#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jn6 s PRO 2 N 0.00 4.30 -0.34 3.17 0.02 -1.26 -4.95 135.00 135.94 2jn6 s PRO 2 Ca 0.00 2.02 -0.29 0.00 0.02 0.00 0.00 61.00 62.75 2jn6 s PRO 2 Cb 0.00 -3.45 0.00 0.00 0.02 0.00 0.00 34.50 31.07 2jn6 s PRO 2 CO 0.00 -0.52 1.41 0.95 -0.33 0.00 0.00 177.00 178.51 2jn6 s THR 3 N 1.91 3.95 -0.45 0.99 -4.23 -1.26 -4.90 115.64 111.65 2jn6 s THR 3 Ca 0.65 1.03 0.07 0.00 -1.18 0.00 0.00 61.69 62.26 2jn6 s THR 3 Cb -0.34 -4.09 0.18 0.00 1.34 0.00 0.00 72.50 69.59 2jn6 s THR 3 CO 0.28 -0.56 0.62 -0.75 -0.54 0.00 0.00 174.62 173.67 2jn6 s LYS 4 N 4.61 0.92 0.16 3.99 2.47 -1.26 -5.09 119.74 125.53 2jn6 s LYS 4 Ca 0.61 -0.84 -0.16 0.00 -1.56 0.00 0.00 55.97 54.03 2jn6 s LYS 4 Cb -0.17 -0.19 0.03 0.00 -1.46 0.00 0.00 37.83 36.04 2jn6 s LYS 4 CO 0.28 -1.27 0.43 0.99 0.16 0.00 0.00 175.35 175.95 2jn6 s THR 5 N 1.22 0.05 -0.07 3.43 2.01 -1.26 -5.16 115.64 115.86 2jn6 s THR 5 Ca 0.24 -0.75 0.03 0.00 0.31 0.00 0.00 61.69 61.52 2jn6 s THR 5 Cb -0.03 -1.40 0.00 0.00 0.01 0.00 0.00 72.50 71.08 2jn6 s THR 5 CO -0.07 -0.24 -0.18 -0.31 -0.69 0.00 0.00 174.62 173.13 2jn6 s TYR 6 N -3.85 1.92 0.11 4.92 2.02 -1.26 -5.10 117.35 116.11 2jn6 s TYR 6 Ca 0.07 -0.71 -0.13 0.00 -0.37 0.00 0.00 57.07 55.93 2jn6 s TYR 6 Cb 0.01 -1.32 0.02 0.00 -0.40 0.00 0.00 41.96 40.27 2jn6 s TYR 6 CO -0.07 -0.30 0.31 -1.12 -1.57 0.00 0.00 175.55 172.79 2jn6 s SER 7 N 0.40 -0.07 -0.02 2.29 0.01 -1.26 -5.08 113.70 109.97 2jn6 s SER 7 Ca -0.14 -0.47 -0.25 0.00 1.31 0.00 0.00 55.95 56.40 2jn6 s SER 7 Cb -0.16 0.41 -0.19 0.00 0.21 0.00 0.00 66.02 66.29 2jn6 s SER 7 CO 0.05 -0.80 1.23 -0.33 0.41 0.00 0.00 173.24 173.80 2jn6 h GLU 8 N 2.54 -0.08 -0.07 12.44 4.39 -2.00 -2.78 114.58 129.02 2jn6 h GLU 8 Ca -0.34 0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.32 2jn6 h GLU 8 Cb 1.23 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.89 2jn6 h GLU 8 CO 0.51 0.37 -0.18 1.05 -1.16 0.00 0.00 179.01 179.60 2jn6 h GLU 9 N -0.56 0.12 -0.50 2.33 9.09 -1.98 -0.85 114.58 122.22 2jn6 h GLU 9 Ca -0.01 -0.03 0.09 0.00 0.05 0.00 0.00 59.36 59.47 2jn6 h GLU 9 Cb 0.49 -0.02 -0.08 0.00 -1.65 0.00 0.00 28.75 27.49 2jn6 h GLU 9 CO 0.01 0.30 0.05 0.35 0.05 0.00 0.00 179.01 179.77 2jn6 h PHE 10 N 0.11 0.06 -0.17 2.06 3.57 -1.95 -0.50 116.94 120.11 2jn6 h PHE 10 Ca 0.02 0.03 -0.18 0.00 3.53 0.00 0.00 57.97 61.38 2jn6 h PHE 10 Cb 0.39 0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.18 2jn6 h PHE 10 CO 0.00 -0.07 -0.62 0.87 -2.23 0.00 0.00 178.31 176.26 2jn6 h LYS 11 N 0.17 0.61 -0.52 1.11 1.57 -1.02 -2.99 116.57 115.49 2jn6 h LYS 11 Ca 0.25 -0.42 0.05 0.00 -1.87 0.00 0.00 60.65 58.66 2jn6 h LYS 11 Cb 0.37 0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.69 2jn6 h LYS 11 CO -0.38 1.04 0.25 0.00 -0.57 0.00 0.00 179.45 179.79 2jn6 h ARG 12 N 0.45 0.47 -0.53 3.15 3.08 -0.58 -1.73 114.38 118.68 2jn6 h ARG 12 Ca -0.01 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 2jn6 h ARG 12 Cb 1.20 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 31.12 2jn6 h ARG 12 CO 0.12 0.31 0.18 0.22 -1.07 0.00 0.00 179.97 179.73 2jn6 h ASP 13 N 0.48 0.71 -0.65 7.04 3.58 -1.08 -1.14 116.42 125.37 2jn6 h ASP 13 Ca 0.24 -0.10 -0.05 0.00 0.42 0.00 0.00 57.03 57.54 2jn6 h ASP 13 Cb 0.18 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 41.01 2jn6 h ASP 13 CO -0.18 0.67 0.22 0.00 -2.88 0.00 0.00 179.24 177.06 2jn6 h ALA 14 N 1.44 1.12 -0.44 -0.78 0.00 -1.19 0.31 119.26 119.71 2jn6 h ALA 14 Ca 0.18 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 2jn6 h ALA 14 Cb 0.20 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2jn6 h ALA 14 CO -0.01 0.61 -0.27 0.28 0.00 0.00 0.00 179.25 179.86 2jn6 h VAL 15 N 0.99 1.27 0.00 0.00 2.07 -0.77 -2.57 116.25 117.24 2jn6 h VAL 15 Ca 0.22 -1.43 -0.06 0.00 0.82 0.00 0.00 66.70 66.25 2jn6 h VAL 15 Cb 0.27 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 2jn6 h VAL 15 CO -0.01 0.49 -0.29 0.00 0.02 0.00 0.00 177.57 177.78 2jn6 h ALA 16 N 0.87 1.27 -0.21 1.67 0.00 -0.67 -1.41 119.26 120.78 2jn6 h ALA 16 Ca 0.09 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 2jn6 h ALA 16 Cb 0.85 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2jn6 h ALA 16 CO 0.07 0.36 -0.11 -0.07 0.00 0.00 0.00 179.25 179.51 2jn6 h LEU 17 N 0.00 0.32 -1.15 0.00 3.38 -0.02 -2.04 115.31 115.81 2jn6 h LEU 17 Ca -0.00 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 2jn6 h LEU 17 Cb 0.60 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 2jn6 h LEU 17 CO 0.04 0.47 -0.37 0.22 0.09 0.00 0.00 178.44 178.89 2jn6 h TYR 18 N 0.32 0.00 0.00 1.13 3.20 -0.94 -1.54 116.97 119.15 2jn6 h TYR 18 Ca 0.07 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.92 2jn6 h TYR 18 Cb 0.39 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.66 2jn6 h TYR 18 CO 0.01 0.37 -0.06 0.93 -1.64 0.00 0.00 178.16 177.76 2jn6 h GLU 19 N 0.00 0.00 -0.60 1.82 5.08 -1.19 -2.73 114.58 116.97 2jn6 h GLU 19 Ca -0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 2jn6 h GLU 19 Cb 0.77 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.99 2jn6 h GLU 19 CO 0.05 0.06 0.07 0.09 -1.00 0.00 0.00 179.01 178.28 2jn6 n ASN 20 N -3.17 5.37 0.05 1.42 3.02 -0.59 -4.45 115.26 116.91 2jn6 n ASN 20 Ca 0.01 -3.03 0.07 0.00 -0.03 0.00 0.00 54.58 51.59 2jn6 n ASN 20 Cb 0.36 -0.69 0.29 0.00 -0.61 0.00 0.00 39.78 39.13 2jn6 n ASN 20 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2jn6 n SER 21 N 0.32 0.20 -0.32 6.41 3.41 -1.03 -3.36 113.62 119.26 2jn6 n SER 21 Ca 0.31 0.56 0.19 0.00 -0.26 0.00 0.00 58.87 59.68 2jn6 n SER 21 Cb 1.23 -0.60 0.38 0.00 -0.26 0.00 0.00 64.21 64.97 2jn6 n SER 21 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2jn6 h ASP 22 N 0.00 0.09 -0.20 4.04 1.82 -1.85 -1.23 116.42 119.09 2jn6 h ASP 22 Ca 0.00 0.22 -0.17 0.00 -0.39 0.00 0.00 57.03 56.69 2jn6 h ASP 22 Cb 0.17 0.28 -0.19 0.00 0.68 0.00 0.00 39.33 40.27 2jn6 h ASP 22 CO 0.00 -0.24 -0.70 0.61 -1.61 0.00 0.00 179.24 177.30 2jn6 n GLY 23 N -1.36 4.53 3.55 -0.78 0.00 -1.21 -5.01 105.19 104.91 2jn6 n GLY 23 Ca 0.27 -1.52 -0.08 0.00 0.00 0.00 0.00 46.02 44.69 2jn6 n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jn6 s ALA 24 N -2.83 -1.68 0.65 4.61 0.00 -0.46 -5.15 121.76 116.90 2jn6 s ALA 24 Ca 0.40 2.20 -0.15 0.00 0.00 0.00 0.00 51.96 54.41 2jn6 s ALA 24 Cb 0.38 -1.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.18 2jn6 s ALA 24 CO -0.06 -0.37 1.09 0.45 0.00 0.00 0.00 175.76 176.87 2jn6 s SER 25 N 1.61 5.28 0.27 0.00 0.15 -1.26 -4.48 113.70 115.26 2jn6 s SER 25 Ca -0.10 1.90 -0.05 0.00 0.70 0.00 0.00 55.95 58.41 2jn6 s SER 25 Cb -0.06 -2.54 0.32 0.00 -1.71 0.00 0.00 66.02 62.03 2jn6 s SER 25 CO -0.18 -1.51 1.94 0.25 1.20 0.00 0.00 173.24 174.94 2jn6 h LEU 26 N 0.00 1.09 -0.64 3.45 6.46 -2.00 -1.08 115.31 122.60 2jn6 h LEU 26 Ca -0.46 -0.03 0.02 0.00 -0.12 0.00 0.00 57.88 57.29 2jn6 h LEU 26 Cb 1.23 -0.27 -0.04 0.00 -0.73 0.00 0.00 40.66 40.86 2jn6 h LEU 26 CO 0.55 0.79 0.41 -0.61 -0.62 0.00 0.00 178.44 178.96 2jn6 h GLN 27 N 1.29 0.80 -0.67 1.25 5.75 -1.96 -1.95 115.11 119.62 2jn6 h GLN 27 Ca 0.35 -0.05 -0.05 0.00 -0.15 0.00 0.00 58.65 58.75 2jn6 h GLN 27 Cb -0.15 -0.18 -0.03 0.00 1.07 0.00 0.00 27.48 28.19 2jn6 h GLN 27 CO -0.08 0.53 0.23 0.37 -2.65 0.00 0.00 178.83 177.24 2jn6 h GLN 28 N 0.82 1.01 0.12 1.69 5.75 -1.64 0.45 115.11 123.31 2jn6 h GLN 28 Ca 0.25 -0.19 -0.01 0.00 -0.15 0.00 0.00 58.65 58.55 2jn6 h GLN 28 Cb -0.04 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 28.35 2jn6 h GLN 28 CO -0.08 0.85 -0.06 0.82 -2.65 0.00 0.00 178.83 177.71 2jn6 h ILE 29 N 0.98 0.93 -0.30 2.39 1.08 -0.73 0.14 117.51 122.01 2jn6 h ILE 29 Ca 0.22 -0.19 -0.09 0.00 -0.39 0.00 0.00 64.86 64.41 2jn6 h ILE 29 Cb 0.24 1.06 -0.02 0.00 -3.07 0.00 0.00 36.82 35.03 2jn6 h ILE 29 CO -0.01 0.05 -0.18 0.00 -0.69 0.00 0.00 178.15 177.31 2jn6 h ALA 30 N 0.62 1.12 -0.33 1.87 0.00 -1.12 -2.21 119.26 119.21 2jn6 h ALA 30 Ca -0.02 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 2jn6 h ALA 30 Cb 0.20 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2jn6 h ALA 30 CO 0.03 0.55 -0.18 -0.97 0.00 0.00 0.00 179.25 178.68 2jn6 h ASN 31 N 0.49 0.61 0.46 0.00 -0.73 0.12 0.33 115.58 116.86 2jn6 h ASN 31 Ca 0.08 -0.19 -0.21 0.00 1.87 0.00 0.00 56.30 57.85 2jn6 h ASN 31 Cb 0.60 -0.16 -0.01 0.00 0.27 0.00 0.00 38.32 39.02 2jn6 h ASN 31 CO 0.04 0.80 -0.89 -0.78 -0.37 0.00 0.00 177.43 176.23 2jn6 h ASP 32 N 0.55 0.38 1.40 1.15 3.58 -0.46 -3.11 116.42 119.92 2jn6 h ASP 32 Ca 0.09 -0.30 -0.10 0.00 0.42 0.00 0.00 57.03 57.14 2jn6 h ASP 32 Cb 0.62 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.54 2jn6 h ASP 32 CO 0.04 1.09 -0.62 0.25 -2.88 0.00 0.00 179.24 177.13 2jn6 h LEU 33 N 0.17 0.00 0.00 2.28 5.85 -1.20 -3.48 115.31 118.93 2jn6 h LEU 33 Ca -0.06 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.66 2jn6 h LEU 33 Cb 1.51 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.54 2jn6 h LEU 33 CO 0.14 0.46 0.00 0.61 -0.34 0.00 0.00 178.44 179.31 2jn6 n GLY 34 N 1.24 0.88 3.82 3.75 0.00 0.10 -5.07 105.19 109.92 2jn6 n GLY 34 Ca 0.00 -0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2jn6 n GLY 34 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2jn6 s ILE 35 N -2.00 2.50 0.43 -0.61 -4.36 -0.47 -4.99 121.20 111.70 2jn6 s ILE 35 Ca 0.00 -1.48 -0.25 0.00 -0.26 0.00 0.00 60.65 58.66 2jn6 s ILE 35 Cb 0.00 -2.98 -0.08 0.00 1.25 0.00 0.00 42.46 40.65 2jn6 s ILE 35 CO 0.00 0.00 1.25 0.21 0.24 0.00 0.00 174.94 176.64 2jn6 s ASN 36 N -4.05 6.25 0.36 4.36 2.47 -1.26 -4.31 114.94 118.76 2jn6 s ASN 36 Ca 0.45 2.52 0.04 0.00 0.42 0.00 0.00 52.86 56.29 2jn6 s ASN 36 Cb -0.00 -2.62 0.69 0.00 -1.45 0.00 0.00 41.25 37.86 2jn6 s ASN 36 CO 0.26 -0.88 2.00 0.08 -3.72 0.00 0.00 177.10 174.84 2jn6 h ARG 37 N 2.44 0.71 -0.13 0.43 0.11 -1.93 -0.20 114.38 115.82 2jn6 h ARG 37 Ca -0.49 -0.06 -0.23 0.00 0.10 0.00 0.00 59.98 59.30 2jn6 h ARG 37 Cb 1.25 -0.15 0.01 0.00 1.11 0.00 0.00 29.97 32.19 2jn6 h ARG 37 CO 0.62 0.50 -0.82 0.28 0.10 0.00 0.00 179.97 180.65 2jn6 h VAL 38 N 0.72 1.28 -0.76 0.08 2.07 -1.98 -1.04 116.25 116.61 2jn6 h VAL 38 Ca 0.19 -2.02 -0.05 0.00 0.82 0.00 0.00 66.70 65.65 2jn6 h VAL 38 Cb -0.03 2.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 2jn6 h VAL 38 CO -0.04 0.64 0.30 0.74 0.02 0.00 0.00 177.57 179.23 2jn6 h THR 39 N 0.52 1.26 -0.25 2.57 2.02 -1.80 0.12 112.91 117.35 2jn6 h THR 39 Ca -0.06 -0.82 -0.01 0.00 0.77 0.00 0.00 66.41 66.29 2jn6 h THR 39 Cb 1.45 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 2jn6 h THR 39 CO 0.17 0.33 0.13 0.25 0.37 0.00 0.00 175.52 176.77 2jn6 h LEU 40 N 1.11 0.31 -0.87 2.58 5.85 -1.00 -2.91 115.31 120.37 2jn6 h LEU 40 Ca 0.25 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.93 2jn6 h LEU 40 Cb 0.22 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.12 2jn6 h LEU 40 CO -0.02 0.32 0.55 0.50 -0.34 0.00 0.00 178.44 179.45 2jn6 h LYS 41 N 0.28 1.00 -0.62 1.25 3.64 -0.61 -2.03 116.57 119.48 2jn6 h LYS 41 Ca 0.09 -0.06 0.08 0.00 -1.27 0.00 0.00 60.65 59.49 2jn6 h LYS 41 Cb 0.08 -0.23 -0.07 0.00 -0.41 0.00 0.00 32.23 31.61 2jn6 h LYS 41 CO -0.01 0.66 0.28 -0.91 -2.27 0.00 0.00 179.45 177.20 2jn6 h ASN 42 N 1.03 0.35 -0.46 4.20 2.35 -0.58 0.27 115.58 122.74 2jn6 h ASN 42 Ca 0.37 0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 56.12 2jn6 h ASN 42 Cb 0.11 0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 2jn6 h ASN 42 CO -0.15 0.21 0.05 -0.50 -1.65 0.00 0.00 177.43 175.39 2jn6 h TRP 43 N 0.50 0.83 -0.78 1.19 6.55 -1.30 -2.12 115.95 120.82 2jn6 h TRP 43 Ca 0.30 -0.13 -0.02 0.00 0.95 0.00 0.00 58.89 60.00 2jn6 h TRP 43 Cb 0.31 -0.22 -0.04 0.00 -0.86 0.00 0.00 29.16 28.35 2jn6 h TRP 43 CO -0.13 0.79 0.41 0.82 -1.05 0.00 0.00 178.44 179.28 2jn6 h ILE 44 N 0.64 1.24 -0.08 1.49 2.04 -0.60 0.74 117.51 122.99 2jn6 h ILE 44 Ca 0.14 -0.63 -0.15 0.00 1.00 0.00 0.00 64.86 65.22 2jn6 h ILE 44 Cb 0.42 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 2jn6 h ILE 44 CO 0.01 0.27 -0.61 0.40 0.00 0.00 0.00 178.15 178.23 2jn6 h ILE 45 N 1.09 1.38 0.06 -0.67 2.04 -0.41 0.45 117.51 121.46 2jn6 h ILE 45 Ca 0.27 -1.99 -0.17 0.00 1.00 0.00 0.00 64.86 63.98 2jn6 h ILE 45 Cb 0.07 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 2jn6 h ILE 45 CO -0.04 0.59 -0.88 0.50 0.00 0.00 0.00 178.15 178.32 2jn6 h LYS 46 N 0.19 0.12 0.14 2.37 3.64 -1.08 -3.18 116.57 118.78 2jn6 h LYS 46 Ca -0.01 -0.21 -0.34 0.00 -1.27 0.00 0.00 60.65 58.83 2jn6 h LYS 46 Cb 1.12 0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 33.01 2jn6 h LYS 46 CO 0.10 1.10 -1.72 1.88 -2.27 0.00 0.00 179.45 178.54 2jn6 h TYR 47 N -0.68 0.55 -1.96 1.91 -1.99 -0.96 -3.36 116.97 110.48 2jn6 h TYR 47 Ca -0.20 -0.40 -0.70 0.00 2.00 0.00 0.00 58.73 59.43 2jn6 h TYR 47 Cb 1.41 -0.02 -0.34 0.00 2.00 0.00 0.00 36.73 39.79 2jn6 h TYR 47 CO 0.17 1.56 0.29 0.41 -0.00 0.00 0.00 178.16 180.59 2jn6 n GLY 48 N 1.80 5.80 0.35 3.88 0.00 0.15 -4.82 105.19 112.34 2jn6 n GLY 48 Ca -0.23 -2.63 0.18 0.00 0.00 0.00 0.00 46.02 43.34 2jn6 n GLY 48 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2jn6 h SER 49 N 3.12 0.00 0.00 1.61 0.87 -1.58 -3.42 113.55 114.16 2jn6 h SER 49 Ca 0.42 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.98 2jn6 h SER 49 Cb 0.41 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.37 2jn6 h SER 49 CO 1.12 0.00 0.00 -3.20 -0.53 0.00 0.00 176.83 174.22 2jn6 n ASN 50 N -3.54 0.00 -4.56 6.23 2.85 -1.26 -4.89 115.26 110.10 2jn6 n ASN 50 Ca 0.02 0.00 -0.38 0.00 -0.11 0.00 0.00 54.58 54.11 2jn6 n ASN 50 Cb 0.37 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.35 2jn6 n ASN 50 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 2jn6 s HIS 51 N 0.00 2.20 -1.38 1.20 0.09 -1.26 -4.90 115.29 111.24 2jn6 s HIS 51 Ca 0.00 -0.12 -0.13 0.00 -0.00 0.00 0.00 55.06 54.80 2jn6 s HIS 51 Cb 0.00 -4.46 0.08 0.00 -0.00 0.00 0.00 32.58 28.20 2jn6 s HIS 51 CO 0.00 -1.98 2.05 0.27 -0.00 0.00 0.00 174.74 175.08 2jn6 n ASN 52 N 10.61 4.37 -0.05 1.40 6.94 -1.26 -4.67 115.26 132.60 2jn6 n ASN 52 Ca 0.26 -2.93 -0.15 0.00 -0.02 0.00 0.00 54.58 51.74 2jn6 n ASN 52 Cb 0.50 -1.62 -0.07 0.00 -2.36 0.00 0.00 39.78 36.23 2jn6 n ASN 52 CO 0.00 0.00 0.00 1.62 -1.03 0.00 0.00 177.26 177.85 2jn6 h VAL 53 N 4.14 1.33 -3.66 3.53 3.04 -2.01 -3.38 116.25 119.23 2jn6 h VAL 53 Ca 0.50 -1.69 -0.68 0.00 -1.01 0.00 0.00 66.70 63.82 2jn6 h VAL 53 Cb 0.67 1.91 -0.37 0.00 -2.01 0.00 0.00 31.29 31.50 2jn6 h VAL 53 CO 1.74 0.53 -0.67 -1.10 -1.01 0.00 0.00 177.57 177.06 2jn6 s GLN 54 N -3.97 1.91 0.00 4.17 1.11 -1.26 -5.05 119.66 116.58 2jn6 s GLN 54 Ca -0.12 -1.68 0.00 0.00 0.01 0.00 0.00 55.36 53.56 2jn6 s GLN 54 Cb 0.07 -3.29 0.00 0.00 -1.01 0.00 0.00 33.01 28.78 2jn6 s GLN 54 CO 0.84 -0.88 0.00 0.41 0.01 0.00 0.00 175.29 175.67 2jn6 n GLY 55 N 4.45 1.17 2.65 3.09 0.00 -1.26 -5.05 105.19 110.24 2jn6 n GLY 55 Ca -0.03 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.96 2jn6 n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jn6 n THR 56 N 0.00 -9.02 -1.81 2.61 -2.24 -1.26 -4.86 114.28 97.71 2jn6 n THR 56 Ca 0.00 1.94 -0.42 0.00 -2.27 0.00 0.00 64.05 63.30 2jn6 n THR 56 Cb 0.00 -5.08 -0.03 0.00 -2.10 0.00 0.00 70.33 63.12 2jn6 n THR 56 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2jn6 s THR 57 N -0.43 3.01 0.10 4.28 2.01 -1.26 -4.91 115.64 118.45 2jn6 s THR 57 Ca -0.15 0.27 -0.34 0.00 0.31 0.00 0.00 61.69 61.77 2jn6 s THR 57 Cb 0.01 -3.17 -0.13 0.00 0.01 0.00 0.00 72.50 69.22 2jn6 s THR 57 CO 0.42 -0.01 1.66 -0.81 -0.69 0.00 0.00 174.62 175.18 2jn6 n PRO 58 N 6.55 2.18 0.31 4.92 -0.04 -1.26 -4.86 135.00 142.80 2jn6 n PRO 58 Ca 0.18 0.79 0.19 0.00 -0.04 0.00 0.00 63.50 64.62 2jn6 n PRO 58 Cb 0.41 -2.58 0.97 0.00 -0.04 0.00 0.00 33.50 32.25 2jn6 n PRO 58 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2jn6 h SER 59 N 6.76 0.00 1.14 3.54 0.02 -2.03 -1.06 113.55 121.91 2jn6 h SER 59 Ca -0.46 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.49 2jn6 h SER 59 Cb 1.26 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.80 2jn6 h SER 59 CO 0.90 0.02 -0.01 0.00 -1.14 0.00 0.00 176.83 176.60 2jn6 h ALA 60 N 1.98 1.00 0.00 3.77 0.00 -2.02 -3.11 119.26 120.88 2jn6 h ALA 60 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2jn6 h ALA 60 Cb 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2jn6 h ALA 60 CO 0.00 0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.27 2jn6 n ALA 61 N -2.10 2.10 -0.07 0.00 0.00 -0.40 -1.22 120.51 118.82 2jn6 n ALA 61 Ca 0.01 -0.10 -0.13 0.00 0.00 0.00 0.00 53.44 53.22 2jn6 n ALA 61 Cb 0.34 -1.34 -0.06 0.00 0.00 0.00 0.00 19.45 18.39 2jn6 n ALA 61 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2jn6 h VAL 62 N 0.00 1.32 0.06 0.00 2.07 -1.73 -2.18 116.25 115.79 2jn6 h VAL 62 Ca 0.00 -1.26 -0.30 0.00 0.82 0.00 0.00 66.70 65.95 2jn6 h VAL 62 Cb 0.19 1.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 2jn6 h VAL 62 CO 0.00 0.38 -1.66 0.28 0.02 0.00 0.00 177.57 176.59 2jn6 h SER 63 N 0.12 0.19 -0.17 0.57 0.02 -1.73 -3.35 113.55 109.20 2jn6 h SER 63 Ca 0.04 -0.34 -0.00 0.00 -0.84 0.00 0.00 61.79 60.65 2jn6 h SER 63 Cb 0.66 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.13 2jn6 h SER 63 CO 0.04 1.30 0.10 -0.08 -1.14 0.00 0.00 176.83 177.05 2jn6 h GLU 64 N 0.03 0.24 -0.18 3.45 4.57 -1.21 -2.40 114.58 119.08 2jn6 h GLU 64 Ca -0.28 -0.02 0.05 0.00 -1.18 0.00 0.00 59.36 57.94 2jn6 h GLU 64 Cb 2.00 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 30.53 2jn6 h GLU 64 CO 0.11 0.18 0.22 0.00 -1.18 0.00 0.00 179.01 178.33 2jn6 h ALA 65 N 1.87 1.76 0.18 2.92 0.00 -1.53 0.51 119.26 124.97 2jn6 h ALA 65 Ca 0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2jn6 h ALA 65 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2jn6 h ALA 65 CO -0.01 -0.31 -0.09 1.49 0.00 0.00 0.00 179.25 180.33 2jn6 h GLU 66 N 0.00 -0.24 -0.04 0.00 4.22 -1.68 -1.65 114.58 115.19 2jn6 h GLU 66 Ca 0.09 0.02 -0.14 0.00 0.08 0.00 0.00 59.36 59.40 2jn6 h GLU 66 Cb 0.52 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 2jn6 h GLU 66 CO -0.00 0.17 -0.60 -0.56 -2.18 0.00 0.00 179.01 175.84 2jn6 h GLN 67 N -0.78 0.15 -0.63 1.92 -0.00 -1.56 -2.59 115.11 111.62 2jn6 h GLN 67 Ca -0.03 -0.10 -0.02 0.00 -0.00 0.00 0.00 58.65 58.50 2jn6 h GLN 67 Cb 0.52 0.02 -0.03 0.00 -0.00 0.00 0.00 27.48 27.98 2jn6 h GLN 67 CO 0.04 0.71 0.32 0.82 -0.00 0.00 0.00 178.83 180.71 2jn6 h ILE 68 N 0.11 1.21 -0.04 1.86 2.04 -0.97 -1.22 117.51 120.50 2jn6 h ILE 68 Ca -0.01 -0.58 -0.05 0.00 1.00 0.00 0.00 64.86 65.23 2jn6 h ILE 68 Cb 1.09 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 2jn6 h ILE 68 CO 0.09 0.24 -0.20 -0.09 0.00 0.00 0.00 178.15 178.19 2jn6 h ARG 69 N 0.86 0.06 -0.03 2.37 1.12 -1.05 0.21 114.38 117.93 2jn6 h ARG 69 Ca 0.22 -0.01 -0.01 0.00 -1.11 0.00 0.00 59.98 59.07 2jn6 h ARG 69 Cb 0.09 -0.01 -0.00 0.00 -0.01 0.00 0.00 29.97 30.04 2jn6 h ARG 69 CO -0.03 0.27 -0.00 0.37 -3.11 0.00 0.00 179.97 177.46 2jn6 h GLN 70 N 0.06 0.06 -0.83 0.20 -0.00 -1.03 -0.91 115.11 112.65 2jn6 h GLN 70 Ca 0.01 -0.02 -0.02 0.00 -0.00 0.00 0.00 58.65 58.62 2jn6 h GLN 70 Cb 0.39 -0.00 -0.04 0.00 0.00 0.00 0.00 27.48 27.83 2jn6 h GLN 70 CO 0.03 0.39 0.44 1.25 0.00 0.00 0.00 178.83 180.93 2jn6 h LEU 71 N -0.28 1.05 -1.80 -2.39 7.12 -0.67 -0.53 115.31 117.82 2jn6 h LEU 71 Ca 0.01 -0.10 -0.03 0.00 0.13 0.00 0.00 57.88 57.89 2jn6 h LEU 71 Cb 0.36 -0.27 -0.00 0.00 -0.53 0.00 0.00 40.66 40.22 2jn6 h LEU 71 CO 0.00 0.86 -0.15 0.11 -0.13 0.00 0.00 178.44 179.12 2jn6 h LYS 72 N 1.17 0.00 -1.06 1.25 1.79 -0.52 -3.46 116.57 115.74 2jn6 h LYS 72 Ca 0.29 0.00 -0.26 0.00 -2.18 0.00 0.00 60.65 58.50 2jn6 h LYS 72 Cb 0.05 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.63 2jn6 h LYS 72 CO -0.04 0.15 -0.27 1.63 -1.08 0.00 0.00 179.45 179.84 2jn6 n LYS 73 N -3.85 -0.93 -2.52 3.15 5.02 -0.21 -4.96 118.16 113.86 2jn6 n LYS 73 Ca -0.02 0.82 -0.43 0.00 -2.02 0.00 0.00 58.31 56.66 2jn6 n LYS 73 Cb 0.25 -4.93 -0.02 0.00 -0.02 0.00 0.00 35.03 30.31 2jn6 n LYS 73 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2jn6 s GLU 74 N -3.66 3.96 0.53 1.97 2.02 -1.04 -5.02 118.70 117.46 2jn6 s GLU 74 Ca 0.00 1.12 0.04 0.00 0.02 0.00 0.00 54.97 56.14 2jn6 s GLU 74 Cb 0.00 -3.82 0.02 0.00 0.10 0.00 0.00 34.13 30.42 2jn6 s GLU 74 CO 0.00 -1.06 0.23 0.54 0.02 0.00 0.00 175.26 175.00 2jn6 s ASN 75 N 2.31 4.42 0.29 -0.19 2.20 -1.26 -4.89 114.94 117.82 2jn6 s ASN 75 Ca 0.51 -1.42 0.13 0.00 -0.94 0.00 0.00 52.86 51.14 2jn6 s ASN 75 Cb -0.14 0.46 0.39 0.00 -2.00 0.00 0.00 41.25 39.97 2jn6 s ASN 75 CO 0.21 -1.00 1.61 0.00 -2.94 0.00 0.00 177.10 174.98 2jn6 h ALA 76 N 1.00 0.90 0.00 3.54 0.00 -2.03 -3.19 119.26 119.49 2jn6 h ALA 76 Ca -0.40 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 53.97 2jn6 h ALA 76 Cb 1.31 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 2jn6 h ALA 76 CO 0.64 0.71 -0.12 -0.07 0.00 0.00 0.00 179.25 180.41 2jn6 h LEU 77 N 0.00 0.00 -0.14 0.00 3.38 -1.97 -2.74 115.31 113.84 2jn6 h LEU 77 Ca -0.01 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.01 2jn6 h LEU 77 Cb 1.11 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.80 2jn6 h LEU 77 CO 0.07 0.12 -0.38 -0.61 0.09 0.00 0.00 178.44 177.73 2jn6 h GLN 78 N 0.00 -0.43 0.00 1.13 -0.00 -1.96 -1.38 115.11 112.46 2jn6 h GLN 78 Ca -0.00 0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.68 2jn6 h GLN 78 Cb 0.30 0.10 0.00 0.00 0.00 0.00 0.00 27.48 27.87 2jn6 h GLN 78 CO 0.02 -0.29 -0.45 0.54 0.00 0.00 0.00 178.83 178.65 2jn6 n ARG 79 N -5.43 0.29 0.28 1.69 1.74 -1.17 -3.03 116.66 111.03 2jn6 n ARG 79 Ca -0.03 0.13 0.17 0.00 -0.77 0.00 0.00 57.85 57.35 2jn6 n ARG 79 Cb 0.35 -1.73 0.69 0.00 -1.02 0.00 0.00 32.46 30.76 2jn6 n ARG 79 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jn6 h ALA 80 N 2.50 1.00 0.00 7.54 0.00 -1.09 -2.29 119.26 126.93 2jn6 h ALA 80 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jn6 h ALA 80 Cb 0.75 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2jn6 h ALA 80 CO 0.00 0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.26 2jn6 h ARG 81 N 0.00 0.00 -0.00 0.00 3.08 -1.19 -3.26 114.38 113.01 2jn6 h ARG 81 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2jn6 h ARG 81 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.55 2jn6 h ARG 81 CO 0.00 0.00 -0.06 2.41 -1.07 0.00 0.00 179.97 181.25 2jn6 n THR 82 N -2.77 0.00 -3.94 2.04 -1.04 -0.86 -4.83 114.28 102.89 2jn6 n THR 82 Ca 0.03 -0.07 -0.29 0.00 -2.04 0.00 0.00 64.05 61.68 2jn6 n THR 82 Cb 0.39 -0.14 -0.04 0.00 -1.82 0.00 0.00 70.33 68.73 2jn6 n THR 82 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jn6 s ARG 83 N -2.31 3.41 0.22 -2.82 1.04 -1.23 -5.11 118.95 112.15 2jn6 s ARG 83 Ca 0.34 -0.51 -0.03 0.00 -1.04 0.00 0.00 55.73 54.50 2jn6 s ARG 83 Cb 0.21 -3.00 -0.05 0.00 -2.04 0.00 0.00 34.95 30.07 2jn6 s ARG 83 CO 0.43 0.57 0.44 -1.01 -0.04 0.00 0.00 175.30 175.69 2jn6 s HIS 84 N -1.59 3.48 0.88 5.89 3.76 -1.26 -5.09 115.29 121.35 2jn6 s HIS 84 Ca 0.35 0.46 -0.13 0.00 -0.15 0.00 0.00 55.06 55.59 2jn6 s HIS 84 Cb -0.12 -1.95 0.14 0.00 1.11 0.00 0.00 32.58 31.76 2jn6 s HIS 84 CO 0.28 0.33 1.24 -1.25 -0.85 0.00 0.00 174.74 174.49 2jn6 s PRO 85 N -3.27 1.28 -0.54 8.40 0.04 -1.26 -5.05 135.00 134.61 2jn6 s PRO 85 Ca 0.40 -0.22 0.07 0.00 0.04 0.00 0.00 61.00 61.29 2jn6 s PRO 85 Cb -0.11 -1.92 0.26 0.00 0.04 0.00 0.00 34.50 32.77 2jn6 s PRO 85 CO 0.28 -2.00 0.69 0.00 0.04 0.00 0.00 177.00 176.02 2jn6 n ALA 86 N -3.51 3.46 -0.16 8.56 0.00 -1.26 -4.93 120.51 122.67 2jn6 n ALA 86 Ca 0.12 -4.24 -0.00 0.00 0.00 0.00 0.00 53.44 49.32 2jn6 n ALA 86 Cb 0.60 -0.86 0.25 0.00 0.00 0.00 0.00 19.45 19.44 2jn6 n ALA 86 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2jn6 h GLU 87 N 3.96 0.89 -0.50 0.00 5.08 -1.99 -1.51 114.58 120.50 2jn6 h GLU 87 Ca 0.15 -0.09 -0.13 0.00 -1.00 0.00 0.00 59.36 58.28 2jn6 h GLU 87 Cb 0.74 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 2jn6 h GLU 87 CO 0.69 0.65 -0.20 1.03 -1.00 0.00 0.00 179.01 180.19 2jn6 h SER 88 N 0.90 1.04 1.01 1.42 0.87 -1.91 -2.58 113.55 114.29 2jn6 h SER 88 Ca 0.23 -0.39 -0.07 0.00 -1.23 0.00 0.00 61.79 60.33 2jn6 h SER 88 Cb 0.03 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 61.69 2jn6 h SER 88 CO -0.04 1.19 -0.34 0.00 -0.53 0.00 0.00 176.83 177.11 2jn6 h LEU 90 N 0.00 0.62 0.01 0.00 5.85 -1.10 -3.27 115.31 117.42 2jn6 h LEU 90 Ca -0.00 -0.32 -0.04 0.00 0.84 0.00 0.00 57.88 58.36 2jn6 h LEU 90 Cb 0.94 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.80 2jn6 h LEU 90 CO 0.04 1.03 -0.15 -0.08 -0.34 0.00 0.00 178.44 178.95 2jn6 h GLU 91 N 0.44 0.08 -3.21 1.25 4.22 -1.09 -3.46 114.58 112.80 2jn6 h GLU 91 Ca 0.01 -0.10 -0.23 0.00 0.08 0.00 0.00 59.36 59.13 2jn6 h GLU 91 Cb 1.07 0.03 -0.31 0.00 0.50 0.00 0.00 28.75 30.04 2jn6 h GLU 91 CO 0.10 0.94 -0.57 -1.01 -2.18 0.00 0.00 179.01 176.30 2jn6 s HIS 92 N -2.73 -0.20 0.29 0.92 3.76 0.20 -5.12 115.29 112.40 2jn6 s HIS 92 Ca -0.17 0.55 0.03 0.00 -0.15 0.00 0.00 55.06 55.32 2jn6 s HIS 92 Cb -0.01 -0.04 -0.06 0.00 1.11 0.00 0.00 32.58 33.58 2jn6 s HIS 92 CO 0.72 -0.17 0.05 -3.38 -0.85 0.00 0.00 174.74 171.10 2jn6 s HIS 93 N 1.09 1.76 -0.15 1.40 -3.43 -1.24 -3.83 115.29 110.89 2jn6 s HIS 93 Ca -0.08 -1.00 -0.28 0.00 -0.80 0.00 0.00 55.06 52.89 2jn6 s HIS 93 Cb -0.10 -1.09 -0.01 0.00 -1.43 0.00 0.00 32.58 29.95 2jn6 s HIS 93 CO -0.06 -0.09 0.95 -1.58 -2.00 0.00 0.00 174.74 171.96 2jn6 s HIS 94 N -3.44 3.45 -0.09 0.38 2.46 -1.26 -5.02 115.29 111.76 2jn6 s HIS 94 Ca 0.35 1.45 0.01 0.00 0.47 0.00 0.00 55.06 57.34 2jn6 s HIS 94 Cb 0.08 -3.14 0.02 0.00 -0.13 0.00 0.00 32.58 29.40 2jn6 s HIS 94 CO 0.13 -0.28 -0.10 -1.58 -2.47 0.00 0.00 174.74 170.44 2jn6 s HIS 95 N 2.29 1.47 -0.01 3.88 5.04 -1.26 -5.13 115.29 121.58 2jn6 s HIS 95 Ca 0.44 -0.64 -0.23 0.00 -1.54 0.00 0.00 55.06 53.09 2jn6 s HIS 95 Cb -0.17 -1.15 -0.05 0.00 0.04 0.00 0.00 32.58 31.25 2jn6 s HIS 95 CO 0.14 -0.40 0.69 -1.58 -2.34 0.00 0.00 174.74 171.25 2jn6 s HIS 96 N 1.18 3.66 0.00 3.88 2.46 -1.26 -5.34 115.29 119.87 2jn6 s HIS 96 Ca -0.05 1.30 0.00 0.00 0.47 0.00 0.00 55.06 56.79 2jn6 s HIS 96 Cb -0.14 -2.74 0.00 0.00 -0.13 0.00 0.00 32.58 29.56 2jn6 s HIS 96 CO -0.02 0.24 0.00 1.58 -2.47 0.00 0.00 174.74 174.06