#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jk6 s ARG 8 N 0.00 3.00 0.55 3.23 1.70 -1.26 -4.66 118.95 121.50 1jk6 s ARG 8 Ca 0.00 1.38 -0.16 0.00 -0.47 0.00 0.00 55.73 56.48 1jk6 s ARG 8 Cb 0.00 -1.98 -0.06 0.00 -0.57 0.00 0.00 34.95 32.34 1jk6 s ARG 8 CO 0.00 -1.09 1.02 -0.65 -1.08 0.00 0.00 175.30 173.49 1jk6 s GLN 9 N -3.97 3.68 0.50 3.89 -0.21 -1.26 -0.58 119.66 121.72 1jk6 s GLN 9 Ca 0.67 1.07 -0.21 0.00 0.02 0.00 0.00 55.36 56.91 1jk6 s GLN 9 Cb -0.20 -2.09 -0.07 0.00 1.00 0.00 0.00 33.01 31.65 1jk6 s GLN 9 CO 0.38 -0.50 1.11 0.00 -2.12 0.00 0.00 175.29 174.16 1jk6 n LEU 11 N -0.99 4.55 -4.80 0.00 4.77 -1.26 -4.73 117.00 114.53 1jk6 n LEU 11 Ca 0.10 1.20 -0.35 0.00 -0.03 0.00 0.00 56.01 56.93 1jk6 n LEU 11 Cb 0.51 -1.60 -0.06 0.00 -2.33 0.00 0.00 43.42 39.94 1jk6 n LEU 11 CO 0.42 0.12 0.68 -2.16 -1.33 0.00 0.00 177.39 175.12 1jk6 s PRO 12 N -1.49 4.25 0.34 3.23 0.04 -1.26 -0.42 135.00 139.69 1jk6 s PRO 12 Ca 0.57 1.30 -0.15 0.00 0.04 0.00 0.00 61.00 62.76 1jk6 s PRO 12 Cb -0.49 -2.42 0.03 0.00 0.04 0.00 0.00 34.50 31.66 1jk6 s PRO 12 CO 0.58 -0.03 0.70 0.00 0.04 0.00 0.00 177.00 178.29 1jk6 n GLY 14 N -0.50 -1.93 3.68 0.00 0.00 -1.18 -1.29 105.19 103.98 1jk6 n GLY 14 Ca -0.05 -1.36 -0.42 0.00 0.00 0.00 0.00 46.02 44.19 1jk6 n GLY 14 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1jk6 s PRO 15 N -0.32 4.16 -1.15 1.61 0.04 -1.26 -1.93 135.00 136.15 1jk6 s PRO 15 Ca 0.00 2.48 0.00 0.00 0.04 0.00 0.00 61.00 63.52 1jk6 s PRO 15 Cb 0.00 -3.71 0.00 0.00 0.04 0.00 0.00 34.50 30.83 1jk6 s PRO 15 CO 0.00 -0.82 0.00 0.41 0.04 0.00 0.00 177.00 176.63 1jk6 n GLY 16 N 4.19 1.12 2.41 0.56 0.00 -1.26 -2.30 105.19 109.91 1jk6 n GLY 16 Ca 0.17 -0.15 -0.18 0.00 0.00 0.00 0.00 46.02 45.85 1jk6 n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jk6 n GLY 17 N -0.57 0.89 0.00 -0.02 0.00 -0.81 -4.82 105.19 99.85 1jk6 n GLY 17 Ca -0.11 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.02 1jk6 n GLY 17 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1jk6 n LYS 18 N -2.51 0.06 -3.63 1.61 5.02 -0.97 -4.37 118.16 113.37 1jk6 n LYS 18 Ca -0.20 0.10 -0.23 0.00 -2.02 0.00 0.00 58.31 55.97 1jk6 n LYS 18 Cb 0.63 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 34.13 1jk6 n LYS 18 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1jk6 s GLY 19 N -2.92 2.18 0.03 0.72 0.00 -0.41 -4.66 107.32 102.25 1jk6 s GLY 19 Ca 0.13 -1.72 -0.01 0.00 0.00 0.00 0.00 44.72 43.11 1jk6 s GLY 19 CO 0.40 -1.78 -0.00 0.50 0.00 0.00 0.00 173.10 172.22 1jk6 s ARG 20 N -4.23 0.41 -0.28 2.90 0.52 0.50 -0.77 118.95 118.00 1jk6 s ARG 20 Ca 0.45 -0.71 -0.28 0.00 -0.52 0.00 0.00 55.73 54.67 1jk6 s ARG 20 Cb -0.03 0.15 0.01 0.00 0.52 0.00 0.00 34.95 35.60 1jk6 s ARG 20 CO 0.27 -0.08 1.01 0.00 0.02 0.00 0.00 175.30 176.52 1jk6 n PHE 22 N 6.49 0.12 -3.93 0.00 3.01 -0.13 -4.56 117.46 118.47 1jk6 n PHE 22 Ca 0.10 0.03 -0.12 0.00 1.01 0.00 0.00 57.45 58.48 1jk6 n PHE 22 Cb 0.47 -0.34 0.00 0.00 -0.01 0.00 0.00 39.48 39.60 1jk6 n PHE 22 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1jk6 s GLY 23 N -3.76 0.91 0.46 1.37 0.00 -1.18 -4.28 107.32 100.84 1jk6 s GLY 23 Ca 0.01 -1.12 0.22 0.00 0.00 0.00 0.00 44.72 43.82 1jk6 s GLY 23 CO 0.86 -0.62 1.97 -0.56 0.00 0.00 0.00 173.10 174.74 1jk6 h PRO 24 N 2.03 0.00 0.00 2.90 0.13 -1.75 -3.13 132.00 132.17 1jk6 h PRO 24 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1jk6 h PRO 24 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1jk6 h PRO 24 CO 0.41 0.21 -0.06 0.43 -0.23 0.00 0.00 178.00 178.75 1jk6 n SER 25 N -3.80 2.01 -3.96 1.44 7.64 -1.26 -2.10 113.62 113.58 1jk6 n SER 25 Ca -0.02 -2.81 -0.28 0.00 1.01 0.00 0.00 58.87 56.77 1jk6 n SER 25 Cb 0.31 -0.35 -0.17 0.00 -1.01 0.00 0.00 64.21 62.99 1jk6 n SER 25 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1jk6 s ILE 26 N -2.30 1.28 -0.14 0.44 1.01 -1.19 -1.41 121.20 118.90 1jk6 s ILE 26 Ca 0.24 -0.45 0.01 0.00 0.00 0.00 0.00 60.65 60.46 1jk6 s ILE 26 Cb 0.21 -1.24 0.02 0.00 0.01 0.00 0.00 42.46 41.46 1jk6 s ILE 26 CO 0.02 0.41 -0.16 0.00 0.00 0.00 0.00 174.94 175.22 1jk6 s GLY 29 N -2.42 0.10 0.25 0.00 0.00 -0.55 -0.37 107.32 104.32 1jk6 s GLY 29 Ca 0.03 -0.12 -0.08 0.00 0.00 0.00 0.00 44.72 44.56 1jk6 s GLY 29 CO -0.02 -0.11 1.62 -1.80 0.00 0.00 0.00 173.10 172.79 1jk6 h ASP 30 N 5.97 -0.47 0.22 1.64 3.58 -1.84 -0.99 116.42 124.53 1jk6 h ASP 30 Ca -0.26 0.21 0.00 0.00 0.42 0.00 0.00 57.03 57.40 1jk6 h ASP 30 Cb 1.21 0.40 0.00 0.00 1.72 0.00 0.00 39.33 42.65 1jk6 h ASP 30 CO 0.50 -0.22 -1.61 -1.84 -2.88 0.00 0.00 179.24 173.20 1jk6 n GLU 31 N -5.41 0.54 0.11 0.28 0.00 -1.26 -2.41 120.64 112.49 1jk6 n GLU 31 Ca 0.13 -0.10 0.02 0.00 0.00 0.00 0.00 57.16 57.21 1jk6 n GLU 31 Cb 0.47 -1.58 -0.00 0.00 0.00 0.00 0.00 31.44 30.33 1jk6 n GLU 31 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 1jk6 h LEU 32 N 0.00 0.00 0.00 -1.84 3.38 -1.83 -3.50 115.31 111.52 1jk6 h LEU 32 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1jk6 h LEU 32 Cb 0.91 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1jk6 h LEU 32 CO 0.00 0.53 0.00 0.61 0.09 0.00 0.00 178.44 179.67 1jk6 n GLY 33 N 1.26 -1.63 3.18 0.83 0.00 -0.42 -4.87 105.19 103.54 1jk6 n GLY 33 Ca -0.01 -1.76 -0.27 0.00 0.00 0.00 0.00 46.02 43.99 1jk6 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jk6 s PHE 35 N -0.27 3.11 -0.34 0.00 0.40 0.16 -4.98 117.98 116.06 1jk6 s PHE 35 Ca 0.03 -0.84 -0.04 0.00 -0.60 0.00 0.00 56.93 55.48 1jk6 s PHE 35 Cb -0.09 -2.24 0.06 0.00 0.51 0.00 0.00 43.02 41.26 1jk6 s PHE 35 CO 0.01 -0.52 0.09 0.08 0.70 0.00 0.00 175.22 175.58 1jk6 s VAL 36 N 1.53 3.43 -0.47 -0.44 1.01 -1.26 -1.49 120.40 122.71 1jk6 s VAL 36 Ca 0.04 -1.41 0.00 0.00 0.00 0.00 0.00 61.98 60.61 1jk6 s VAL 36 Cb -0.16 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.18 1jk6 s VAL 36 CO 0.02 -0.27 0.00 0.61 0.00 0.00 0.00 175.10 175.46 1jk6 n GLY 37 N 4.71 0.70 4.00 4.51 0.00 -0.50 -5.03 105.19 113.58 1jk6 n GLY 37 Ca -0.11 -0.48 -0.22 0.00 0.00 0.00 0.00 46.02 45.22 1jk6 n GLY 37 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jk6 s THR 38 N -2.05 2.36 0.37 2.61 -4.23 -1.26 -4.96 115.64 108.47 1jk6 s THR 38 Ca 0.00 -0.71 0.04 0.00 -1.18 0.00 0.00 61.69 59.84 1jk6 s THR 38 Cb 0.00 -2.64 0.27 0.00 1.34 0.00 0.00 72.50 71.47 1jk6 s THR 38 CO 0.00 0.00 2.01 0.00 -0.54 0.00 0.00 174.62 176.09 1jk6 h ALA 39 N -0.14 1.63 -0.08 3.99 0.00 -1.98 -1.32 119.26 121.35 1jk6 h ALA 39 Ca -0.37 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.53 1jk6 h ALA 39 Cb 1.28 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1jk6 h ALA 39 CO 0.44 0.32 0.15 0.93 0.00 0.00 0.00 179.25 181.09 1jk6 h GLU 40 N 0.77 0.00 -0.40 0.00 3.07 -1.96 -1.18 114.58 114.88 1jk6 h GLU 40 Ca 0.24 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.10 1jk6 h GLU 40 Cb 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 1jk6 h GLU 40 CO -0.06 0.00 0.00 0.00 -1.40 0.00 0.00 179.01 177.55 1jk6 n ALA 41 N -2.19 2.39 -0.23 3.43 0.00 -0.50 -3.09 120.51 120.32 1jk6 n ALA 41 Ca -0.01 -1.02 -0.04 0.00 0.00 0.00 0.00 53.44 52.38 1jk6 n ALA 41 Cb 0.24 -0.80 0.07 0.00 0.00 0.00 0.00 19.45 18.96 1jk6 n ALA 41 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1jk6 h LEU 42 N 4.06 0.68 -1.73 0.00 5.85 -1.19 -1.95 115.31 121.03 1jk6 h LEU 42 Ca 0.00 0.00 0.11 0.00 0.84 0.00 0.00 57.88 58.83 1jk6 h LEU 42 Cb 0.93 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.78 1jk6 h LEU 42 CO 0.00 0.47 0.39 0.03 -0.34 0.00 0.00 178.44 178.99 1jk6 h ARG 43 N 0.81 0.29 0.00 1.25 3.08 -1.79 -2.42 114.38 115.60 1jk6 h ARG 43 Ca 0.27 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.30 1jk6 h ARG 43 Cb 0.02 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.00 1jk6 h ARG 43 CO -0.11 0.19 0.00 0.00 -1.07 0.00 0.00 179.97 178.98 1jk6 h GLN 45 N 0.00 0.22 -0.29 0.00 1.08 -0.89 0.35 115.11 115.58 1jk6 h GLN 45 Ca 0.00 -0.01 0.09 0.00 -1.45 0.00 0.00 58.65 57.27 1jk6 h GLN 45 Cb 0.05 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.41 1jk6 h GLN 45 CO 0.00 0.15 0.34 1.49 -0.95 0.00 0.00 178.83 179.86 1jk6 h GLU 46 N 0.23 0.00 -0.72 1.46 4.81 -1.75 -0.34 114.58 118.28 1jk6 h GLU 46 Ca 0.27 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.60 1jk6 h GLU 46 Cb 0.75 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.08 1jk6 h GLU 46 CO -0.05 0.00 0.47 0.93 -0.73 0.00 0.00 179.01 179.63 1jk6 h GLU 47 N 0.00 0.57 0.00 1.92 4.39 -1.17 0.65 114.58 120.94 1jk6 h GLU 47 Ca 0.14 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.81 1jk6 h GLU 47 Cb 0.82 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 1jk6 h GLU 47 CO -0.00 0.38 0.00 -0.91 -1.16 0.00 0.00 179.01 177.31 1jk6 h ASN 48 N 0.59 0.00 -0.55 1.42 -0.26 -1.24 -1.56 115.58 113.98 1jk6 h ASN 48 Ca 0.33 0.00 -0.30 0.00 -0.56 0.00 0.00 56.30 55.77 1jk6 h ASN 48 Cb 0.51 0.00 -0.18 0.00 -1.06 0.00 0.00 38.32 37.59 1jk6 h ASN 48 CO -0.11 0.00 0.07 -1.22 -1.06 0.00 0.00 177.43 175.11 1jk6 n TYR 49 N -2.78 1.72 -3.45 1.19 4.02 0.22 -4.76 117.16 113.31 1jk6 n TYR 49 Ca -0.02 -1.79 -0.25 0.00 -0.01 0.00 0.00 57.90 55.82 1jk6 n TYR 49 Cb 0.06 -0.64 -0.12 0.00 -0.02 0.00 0.00 39.34 38.63 1jk6 n TYR 49 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1jk6 s LEU 50 N -3.33 0.46 0.24 7.72 1.43 -0.59 -5.03 118.68 119.59 1jk6 s LEU 50 Ca 0.49 -1.60 -0.07 0.00 -1.03 0.00 0.00 54.13 51.92 1jk6 s LEU 50 Cb 0.43 -0.05 0.24 0.00 0.03 0.00 0.00 46.19 46.83 1jk6 s LEU 50 CO 0.02 -0.35 1.91 1.55 0.23 0.00 0.00 176.35 179.71 1jk6 h PRO 51 N 7.60 1.27 -6.93 1.29 0.13 -1.86 -3.44 132.00 130.06 1jk6 h PRO 51 Ca -0.04 -0.09 -0.53 0.00 -0.87 0.00 0.00 66.00 64.47 1jk6 h PRO 51 Cb 1.01 -0.28 0.09 0.00 0.13 0.00 0.00 31.00 31.95 1jk6 h PRO 51 CO 0.31 0.86 0.67 -1.54 -0.23 0.00 0.00 178.00 178.07 1jk6 s SER 52 N -6.11 6.41 0.64 1.44 1.04 -1.26 -5.00 113.70 110.86 1jk6 s SER 52 Ca -0.13 2.80 -0.14 0.00 0.48 0.00 0.00 55.95 58.96 1jk6 s SER 52 Cb 0.17 -2.65 -0.01 0.00 0.10 0.00 0.00 66.02 63.63 1jk6 s SER 52 CO 0.82 -0.80 1.08 -2.84 0.98 0.00 0.00 173.24 172.47 1jk6 s PRO 53 N -2.09 3.01 0.26 4.02 0.02 -1.26 -5.03 135.00 133.94 1jk6 s PRO 53 Ca 0.54 1.21 0.11 0.00 0.02 0.00 0.00 61.00 62.88 1jk6 s PRO 53 Cb -0.41 -1.99 -0.05 0.00 0.02 0.00 0.00 34.50 32.07 1jk6 s PRO 53 CO 0.55 -1.06 -0.11 0.00 -0.33 0.00 0.00 177.00 176.05 1jk6 s GLN 55 N -3.52 4.09 -0.01 0.00 1.11 0.26 -4.82 119.66 116.78 1jk6 s GLN 55 Ca 0.30 -0.27 0.12 0.00 0.01 0.00 0.00 55.36 55.52 1jk6 s GLN 55 Cb -0.06 -3.36 -0.17 0.00 -1.01 0.00 0.00 33.01 28.41 1jk6 s GLN 55 CO 0.17 0.26 0.33 -1.13 0.01 0.00 0.00 175.29 174.93 1jk6 n SER 56 N 3.63 1.75 -2.81 5.90 3.41 -1.26 -2.76 113.62 121.49 1jk6 n SER 56 Ca -0.16 -0.22 -0.20 0.00 -0.26 0.00 0.00 58.87 58.03 1jk6 n SER 56 Cb 0.52 1.40 0.04 0.00 -0.26 0.00 0.00 64.21 65.92 1jk6 n SER 56 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jk6 n GLY 57 N 1.66 -0.37 3.49 5.00 0.00 -1.26 -5.01 105.19 108.71 1jk6 n GLY 57 Ca -0.01 0.05 -0.26 0.00 0.00 0.00 0.00 46.02 45.80 1jk6 n GLY 57 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1jk6 s GLN 58 N -5.72 1.76 0.33 1.61 -1.52 -1.26 -5.11 119.66 109.75 1jk6 s GLN 58 Ca 0.33 -1.53 -0.29 0.00 -1.95 0.00 0.00 55.36 51.93 1jk6 s GLN 58 Cb -0.15 -1.93 -0.10 0.00 -0.22 0.00 0.00 33.01 30.61 1jk6 s GLN 58 CO 0.41 0.38 1.35 0.21 -0.25 0.00 0.00 175.29 177.39 1jk6 s LYS 59 N -3.04 4.31 1.03 2.91 2.20 -1.26 -4.74 119.74 121.15 1jk6 s LYS 59 Ca 0.25 2.28 -0.12 0.00 -0.36 0.00 0.00 55.97 58.02 1jk6 s LYS 59 Cb -0.07 -3.06 0.21 0.00 -1.51 0.00 0.00 37.83 33.40 1jk6 s LYS 59 CO 0.13 -0.26 1.08 -2.14 -0.36 0.00 0.00 175.35 173.80 1jk6 s PRO 60 N -1.73 0.14 -0.09 4.03 0.02 -1.26 -0.25 135.00 135.86 1jk6 s PRO 60 Ca 0.50 0.57 -0.32 0.00 0.02 0.00 0.00 61.00 61.78 1jk6 s PRO 60 Cb -0.41 -1.70 0.12 0.00 0.02 0.00 0.00 34.50 32.53 1jk6 s PRO 60 CO 0.54 -2.94 1.16 0.00 -0.33 0.00 0.00 177.00 175.43 1jk6 n GLY 62 N -0.25 2.94 2.69 0.00 0.00 -1.26 -2.49 105.19 106.81 1jk6 n GLY 62 Ca -0.04 -0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 1jk6 n GLY 62 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jk6 s SER 63 N -4.00 3.77 0.00 1.61 1.04 -1.26 -4.70 113.70 110.16 1jk6 s SER 63 Ca 0.00 -1.45 0.00 0.00 0.48 0.00 0.00 55.95 54.98 1jk6 s SER 63 Cb 0.00 -0.71 0.00 0.00 0.10 0.00 0.00 66.02 65.41 1jk6 s SER 63 CO 0.00 -0.41 0.00 0.61 0.98 0.00 0.00 173.24 174.42 1jk6 n GLY 64 N 4.97 1.88 3.88 7.32 0.00 -1.25 -5.01 105.19 116.97 1jk6 n GLY 64 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 1jk6 n GLY 64 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jk6 s GLY 65 N -1.99 1.64 0.01 -0.02 0.00 -1.04 -4.68 107.32 101.25 1jk6 s GLY 65 Ca 0.00 -0.18 0.02 0.00 0.00 0.00 0.00 44.72 44.56 1jk6 s GLY 65 CO 0.00 0.11 -0.07 -1.60 0.00 0.00 0.00 173.10 171.54 1jk6 s ARG 66 N -5.21 0.55 -1.10 2.90 6.06 0.67 -1.80 118.95 121.02 1jk6 s ARG 66 Ca 0.56 -0.44 -0.23 0.00 -2.50 0.00 0.00 55.73 53.12 1jk6 s ARG 66 Cb -0.11 -0.46 -0.05 0.00 0.06 0.00 0.00 34.95 34.39 1jk6 s ARG 66 CO 0.53 0.12 1.89 0.00 -2.50 0.00 0.00 175.30 175.33 1jk6 h ALA 68 N 10.01 1.52 -2.61 0.00 0.00 -1.71 -3.42 119.26 123.05 1jk6 h ALA 68 Ca 0.20 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1jk6 h ALA 68 Cb 0.96 -0.05 -0.13 0.00 0.00 0.00 0.00 17.79 18.56 1jk6 h ALA 68 CO 1.26 0.36 -0.29 0.00 0.00 0.00 0.00 179.25 180.58 1jk6 s ALA 69 N -4.45 -0.28 -0.12 0.00 0.00 -1.14 -4.02 121.76 111.76 1jk6 s ALA 69 Ca -0.04 -0.61 -0.34 0.00 0.00 0.00 0.00 51.96 50.96 1jk6 s ALA 69 Cb 0.15 0.67 -0.12 0.00 0.00 0.00 0.00 23.12 23.82 1jk6 s ALA 69 CO 0.72 -0.59 1.90 0.00 0.00 0.00 0.00 175.76 177.78 1jk6 n ALA 70 N -0.15 0.83 -1.08 0.00 0.00 -1.01 -0.73 120.51 118.36 1jk6 n ALA 70 Ca -0.12 0.26 -0.03 0.00 0.00 0.00 0.00 53.44 53.55 1jk6 n ALA 70 Cb 0.63 -2.49 -0.01 0.00 0.00 0.00 0.00 19.45 17.57 1jk6 n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jk6 n GLY 71 N 4.51 0.61 2.84 0.00 0.00 -0.97 -4.91 105.19 107.27 1jk6 n GLY 71 Ca 0.24 -0.71 -0.16 0.00 0.00 0.00 0.00 46.02 45.40 1jk6 n GLY 71 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jk6 s ILE 72 N -2.07 -0.13 -0.18 -0.61 1.01 0.09 -0.56 121.20 118.76 1jk6 s ILE 72 Ca 0.00 0.27 -0.05 0.00 0.00 0.00 0.00 60.65 60.87 1jk6 s ILE 72 Cb 0.00 -0.22 -0.03 0.00 0.01 0.00 0.00 42.46 42.22 1jk6 s ILE 72 CO 0.00 0.11 0.00 0.00 0.00 0.00 0.00 174.94 175.06 1jk6 n ASN 75 N 1.38 1.41 0.28 0.00 0.23 0.38 -0.24 115.26 118.70 1jk6 n ASN 75 Ca -0.22 -0.23 0.16 0.00 -0.53 0.00 0.00 54.58 53.76 1jk6 n ASN 75 Cb 0.55 0.00 0.78 0.00 -2.08 0.00 0.00 39.78 39.03 1jk6 n ASN 75 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1jk6 h ASP 76 N 0.00 0.00 0.00 0.53 3.32 -1.87 -3.31 116.42 115.09 1jk6 h ASP 76 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1jk6 h ASP 76 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1jk6 h ASP 76 CO 0.00 0.07 0.00 -1.84 -1.72 0.00 0.00 179.24 175.75 1jk6 n GLU 77 N -3.31 0.33 -3.63 3.56 0.28 -1.26 -4.32 120.64 112.29 1jk6 n GLU 77 Ca -0.01 -0.57 -0.10 0.00 -0.16 0.00 0.00 57.16 56.32 1jk6 n GLU 77 Cb 0.25 -0.76 -0.04 0.00 1.43 0.00 0.00 31.44 32.33 1jk6 n GLU 77 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 1jk6 s SER 78 N -0.21 -0.33 0.03 -1.84 1.04 -1.25 -5.11 113.70 106.03 1jk6 s SER 78 Ca 0.00 -0.32 0.02 0.00 0.48 0.00 0.00 55.95 56.13 1jk6 s SER 78 Cb 0.00 0.55 -0.02 0.00 0.10 0.00 0.00 66.02 66.65 1jk6 s SER 78 CO 0.00 -0.98 -0.06 0.00 0.98 0.00 0.00 173.24 173.18 1jk6 s VAL 80 N -1.22 -0.00 0.08 0.00 1.01 0.67 -4.97 120.40 115.96 1jk6 s VAL 80 Ca -0.10 0.01 -0.31 0.00 0.00 0.00 0.00 61.98 61.59 1jk6 s VAL 80 Cb -0.09 -0.23 -0.08 0.00 0.00 0.00 0.00 36.38 35.98 1jk6 s VAL 80 CO -0.00 0.01 1.64 0.42 0.00 0.00 0.00 175.10 177.17 1jk6 s THR 81 N 0.17 3.00 -0.20 3.92 -4.23 -1.26 -0.74 115.64 116.30 1jk6 s THR 81 Ca -0.01 0.49 -0.05 0.00 -1.18 0.00 0.00 61.69 60.95 1jk6 s THR 81 Cb -0.02 -3.32 0.07 0.00 1.34 0.00 0.00 72.50 70.58 1jk6 s THR 81 CO -0.00 0.00 0.12 -0.70 -0.54 0.00 0.00 174.62 173.50 1jk6 s GLU 82 N 2.47 0.11 0.52 3.99 2.56 0.27 -4.86 118.70 123.77 1jk6 s GLU 82 Ca 0.73 -0.11 0.21 0.00 0.00 0.00 0.00 54.97 55.79 1jk6 s GLU 82 Cb -0.40 -1.58 1.32 0.00 2.00 0.00 0.00 34.13 35.47 1jk6 s GLU 82 CO 0.32 -0.74 2.06 -1.00 -0.56 0.00 0.00 175.26 175.34 1jk6 h PRO 83 N 8.40 0.03 0.00 4.30 0.13 -1.94 0.29 132.00 143.20 1jk6 h PRO 83 Ca -0.16 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 1jk6 h PRO 83 Cb 1.12 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1jk6 h PRO 83 CO 0.32 0.02 0.00 1.49 -0.23 0.00 0.00 178.00 179.59 1jk6 h GLU 84 N 0.03 0.00 -0.33 0.86 4.81 -1.95 -0.29 114.58 117.71 1jk6 h GLU 84 Ca 0.15 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1jk6 h GLU 84 Cb 0.55 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.93 1jk6 h GLU 84 CO -0.01 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.27