jvk n PRO 105 Ca -0.05 1.37 -0.31 0.00 -0.01 0.00 0.00 63.50 64.50 2jvk n PRO 105 Cb 0.20 -2.44 0.20 0.00 -0.01 0.00 0.00 33.50 31.45 2jvk n PRO 105 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 175.50 176.68 2jvk n PHE 106 N -5.25 -0.91 -2.93 6.00 3.72 -0.56 -4.98 117.46 112.56 2jvk n PHE 106 Ca 0.36 0.09 -0.33 0.00 -0.05 0.00 0.00 57.45 57.53 2jvk n PHE 106 Cb 1.23 -1.74 -0.07 0.00 -0.94 0.00 0.00 39.48 37.96 2jvk n PHE 106 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2jvk s ASP 107 N -2.25 6.86 0.17 4.37 1.11 -1.26 -4.98 116.67 120.69 2jvk s ASP 107 Ca 0.63 1.52 -0.07 0.00 0.18 0.00 0.00 52.55 54.81 2jvk s ASP 107 Cb -0.21 -2.47 0.05 0.00 1.07 0.00 0.00 42.92 41.36 2jvk s ASP 107 CO 0.64 -0.31 1.51 0.40 1.18 0.00 0.00 175.17 178.60 2jvk h ILE 108 N 1.89 1.28 0.00 0.77 2.04 -1.95 -2.02 117.51 119.52 2jvk h ILE 108 Ca -0.48 -1.59 -0.06 0.00 1.00 0.00 0.00 64.86 63.72 2jvk h ILE 108 Cb 1.18 1.47 -0.01 0.00 -0.74 0.00 0.00 36.82 38.72 2jvk h ILE 108 CO 0.63 0.52 -0.30 -0.78 0.00 0.00 0.00 178.15 178.21 2jvk h ASP 109 N 0.64 0.00 0.25 1.72 3.58 -1.99 0.11 116.42 120.73 2jvk h ASP 109 Ca 0.05 0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.37 2jvk h ASP 109 Cb 0.97 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.01 2jvk h ASP 109 CO 0.09 0.30 -0.48 -0.08 -2.88 0.00 0.00 179.24 176.19 2jvk h GLU 110 N 0.00 0.28 -0.02 0.28 4.22 -1.89 -0.98 114.58 116.47 2jvk h GLU 110 Ca -0.00 -0.16 -0.00 0.00 0.08 0.00 0.00 59.36 59.28 2jvk h GLU 110 Cb 0.60 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 2jvk h GLU 110 CO 0.04 0.71 0.00 0.82 -2.18 0.00 0.00 179.01 178.40 2jvk h ILE 111 N 0.23 1.22 -0.31 2.32 5.03 -0.10 0.30 117.51 126.19 2jvk h ILE 111 Ca 0.01 -0.65 -0.14 0.00 -0.12 0.00 0.00 64.86 63.96 2jvk h ILE 111 Cb 0.94 1.62 -0.01 0.00 -3.03 0.00 0.00 36.82 36.34 2jvk h ILE 111 CO 0.08 0.17 -0.37 0.08 -0.68 0.00 0.00 178.15 177.43 2jvk h ARG 112 N -0.23 0.73 -0.05 2.37 0.11 -1.27 -2.25 114.38 113.78 2jvk h ARG 112 Ca 0.01 -0.37 -0.02 0.00 0.10 0.00 0.00 59.98 59.70 2jvk h ARG 112 Cb 0.28 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.36 2jvk h ARG 112 CO 0.00 0.98 -0.04 0.22 0.10 0.00 0.00 179.97 181.23 2jvk h ASP 113 N 0.60 0.13 0.04 0.08 3.58 -1.05 -1.40 116.42 118.41 2jvk h ASP 113 Ca 0.06 -0.46 -0.12 0.00 0.42 0.00 0.00 57.03 56.93 2jvk h ASP 113 Cb 0.91 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.91 2jvk h ASP 113 CO 0.08 0.56 -0.38 0.00 -2.88 0.00 0.00 179.24 176.62 2jvk h ALA 114 N 0.57 0.97 -0.03 -0.78 0.00 -0.45 -2.49 119.26 117.06 2jvk h ALA 114 Ca 0.01 -0.42 -0.17 0.00 0.00 0.00 0.00 54.91 54.34 2jvk h ALA 114 Cb 0.52 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2jvk h ALA 114 CO 0.01 0.61 -0.73 -0.39 0.00 0.00 0.00 179.25 178.76 2jvk h VAL 115 N 0.38 1.45 -0.18 0.00 -1.51 -1.41 -2.74 116.25 112.23 2jvk h VAL 115 Ca 0.04 -2.30 -0.06 0.00 -1.23 0.00 0.00 66.70 63.15 2jvk h VAL 115 Cb 0.84 2.23 -0.01 0.00 -2.13 0.00 0.00 31.29 32.22 2jvk h VAL 115 CO 0.07 0.67 -0.15 0.07 -1.23 0.00 0.00 177.57 177.00 2jvk h LYS 116 N 0.13 0.29 0.00 5.19 2.10 -0.98 0.87 116.57 124.17 2jvk h LYS 116 Ca -0.02 -0.07 0.00 0.00 -2.00 0.00 0.00 60.65 58.55 2jvk h LYS 116 Cb 1.29 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 2jvk h LYS 116 CO 0.11 0.44 0.00 0.87 -2.00 0.00 0.00 179.45 178.87 2jvk h LYS 117 N 0.27 0.00 0.00 0.07 1.79 -1.32 -3.20 116.57 114.19 2jvk h LYS 117 Ca 0.05 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 2jvk h LYS 117 Cb 0.43 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.08 2jvk h LYS 117 CO 0.03 0.00 -0.25 0.66 -1.08 0.00 0.00 179.45 178.80 2jvk n TYR 118 N -2.58 0.00 -3.05 -1.35 4.01 -0.40 -4.80 117.16 108.98 2jvk n TYR 118 Ca 0.04 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.33 2jvk n TYR 118 Cb 0.38 -0.13 -0.04 0.00 -0.31 0.00 0.00 39.34 39.25 2jvk n TYR 118 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 2jvk s LEU 119 N -5.75 5.27 -0.00 7.72 2.96 0.29 -5.04 118.68 124.13 2jvk s LEU 119 Ca -0.07 -1.56 -0.13 0.00 -0.22 0.00 0.00 54.13 52.15 2jvk s LEU 119 Cb 0.01 -2.33 -0.05 0.00 0.50 0.00 0.00 46.19 44.31 2jvk s LEU 119 CO 0.11 -1.12 0.37 -2.16 -1.32 0.00 0.00 176.35 172.23 2jvk s PRO 120 N 2.73 3.83 0.00 0.98 0.05 -1.21 -4.05 135.00 137.34 2jvk s PRO 120 Ca 0.17 0.31 0.00 0.00 0.05 0.00 0.00 61.00 61.53 2jvk s PRO 120 Cb -0.19 -3.18 0.00 0.00 0.05 0.00 0.00 34.50 31.18 2jvk s PRO 120 CO 0.03 0.68 0.00 1.47 0.05 0.00 0.00 177.00 179.23 2jvk n LEU 121 N 1.70 0.00 0.00 -3.56 -0.00 -1.26 -5.04 117.00 108.84 2jvk n LEU 121 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.87 2jvk n LEU 121 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.95 2jvk n LEU 121 CO 0.37 0.00 0.00 2.29 -0.00 0.00 0.00 177.39 180.05 2jvk n LYS 122 N -0.49 0.00 -2.22 1.47 2.85 -1.26 -5.09 118.16 113.42 2jvk n LYS 122 Ca 0.00 0.00 -0.42 0.00 -1.05 0.00 0.00 58.31 56.84 2jvk n LYS 122 Cb 0.00 -0.01 -0.03 0.00 -0.65 0.00 0.00 35.03 34.35 2jvk n LYS 122 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2jvk s SER 123 N -1.89 5.95 -0.26 -5.58 0.15 -1.26 -4.92 113.70 105.89 2jvk s SER 123 Ca 0.00 0.66 -0.03 0.00 0.70 0.00 0.00 55.95 57.28 2jvk s SER 123 Cb 0.00 -2.54 0.11 0.00 -1.71 0.00 0.00 66.02 61.88 2jvk s SER 123 CO 0.00 -1.78 0.20 0.21 1.20 0.00 0.00 173.24 173.07 2jvk s ASN 124 N 5.43 2.41 -0.29 5.45 3.84 -1.26 -4.76 114.94 125.76 2jvk s ASN 124 Ca 0.64 -0.86 0.10 0.00 0.21 0.00 0.00 52.86 52.96 2jvk s ASN 124 Cb -0.15 0.08 0.47 0.00 -0.55 0.00 0.00 41.25 41.11 2jvk s ASN 124 CO 0.28 -0.39 1.17 0.18 -2.79 0.00 0.00 177.10 175.54 2jvk n LEU 125 N 5.29 4.19 0.13 3.21 7.99 -1.26 -4.84 117.00 131.70 2jvk n LEU 125 Ca -0.05 -4.40 -0.13 0.00 -0.01 0.00 0.00 56.01 51.42 2jvk n LEU 125 Cb 0.45 -0.17 -0.07 0.00 -0.11 0.00 0.00 43.42 43.53 2jvk n LEU 125 CO 0.04 1.89 0.79 -0.33 -1.51 0.00 0.00 177.39 178.27 2jvk h GLU 126 N 2.29 -0.27 -3.92 3.23 5.08 -2.03 -3.35 114.58 115.61 2jvk h GLU 126 Ca 0.26 0.02 -0.68 0.00 -1.00 0.00 0.00 59.36 57.96 2jvk h GLU 126 Cb 1.46 0.06 -0.37 0.00 0.50 0.00 0.00 28.75 30.40 2jvk h GLU 126 CO 0.64 -0.18 -0.52 -1.01 -1.00 0.00 0.00 179.01 176.94 2jvk s HIS 127 N -6.14 3.45 0.00 4.33 3.76 -1.26 -4.86 115.29 114.57 2jvk s HIS 127 Ca -0.15 -2.78 0.00 0.00 -0.15 0.00 0.00 55.06 51.99 2jvk s HIS 127 Cb 0.06 -3.09 0.00 0.00 1.11 0.00 0.00 32.58 30.66 2jvk s HIS 127 CO 0.65 -0.87 0.00 -2.39 -0.85 0.00 0.00 174.74 171.28 2jvk n HIS 128 N 3.79 0.00 0.00 1.40 1.44 -1.26 -5.06 115.22 115.54 2jvk n HIS 128 Ca 0.04 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.75 2jvk n HIS 128 Cb 0.38 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.49 2jvk n HIS 128 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11 2jvk n HIS 129 N -1.09 0.00 -2.87 -1.40 -0.00 -1.26 -5.11 115.22 103.50 2jvk n HIS 129 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 57.72 57.66 2jvk n HIS 129 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 29.99 30.00 2jvk n HIS 129 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2jvk n HIS 130 N -0.13 -3.43 -3.40 1.57 8.25 -1.26 -4.98 115.22 111.84 2jvk n HIS 130 Ca 0.00 1.45 -0.38 0.00 -0.26 0.00 0.00 57.72 58.53 2jvk n HIS 130 Cb 0.00 -3.69 -0.07 0.00 1.12 0.00 0.00 29.99 27.34 2jvk n HIS 130 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2jvk s HIS 131 N -2.01 3.41 0.00 4.41 2.46 -1.26 -5.25 115.29 117.04 2jvk s HIS 131 Ca 0.14 0.65 0.00 0.00 0.47 0.00 0.00 55.06 56.32 2jvk s HIS 131 Cb -0.03 -2.50 0.00 0.00 -0.13 0.00 0.00 32.58 29.91 2jvk s HIS 131 CO 0.73 0.05 0.02 -2.39 -2.47 0.00 0.00 174.74 170.69