#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j6k s ASP 3 N 0.00 5.39 0.09 -1.34 1.01 -1.26 -1.64 116.67 118.92 2j6k s ASP 3 Ca 0.00 -0.14 0.07 0.00 0.71 0.00 0.00 52.55 53.19 2j6k s ASP 3 Cb 0.00 -1.38 -0.03 0.00 1.01 0.00 0.00 42.92 42.52 2j6k s ASP 3 CO 0.00 0.10 -0.17 -0.31 0.21 0.00 0.00 175.17 175.00 2j6k s TYR 4 N -1.63 1.49 -0.12 4.23 2.02 -0.44 -0.75 117.35 122.16 2j6k s TYR 4 Ca 0.30 -0.45 -0.05 0.00 -0.37 0.00 0.00 57.07 56.50 2j6k s TYR 4 Cb -0.11 -0.82 -0.04 0.00 -0.40 0.00 0.00 41.96 40.59 2j6k s TYR 4 CO 0.22 0.13 0.09 -1.50 -1.57 0.00 0.00 175.55 172.92 2j6k s ILE 5 N -1.28 5.03 -0.12 2.71 2.07 0.17 -0.47 121.20 129.32 2j6k s ILE 5 Ca 0.03 0.03 -0.29 0.00 -1.41 0.00 0.00 60.65 59.00 2j6k s ILE 5 Cb -0.10 -3.18 -0.01 0.00 0.13 0.00 0.00 42.46 39.30 2j6k s ILE 5 CO 0.03 0.59 1.01 -0.69 -1.91 0.00 0.00 174.94 173.97 2j6k s VAL 6 N -0.77 4.77 -0.09 4.00 1.01 0.25 -1.02 120.40 128.56 2j6k s VAL 6 Ca 0.13 2.04 0.16 0.00 0.00 0.00 0.00 61.98 64.31 2j6k s VAL 6 Cb -0.12 -4.31 -0.23 0.00 0.00 0.00 0.00 36.38 31.72 2j6k s VAL 6 CO 0.03 -0.02 0.22 -0.62 0.00 0.00 0.00 175.10 174.70 2j6k n GLU 7 N 5.19 0.96 -3.82 2.72 -0.58 0.11 -1.02 120.64 124.20 2j6k n GLU 7 Ca 0.09 -0.08 -0.13 0.00 -0.42 0.00 0.00 57.16 56.62 2j6k n GLU 7 Cb 0.48 -1.40 -0.14 0.00 -0.57 0.00 0.00 31.44 29.81 2j6k n GLU 7 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 2j6k s TYR 8 N -2.79 -0.10 0.29 -0.32 1.51 -0.92 -4.84 117.35 110.17 2j6k s TYR 8 Ca -0.07 0.28 -0.30 0.00 -1.01 0.00 0.00 57.07 55.97 2j6k s TYR 8 Cb 0.08 -0.00 -0.12 0.00 -0.11 0.00 0.00 41.96 41.80 2j6k s TYR 8 CO 0.68 -0.07 1.49 -0.25 -1.11 0.00 0.00 175.55 176.29 2j6k n ASP 9 N 3.30 3.37 -4.09 2.29 8.00 -1.26 -4.63 116.55 123.53 2j6k n ASP 9 Ca -0.16 1.16 -0.20 0.00 0.71 0.00 0.00 54.79 56.30 2j6k n ASP 9 Cb 0.57 -1.53 -0.14 0.00 -0.02 0.00 0.00 41.12 40.01 2j6k n ASP 9 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2j6k s TYR 10 N -0.21 1.06 -0.19 1.24 6.14 -0.34 -5.01 117.35 120.04 2j6k s TYR 10 Ca 0.64 -0.27 -0.02 0.00 0.64 0.00 0.00 57.07 58.06 2j6k s TYR 10 Cb -0.55 -0.66 -0.00 0.00 0.42 0.00 0.00 41.96 41.17 2j6k s TYR 10 CO 0.51 -0.00 -0.11 -0.51 0.64 0.00 0.00 175.55 176.08 2j6k s ASP 11 N -0.68 3.87 0.34 4.32 -0.00 -1.26 -1.07 116.67 122.19 2j6k s ASP 11 Ca 0.02 -0.46 -0.29 0.00 -0.00 0.00 0.00 52.55 51.82 2j6k s ASP 11 Cb -0.06 -1.63 -0.11 0.00 -0.00 0.00 0.00 42.92 41.12 2j6k s ASP 11 CO 0.00 0.02 1.55 0.00 -0.00 0.00 0.00 175.17 176.74 2j6k s ALA 12 N 1.22 3.66 -0.04 5.23 0.00 -1.25 -4.90 121.76 125.69 2j6k s ALA 12 Ca 0.02 1.60 0.13 0.00 0.00 0.00 0.00 51.96 53.71 2j6k s ALA 12 Cb -0.14 -3.64 -0.20 0.00 0.00 0.00 0.00 23.12 19.14 2j6k s ALA 12 CO -0.05 -1.05 0.25 0.28 0.00 0.00 0.00 175.76 175.20 2j6k n VAL 13 N 1.26 0.14 -4.35 0.00 0.31 -1.26 -4.98 118.33 109.45 2j6k n VAL 13 Ca 0.04 -0.34 -0.18 0.00 -0.01 0.00 0.00 64.34 63.85 2j6k n VAL 13 Cb 0.38 0.05 -0.10 0.00 -0.91 0.00 0.00 33.84 33.26 2j6k n VAL 13 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 2j6k s HIS 14 N -2.82 1.66 0.52 3.52 3.76 -1.26 -5.04 115.29 115.63 2j6k s HIS 14 Ca -0.05 -0.70 0.17 0.00 -0.15 0.00 0.00 55.06 54.33 2j6k s HIS 14 Cb 0.08 -0.87 1.27 0.00 1.11 0.00 0.00 32.58 34.17 2j6k s HIS 14 CO 0.55 0.22 2.13 -0.44 -0.85 0.00 0.00 174.74 176.35 2j6k h ASP 15 N 2.51 0.02 -0.20 1.40 3.45 -2.03 -1.73 116.42 119.84 2j6k h ASP 15 Ca -0.38 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.08 2j6k h ASP 15 Cb 1.22 -0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.98 2j6k h ASP 15 CO 0.64 0.01 0.00 -0.90 -1.57 0.00 0.00 179.24 177.42 2j6k n ASP 16 N -4.52 1.80 -4.92 6.45 3.85 -1.26 -4.83 116.55 113.11 2j6k n ASP 16 Ca -0.01 -1.76 -0.27 0.00 -0.71 0.00 0.00 54.79 52.03 2j6k n ASP 16 Cb 0.14 -0.13 -0.03 0.00 -1.35 0.00 0.00 41.12 39.75 2j6k n ASP 16 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 2j6k s GLU 17 N -1.74 3.54 -0.10 0.11 2.02 -0.65 -0.89 118.70 120.99 2j6k s GLU 17 Ca 0.32 -0.28 -0.09 0.00 0.02 0.00 0.00 54.97 54.94 2j6k s GLU 17 Cb 0.17 -2.80 -0.04 0.00 0.10 0.00 0.00 34.13 31.56 2j6k s GLU 17 CO 0.25 0.36 0.20 -0.51 0.02 0.00 0.00 175.26 175.58 2j6k s LEU 18 N -3.39 4.40 -0.18 1.80 1.43 0.44 -4.69 118.68 118.49 2j6k s LEU 18 Ca 0.39 0.56 -0.22 0.00 -1.03 0.00 0.00 54.13 53.83 2j6k s LEU 18 Cb -0.11 -2.18 -0.02 0.00 0.03 0.00 0.00 46.19 43.91 2j6k s LEU 18 CO 0.29 0.38 0.68 -0.89 0.23 0.00 0.00 176.35 177.04 2j6k s THR 19 N -0.96 4.99 0.10 5.49 2.01 -1.26 -3.97 115.64 122.04 2j6k s THR 19 Ca 0.16 1.31 0.05 0.00 0.31 0.00 0.00 61.69 63.53 2j6k s THR 19 Cb -0.13 -4.00 -0.03 0.00 0.01 0.00 0.00 72.50 68.35 2j6k s THR 19 CO 0.06 0.11 -0.14 0.27 -0.69 0.00 0.00 174.62 174.23 2j6k s ILE 20 N 1.83 1.22 0.03 1.82 -4.36 -0.23 -4.96 121.20 116.55 2j6k s ILE 20 Ca 0.32 -1.56 0.05 0.00 -0.26 0.00 0.00 60.65 59.20 2j6k s ILE 20 Cb -0.16 -1.35 -0.02 0.00 1.25 0.00 0.00 42.46 42.18 2j6k s ILE 20 CO 0.11 -0.35 -0.14 -0.13 0.24 0.00 0.00 174.94 174.68 2j6k s ARG 21 N -2.33 0.95 -0.05 0.37 1.81 -1.26 -1.20 118.95 117.25 2j6k s ARG 21 Ca 0.05 -0.69 -0.39 0.00 -1.72 0.00 0.00 55.73 52.98 2j6k s ARG 21 Cb -0.07 -0.95 -0.18 0.00 -0.45 0.00 0.00 34.95 33.31 2j6k s ARG 21 CO 0.02 0.24 1.37 0.28 -0.68 0.00 0.00 175.30 176.53 2j6k n VAL 22 N 2.08 0.05 0.00 3.52 0.31 -1.26 -1.54 118.33 121.50 2j6k n VAL 22 Ca -0.17 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 2j6k n VAL 22 Cb 0.55 -0.67 0.00 0.00 -0.91 0.00 0.00 33.84 32.81 2j6k n VAL 22 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2j6k n GLY 23 N 2.69 3.42 3.76 2.92 0.00 -0.19 -5.00 105.19 112.80 2j6k n GLY 23 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 2j6k n GLY 23 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2j6k s GLU 24 N -0.94 3.64 -0.25 1.61 2.02 -0.59 -4.71 118.70 119.48 2j6k s GLU 24 Ca 0.00 2.01 -0.14 0.00 0.02 0.00 0.00 54.97 56.86 2j6k s GLU 24 Cb 0.00 -2.46 -0.04 0.00 0.10 0.00 0.00 34.13 31.73 2j6k s GLU 24 CO 0.00 -0.72 0.34 0.42 0.02 0.00 0.00 175.26 175.32 2j6k s ILE 25 N -1.40 5.22 -0.19 -1.63 -1.09 -1.26 -0.58 121.20 120.27 2j6k s ILE 25 Ca 0.64 0.53 -0.21 0.00 -2.23 0.00 0.00 60.65 59.38 2j6k s ILE 25 Cb -0.34 -3.67 -0.03 0.00 -1.58 0.00 0.00 42.46 36.84 2j6k s ILE 25 CO 0.42 0.22 0.63 -0.63 -1.23 0.00 0.00 174.94 174.35 2j6k s ILE 26 N 1.68 5.03 0.04 2.92 -1.09 0.39 -4.83 121.20 125.33 2j6k s ILE 26 Ca 0.15 1.20 0.00 0.00 -2.23 0.00 0.00 60.65 59.77 2j6k s ILE 26 Cb -0.15 -3.95 -0.04 0.00 -1.58 0.00 0.00 42.46 36.74 2j6k s ILE 26 CO 0.09 0.13 0.15 0.00 -1.23 0.00 0.00 174.94 174.07 2j6k s ARG 27 N 1.79 3.24 -1.15 2.79 1.70 -0.04 -1.33 118.95 125.94 2j6k s ARG 27 Ca 0.29 -0.49 -0.07 0.00 -0.47 0.00 0.00 55.73 54.99 2j6k s ARG 27 Cb -0.16 -2.94 -0.03 0.00 -0.57 0.00 0.00 34.95 31.25 2j6k s ARG 27 CO 0.11 0.62 0.85 -1.71 -1.08 0.00 0.00 175.30 174.08 2j6k n ASN 28 N 0.60 -4.34 -4.75 -2.89 4.05 -1.19 -1.16 115.26 105.58 2j6k n ASN 28 Ca -0.08 -0.80 -0.41 0.00 0.45 0.00 0.00 54.58 53.74 2j6k n ASN 28 Cb 0.52 -4.47 -0.04 0.00 1.23 0.00 0.00 39.78 37.01 2j6k n ASN 28 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2j6k s VAL 29 N -3.47 3.74 0.05 3.44 1.01 -0.65 -4.44 120.40 120.06 2j6k s VAL 29 Ca 0.29 1.64 0.05 0.00 0.00 0.00 0.00 61.98 63.95 2j6k s VAL 29 Cb -0.06 -4.04 -0.02 0.00 0.00 0.00 0.00 36.38 32.25 2j6k s VAL 29 CO 0.79 0.35 -0.13 -0.54 0.00 0.00 0.00 175.10 175.56 2j6k s LYS 30 N -0.96 0.86 0.43 2.72 1.02 0.12 -4.67 119.74 119.26 2j6k s LYS 30 Ca 0.46 -0.80 -0.24 0.00 0.02 0.00 0.00 55.97 55.41 2j6k s LYS 30 Cb -0.30 -0.85 -0.08 0.00 -0.52 0.00 0.00 37.83 36.08 2j6k s LYS 30 CO 0.37 0.20 1.19 0.15 -0.92 0.00 0.00 175.35 176.34 2j6k s LYS 31 N -1.31 3.87 0.20 1.68 -0.14 -1.26 -1.67 119.74 121.11 2j6k s LYS 31 Ca -0.00 1.85 0.09 0.00 -1.36 0.00 0.00 55.97 56.55 2j6k s LYS 31 Cb -0.08 -2.54 -0.04 0.00 -1.68 0.00 0.00 37.83 33.49 2j6k s LYS 31 CO 0.01 -0.48 -0.06 -0.51 -0.76 0.00 0.00 175.35 173.56 2j6k s LEU 32 N -2.78 3.07 0.25 3.17 1.43 -1.23 -4.86 118.68 117.74 2j6k s LEU 32 Ca 0.61 -0.58 -0.03 0.00 -1.03 0.00 0.00 54.13 53.10 2j6k s LEU 32 Cb -0.31 -1.70 0.52 0.00 0.03 0.00 0.00 46.19 44.73 2j6k s LEU 32 CO 0.38 0.07 1.70 -0.61 0.23 0.00 0.00 176.35 178.12 2j6k h GLN 33 N 2.59 0.32 -6.48 1.70 4.15 -1.97 -3.41 115.11 112.02 2j6k h GLN 33 Ca -0.46 -0.02 -0.53 0.00 0.77 0.00 0.00 58.65 58.41 2j6k h GLN 33 Cb 1.22 -0.07 0.02 0.00 0.21 0.00 0.00 27.48 28.86 2j6k h GLN 33 CO 0.57 0.21 0.97 -1.21 -1.93 0.00 0.00 178.83 177.44 2j6k s GLU 34 N -6.01 4.20 0.09 1.69 0.41 -1.26 -4.95 118.70 112.87 2j6k s GLU 34 Ca -0.12 2.33 -0.31 0.00 -0.41 0.00 0.00 54.97 56.46 2j6k s GLU 34 Cb 0.22 -3.52 -0.08 0.00 -1.78 0.00 0.00 34.13 28.97 2j6k s GLU 34 CO 0.76 -0.71 1.49 -2.00 -0.49 0.00 0.00 175.26 174.31 2j6k s GLU 35 N 2.36 4.26 0.00 1.61 -6.30 -1.26 -3.15 118.70 116.22 2j6k s GLU 35 Ca 0.73 2.17 0.00 0.00 -2.50 0.00 0.00 54.97 55.37 2j6k s GLU 35 Cb -0.40 -3.38 0.00 0.00 0.00 0.00 0.00 34.13 30.35 2j6k s GLU 35 CO 0.32 -0.57 0.00 0.41 0.02 0.00 0.00 175.26 175.44 2j6k n GLY 36 N 3.69 0.70 3.24 -1.50 0.00 -1.26 -5.05 105.19 105.01 2j6k n GLY 36 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 2j6k n GLY 36 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2j6k s TRP 37 N -2.42 1.72 0.26 1.61 0.52 -1.19 -0.62 118.94 118.83 2j6k s TRP 37 Ca 0.00 -0.37 0.06 0.00 0.02 0.00 0.00 56.10 55.81 2j6k s TRP 37 Cb 0.00 -1.03 -0.06 0.00 -1.15 0.00 0.00 33.47 31.24 2j6k s TRP 37 CO 0.00 0.09 -0.05 -0.51 0.02 0.00 0.00 176.95 176.50 2j6k s LEU 38 N -1.19 2.42 0.02 2.99 1.43 0.39 -3.51 118.68 121.24 2j6k s LEU 38 Ca 0.07 -1.19 0.07 0.00 -1.03 0.00 0.00 54.13 52.05 2j6k s LEU 38 Cb -0.09 -0.55 -0.02 0.00 0.03 0.00 0.00 46.19 45.56 2j6k s LEU 38 CO 0.02 -0.37 -0.21 -0.70 0.23 0.00 0.00 176.35 175.32 2j6k s GLU 39 N -3.75 1.49 0.08 1.70 2.12 -0.67 -1.31 118.70 118.36 2j6k s GLU 39 Ca 0.29 -0.87 -0.25 0.00 0.36 0.00 0.00 54.97 54.49 2j6k s GLU 39 Cb 0.04 -1.55 0.09 0.00 0.26 0.00 0.00 34.13 32.97 2j6k s GLU 39 CO 0.11 0.41 1.16 0.20 -0.54 0.00 0.00 175.26 176.59 2j6k s GLY 40 N -0.93 -0.02 -0.13 -1.50 0.00 -0.52 0.15 107.32 104.37 2j6k s GLY 40 Ca 0.08 -0.12 -0.01 0.00 0.00 0.00 0.00 44.72 44.67 2j6k s GLY 40 CO 0.01 3.76 -0.08 1.85 0.00 0.00 0.00 173.10 178.63 2j6k s GLU 41 N -2.13 3.40 -0.03 2.90 2.12 -0.31 -0.86 118.70 123.80 2j6k s GLU 41 Ca 0.25 -0.60 0.00 0.00 0.36 0.00 0.00 54.97 54.98 2j6k s GLU 41 Cb -0.01 -2.74 0.03 0.00 0.26 0.00 0.00 34.13 31.67 2j6k s GLU 41 CO 0.02 0.29 0.01 -1.17 -0.54 0.00 0.00 175.26 173.88 2j6k s LEU 42 N 0.18 1.04 -1.30 2.70 2.96 0.34 -0.86 118.68 123.74 2j6k s LEU 42 Ca -0.05 0.00 -0.07 0.00 -0.22 0.00 0.00 54.13 53.80 2j6k s LEU 42 Cb -0.14 -0.17 -0.00 0.00 0.50 0.00 0.00 46.19 46.37 2j6k s LEU 42 CO 0.04 -0.12 0.59 -3.20 -1.32 0.00 0.00 176.35 172.34 2j6k n ASN 43 N 4.27 -2.06 0.00 3.68 5.15 -1.26 -1.68 115.26 123.36 2j6k n ASN 43 Ca -0.25 -0.97 0.00 0.00 -0.60 0.00 0.00 54.58 52.76 2j6k n ASN 43 Cb 0.50 -3.37 0.00 0.00 -0.53 0.00 0.00 39.78 36.39 2j6k n ASN 43 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2j6k n GLY 44 N -1.80 0.47 3.16 8.20 0.00 -1.26 -4.98 105.19 108.97 2j6k n GLY 44 Ca -0.24 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.56 2j6k n GLY 44 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2j6k s ARG 45 N -0.57 1.14 -0.07 1.61 3.52 -0.68 -5.14 118.95 118.76 2j6k s ARG 45 Ca 0.00 -0.73 -0.02 0.00 -0.13 0.00 0.00 55.73 54.85 2j6k s ARG 45 Cb 0.00 -1.16 -0.04 0.00 -1.56 0.00 0.00 34.95 32.20 2j6k s ARG 45 CO 0.00 0.30 0.04 1.03 -0.81 0.00 0.00 175.30 175.86 2j6k s ARG 46 N -0.88 3.06 0.09 5.12 0.52 -1.26 -0.50 118.95 125.09 2j6k s ARG 46 Ca 0.04 -0.38 -0.26 0.00 -0.52 0.00 0.00 55.73 54.61 2j6k s ARG 46 Cb -0.07 -2.87 0.09 0.00 0.52 0.00 0.00 34.95 32.62 2j6k s ARG 46 CO 0.01 0.70 1.14 0.20 0.02 0.00 0.00 175.30 177.37 2j6k s GLY 47 N -1.08 -0.12 0.27 -3.53 0.00 -0.04 -4.92 107.32 97.90 2j6k s GLY 47 Ca 0.15 0.06 0.06 0.00 0.00 0.00 0.00 44.72 44.99 2j6k s GLY 47 CO 0.05 2.30 0.32 -3.16 0.00 0.00 0.00 173.10 172.61 2j6k s MET 48 N -2.37 3.16 0.10 2.90 0.23 -0.07 -1.44 119.30 121.81 2j6k s MET 48 Ca 0.20 -0.94 -0.25 0.00 -1.03 0.00 0.00 55.69 53.67 2j6k s MET 48 Cb -0.00 -2.74 0.08 0.00 -1.53 0.00 0.00 34.83 30.64 2j6k s MET 48 CO 0.01 0.33 0.73 -0.59 -2.03 0.00 0.00 175.02 173.48 2j6k s PHE 49 N -2.09 -0.44 0.34 3.16 -0.12 -0.43 -0.42 117.98 117.98 2j6k s PHE 49 Ca 0.36 0.25 -0.22 0.00 -0.05 0.00 0.00 56.93 57.26 2j6k s PHE 49 Cb -0.08 0.56 -0.10 0.00 -0.63 0.00 0.00 43.02 42.77 2j6k s PHE 49 CO 0.28 -0.74 0.89 -1.25 -0.05 0.00 0.00 175.22 174.34 2j6k s PRO 50 N -3.49 4.36 0.09 1.99 0.05 -1.26 -0.46 135.00 136.28 2j6k s PRO 50 Ca 0.03 1.11 0.27 0.00 0.05 0.00 0.00 61.00 62.47 2j6k s PRO 50 Cb -0.01 -2.59 1.03 0.00 0.05 0.00 0.00 34.50 32.98 2j6k s PRO 50 CO -0.10 0.19 1.83 -0.40 0.05 0.00 0.00 177.00 178.58 2j6k n ASP 51 N 0.13 0.33 -0.25 6.66 5.68 0.21 -3.06 116.55 126.26 2j6k n ASP 51 Ca 0.03 0.54 0.15 0.00 -0.50 0.00 0.00 54.79 55.00 2j6k n ASP 51 Cb 0.52 -0.62 0.73 0.00 -1.14 0.00 0.00 41.12 40.60 2j6k n ASP 51 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 2j6k n ASN 52 N -1.82 0.77 -0.60 -1.12 6.94 -1.26 -3.47 115.26 114.70 2j6k n ASN 52 Ca 0.06 -1.26 0.12 0.00 -0.02 0.00 0.00 54.58 53.48 2j6k n ASN 52 Cb 0.36 -0.00 0.14 0.00 -2.36 0.00 0.00 39.78 37.92 2j6k n ASN 52 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 2j6k n PHE 53 N -0.39 0.00 -4.21 -2.53 3.01 -1.17 -4.89 117.46 107.27 2j6k n PHE 53 Ca 0.21 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.55 2j6k n PHE 53 Cb 0.23 -0.02 -0.10 0.00 -0.01 0.00 0.00 39.48 39.59 2j6k n PHE 53 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 2j6k s VAL 54 N -2.29 0.33 -0.03 -4.37 -7.23 -1.23 0.04 120.40 105.63 2j6k s VAL 54 Ca 0.24 -1.96 0.01 0.00 -1.81 0.00 0.00 61.98 58.46 2j6k s VAL 54 Cb 0.19 -2.21 0.02 0.00 0.56 0.00 0.00 36.38 34.94 2j6k s VAL 54 CO 0.46 -0.34 -0.02 -0.75 -0.31 0.00 0.00 175.10 174.14 2j6k s LYS 55 N -4.02 0.47 0.15 4.82 2.20 -0.18 -4.87 119.74 118.30 2j6k s LYS 55 Ca 0.28 -0.01 -0.31 0.00 -0.36 0.00 0.00 55.97 55.56 2j6k s LYS 55 Cb 0.07 -0.57 -0.10 0.00 -1.51 0.00 0.00 37.83 35.72 2j6k s LYS 55 CO 0.05 -0.08 1.72 -2.00 -0.36 0.00 0.00 175.35 174.68 2j6k s GLU 56 N 0.82 4.16 -0.19 4.03 2.12 -1.26 -0.66 118.70 127.71 2j6k s GLU 56 Ca -0.09 2.52 -0.25 0.00 0.36 0.00 0.00 54.97 57.51 2j6k s GLU 56 Cb -0.12 -3.36 -0.01 0.00 0.26 0.00 0.00 34.13 30.90 2j6k s GLU 56 CO -0.01 -0.76 0.82 0.42 -0.54 0.00 0.00 175.26 175.20 2j6k s ILE 57 N 1.96 4.87 -1.01 -3.70 1.01 0.07 -4.88 121.20 119.52 2j6k s ILE 57 Ca 0.76 1.59 0.08 0.00 0.00 0.00 0.00 60.65 63.08 2j6k s ILE 57 Cb -0.46 -4.12 0.06 0.00 0.01 0.00 0.00 42.46 37.95 2j6k s ILE 57 CO 0.33 -0.00 0.75 0.29 0.00 0.00 0.00 174.94 176.32