#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 5.74 0.19 -1.34 1.01 -1.26 -1.15 116.67 119.86 2j6k s ASP 3 Ca 0.00 0.06 0.11 0.00 0.71 0.00 0.00 52.55 53.43 2j6k s ASP 3 Cb 0.00 -1.61 -0.04 0.00 1.01 0.00 0.00 42.92 42.28 2j6k s ASP 3 CO 0.00 0.17 -0.18 -0.31 0.21 0.00 0.00 175.17 175.06 2j6k s TYR 4 N -1.42 2.42 -0.03 4.23 4.12 -0.17 -1.07 117.35 125.44 2j6k s TYR 4 Ca 0.31 -0.31 -0.04 0.00 0.02 0.00 0.00 57.07 57.05 2j6k s TYR 4 Cb -0.12 -1.19 -0.04 0.00 -1.52 0.00 0.00 41.96 39.09 2j6k s TYR 4 CO 0.23 0.51 0.18 0.96 0.02 0.00 0.00 175.55 177.46 2j6k s ILE 5 N -1.72 5.45 -0.14 2.71 -4.36 -0.41 -0.06 121.20 122.67 2j6k s ILE 5 Ca 0.23 -0.07 -0.25 0.00 -0.26 0.00 0.00 60.65 60.29 2j6k s ILE 5 Cb -0.08 -3.51 -0.02 0.00 1.25 0.00 0.00 42.46 40.10 2j6k s ILE 5 CO 0.12 0.39 0.82 -0.69 0.24 0.00 0.00 174.94 175.82 2j6k s VAL 6 N -1.26 4.91 -0.04 8.37 1.01 -0.21 -0.45 120.40 132.73 2j6k s VAL 6 Ca 0.25 1.63 0.18 0.00 0.00 0.00 0.00 61.98 64.03 2j6k s VAL 6 Cb -0.12 -4.13 -0.27 0.00 0.00 0.00 0.00 36.38 31.85 2j6k s VAL 6 CO 0.15 0.07 0.36 -0.62 0.00 0.00 0.00 175.10 175.06 2j6k n GLU 7 N 4.90 0.63 -3.89 2.72 1.02 0.44 -1.71 120.64 124.76 2j6k n GLU 7 Ca 0.04 -0.15 -0.15 0.00 -0.02 0.00 0.00 57.16 56.88 2j6k n GLU 7 Cb 0.49 -1.43 -0.15 0.00 -0.02 0.00 0.00 31.44 30.33 2j6k n GLU 7 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 2j6k s TYR 8 N -3.15 0.15 0.25 -0.32 1.51 -0.81 -4.86 117.35 110.12 2j6k s TYR 8 Ca -0.07 0.03 -0.31 0.00 -1.01 0.00 0.00 57.07 55.71 2j6k s TYR 8 Cb 0.11 -0.23 -0.13 0.00 -0.11 0.00 0.00 41.96 41.59 2j6k s TYR 8 CO 0.74 -0.07 1.36 -0.25 -1.11 0.00 0.00 175.55 176.22 2j6k n ASP 9 N 3.72 2.58 -4.03 2.29 8.00 -1.26 -4.67 116.55 123.18 2j6k n ASP 9 Ca -0.22 1.15 -0.20 0.00 0.71 0.00 0.00 54.79 56.24 2j6k n ASP 9 Cb 0.54 -1.41 -0.15 0.00 -0.02 0.00 0.00 41.12 40.08 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 0.91 -0.18 1.24 6.14 -0.58 -5.01 117.35 119.66 2j6k s TYR 10 Ca 0.67 -0.19 -0.04 0.00 0.64 0.00 0.00 57.07 58.15 2j6k s TYR 10 Cb -0.66 -0.60 -0.02 0.00 0.42 0.00 0.00 41.96 41.09 2j6k s TYR 10 CO 0.51 -0.04 -0.03 -0.51 0.64 0.00 0.00 175.55 176.13 2j6k s ASP 11 N -0.10 4.75 0.31 4.32 -0.00 -1.26 -0.84 116.67 123.84 2j6k s ASP 11 Ca 0.02 -0.18 -0.30 0.00 -0.00 0.00 0.00 52.55 52.09 2j6k s ASP 11 Cb -0.05 -1.79 -0.11 0.00 -0.00 0.00 0.00 42.92 40.97 2j6k s ASP 11 CO -0.00 0.12 1.54 0.00 -0.00 0.00 0.00 175.17 176.83 2j6k s ALA 12 N 0.69 3.69 -0.22 5.23 0.00 -1.26 -4.89 121.76 124.99 2j6k s ALA 12 Ca -0.01 1.53 0.15 0.00 0.00 0.00 0.00 51.96 53.63 2j6k s ALA 12 Cb -0.14 -3.62 -0.21 0.00 0.00 0.00 0.00 23.12 19.14 2j6k s ALA 12 CO 0.02 -0.96 0.42 0.28 0.00 0.00 0.00 175.76 175.52 2j6k n VAL 13 N 1.78 0.00 -4.26 0.00 0.31 -1.26 -4.97 118.33 109.93 2j6k n VAL 13 Ca 0.06 -0.29 -0.16 0.00 -0.01 0.00 0.00 64.34 63.94 2j6k n VAL 13 Cb 0.38 0.40 -0.10 0.00 -0.91 0.00 0.00 33.84 33.61 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 -2.86 1.39 0.50 3.52 3.76 -1.26 -5.05 115.29 115.29 2j6k s HIS 14 Ca -0.02 -0.64 0.17 0.00 -0.15 0.00 0.00 55.06 54.41 2j6k s HIS 14 Cb 0.10 -0.70 1.23 0.00 1.11 0.00 0.00 32.58 34.32 2j6k s HIS 14 CO 0.62 0.15 2.09 -0.44 -0.85 0.00 0.00 174.74 176.31 2j6k h ASP 15 N 3.05 0.09 -0.48 1.40 3.45 -2.04 -2.03 116.42 119.86 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 1.20 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 39.95 2j6k h ASP 15 CO 0.58 0.06 0.00 -0.90 -1.57 0.00 0.00 179.24 177.41 2j6k n ASP 16 N -4.49 4.15 -4.92 6.45 3.85 -1.26 -4.85 116.55 115.49 2j6k n ASP 16 Ca 0.02 -2.50 -0.26 0.00 -0.71 0.00 0.00 54.79 51.35 2j6k n ASP 16 Cb 0.24 -0.56 -0.03 0.00 -1.35 0.00 0.00 41.12 39.41 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 -2.01 3.35 -0.14 0.11 2.02 -0.77 -0.50 118.70 120.75 2j6k s GLU 17 Ca 0.41 -0.66 -0.15 0.00 0.02 0.00 0.00 54.97 54.58 2j6k s GLU 17 Cb 0.28 -2.90 -0.04 0.00 0.10 0.00 0.00 34.13 31.56 2j6k s GLU 17 CO 0.16 0.51 0.36 -0.51 0.02 0.00 0.00 175.26 175.80 2j6k s LEU 18 N -3.28 4.26 -0.03 1.80 1.43 0.11 -4.65 118.68 118.32 2j6k s LEU 18 Ca 0.34 0.63 -0.30 0.00 -1.03 0.00 0.00 54.13 53.77 2j6k s LEU 18 Cb -0.11 -2.49 -0.03 0.00 0.03 0.00 0.00 46.19 43.59 2j6k s LEU 18 CO 0.28 0.07 0.97 -0.89 0.23 0.00 0.00 176.35 177.01 2j6k s THR 19 N 0.48 4.86 0.07 5.49 2.01 -1.26 -4.15 115.64 123.14 2j6k s THR 19 Ca 0.20 2.03 0.04 0.00 0.31 0.00 0.00 61.69 64.27 2j6k s THR 19 Cb -0.14 -4.31 -0.03 0.00 0.01 0.00 0.00 72.50 68.04 2j6k s THR 19 CO 0.06 0.13 -0.11 0.27 -0.69 0.00 0.00 174.62 174.28 2j6k s ILE 20 N 1.23 0.92 0.02 1.82 -4.36 -0.02 -4.95 121.20 115.85 2j6k s ILE 20 Ca 0.50 -1.37 0.03 0.00 -0.26 0.00 0.00 60.65 59.55 2j6k s ILE 20 Cb -0.20 -1.06 -0.01 0.00 1.25 0.00 0.00 42.46 42.43 2j6k s ILE 20 CO 0.25 -0.38 -0.09 -0.13 0.24 0.00 0.00 174.94 174.84 2j6k s ARG 21 N -2.07 0.62 0.05 0.37 1.81 -1.26 -1.53 118.95 116.94 2j6k s ARG 21 Ca -0.01 -0.49 -0.38 0.00 -1.72 0.00 0.00 55.73 53.13 2j6k s ARG 21 Cb -0.08 -0.54 -0.19 0.00 -0.45 0.00 0.00 34.95 33.69 2j6k s ARG 21 CO 0.01 0.14 1.09 0.28 -0.68 0.00 0.00 175.30 176.14 2j6k n VAL 22 N 2.29 0.24 0.00 3.52 0.31 -1.26 -1.01 118.33 122.42 2j6k n VAL 22 Ca -0.17 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 2j6k n VAL 22 Cb 0.56 -0.26 0.00 0.00 -0.91 0.00 0.00 33.84 33.23 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 1.82 2.61 3.77 2.92 0.00 -0.69 -5.00 105.19 110.62 2j6k n GLY 23 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.67 4.31 -0.21 1.61 2.02 -0.18 -4.79 118.70 120.78 2j6k s GLU 24 Ca 0.00 2.01 -0.12 0.00 0.02 0.00 0.00 54.97 56.87 2j6k s GLU 24 Cb 0.00 -2.96 -0.05 0.00 0.10 0.00 0.00 34.13 31.22 2j6k s GLU 24 CO 0.00 -0.15 0.25 0.42 0.02 0.00 0.00 175.26 175.79 2j6k s ILE 25 N -1.23 5.31 -0.23 -1.63 -1.09 -1.26 -1.04 121.20 120.02 2j6k s ILE 25 Ca 0.51 0.39 -0.12 0.00 -2.23 0.00 0.00 60.65 59.19 2j6k s ILE 25 Cb -0.35 -3.58 -0.05 0.00 -1.58 0.00 0.00 42.46 36.90 2j6k s ILE 25 CO 0.46 0.33 0.23 -0.63 -1.23 0.00 0.00 174.94 174.10 2j6k s ILE 26 N 0.99 5.31 0.05 2.92 1.01 0.92 -4.85 121.20 127.54 2j6k s ILE 26 Ca 0.12 0.34 -0.01 0.00 0.00 0.00 0.00 60.65 61.10 2j6k s ILE 26 Cb -0.14 -3.57 -0.04 0.00 0.01 0.00 0.00 42.46 38.72 2j6k s ILE 26 CO 0.05 0.31 0.21 0.00 0.00 0.00 0.00 174.94 175.51 2j6k s ARG 27 N 1.20 3.45 -1.12 2.79 1.70 -0.12 -0.99 118.95 125.85 2j6k s ARG 27 Ca 0.11 -0.39 -0.16 0.00 -0.47 0.00 0.00 55.73 54.82 2j6k s ARG 27 Cb -0.14 -3.04 -0.03 0.00 -0.57 0.00 0.00 34.95 31.17 2j6k s ARG 27 CO 0.06 0.62 0.82 -1.71 -1.08 0.00 0.00 175.30 174.01 2j6k n ASN 28 N 0.44 -5.53 -4.72 -2.89 4.05 -1.18 -0.78 115.26 104.64 2j6k n ASN 28 Ca -0.06 -0.93 -0.41 0.00 0.45 0.00 0.00 54.58 53.63 2j6k n ASN 28 Cb 0.51 -3.89 -0.04 0.00 1.23 0.00 0.00 39.78 37.59 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 -3.45 4.35 0.01 3.44 1.01 -0.30 -4.45 120.40 121.00 2j6k s VAL 29 Ca 0.45 1.86 0.08 0.00 0.00 0.00 0.00 61.98 64.38 2j6k s VAL 29 Cb -0.13 -4.19 -0.02 0.00 0.00 0.00 0.00 36.38 32.03 2j6k s VAL 29 CO 0.83 0.24 -0.25 -0.54 0.00 0.00 0.00 175.10 175.38 2j6k s LYS 30 N 0.27 1.86 0.35 2.72 1.02 0.12 -4.56 119.74 121.51 2j6k s LYS 30 Ca 0.50 -0.98 -0.28 0.00 0.02 0.00 0.00 55.97 55.24 2j6k s LYS 30 Cb -0.25 -1.91 -0.10 0.00 -0.52 0.00 0.00 37.83 35.06 2j6k s LYS 30 CO 0.31 0.51 1.24 0.15 -0.92 0.00 0.00 175.35 176.64 2j6k s LYS 31 N -0.90 4.30 0.14 1.68 -0.14 -1.26 -1.52 119.74 122.04 2j6k s LYS 31 Ca 0.10 2.06 0.06 0.00 -1.36 0.00 0.00 55.97 56.84 2j6k s LYS 31 Cb -0.10 -2.97 -0.04 0.00 -1.68 0.00 0.00 37.83 33.04 2j6k s LYS 31 CO 0.01 -0.18 0.02 -1.17 -0.76 0.00 0.00 175.35 173.26 2j6k s LEU 32 N -1.95 3.45 0.32 3.17 2.96 -1.18 -4.87 118.68 120.58 2j6k s LEU 32 Ca 0.51 -0.28 0.01 0.00 -0.22 0.00 0.00 54.13 54.15 2j6k s LEU 32 Cb -0.36 -2.12 0.55 0.00 0.50 0.00 0.00 46.19 44.76 2j6k s LEU 32 CO 0.48 0.11 1.97 1.56 -1.32 0.00 0.00 176.35 179.15 2j6k h GLN 33 N 2.90 0.95 -6.64 1.98 4.20 -1.96 -3.41 115.11 113.12 2j6k h GLN 33 Ca -0.47 -0.06 -0.56 0.00 0.06 0.00 0.00 58.65 57.62 2j6k h GLN 33 Cb 1.19 -0.21 0.07 0.00 0.30 0.00 0.00 27.48 28.83 2j6k h GLN 33 CO 0.59 0.63 0.81 0.39 -0.67 0.00 0.00 178.83 180.58 2j6k n GLU 34 N -4.44 2.39 -2.45 1.46 4.71 -1.26 -4.93 120.64 116.12 2j6k n GLU 34 Ca 0.09 0.86 -0.42 0.00 -0.01 0.00 0.00 57.16 57.68 2j6k n GLU 34 Cb 0.09 -2.61 -0.03 0.00 -1.01 0.00 0.00 31.44 27.88 2j6k n GLU 34 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 2j6k s GLU 35 N 0.13 4.41 0.00 3.49 -6.30 -1.26 -3.38 118.70 115.80 2j6k s GLU 35 Ca 0.70 1.71 0.00 0.00 -2.50 0.00 0.00 54.97 54.89 2j6k s GLU 35 Cb -0.58 -3.43 0.00 0.00 0.00 0.00 0.00 34.13 30.12 2j6k s GLU 35 CO 0.44 -0.31 0.00 0.41 0.02 0.00 0.00 175.26 175.82 2j6k n GLY 36 N 3.25 0.47 3.21 -1.50 0.00 -1.26 -5.04 105.19 104.31 2j6k n GLY 36 Ca 0.09 -0.47 -0.23 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.00 1.58 0.18 1.61 0.52 -1.22 -1.36 118.94 118.26 2j6k s TRP 37 Ca 0.00 -0.36 0.09 0.00 0.02 0.00 0.00 56.10 55.85 2j6k s TRP 37 Cb 0.00 -0.94 -0.04 0.00 -1.15 0.00 0.00 33.47 31.33 2j6k s TRP 37 CO 0.00 0.06 -0.18 -0.51 0.02 0.00 0.00 176.95 176.34 2j6k s LEU 38 N -1.11 2.47 -0.05 2.99 1.43 0.58 -3.10 118.68 121.88 2j6k s LEU 38 Ca 0.05 -0.90 0.04 0.00 -1.03 0.00 0.00 54.13 52.30 2j6k s LEU 38 Cb -0.08 -0.85 -0.02 0.00 0.03 0.00 0.00 46.19 45.27 2j6k s LEU 38 CO 0.01 -0.04 -0.18 -0.70 0.23 0.00 0.00 176.35 175.67 2j6k s GLU 39 N -2.98 2.53 0.29 1.70 2.12 -0.58 -1.13 118.70 120.65 2j6k s GLU 39 Ca 0.18 -0.77 -0.19 0.00 0.36 0.00 0.00 54.97 54.55 2j6k s GLU 39 Cb -0.05 -2.31 0.05 0.00 0.26 0.00 0.00 34.13 32.09 2j6k s GLU 39 CO 0.08 0.53 0.86 0.20 -0.54 0.00 0.00 175.26 176.38 2j6k s GLY 40 N -0.49 0.14 -0.13 -1.50 0.00 -0.68 0.15 107.32 104.81 2j6k s GLY 40 Ca 0.06 -0.46 0.00 0.00 0.00 0.00 0.00 44.72 44.33 2j6k s GLY 40 CO 0.01 0.42 -0.14 1.85 0.00 0.00 0.00 173.10 175.25 2j6k s GLU 41 N -2.70 3.35 -0.05 2.90 2.12 0.04 -1.30 118.70 123.06 2j6k s GLU 41 Ca 0.16 -0.70 -0.02 0.00 0.36 0.00 0.00 54.97 54.77 2j6k s GLU 41 Cb -0.04 -2.60 0.03 0.00 0.26 0.00 0.00 34.13 31.78 2j6k s GLU 41 CO 0.08 0.22 0.08 -1.17 -0.54 0.00 0.00 175.26 173.93 2j6k s LEU 42 N 0.33 0.47 -1.33 2.70 2.96 0.12 -0.95 118.68 122.99 2j6k s LEU 42 Ca -0.11 0.15 -0.01 0.00 -0.22 0.00 0.00 54.13 53.94 2j6k s LEU 42 Cb -0.16 0.03 0.00 0.00 0.50 0.00 0.00 46.19 46.57 2j6k s LEU 42 CO 0.06 -0.20 0.67 -3.20 -1.32 0.00 0.00 176.35 172.37 2j6k n ASN 43 N 4.80 -1.19 -0.12 3.68 5.15 -1.26 -2.12 115.26 124.20 2j6k n ASN 43 Ca -0.15 -0.84 -0.02 0.00 -0.60 0.00 0.00 54.58 52.98 2j6k n ASN 43 Cb 0.50 -3.92 -0.01 0.00 -0.53 0.00 0.00 39.78 35.82 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 -1.63 0.39 3.10 8.20 0.00 -1.26 -5.00 105.19 108.99 2j6k n GLY 44 Ca -0.29 -0.08 -0.22 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.27 1.10 -0.06 1.61 3.52 -0.90 -5.15 118.95 117.81 2j6k s ARG 45 Ca 0.00 -0.50 -0.05 0.00 -0.13 0.00 0.00 55.73 55.05 2j6k s ARG 45 Cb 0.00 -1.06 -0.04 0.00 -1.56 0.00 0.00 34.95 32.29 2j6k s ARG 45 CO 0.00 0.29 0.17 1.03 -0.81 0.00 0.00 175.30 175.98 2j6k s ARG 46 N -0.36 3.46 0.14 5.12 0.52 -1.26 -0.70 118.95 125.86 2j6k s ARG 46 Ca 0.05 -0.20 -0.24 0.00 -0.52 0.00 0.00 55.73 54.82 2j6k s ARG 46 Cb -0.05 -3.14 0.08 0.00 0.52 0.00 0.00 34.95 32.35 2j6k s ARG 46 CO -0.00 0.72 1.07 0.20 0.02 0.00 0.00 175.30 177.31 2j6k s GLY 47 N -1.47 -0.04 0.43 -3.53 0.00 -0.42 -4.89 107.32 97.40 2j6k s GLY 47 Ca 0.21 -0.10 -0.06 0.00 0.00 0.00 0.00 44.72 44.78 2j6k s GLY 47 CO 0.11 1.96 0.73 1.06 0.00 0.00 0.00 173.10 176.97 2j6k s MET 48 N -2.43 3.60 -0.10 2.90 -1.94 0.34 -1.69 119.30 119.98 2j6k s MET 48 Ca 0.20 0.19 -0.30 0.00 -1.71 0.00 0.00 55.69 54.06 2j6k s MET 48 Cb -0.01 -2.44 0.12 0.00 2.01 0.00 0.00 34.83 34.51 2j6k s MET 48 CO 0.03 -0.08 0.99 -0.59 -0.01 0.00 0.00 175.02 175.36 2j6k s PHE 49 N -2.54 -0.31 0.16 -0.03 -0.12 -0.29 0.05 117.98 114.91 2j6k s PHE 49 Ca 0.47 0.33 -0.18 0.00 -0.05 0.00 0.00 56.93 57.50 2j6k s PHE 49 Cb -0.10 0.50 -0.07 0.00 -0.63 0.00 0.00 43.02 42.72 2j6k s PHE 49 CO 0.39 -0.41 0.63 -1.25 -0.05 0.00 0.00 175.22 174.54 2j6k s PRO 50 N -2.28 4.17 0.36 1.99 0.04 -1.26 -0.31 135.00 137.71 2j6k s PRO 50 Ca 0.04 0.73 0.27 0.00 0.04 0.00 0.00 61.00 62.08 2j6k s PRO 50 Cb -0.01 -3.00 1.09 0.00 0.04 0.00 0.00 34.50 32.62 2j6k s PRO 50 CO -0.05 0.49 1.81 0.38 0.04 0.00 0.00 177.00 179.67 2j6k h ASP 51 N 3.77 0.00 -0.01 6.66 3.04 -1.55 -2.68 116.42 125.66 2j6k h ASP 51 Ca -0.48 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.31 2j6k h ASP 51 Cb 1.20 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.49 2j6k h ASP 51 CO 0.65 0.00 0.00 -0.46 -2.04 0.00 0.00 179.24 177.39 2j6k n ASN 52 N -2.54 0.07 -0.19 4.15 6.94 -1.26 -3.21 115.26 119.22 2j6k n ASN 52 Ca 0.02 -1.65 0.07 0.00 -0.02 0.00 0.00 54.58 52.99 2j6k n ASN 52 Cb 0.27 -0.01 -0.03 0.00 -2.36 0.00 0.00 39.78 37.65 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 -0.63 0.00 -4.41 -2.53 3.01 -1.01 -4.89 117.46 107.00 2j6k n PHE 53 Ca 0.09 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.35 2j6k n PHE 53 Cb 0.05 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.42 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 -2.00 0.94 -0.04 -4.37 -7.23 -1.20 -0.42 120.40 106.09 2j6k s VAL 54 Ca 0.09 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.25 2j6k s VAL 54 Cb 0.11 -2.72 0.03 0.00 0.56 0.00 0.00 36.38 34.36 2j6k s VAL 54 CO 0.45 0.00 0.08 -0.75 -0.31 0.00 0.00 175.10 174.57 2j6k s LYS 55 N -3.93 0.03 0.24 4.82 2.20 0.40 -4.83 119.74 118.67 2j6k s LYS 55 Ca 0.36 0.25 -0.30 0.00 -0.36 0.00 0.00 55.97 55.92 2j6k s LYS 55 Cb 0.08 -0.18 -0.10 0.00 -1.51 0.00 0.00 37.83 36.12 2j6k s LYS 55 CO 0.15 -0.14 1.50 -2.00 -0.36 0.00 0.00 175.35 174.49 2j6k s GLU 56 N 0.96 4.23 -0.32 4.03 2.12 -1.26 -1.29 118.70 127.17 2j6k s GLU 56 Ca -0.08 2.37 -0.26 0.00 0.36 0.00 0.00 54.97 57.36 2j6k s GLU 56 Cb -0.11 -3.10 0.01 0.00 0.26 0.00 0.00 34.13 31.20 2j6k s GLU 56 CO -0.04 -0.50 0.93 0.42 -0.54 0.00 0.00 175.26 175.54 2j6k s ILE 57 N 0.20 4.64 0.00 -3.70 1.01 -0.23 -4.87 121.20 118.25 2j6k s ILE 57 Ca 0.62 1.44 0.00 0.00 0.00 0.00 0.00 60.65 62.71 2j6k s ILE 57 Cb -0.44 -4.29 0.00 0.00 0.01 0.00 0.00 42.46 37.75 2j6k s ILE 57 CO 0.42 -0.38 0.45 0.29 0.00 0.00 0.00 174.94 175.72