#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 5.84 0.09 4.52 1.01 -1.26 -1.80 116.67 125.06 2j6k s ASP 3 Ca 0.00 0.08 0.08 0.00 0.71 0.00 0.00 52.55 53.42 2j6k s ASP 3 Cb 0.00 -1.66 -0.03 0.00 1.01 0.00 0.00 42.92 42.24 2j6k s ASP 3 CO 0.00 0.15 -0.21 -0.31 0.21 0.00 0.00 175.17 175.01 2j6k s TYR 4 N -1.49 1.85 -0.12 4.23 2.02 -0.20 -1.17 117.35 122.47 2j6k s TYR 4 Ca 0.32 -0.40 -0.07 0.00 -0.37 0.00 0.00 57.07 56.54 2j6k s TYR 4 Cb -0.12 -1.04 -0.04 0.00 -0.40 0.00 0.00 41.96 40.36 2j6k s TYR 4 CO 0.24 0.18 0.14 -1.50 -1.57 0.00 0.00 175.55 173.04 2j6k s ILE 5 N -1.05 5.48 -0.10 2.71 2.07 0.20 -0.75 121.20 129.76 2j6k s ILE 5 Ca 0.07 0.20 -0.30 0.00 -1.41 0.00 0.00 60.65 59.22 2j6k s ILE 5 Cb -0.10 -3.39 -0.01 0.00 0.13 0.00 0.00 42.46 39.09 2j6k s ILE 5 CO 0.04 0.61 1.02 -0.69 -1.91 0.00 0.00 174.94 174.00 2j6k s VAL 6 N -0.95 4.75 -0.07 4.00 1.01 -0.11 -0.32 120.40 128.71 2j6k s VAL 6 Ca 0.15 2.02 0.18 0.00 0.00 0.00 0.00 61.98 64.33 2j6k s VAL 6 Cb -0.12 -4.30 -0.27 0.00 0.00 0.00 0.00 36.38 31.69 2j6k s VAL 6 CO 0.04 0.00 0.30 -0.62 0.00 0.00 0.00 175.10 174.83 2j6k n GLU 7 N 5.01 0.75 -3.81 2.72 -0.58 0.72 -1.34 120.64 124.11 2j6k n GLU 7 Ca 0.09 -0.12 -0.13 0.00 -0.42 0.00 0.00 57.16 56.58 2j6k n GLU 7 Cb 0.49 -1.45 -0.14 0.00 -0.57 0.00 0.00 31.44 29.77 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 -3.04 -0.11 0.38 -0.32 1.51 -0.95 -4.85 117.35 109.97 2j6k s TYR 8 Ca -0.08 0.30 -0.27 0.00 -1.01 0.00 0.00 57.07 56.01 2j6k s TYR 8 Cb 0.10 -0.02 -0.11 0.00 -0.11 0.00 0.00 41.96 41.82 2j6k s TYR 8 CO 0.77 -0.08 1.39 -0.25 -1.11 0.00 0.00 175.55 176.27 2j6k n ASP 9 N 3.43 3.27 -3.95 2.29 8.00 -1.26 -4.62 116.55 123.71 2j6k n ASP 9 Ca -0.17 1.19 -0.16 0.00 0.71 0.00 0.00 54.79 56.36 2j6k n ASP 9 Cb 0.57 -1.56 -0.14 0.00 -0.02 0.00 0.00 41.12 39.96 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 -1.13 0.45 -0.17 1.24 6.14 -0.48 -5.01 117.35 118.39 2j6k s TYR 10 Ca 0.56 -0.09 -0.03 0.00 0.64 0.00 0.00 57.07 58.16 2j6k s TYR 10 Cb -0.50 -0.29 -0.02 0.00 0.42 0.00 0.00 41.96 41.56 2j6k s TYR 10 CO 0.62 -0.01 -0.07 -0.51 0.64 0.00 0.00 175.55 176.22 2j6k s ASP 11 N -0.10 4.37 0.33 4.32 -0.00 -1.26 -1.07 116.67 123.27 2j6k s ASP 11 Ca 0.02 -0.29 -0.29 0.00 -0.00 0.00 0.00 52.55 51.99 2j6k s ASP 11 Cb -0.02 -1.71 -0.11 0.00 -0.00 0.00 0.00 42.92 41.07 2j6k s ASP 11 CO -0.00 0.10 1.54 0.00 -0.00 0.00 0.00 175.17 176.80 2j6k n ALA 12 N 4.00 2.44 -0.01 5.23 0.00 -1.26 -4.90 120.51 126.02 2j6k n ALA 12 Ca -0.18 0.36 0.05 0.00 0.00 0.00 0.00 53.44 53.66 2j6k n ALA 12 Cb 0.52 -2.44 -0.09 0.00 0.00 0.00 0.00 19.45 17.44 2j6k n ALA 12 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2j6k n VAL 13 N 1.30 0.06 -4.42 0.00 0.31 -1.26 -4.98 118.33 109.33 2j6k n VAL 13 Ca 0.05 -0.27 -0.24 0.00 -0.01 0.00 0.00 64.34 63.87 2j6k n VAL 13 Cb 0.38 0.16 -0.11 0.00 -0.91 0.00 0.00 33.84 33.36 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 -2.72 2.16 0.45 3.52 3.76 -1.26 -5.04 115.29 116.15 2j6k s HIS 14 Ca -0.04 -0.39 0.13 0.00 -0.15 0.00 0.00 55.06 54.61 2j6k s HIS 14 Cb 0.07 -1.00 1.05 0.00 1.11 0.00 0.00 32.58 33.82 2j6k s HIS 14 CO 0.46 0.57 2.04 -0.44 -0.85 0.00 0.00 174.74 176.51 2j6k h ASP 15 N 2.68 0.30 -0.42 1.40 3.45 -2.03 -1.68 116.42 120.13 2j6k h ASP 15 Ca -0.42 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.04 2j6k h ASP 15 Cb 1.23 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 39.94 2j6k h ASP 15 CO 0.56 0.20 0.00 -0.90 -1.57 0.00 0.00 179.24 177.53 2j6k n ASP 16 N -4.48 2.29 -4.92 6.45 3.85 -1.26 -4.83 116.55 113.66 2j6k n ASP 16 Ca 0.05 -2.02 -0.29 0.00 -0.71 0.00 0.00 54.79 51.83 2j6k n ASP 16 Cb 0.24 -0.29 -0.04 0.00 -1.35 0.00 0.00 41.12 39.69 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 -1.46 3.56 -0.11 0.11 2.02 -0.63 -0.58 118.70 121.61 2j6k s GLU 17 Ca 0.28 -0.22 -0.14 0.00 0.02 0.00 0.00 54.97 54.92 2j6k s GLU 17 Cb 0.15 -2.81 -0.05 0.00 0.10 0.00 0.00 34.13 31.52 2j6k s GLU 17 CO 0.19 0.38 0.32 -0.51 0.02 0.00 0.00 175.26 175.66 2j6k s LEU 18 N -3.20 4.32 -0.15 1.80 1.43 0.76 -4.70 118.68 118.94 2j6k s LEU 18 Ca 0.40 0.65 -0.23 0.00 -1.03 0.00 0.00 54.13 53.92 2j6k s LEU 18 Cb -0.11 -2.42 -0.02 0.00 0.03 0.00 0.00 46.19 43.66 2j6k s LEU 18 CO 0.28 0.19 0.72 -0.89 0.23 0.00 0.00 176.35 176.88 2j6k s THR 19 N -0.10 4.98 0.07 5.49 2.01 -1.26 -4.04 115.64 122.79 2j6k s THR 19 Ca 0.19 1.42 0.03 0.00 0.31 0.00 0.00 61.69 63.64 2j6k s THR 19 Cb -0.14 -4.04 -0.03 0.00 0.01 0.00 0.00 72.50 68.30 2j6k s THR 19 CO 0.07 0.12 -0.10 0.27 -0.69 0.00 0.00 174.62 174.29 2j6k s ILE 20 N 1.66 0.80 -0.01 1.82 -4.36 -0.23 -4.95 121.20 115.93 2j6k s ILE 20 Ca 0.35 -1.36 0.03 0.00 -0.26 0.00 0.00 60.65 59.41 2j6k s ILE 20 Cb -0.17 -1.01 -0.00 0.00 1.25 0.00 0.00 42.46 42.53 2j6k s ILE 20 CO 0.13 -0.43 -0.10 -0.13 0.24 0.00 0.00 174.94 174.66 2j6k s ARG 21 N -2.12 0.84 -0.37 0.37 1.81 -1.26 -1.39 118.95 116.82 2j6k s ARG 21 Ca -0.02 -0.33 -0.37 0.00 -1.72 0.00 0.00 55.73 53.28 2j6k s ARG 21 Cb -0.07 -0.80 -0.16 0.00 -0.45 0.00 0.00 34.95 33.47 2j6k s ARG 21 CO 0.00 0.18 1.25 0.28 -0.68 0.00 0.00 175.30 176.34 2j6k n VAL 22 N 2.97 0.00 0.00 3.52 0.31 -1.26 -1.40 118.33 122.47 2j6k n VAL 22 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 2j6k n VAL 22 Cb 0.56 -0.37 0.00 0.00 -0.91 0.00 0.00 33.84 33.12 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 3.06 2.86 3.77 2.92 0.00 -0.45 -5.01 105.19 112.35 2j6k n GLY 23 Ca 0.24 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.97 3.62 -0.24 1.61 2.02 -0.49 -4.72 118.70 119.53 2j6k s GLU 24 Ca 0.00 1.67 -0.10 0.00 0.02 0.00 0.00 54.97 56.57 2j6k s GLU 24 Cb 0.00 -2.24 -0.05 0.00 0.10 0.00 0.00 34.13 31.95 2j6k s GLU 24 CO 0.00 -0.64 0.14 0.42 0.02 0.00 0.00 175.26 175.20 2j6k s ILE 25 N -1.66 5.12 -0.15 -1.63 1.01 -1.26 -0.93 121.20 121.69 2j6k s ILE 25 Ca 0.67 0.10 -0.19 0.00 0.00 0.00 0.00 60.65 61.23 2j6k s ILE 25 Cb -0.26 -3.39 -0.04 0.00 0.01 0.00 0.00 42.46 38.78 2j6k s ILE 25 CO 0.30 0.33 0.53 -0.63 0.00 0.00 0.00 174.94 175.47 2j6k s ILE 26 N 1.24 5.13 0.09 2.92 -1.09 0.07 -4.83 121.20 124.73 2j6k s ILE 26 Ca 0.07 1.02 0.05 0.00 -2.23 0.00 0.00 60.65 59.55 2j6k s ILE 26 Cb -0.14 -3.86 -0.04 0.00 -1.58 0.00 0.00 42.46 36.84 2j6k s ILE 26 CO 0.06 0.24 -0.02 0.00 -1.23 0.00 0.00 174.94 173.99 2j6k s ARG 27 N 1.13 2.49 -1.15 2.79 1.70 -0.33 -1.03 118.95 124.55 2j6k s ARG 27 Ca 0.27 -0.86 -0.09 0.00 -0.47 0.00 0.00 55.73 54.57 2j6k s ARG 27 Cb -0.15 -2.51 -0.03 0.00 -0.57 0.00 0.00 34.95 31.69 2j6k s ARG 27 CO 0.11 0.54 0.83 -1.71 -1.08 0.00 0.00 175.30 173.99 2j6k n ASN 28 N 0.63 -4.67 -4.75 -2.89 4.05 -1.18 -1.20 115.26 105.25 2j6k n ASN 28 Ca -0.11 -0.84 -0.40 0.00 0.45 0.00 0.00 54.58 53.68 2j6k n ASN 28 Cb 0.52 -4.32 -0.05 0.00 1.23 0.00 0.00 39.78 37.17 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 -3.48 3.71 0.02 3.44 1.01 -0.75 -4.43 120.40 119.92 2j6k s VAL 29 Ca 0.33 1.69 0.05 0.00 0.00 0.00 0.00 61.98 64.05 2j6k s VAL 29 Cb -0.08 -4.08 -0.02 0.00 0.00 0.00 0.00 36.38 32.21 2j6k s VAL 29 CO 0.80 0.39 -0.15 -0.54 0.00 0.00 0.00 175.10 175.60 2j6k s LYS 30 N -1.24 1.06 0.44 2.72 1.02 0.19 -4.64 119.74 119.29 2j6k s LYS 30 Ca 0.44 -0.66 -0.23 0.00 0.02 0.00 0.00 55.97 55.53 2j6k s LYS 30 Cb -0.30 -1.06 -0.08 0.00 -0.52 0.00 0.00 37.83 35.87 2j6k s LYS 30 CO 0.38 0.28 1.15 0.15 -0.92 0.00 0.00 175.35 176.39 2j6k s LYS 31 N -0.79 3.86 0.23 1.68 1.02 -1.26 -1.38 119.74 123.10 2j6k s LYS 31 Ca 0.04 1.76 0.09 0.00 0.02 0.00 0.00 55.97 57.88 2j6k s LYS 31 Cb -0.07 -2.48 -0.04 0.00 -0.52 0.00 0.00 37.83 34.72 2j6k s LYS 31 CO 0.01 -0.46 -0.03 -0.51 -0.92 0.00 0.00 175.35 173.43 2j6k s LEU 32 N -2.87 3.14 0.51 3.17 1.43 -1.22 -4.87 118.68 117.96 2j6k s LEU 32 Ca 0.62 -0.60 0.17 0.00 -1.03 0.00 0.00 54.13 53.29 2j6k s LEU 32 Cb -0.28 -1.72 1.26 0.00 0.03 0.00 0.00 46.19 45.48 2j6k s LEU 32 CO 0.35 0.04 2.12 1.56 0.23 0.00 0.00 176.35 180.65 2j6k h GLN 33 N 2.30 0.00 -6.38 1.70 1.08 -1.97 -3.41 115.11 108.44 2j6k h GLN 33 Ca -0.45 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 56.21 2j6k h GLN 33 Cb 1.23 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 28.68 2j6k h GLN 33 CO 0.58 0.05 1.14 -1.21 -0.95 0.00 0.00 178.83 178.44 2j6k s GLU 34 N -4.88 4.16 0.10 1.46 0.41 -1.26 -4.95 118.70 113.74 2j6k s GLU 34 Ca -0.05 2.46 -0.31 0.00 -0.41 0.00 0.00 54.97 56.66 2j6k s GLU 34 Cb 0.16 -3.92 -0.10 0.00 -1.78 0.00 0.00 34.13 28.50 2j6k s GLU 34 CO 0.66 -0.87 1.80 -2.00 -0.49 0.00 0.00 175.26 174.36 2j6k s GLU 35 N 3.73 4.15 0.00 1.61 -6.30 -1.26 -3.04 118.70 117.59 2j6k s GLU 35 Ca 0.81 2.53 0.00 0.00 -2.50 0.00 0.00 54.97 55.81 2j6k s GLU 35 Cb -0.40 -3.65 0.00 0.00 0.00 0.00 0.00 34.13 30.07 2j6k s GLU 35 CO 0.36 -0.83 0.00 0.41 0.02 0.00 0.00 175.26 175.22 2j6k n GLY 36 N 4.21 0.76 3.15 -1.50 0.00 -1.26 -5.05 105.19 105.50 2j6k n GLY 36 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.33 1.36 0.25 1.61 0.52 -1.17 -0.87 118.94 118.32 2j6k s TRP 37 Ca 0.00 -0.32 0.09 0.00 0.02 0.00 0.00 56.10 55.89 2j6k s TRP 37 Cb 0.00 -0.83 -0.05 0.00 -1.15 0.00 0.00 33.47 31.44 2j6k s TRP 37 CO 0.00 0.03 -0.14 -0.51 0.02 0.00 0.00 176.95 176.34 2j6k s LEU 38 N -0.88 2.57 0.00 2.99 1.43 0.32 -3.46 118.68 121.65 2j6k s LEU 38 Ca 0.04 -1.07 0.06 0.00 -1.03 0.00 0.00 54.13 52.14 2j6k s LEU 38 Cb -0.07 -0.83 -0.02 0.00 0.03 0.00 0.00 46.19 45.30 2j6k s LEU 38 CO 0.01 -0.13 -0.19 -0.70 0.23 0.00 0.00 176.35 175.56 2j6k s GLU 39 N -3.61 1.49 0.19 1.70 2.12 -0.48 -1.19 118.70 118.92 2j6k s GLU 39 Ca 0.27 -0.74 -0.19 0.00 0.36 0.00 0.00 54.97 54.66 2j6k s GLU 39 Cb -0.01 -1.48 0.07 0.00 0.26 0.00 0.00 34.13 32.97 2j6k s GLU 39 CO 0.11 0.40 0.94 0.41 -0.54 0.00 0.00 175.26 176.58 2j6k n GLY 40 N 2.41 0.69 3.34 -1.50 0.00 -0.43 0.53 105.19 110.24 2j6k n GLY 40 Ca -0.16 -1.15 -0.34 0.00 0.00 0.00 0.00 46.02 44.38 2j6k n GLY 40 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2j6k s GLU 41 N -2.05 3.38 -0.05 1.61 2.12 -0.34 -1.02 118.70 122.34 2j6k s GLU 41 Ca 0.21 -0.66 0.00 0.00 0.36 0.00 0.00 54.97 54.87 2j6k s GLU 41 Cb -0.03 -2.76 0.02 0.00 0.26 0.00 0.00 34.13 31.62 2j6k s GLU 41 CO 0.06 0.06 -0.02 -1.17 -0.54 0.00 0.00 175.26 173.65 2j6k s LEU 42 N 0.76 1.05 -1.30 2.70 2.96 0.64 -1.18 118.68 124.32 2j6k s LEU 42 Ca -0.04 -0.09 -0.02 0.00 -0.22 0.00 0.00 54.13 53.75 2j6k s LEU 42 Cb -0.15 -0.40 -0.00 0.00 0.50 0.00 0.00 46.19 46.13 2j6k s LEU 42 CO 0.01 -0.11 0.67 -3.20 -1.32 0.00 0.00 176.35 172.40 2j6k n ASN 43 N 4.43 -1.57 0.00 3.68 5.15 -1.26 -1.82 115.26 123.87 2j6k n ASN 43 Ca -0.19 -0.87 0.00 0.00 -0.60 0.00 0.00 54.58 52.92 2j6k n ASN 43 Cb 0.50 -3.87 0.00 0.00 -0.53 0.00 0.00 39.78 35.89 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 -1.64 0.41 3.20 8.20 0.00 -1.26 -5.00 105.19 109.10 2j6k n GLY 44 Ca -0.28 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.64 1.28 -0.02 1.61 3.52 -0.76 -5.14 118.95 118.80 2j6k s ARG 45 Ca 0.00 -0.80 0.00 0.00 -0.13 0.00 0.00 55.73 54.81 2j6k s ARG 45 Cb 0.00 -1.32 -0.04 0.00 -1.56 0.00 0.00 34.95 32.04 2j6k s ARG 45 CO 0.00 0.34 0.02 1.03 -0.81 0.00 0.00 175.30 175.88 2j6k s ARG 46 N -0.93 2.89 0.17 5.12 0.52 -1.26 -0.26 118.95 125.20 2j6k s ARG 46 Ca 0.06 -0.54 -0.24 0.00 -0.52 0.00 0.00 55.73 54.49 2j6k s ARG 46 Cb -0.08 -2.74 0.07 0.00 0.52 0.00 0.00 34.95 32.72 2j6k s ARG 46 CO 0.01 0.65 0.97 0.20 0.02 0.00 0.00 175.30 177.15 2j6k s GLY 47 N -1.45 -0.12 0.34 -3.53 0.00 -0.19 -4.92 107.32 97.46 2j6k s GLY 47 Ca 0.19 -0.03 0.04 0.00 0.00 0.00 0.00 44.72 44.91 2j6k s GLY 47 CO 0.09 0.58 0.51 -3.16 0.00 0.00 0.00 173.10 171.12 2j6k s MET 48 N -2.95 3.24 -0.04 2.90 0.23 0.25 -1.31 119.30 121.61 2j6k s MET 48 Ca 0.15 -0.72 -0.29 0.00 -1.03 0.00 0.00 55.69 53.79 2j6k s MET 48 Cb -0.02 -2.75 0.11 0.00 -1.53 0.00 0.00 34.83 30.64 2j6k s MET 48 CO 0.03 0.08 0.91 -0.59 -2.03 0.00 0.00 175.02 173.43 2j6k s PHE 49 N -2.24 -0.36 0.42 3.16 -0.12 -0.33 -0.17 117.98 118.33 2j6k s PHE 49 Ca 0.42 0.33 -0.23 0.00 -0.05 0.00 0.00 56.93 57.40 2j6k s PHE 49 Cb -0.10 0.51 -0.09 0.00 -0.63 0.00 0.00 43.02 42.72 2j6k s PHE 49 CO 0.33 -0.50 1.04 -1.25 -0.05 0.00 0.00 175.22 174.80 2j6k s PRO 50 N -2.62 4.09 0.41 1.99 0.04 -1.26 -0.52 135.00 137.14 2j6k s PRO 50 Ca 0.03 1.46 0.28 0.00 0.04 0.00 0.00 61.00 62.81 2j6k s PRO 50 Cb -0.01 -2.43 0.90 0.00 0.04 0.00 0.00 34.50 33.00 2j6k s PRO 50 CO -0.06 -0.19 1.79 0.38 0.04 0.00 0.00 177.00 178.96 2j6k h ASP 51 N 2.28 0.00 0.13 6.66 3.04 -1.33 -3.05 116.42 124.14 2j6k h ASP 51 Ca -0.49 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.30 2j6k h ASP 51 Cb 1.21 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.50 2j6k h ASP 51 CO 0.62 0.00 -0.02 -0.46 -2.04 0.00 0.00 179.24 177.33 2j6k n ASN 52 N -2.82 0.43 -0.73 4.15 6.94 -1.26 -3.21 115.26 118.77 2j6k n ASN 52 Ca 0.03 -0.94 0.13 0.00 -0.02 0.00 0.00 54.58 53.77 2j6k n ASN 52 Cb 0.38 -0.04 0.33 0.00 -2.36 0.00 0.00 39.78 38.09 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 -0.76 0.08 -3.92 -2.53 3.01 -1.15 -4.89 117.46 107.29 2j6k n PHE 53 Ca 0.20 -0.04 -0.09 0.00 1.01 0.00 0.00 57.45 58.53 2j6k n PHE 53 Cb 0.21 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.59 2j6k n PHE 53 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2j6k s VAL 54 N -1.92 0.13 -0.04 -4.37 0.11 -1.20 -0.20 120.40 112.91 2j6k s VAL 54 Ca 0.34 -1.07 0.02 0.00 -2.93 0.00 0.00 61.98 58.34 2j6k s VAL 54 Cb 0.20 -0.90 0.01 0.00 -1.53 0.00 0.00 36.38 34.17 2j6k s VAL 54 CO 0.31 -0.59 -0.08 -0.75 -3.33 0.00 0.00 175.10 170.66 2j6k s LYS 55 N -2.60 1.14 0.14 1.54 2.20 0.56 -4.87 119.74 117.85 2j6k s LYS 55 Ca -0.05 -0.27 -0.31 0.00 -0.36 0.00 0.00 55.97 54.98 2j6k s LYS 55 Cb -0.01 -1.03 -0.10 0.00 -1.51 0.00 0.00 37.83 35.18 2j6k s LYS 55 CO -0.04 0.02 1.56 -2.00 -0.36 0.00 0.00 175.35 174.53 2j6k s GLU 56 N 0.58 4.22 -0.13 4.03 2.12 -1.26 -0.63 118.70 127.64 2j6k s GLU 56 Ca -0.10 2.33 -0.25 0.00 0.36 0.00 0.00 54.97 57.31 2j6k s GLU 56 Cb -0.13 -3.24 -0.02 0.00 0.26 0.00 0.00 34.13 31.00 2j6k s GLU 56 CO 0.01 -0.61 0.81 0.42 -0.54 0.00 0.00 175.26 175.35 2j6k s ILE 57 N 1.39 4.92 -0.60 -3.70 1.01 -0.31 -4.89 121.20 119.03 2j6k s ILE 57 Ca 0.70 1.62 0.05 0.00 0.00 0.00 0.00 60.65 63.02 2j6k s ILE 57 Cb -0.42 -4.13 0.04 0.00 0.01 0.00 0.00 42.46 37.96 2j6k s ILE 57 CO 0.31 0.10 0.65 0.29 0.00 0.00 0.00 174.94 176.29