#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jn6 h PRO 2 N 0.00 -0.38 -3.84 0.03 0.11 -2.12 -3.47 132.00 122.33 2jn6 h PRO 2 Ca 0.00 0.03 -0.15 0.00 0.11 0.00 0.00 66.00 65.99 2jn6 h PRO 2 Cb 0.00 0.09 -0.20 0.00 0.11 0.00 0.00 31.00 31.00 2jn6 h PRO 2 CO 0.00 -0.04 -0.61 0.95 -0.21 0.00 0.00 178.00 178.10 2jn6 s THR 3 N -4.30 0.12 -0.64 -1.15 -4.23 -1.26 -5.10 115.64 99.07 2jn6 s THR 3 Ca -0.14 -0.97 -0.28 0.00 -1.18 0.00 0.00 61.69 59.12 2jn6 s THR 3 Cb 0.02 -0.55 0.03 0.00 1.34 0.00 0.00 72.50 73.33 2jn6 s THR 3 CO 0.51 -0.54 1.22 -0.75 -0.54 0.00 0.00 174.62 174.52 2jn6 s LYS 4 N -1.91 3.38 0.17 3.99 2.20 -1.26 -4.99 119.74 121.31 2jn6 s LYS 4 Ca -0.11 0.03 -0.03 0.00 -0.36 0.00 0.00 55.97 55.49 2jn6 s LYS 4 Cb -0.06 -4.08 -0.05 0.00 -1.51 0.00 0.00 37.83 32.13 2jn6 s LYS 4 CO -0.02 -1.86 0.38 0.99 -0.36 0.00 0.00 175.35 174.48 2jn6 s THR 5 N 5.22 5.18 0.18 3.43 2.01 -1.26 -5.10 115.64 125.30 2jn6 s THR 5 Ca 0.39 -0.11 -0.17 0.00 0.31 0.00 0.00 61.69 62.11 2jn6 s THR 5 Cb -0.08 -3.66 0.03 0.00 0.01 0.00 0.00 72.50 68.80 2jn6 s THR 5 CO 0.21 -0.04 0.49 -0.72 -0.69 0.00 0.00 174.62 173.86 2jn6 s TYR 6 N -1.74 -0.13 0.31 4.92 -0.85 -1.26 -5.17 117.35 113.43 2jn6 s TYR 6 Ca 0.40 -0.20 0.10 0.00 -0.52 0.00 0.00 57.07 56.84 2jn6 s TYR 6 Cb -0.12 0.34 -0.05 0.00 0.38 0.00 0.00 41.96 42.51 2jn6 s TYR 6 CO 0.26 -0.85 -0.04 -1.12 -1.52 0.00 0.00 175.55 172.28 2jn6 s SER 7 N -2.86 4.11 0.49 -0.18 0.01 -1.26 -4.98 113.70 109.04 2jn6 s SER 7 Ca 0.08 -0.95 0.22 0.00 1.31 0.00 0.00 55.95 56.61 2jn6 s SER 7 Cb -0.00 -0.54 1.27 0.00 0.21 0.00 0.00 66.02 66.97 2jn6 s SER 7 CO -0.05 -0.14 2.04 -0.33 0.41 0.00 0.00 173.24 175.17 2jn6 h GLU 8 N 1.92 0.00 -0.43 12.44 5.08 -2.03 -0.02 114.58 131.55 2jn6 h GLU 8 Ca -0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 2jn6 h GLU 8 Cb 1.25 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.48 2jn6 h GLU 8 CO 0.65 0.15 0.28 1.49 -1.00 0.00 0.00 179.01 180.57 2jn6 h GLU 9 N 0.00 0.57 -0.48 2.33 4.81 -1.99 0.57 114.58 120.39 2jn6 h GLU 9 Ca -0.00 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.14 2jn6 h GLU 9 Cb 0.32 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 2jn6 h GLU 9 CO 0.02 0.39 0.09 0.35 -0.73 0.00 0.00 179.01 179.12 2jn6 h PHE 10 N 0.57 0.77 -0.26 0.92 3.57 -1.51 0.82 116.94 121.83 2jn6 h PHE 10 Ca 0.16 -0.07 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 2jn6 h PHE 10 Cb -0.05 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.45 2jn6 h PHE 10 CO -0.04 0.67 0.15 0.87 -2.23 0.00 0.00 178.31 177.73 2jn6 h LYS 11 N 0.72 0.35 -0.80 1.11 1.57 -0.64 -0.83 116.57 118.05 2jn6 h LYS 11 Ca 0.16 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.86 2jn6 h LYS 11 Cb 0.31 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.51 2jn6 h LYS 11 CO 0.00 0.29 0.36 -0.09 -0.57 0.00 0.00 179.45 179.45 2jn6 h ARG 12 N 0.31 1.17 -0.81 3.15 1.12 -0.29 -1.84 114.38 117.18 2jn6 h ARG 12 Ca 0.09 -0.19 -0.02 0.00 -1.11 0.00 0.00 59.98 58.76 2jn6 h ARG 12 Cb 0.04 -0.20 -0.04 0.00 -0.01 0.00 0.00 29.97 29.76 2jn6 h ARG 12 CO -0.02 0.92 0.44 0.22 -3.11 0.00 0.00 179.97 178.42 2jn6 h ASP 13 N 1.14 1.01 -0.51 -3.80 1.82 -0.64 -1.91 116.42 113.54 2jn6 h ASP 13 Ca 0.27 -0.10 -0.02 0.00 -0.39 0.00 0.00 57.03 56.79 2jn6 h ASP 13 Cb 0.15 -0.26 -0.03 0.00 0.68 0.00 0.00 39.33 39.88 2jn6 h ASP 13 CO -0.03 0.82 0.25 0.00 -1.61 0.00 0.00 179.24 178.67 2jn6 h ALA 14 N 1.23 1.43 -0.53 -0.78 0.00 -0.66 0.01 119.26 119.96 2jn6 h ALA 14 Ca 0.28 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 2jn6 h ALA 14 Cb 0.03 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2jn6 h ALA 14 CO -0.05 0.45 0.13 0.28 0.00 0.00 0.00 179.25 180.07 2jn6 h VAL 15 N 0.76 1.24 0.00 0.00 2.07 -0.66 -2.40 116.25 117.27 2jn6 h VAL 15 Ca 0.19 -0.85 -0.06 0.00 0.82 0.00 0.00 66.70 66.80 2jn6 h VAL 15 Cb 0.09 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 2jn6 h VAL 15 CO -0.02 0.31 -0.29 0.00 0.02 0.00 0.00 177.57 177.59 2jn6 h ALA 16 N 1.01 1.39 -0.29 1.67 0.00 -0.62 -1.98 119.26 120.43 2jn6 h ALA 16 Ca 0.17 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 2jn6 h ALA 16 Cb 0.33 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2jn6 h ALA 16 CO 0.00 0.36 -0.09 -0.07 0.00 0.00 0.00 179.25 179.45 2jn6 h LEU 17 N 0.00 0.45 -0.74 0.00 3.38 -0.53 -2.35 115.31 115.51 2jn6 h LEU 17 Ca -0.00 -0.10 -0.12 0.00 0.09 0.00 0.00 57.88 57.75 2jn6 h LEU 17 Cb 0.56 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2jn6 h LEU 17 CO 0.04 0.58 -0.56 0.22 0.09 0.00 0.00 178.44 178.81 2jn6 h TYR 18 N 0.44 0.00 0.00 1.13 3.20 -1.01 -1.79 116.97 118.94 2jn6 h TYR 18 Ca 0.09 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 2jn6 h TYR 18 Cb 0.43 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.70 2jn6 h TYR 18 CO 0.01 0.56 -0.05 0.93 -1.64 0.00 0.00 178.16 177.98 2jn6 h GLU 19 N 0.00 0.00 -0.63 1.82 5.08 -1.19 -2.75 114.58 116.90 2jn6 h GLU 19 Ca -0.01 0.00 -0.42 0.00 -1.00 0.00 0.00 59.36 57.94 2jn6 h GLU 19 Cb 1.08 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 30.07 2jn6 h GLU 19 CO 0.07 0.05 -0.14 0.09 -1.00 0.00 0.00 179.01 178.08 2jn6 n ASN 20 N -3.17 4.41 0.02 1.42 3.02 -0.72 -4.65 115.26 115.58 2jn6 n ASN 20 Ca 0.00 -3.78 0.14 0.00 -0.03 0.00 0.00 54.58 50.91 2jn6 n ASN 20 Cb 0.32 -0.61 0.58 0.00 -0.61 0.00 0.00 39.78 39.46 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 -0.94 0.15 -0.34 6.41 3.41 -0.91 -4.06 113.62 117.33 2jn6 n SER 21 Ca 0.44 0.50 0.21 0.00 -0.26 0.00 0.00 58.87 59.76 2jn6 n SER 21 Cb 0.94 -0.53 0.45 0.00 -0.26 0.00 0.00 64.21 64.81 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 0.56 -0.09 4.04 3.58 -1.84 0.48 116.42 123.15 2jn6 h ASP 22 Ca 0.00 0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.58 2jn6 h ASP 22 Cb 0.54 0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.64 2jn6 h ASP 22 CO 0.00 0.04 0.00 0.61 -2.88 0.00 0.00 179.24 177.01 2jn6 n GLY 23 N -1.37 0.44 2.73 -0.78 0.00 -1.26 -4.92 105.19 100.03 2jn6 n GLY 23 Ca 0.28 -0.43 -0.20 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.18 0.02 0.83 4.61 0.00 0.16 -5.14 121.76 121.05 2jn6 s ALA 24 Ca 0.19 0.18 -0.11 0.00 0.00 0.00 0.00 51.96 52.22 2jn6 s ALA 24 Cb 0.13 -1.01 0.10 0.00 0.00 0.00 0.00 23.12 22.34 2jn6 s ALA 24 CO 0.19 -0.93 1.14 -1.12 0.00 0.00 0.00 175.76 175.04 2jn6 s SER 25 N 2.25 3.67 0.24 0.00 0.01 -1.26 -4.44 113.70 114.17 2jn6 s SER 25 Ca 0.04 2.10 -0.06 0.00 1.31 0.00 0.00 55.95 59.34 2jn6 s SER 25 Cb -0.14 -2.56 0.27 0.00 0.21 0.00 0.00 66.02 63.80 2jn6 s SER 25 CO -0.08 -2.60 1.91 0.25 0.41 0.00 0.00 173.24 173.12 2jn6 h LEU 26 N -1.34 1.06 -1.48 2.44 5.85 -1.99 0.04 115.31 119.88 2jn6 h LEU 26 Ca -0.44 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.23 2jn6 h LEU 26 Cb 1.26 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 2jn6 h LEU 26 CO 0.46 0.74 -0.02 -0.61 -0.34 0.00 0.00 178.44 178.68 2jn6 h GLN 27 N 1.24 0.32 -0.28 1.25 5.75 -1.99 -1.86 115.11 119.54 2jn6 h GLN 27 Ca 0.36 -0.05 -0.14 0.00 -0.15 0.00 0.00 58.65 58.67 2jn6 h GLN 27 Cb -0.07 -0.05 -0.00 0.00 1.07 0.00 0.00 27.48 28.42 2jn6 h GLN 27 CO -0.10 0.36 -0.37 0.37 -2.65 0.00 0.00 178.83 176.44 2jn6 h GLN 28 N 0.31 0.74 -0.14 1.69 -0.00 -1.37 0.88 115.11 117.22 2jn6 h GLN 28 Ca 0.07 -0.43 0.03 0.00 -0.00 0.00 0.00 58.65 58.32 2jn6 h GLN 28 Cb 0.24 0.03 -0.03 0.00 0.00 0.00 0.00 27.48 27.73 2jn6 h GLN 28 CO 0.01 1.05 -0.03 0.82 0.00 0.00 0.00 178.83 180.68 2jn6 h ILE 29 N 0.49 0.86 -0.15 2.39 1.08 -0.84 0.27 117.51 121.61 2jn6 h ILE 29 Ca 0.03 -0.00 -0.08 0.00 -0.39 0.00 0.00 64.86 64.42 2jn6 h ILE 29 Cb 0.96 0.86 -0.01 0.00 -3.07 0.00 0.00 36.82 35.56 2jn6 h ILE 29 CO 0.09 0.00 -0.26 0.00 -0.69 0.00 0.00 178.15 177.29 2jn6 h ALA 30 N 1.14 1.30 -0.08 1.87 0.00 -1.29 -2.12 119.26 120.08 2jn6 h ALA 30 Ca 0.07 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 2jn6 h ALA 30 Cb 0.10 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2jn6 h ALA 30 CO -0.15 0.48 -0.11 -0.97 0.00 0.00 0.00 179.25 178.50 2jn6 h ASN 31 N 0.24 0.23 -0.49 0.00 -0.73 -0.12 0.16 115.58 114.87 2jn6 h ASN 31 Ca 0.04 -0.52 -0.09 0.00 1.87 0.00 0.00 56.30 57.60 2jn6 h ASN 31 Cb 0.59 -0.06 -0.02 0.00 0.27 0.00 0.00 38.32 39.10 2jn6 h ASN 31 CO 0.04 0.70 -0.05 -0.78 -0.37 0.00 0.00 177.43 176.98 2jn6 h ASP 32 N -0.24 0.88 0.22 1.15 3.58 -0.43 -2.92 116.42 118.65 2jn6 h ASP 32 Ca 0.01 -0.33 -0.19 0.00 0.42 0.00 0.00 57.03 56.93 2jn6 h ASP 32 Cb 0.65 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 41.46 2jn6 h ASP 32 CO 0.02 1.00 -0.76 -0.07 -2.88 0.00 0.00 179.24 176.55 2jn6 h LEU 33 N 0.74 0.54 -0.43 2.28 4.07 -1.44 -3.48 115.31 117.59 2jn6 h LEU 33 Ca 0.13 -0.37 0.00 0.00 0.08 0.00 0.00 57.88 57.72 2jn6 h LEU 33 Cb 0.58 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.16 2jn6 h LEU 33 CO 0.03 1.12 0.00 0.61 -1.08 0.00 0.00 178.44 179.13 2jn6 n GLY 34 N 0.63 0.98 3.45 0.83 0.00 0.35 -5.09 105.19 106.34 2jn6 n GLY 34 Ca -0.05 -0.30 -0.22 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.43 1.10 0.35 -0.61 -4.36 -0.04 -5.03 121.20 110.16 2jn6 s ILE 35 Ca 0.00 -2.00 -0.26 0.00 -0.26 0.00 0.00 60.65 58.13 2jn6 s ILE 35 Cb 0.00 -2.74 -0.09 0.00 1.25 0.00 0.00 42.46 40.88 2jn6 s ILE 35 CO 0.00 0.00 1.01 0.21 0.24 0.00 0.00 174.94 176.40 2jn6 s ASN 36 N -3.49 7.09 0.28 4.36 3.84 -1.26 -4.53 114.94 121.23 2jn6 s ASN 36 Ca 0.35 1.99 -0.02 0.00 0.21 0.00 0.00 52.86 55.39 2jn6 s ASN 36 Cb 0.08 -2.59 0.39 0.00 -0.55 0.00 0.00 41.25 38.58 2jn6 s ASN 36 CO 0.15 -0.25 1.86 -0.09 -2.79 0.00 0.00 177.10 175.99 2jn6 h ARG 37 N 3.01 0.95 -0.09 0.43 2.43 -1.94 0.19 114.38 119.37 2jn6 h ARG 37 Ca -0.47 -0.15 -0.22 0.00 -0.81 0.00 0.00 59.98 58.33 2jn6 h ARG 37 Cb 1.20 -0.17 0.01 0.00 -0.42 0.00 0.00 29.97 30.60 2jn6 h ARG 37 CO 0.64 0.76 -0.79 0.28 -1.51 0.00 0.00 179.97 179.35 2jn6 h VAL 38 N 0.94 1.31 -0.73 0.20 2.07 -1.98 -1.05 116.25 117.00 2jn6 h VAL 38 Ca 0.22 -2.03 0.01 0.00 0.82 0.00 0.00 66.70 65.72 2jn6 h VAL 38 Cb 0.16 2.19 -0.04 0.00 -1.52 0.00 0.00 31.29 32.08 2jn6 h VAL 38 CO -0.02 0.63 0.48 0.74 0.02 0.00 0.00 177.57 179.42 2jn6 h THR 39 N 0.37 1.19 -0.22 2.57 2.02 -1.89 0.86 112.91 117.80 2jn6 h THR 39 Ca -0.07 -0.35 0.01 0.00 0.77 0.00 0.00 66.41 66.77 2jn6 h THR 39 Cb 1.44 0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 2jn6 h THR 39 CO 0.16 0.18 0.13 0.25 0.37 0.00 0.00 175.52 176.61 2jn6 h LEU 40 N 0.99 0.20 -0.61 2.58 5.85 -0.90 -2.41 115.31 121.01 2jn6 h LEU 40 Ca 0.27 0.00 0.03 0.00 0.84 0.00 0.00 57.88 59.02 2jn6 h LEU 40 Cb -0.11 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 40.84 2jn6 h LEU 40 CO -0.06 0.15 0.37 0.50 -0.34 0.00 0.00 178.44 179.06 2jn6 h LYS 41 N 0.26 0.70 -0.77 1.25 3.64 -0.60 -1.38 116.57 119.67 2jn6 h LYS 41 Ca 0.09 -0.04 0.06 0.00 -1.27 0.00 0.00 60.65 59.48 2jn6 h LYS 41 Cb 0.00 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 31.62 2jn6 h LYS 41 CO -0.05 0.46 0.51 -0.91 -2.27 0.00 0.00 179.45 177.19 2jn6 h ASN 42 N 0.72 0.75 -0.18 4.20 2.35 -0.60 -0.52 115.58 122.30 2jn6 h ASN 42 Ca 0.25 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.90 2jn6 h ASN 42 Cb 0.04 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.25 2jn6 h ASN 42 CO -0.11 0.49 -0.27 -0.50 -1.65 0.00 0.00 177.43 175.39 2jn6 h TRP 43 N 0.86 0.62 -0.44 1.19 6.55 -0.86 -2.18 115.95 121.68 2jn6 h TRP 43 Ca 0.33 -0.21 0.01 0.00 0.95 0.00 0.00 58.89 59.96 2jn6 h TRP 43 Cb 0.19 -0.12 -0.02 0.00 -0.86 0.00 0.00 29.16 28.35 2jn6 h TRP 43 CO -0.00 0.91 0.29 0.82 -1.05 0.00 0.00 178.44 179.41 2jn6 h ILE 44 N 0.15 1.10 -0.35 1.49 2.04 -0.58 0.61 117.51 121.98 2jn6 h ILE 44 Ca 0.02 -0.20 -0.11 0.00 1.00 0.00 0.00 64.86 65.56 2jn6 h ILE 44 Cb 0.85 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 2jn6 h ILE 44 CO 0.06 0.11 -0.22 0.40 0.00 0.00 0.00 178.15 178.50 2jn6 h ILE 45 N 0.58 1.29 0.11 -0.67 2.04 -1.17 -0.61 117.51 119.08 2jn6 h ILE 45 Ca 0.16 -1.36 -0.01 0.00 1.00 0.00 0.00 64.86 64.66 2jn6 h ILE 45 Cb -0.05 1.41 0.00 0.00 -0.74 0.00 0.00 36.82 37.44 2jn6 h ILE 45 CO -0.04 0.45 -0.05 0.50 0.00 0.00 0.00 178.15 179.00 2jn6 h LYS 46 N 0.54 -0.15 0.00 2.37 3.64 -1.16 -3.21 116.57 118.60 2jn6 h LYS 46 Ca 0.07 0.01 -0.17 0.00 -1.27 0.00 0.00 60.65 59.29 2jn6 h LYS 46 Cb 0.78 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.60 2jn6 h LYS 46 CO 0.06 0.35 -0.99 1.88 -2.27 0.00 0.00 179.45 178.47 2jn6 h TYR 47 N -0.80 0.00 0.00 1.91 -1.99 -1.00 -3.18 116.97 111.91 2jn6 h TYR 47 Ca -0.02 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.71 2jn6 h TYR 47 Cb 0.56 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.29 2jn6 h TYR 47 CO 0.10 0.69 0.00 0.41 -0.00 0.00 0.00 178.16 179.36 2jn6 n GLY 48 N 1.33 -1.13 0.14 3.88 0.00 -0.23 -2.09 105.19 107.09 2jn6 n GLY 48 Ca -0.04 -0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.00 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 0.00 0.00 0.00 1.61 0.87 -1.55 -3.48 113.55 111.00 2jn6 h SER 49 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2jn6 h SER 49 Cb 0.31 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 2jn6 h SER 49 CO 0.00 0.51 0.00 -3.20 -0.53 0.00 0.00 176.83 173.61 2jn6 n ASN 50 N -3.24 0.00 -3.31 6.23 5.15 -0.89 -3.76 115.26 115.45 2jn6 n ASN 50 Ca 0.02 0.00 -0.12 0.00 -0.60 0.00 0.00 54.58 53.88 2jn6 n ASN 50 Cb 0.74 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.93 2jn6 n ASN 50 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 2jn6 s HIS 51 N 0.00 -0.67 -0.41 1.20 3.76 -1.26 -4.99 115.29 112.92 2jn6 s HIS 51 Ca 0.00 -0.58 0.05 0.00 -0.15 0.00 0.00 55.06 54.37 2jn6 s HIS 51 Cb 0.00 -0.21 0.49 0.00 1.11 0.00 0.00 32.58 33.97 2jn6 s HIS 51 CO 0.00 -1.03 1.59 -1.71 -0.85 0.00 0.00 174.74 172.74 2jn6 n ASN 52 N 4.21 4.77 0.05 1.40 2.85 -1.25 -4.53 115.26 122.76 2jn6 n ASN 52 Ca 0.12 -3.77 -0.06 0.00 -0.11 0.00 0.00 54.58 50.76 2jn6 n ASN 52 Cb 0.48 -0.66 -0.11 0.00 1.24 0.00 0.00 39.78 40.73 2jn6 n ASN 52 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 2jn6 h VAL 53 N 1.35 1.47 -4.17 3.44 2.07 -1.94 -3.46 116.25 115.01 2jn6 h VAL 53 Ca 0.41 -3.16 -0.69 0.00 0.82 0.00 0.00 66.70 64.07 2jn6 h VAL 53 Cb 1.49 2.72 -0.25 0.00 -1.52 0.00 0.00 31.29 33.74 2jn6 h VAL 53 CO 0.90 0.84 -0.87 0.00 0.02 0.00 0.00 177.57 178.46 2jn6 s GLN 54 N -2.72 1.73 0.00 1.57 0.00 -1.26 -5.03 119.66 113.95 2jn6 s GLN 54 Ca 0.00 -1.16 0.00 0.00 -0.00 0.00 0.00 55.36 54.21 2jn6 s GLN 54 Cb 0.09 -1.98 0.00 0.00 0.00 0.00 0.00 33.01 31.12 2jn6 s GLN 54 CO 0.81 0.50 0.00 0.41 0.00 0.00 0.00 175.29 177.01 2jn6 n GLY 55 N 1.54 0.48 3.01 2.60 0.00 -1.26 -5.08 105.19 106.47 2jn6 n GLY 55 Ca -0.17 -0.01 -0.01 0.00 0.00 0.00 0.00 46.02 45.83 2jn6 n GLY 55 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2jn6 n THR 56 N 0.00 -3.92 -3.68 2.61 -1.04 -1.26 -4.96 114.28 102.03 2jn6 n THR 56 Ca 0.00 0.70 -0.39 0.00 -2.04 0.00 0.00 64.05 62.32 2jn6 n THR 56 Cb 0.00 -3.59 -0.12 0.00 -1.82 0.00 0.00 70.33 64.81 2jn6 n THR 56 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2jn6 s THR 57 N -0.49 4.20 0.28 12.58 2.01 -1.26 -4.96 115.64 128.00 2jn6 s THR 57 Ca -0.04 -0.95 0.34 0.00 0.31 0.00 0.00 61.69 61.35 2jn6 s THR 57 Cb 0.00 -3.34 0.37 0.00 0.01 0.00 0.00 72.50 69.55 2jn6 s THR 57 CO 0.18 -0.18 2.07 -0.65 -0.69 0.00 0.00 174.62 175.35 2jn6 h PRO 58 N 8.33 0.00 0.00 4.92 0.11 -2.02 -2.67 132.00 140.67 2jn6 h PRO 58 Ca -0.25 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.84 2jn6 h PRO 58 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2jn6 h PRO 58 CO 0.63 0.04 -0.11 0.77 -0.21 0.00 0.00 178.00 179.12 2jn6 h SER 59 N 0.00 0.00 1.85 -2.05 0.02 -2.03 -1.85 113.55 109.49 2jn6 h SER 59 Ca -0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 2jn6 h SER 59 Cb 0.39 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.93 2jn6 h SER 59 CO 0.01 0.11 -0.10 0.00 -1.14 0.00 0.00 176.83 175.70 2jn6 h ALA 60 N 1.89 0.93 0.00 3.77 0.00 -1.91 -3.19 119.26 120.75 2jn6 h ALA 60 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2jn6 h ALA 60 Cb 0.31 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2jn6 h ALA 60 CO 0.01 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.40 2jn6 n ALA 61 N -2.13 2.22 0.03 0.00 0.00 -0.69 -1.80 120.51 118.14 2jn6 n ALA 61 Ca 0.03 -0.11 -0.19 0.00 0.00 0.00 0.00 53.44 53.17 2jn6 n ALA 61 Cb 0.56 -1.38 -0.12 0.00 0.00 0.00 0.00 19.45 18.51 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 1.43 0.14 0.00 2.07 -1.67 -2.61 116.25 115.61 2jn6 h VAL 62 Ca 0.00 -2.27 -0.30 0.00 0.82 0.00 0.00 66.70 64.95 2jn6 h VAL 62 Cb 0.20 2.78 0.03 0.00 -1.52 0.00 0.00 31.29 32.78 2jn6 h VAL 62 CO 0.00 0.66 -1.27 0.28 0.02 0.00 0.00 177.57 177.26 2jn6 h SER 63 N -0.11 0.81 0.01 0.57 0.02 -1.72 -3.25 113.55 109.86 2jn6 h SER 63 Ca -0.11 -0.77 -0.00 0.00 -0.84 0.00 0.00 61.79 60.07 2jn6 h SER 63 Cb 1.51 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 63.79 2jn6 h SER 63 CO 0.15 1.58 -0.00 -0.08 -1.14 0.00 0.00 176.83 177.34 2jn6 h GLU 64 N 0.23 0.00 0.00 3.45 4.57 -1.45 -1.66 114.58 119.72 2jn6 h GLU 64 Ca -0.19 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 57.99 2jn6 h GLU 64 Cb 1.95 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 30.54 2jn6 h GLU 64 CO 0.24 0.00 -0.02 0.00 -1.18 0.00 0.00 179.01 178.05 2jn6 h ALA 65 N 2.00 1.40 -0.13 2.92 0.00 -1.50 -1.46 119.26 122.49 2jn6 h ALA 65 Ca -0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2jn6 h ALA 65 Cb 0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2jn6 h ALA 65 CO 0.00 0.02 -0.17 1.49 0.00 0.00 0.00 179.25 180.60 2jn6 h GLU 66 N 0.00 0.33 -0.33 0.00 4.81 -1.50 0.32 114.58 118.22 2jn6 h GLU 66 Ca -0.00 -0.19 -0.13 0.00 -0.13 0.00 0.00 59.36 58.91 2jn6 h GLU 66 Cb 0.06 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 2jn6 h GLU 66 CO 0.00 0.76 -0.32 1.96 -0.73 0.00 0.00 179.01 180.68 2jn6 h GLN 67 N -0.07 0.71 -0.40 1.92 7.50 -1.56 -2.49 115.11 120.72 2jn6 h GLN 67 Ca 0.02 -0.33 -0.07 0.00 0.50 0.00 0.00 58.65 58.77 2jn6 h GLN 67 Cb 0.72 -0.01 -0.02 0.00 0.05 0.00 0.00 27.48 28.22 2jn6 h GLN 67 CO 0.04 0.94 -0.03 0.82 -1.50 0.00 0.00 178.83 179.10 2jn6 h ILE 68 N 0.60 1.23 -0.60 2.54 5.03 -1.27 -1.96 117.51 123.09 2jn6 h ILE 68 Ca 0.07 -0.96 0.03 0.00 -0.12 0.00 0.00 64.86 63.88 2jn6 h ILE 68 Cb 0.84 0.96 -0.04 0.00 -3.03 0.00 0.00 36.82 35.55 2jn6 h ILE 68 CO 0.07 0.33 0.36 -0.09 -0.68 0.00 0.00 178.15 178.14 2jn6 h ARG 69 N 0.62 0.69 -0.66 2.37 2.43 -0.50 0.68 114.38 120.01 2jn6 h ARG 69 Ca 0.12 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.18 2jn6 h ARG 69 Cb 0.44 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.80 2jn6 h ARG 69 CO 0.02 0.45 0.15 0.37 -1.51 0.00 0.00 179.97 179.46 2jn6 h GLN 70 N 0.71 1.06 -0.83 0.20 -0.00 -1.14 0.29 115.11 115.41 2jn6 h GLN 70 Ca 0.25 -0.26 -0.02 0.00 -0.00 0.00 0.00 58.65 58.61 2jn6 h GLN 70 Cb 0.04 -0.14 -0.04 0.00 0.00 0.00 0.00 27.48 27.35 2jn6 h GLN 70 CO -0.11 0.95 0.44 1.25 0.00 0.00 0.00 178.83 181.36 2jn6 h LEU 71 N 0.98 1.05 0.02 -2.39 6.46 -0.78 -3.08 115.31 117.57 2jn6 h LEU 71 Ca 0.21 -0.11 -0.00 0.00 -0.12 0.00 0.00 57.88 57.85 2jn6 h LEU 71 Cb 0.38 -0.27 0.00 0.00 -0.73 0.00 0.00 40.66 40.04 2jn6 h LEU 71 CO 0.00 0.86 -0.01 0.11 -0.62 0.00 0.00 178.44 178.78 2jn6 h LYS 72 N 1.16 -0.03 -5.54 1.25 1.79 -0.47 -3.40 116.57 111.32 2jn6 h LYS 72 Ca 0.29 0.00 -0.65 0.00 -2.18 0.00 0.00 60.65 58.11 2jn6 h LYS 72 Cb 0.06 0.01 -0.14 0.00 -1.58 0.00 0.00 32.23 30.58 2jn6 h LYS 72 CO -0.04 0.53 1.17 0.21 -1.08 0.00 0.00 179.45 180.24 2jn6 s LYS 73 N -3.85 3.60 0.00 3.15 2.20 0.99 -4.80 119.74 121.04 2jn6 s LYS 73 Ca -0.16 -1.47 0.00 0.00 -0.36 0.00 0.00 55.97 53.98 2jn6 s LYS 73 Cb 0.01 -5.13 0.00 0.00 -1.51 0.00 0.00 37.83 31.19 2jn6 s LYS 73 CO 0.66 -1.98 0.00 0.39 -0.36 0.00 0.00 175.35 174.05 2jn6 n GLU 74 N 7.65 0.00 -4.25 4.03 1.02 -1.26 -4.75 120.64 123.09 2jn6 n GLU 74 Ca 0.29 0.19 -0.14 0.00 -0.02 0.00 0.00 57.16 57.48 2jn6 n GLU 74 Cb 0.50 -0.62 -0.10 0.00 -0.02 0.00 0.00 31.44 31.20 2jn6 n GLU 74 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2jn6 s ASN 75 N -2.76 0.90 0.46 1.62 2.20 -1.26 -5.04 114.94 111.06 2jn6 s ASN 75 Ca 0.00 -1.28 0.25 0.00 -0.94 0.00 0.00 52.86 50.89 2jn6 s ASN 75 Cb 0.00 0.20 1.05 0.00 -2.00 0.00 0.00 41.25 40.50 2jn6 s ASN 75 CO 0.00 -0.69 1.89 0.00 -2.94 0.00 0.00 177.10 175.36 2jn6 h ALA 76 N 2.61 1.08 -0.24 3.54 0.00 -2.00 -2.84 119.26 121.42 2jn6 h ALA 76 Ca -0.37 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.34 2jn6 h ALA 76 Cb 1.22 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2jn6 h ALA 76 CO 0.60 0.26 0.07 -0.07 0.00 0.00 0.00 179.25 180.11 2jn6 h LEU 77 N 0.00 0.30 -1.17 0.00 3.38 -1.98 0.26 115.31 116.10 2jn6 h LEU 77 Ca -0.00 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2jn6 h LEU 77 Cb 0.65 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 2jn6 h LEU 77 CO 0.03 0.30 0.21 -0.61 0.09 0.00 0.00 178.44 178.45 2jn6 h GLN 78 N 0.33 0.79 0.00 1.13 4.15 -1.93 -2.14 115.11 117.44 2jn6 h GLN 78 Ca 0.08 -0.12 0.00 0.00 0.77 0.00 0.00 58.65 59.38 2jn6 h GLN 78 Cb 0.11 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.66 2jn6 h GLN 78 CO -0.01 0.65 -0.45 0.54 -1.93 0.00 0.00 178.83 177.64 2jn6 n ARG 79 N -4.33 0.27 0.25 1.69 5.12 -0.37 -2.95 116.66 116.34 2jn6 n ARG 79 Ca 0.04 0.11 0.14 0.00 -1.93 0.00 0.00 57.85 56.22 2jn6 n ARG 79 Cb 0.17 -1.71 0.51 0.00 -1.16 0.00 0.00 32.46 30.27 2jn6 n ARG 79 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2jn6 h ALA 80 N 2.54 0.99 0.00 7.54 0.00 -0.34 -2.53 119.26 127.46 2jn6 h ALA 80 Ca 0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 2jn6 h ALA 80 Cb 0.73 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2jn6 h ALA 80 CO 0.00 0.07 -0.38 0.00 0.00 0.00 0.00 179.25 178.94 2jn6 h ARG 81 N 0.00 0.00 0.00 0.00 3.08 -1.38 -2.86 114.38 113.21 2jn6 h ARG 81 Ca -0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 2jn6 h ARG 81 Cb 0.69 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.74 2jn6 h ARG 81 CO 0.01 0.38 -0.19 1.15 -1.07 0.00 0.00 179.97 180.25 2jn6 h THR 82 N 0.00 0.52 -3.61 2.04 2.02 -1.56 -3.42 112.91 108.90 2jn6 h THR 82 Ca -0.00 -0.95 -0.51 0.00 0.77 0.00 0.00 66.41 65.71 2jn6 h THR 82 Cb 1.04 1.66 -0.03 0.00 -1.74 0.00 0.00 68.15 69.08 2jn6 h THR 82 CO 0.05 0.19 0.09 -0.13 0.37 0.00 0.00 175.52 176.08 2jn6 s ARG 83 N -3.77 4.13 -0.68 6.66 0.52 -1.08 -5.04 118.95 119.69 2jn6 s ARG 83 Ca -0.00 0.76 0.05 0.00 -0.52 0.00 0.00 55.73 56.02 2jn6 s ARG 83 Cb 0.11 -2.71 0.16 0.00 0.52 0.00 0.00 34.95 33.03 2jn6 s ARG 83 CO 0.62 0.31 0.47 -1.01 0.02 0.00 0.00 175.30 175.70 2jn6 s HIS 84 N -1.70 3.52 0.35 -0.53 3.76 -1.26 -4.98 115.29 114.46 2jn6 s HIS 84 Ca 0.47 -3.32 0.00 0.00 -0.15 0.00 0.00 55.06 52.06 2jn6 s HIS 84 Cb -0.14 -2.72 0.07 0.00 1.11 0.00 0.00 32.58 30.90 2jn6 s HIS 84 CO 0.20 -0.57 0.48 -0.35 -0.85 0.00 0.00 174.74 173.65 2jn6 n PRO 85 N 2.11 0.31 -3.84 8.40 -0.04 -1.26 -5.13 135.00 135.55 2jn6 n PRO 85 Ca 0.18 -1.36 -0.12 0.00 -0.04 0.00 0.00 63.50 62.16 2jn6 n PRO 85 Cb 0.35 -0.31 -0.12 0.00 -0.04 0.00 0.00 33.50 33.37 2jn6 n PRO 85 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jn6 s ALA 86 N -2.90 -0.29 -0.10 0.55 0.00 -1.26 -5.01 121.76 112.74 2jn6 s ALA 86 Ca 0.32 0.28 0.22 0.00 0.00 0.00 0.00 51.96 52.78 2jn6 s ALA 86 Cb -0.02 -0.16 0.56 0.00 0.00 0.00 0.00 23.12 23.50 2jn6 s ALA 86 CO 0.21 -0.07 1.67 1.49 0.00 0.00 0.00 175.76 179.06 2jn6 h GLU 87 N 5.76 0.00 0.00 0.00 4.81 -2.03 -2.91 114.58 120.21 2jn6 h GLU 87 Ca -0.26 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.97 2jn6 h GLU 87 Cb 1.20 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.58 2jn6 h GLU 87 CO 0.43 0.24 -0.00 1.03 -0.73 0.00 0.00 179.01 179.97 2jn6 h SER 88 N 0.00 0.00 0.85 1.04 0.87 -1.97 -1.79 113.55 112.55 2jn6 h SER 88 Ca -0.00 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.51 2jn6 h SER 88 Cb 0.98 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.94 2jn6 h SER 88 CO 0.03 0.00 -0.23 0.00 -0.53 0.00 0.00 176.83 176.11 2jn6 h LEU 90 N 0.00 0.73 0.07 0.00 3.38 -1.49 -3.26 115.31 114.74 2jn6 h LEU 90 Ca -0.00 -0.42 -0.10 0.00 0.09 0.00 0.00 57.88 57.45 2jn6 h LEU 90 Cb 0.71 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 41.27 2jn6 h LEU 90 CO 0.03 0.99 -0.44 -0.08 0.09 0.00 0.00 178.44 179.02 2jn6 h GLU 91 N 0.47 0.16 -3.12 1.13 4.81 -1.59 -3.48 114.58 112.96 2jn6 h GLU 91 Ca 0.07 -0.27 -0.38 0.00 -0.13 0.00 0.00 59.36 58.65 2jn6 h GLU 91 Cb 0.73 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.21 2jn6 h GLU 91 CO 0.05 1.13 -0.51 1.58 -0.73 0.00 0.00 179.01 180.53 2jn6 n HIS 92 N -4.35 -1.16 -3.95 0.92 -0.00 0.17 -4.99 115.22 101.86 2jn6 n HIS 92 Ca -0.12 0.13 0.00 0.00 -0.00 0.00 0.00 57.72 57.73 2jn6 n HIS 92 Cb 0.66 -3.87 0.00 0.00 -0.00 0.00 0.00 29.99 26.78 2jn6 n HIS 92 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2jn6 n HIS 93 N -4.13 0.00 -2.54 1.57 -0.00 -1.26 -5.07 115.22 103.79 2jn6 n HIS 93 Ca -0.19 0.00 -0.17 0.00 -0.00 0.00 0.00 57.72 57.36 2jn6 n HIS 93 Cb 0.66 0.00 0.02 0.00 -0.00 0.00 0.00 29.99 30.67 2jn6 n HIS 93 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2jn6 n HIS 94 N 0.00 2.24 0.00 4.41 -0.00 -1.26 -4.97 115.22 115.64 2jn6 n HIS 94 Ca 0.00 -2.81 0.00 0.00 0.46 0.00 0.00 57.72 55.37 2jn6 n HIS 94 Cb 0.00 -0.24 0.00 0.00 -0.12 0.00 0.00 29.99 29.63 2jn6 n HIS 94 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 2jn6 n HIS 95 N -0.34 0.00 -1.45 1.57 -0.00 -1.26 -4.99 115.22 108.75 2jn6 n HIS 95 Ca 0.24 0.00 0.19 0.00 -0.00 0.00 0.00 57.72 58.16 2jn6 n HIS 95 Cb 0.77 -0.12 -0.06 0.00 -0.00 0.00 0.00 29.99 30.58 2jn6 n HIS 95 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2jn6 n HIS 96 N -0.93 -3.68 -0.61 1.57 -0.00 -1.26 -5.31 115.22 105.01 2jn6 n HIS 96 Ca 0.00 1.87 0.00 0.00 0.46 0.00 0.00 57.72 60.05 2jn6 n HIS 96 Cb 0.00 -3.34 0.00 0.00 -0.12 0.00 0.00 29.99 26.53 2jn6 n HIS 96 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41