#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u5m s VAL 2 N 0.00 3.74 0.68 -0.72 1.01 -1.26 -5.08 120.40 118.78 1u5m s VAL 2 Ca 0.00 -1.96 -0.17 0.00 0.00 0.00 0.00 61.98 59.86 1u5m s VAL 2 Cb 0.00 -3.51 -0.01 0.00 0.00 0.00 0.00 36.38 32.86 1u5m s VAL 2 CO 0.00 -0.74 0.99 -0.62 0.00 0.00 0.00 175.10 174.73 1u5m n GLU 3 N 4.71 0.66 -1.04 2.72 4.71 -1.26 -4.90 120.64 126.24 1u5m n GLU 3 Ca -0.04 0.28 -0.35 0.00 -0.01 0.00 0.00 57.16 57.03 1u5m n GLU 3 Cb 0.41 -2.23 0.08 0.00 -1.01 0.00 0.00 31.44 28.68 1u5m n GLU 3 CO 0.00 0.00 0.00 1.97 0.09 0.00 0.00 177.13 179.19 1u5m n PHE 4 N -2.26 -2.15 -1.68 -0.32 -1.74 -1.26 -4.78 117.46 103.27 1u5m n PHE 4 Ca 0.14 0.23 -0.45 0.00 -0.56 0.00 0.00 57.45 56.81 1u5m n PHE 4 Cb 0.49 -1.75 -0.04 0.00 1.52 0.00 0.00 39.48 39.70 1u5m n PHE 4 CO 0.00 0.00 0.00 1.04 -0.56 0.00 0.00 176.76 177.24 1u5m n GLN 5 N -0.20 2.41 0.01 3.97 1.13 -1.26 -4.86 117.38 118.58 1u5m n GLN 5 Ca 0.06 0.88 -0.03 0.00 -1.94 0.00 0.00 57.00 55.97 1u5m n GLN 5 Cb 0.52 -2.72 -0.01 0.00 0.11 0.00 0.00 30.24 28.14 1u5m n GLN 5 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 1u5m n GLU 6 N 5.39 0.14 -4.10 -1.09 2.13 -1.26 -5.08 120.64 116.76 1u5m n GLU 6 Ca 0.19 0.05 -0.14 0.00 0.66 0.00 0.00 57.16 57.93 1u5m n GLU 6 Cb 0.32 -0.74 -0.12 0.00 0.27 0.00 0.00 31.44 31.17 1u5m n GLU 6 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1u5m s ALA 7 N -2.23 0.57 -0.02 4.31 0.00 -1.26 -5.08 121.76 118.06 1u5m s ALA 7 Ca -0.08 -0.62 -0.19 0.00 0.00 0.00 0.00 51.96 51.07 1u5m s ALA 7 Cb 0.01 -0.01 -0.11 0.00 0.00 0.00 0.00 23.12 23.01 1u5m s ALA 7 CO 0.11 0.03 0.81 0.78 0.00 0.00 0.00 175.76 177.49 1u5m h GLY 8 N 4.94 -0.72 -1.38 0.00 0.00 -1.96 -3.46 103.07 100.49 1u5m h GLY 8 Ca -0.34 0.27 -0.41 0.00 0.00 0.00 0.00 47.33 46.85 1u5m h GLY 8 CO 0.43 -0.26 -0.97 -1.14 0.00 0.00 0.00 176.54 174.61 1u5m n SER 9 N -5.12 -2.59 -4.65 0.19 3.41 -1.26 -3.85 113.62 99.75 1u5m n SER 9 Ca -0.09 -0.21 -0.31 0.00 -0.26 0.00 0.00 58.87 58.00 1u5m n SER 9 Cb 0.27 -0.90 -0.09 0.00 -0.26 0.00 0.00 64.21 63.24 1u5m n SER 9 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1u5m s VAL 11 N -1.17 5.11 -0.34 0.00 1.01 -1.26 -1.88 120.40 121.88 1u5m s VAL 11 Ca 0.22 -0.22 0.04 0.00 0.00 0.00 0.00 61.98 62.01 1u5m s VAL 11 Cb -0.11 -3.97 0.10 0.00 0.00 0.00 0.00 36.38 32.39 1u5m s VAL 11 CO 0.13 -0.32 0.04 -1.58 0.00 0.00 0.00 175.10 173.37 1u5m s GLN 12 N 2.10 1.49 -0.44 2.72 -0.44 0.34 -4.64 119.66 120.77 1u5m s GLN 12 Ca 0.12 -1.82 0.00 0.00 -2.50 0.00 0.00 55.36 51.16 1u5m s GLN 12 Cb -0.17 -3.15 0.00 0.00 -1.64 0.00 0.00 33.01 28.05 1u5m s GLN 12 CO 0.13 -0.92 0.00 -0.25 0.50 0.00 0.00 175.29 174.75 1u5m n ASP 13 N 4.28 -5.22 0.00 6.67 8.00 -1.26 -1.38 116.55 127.64 1u5m n ASP 13 Ca 0.03 0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.63 1u5m n ASP 13 Cb 0.42 -3.09 0.00 0.00 -0.02 0.00 0.00 41.12 38.43 1u5m n ASP 13 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1u5m n GLY 14 N -0.19 1.87 3.01 0.44 0.00 -1.26 -5.10 105.19 103.95 1u5m n GLY 14 Ca -0.04 -0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.75 1u5m n GLY 14 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1u5m s GLN 15 N -0.92 1.18 -0.14 1.61 -0.21 -0.48 -5.10 119.66 115.60 1u5m s GLN 15 Ca 0.00 -0.34 -0.27 0.00 0.02 0.00 0.00 55.36 54.78 1u5m s GLN 15 Cb 0.00 -1.06 -0.01 0.00 1.00 0.00 0.00 33.01 32.93 1u5m s GLN 15 CO 0.00 0.09 0.89 -0.98 -2.12 0.00 0.00 175.29 173.17 1u5m s ARG 16 N 0.34 4.35 -0.08 2.91 1.04 -1.25 -0.51 118.95 125.76 1u5m s ARG 16 Ca -0.06 1.14 0.01 0.00 -1.04 0.00 0.00 55.73 55.78 1u5m s ARG 16 Cb -0.11 -3.56 0.02 0.00 -2.04 0.00 0.00 34.95 29.26 1u5m s ARG 16 CO 0.01 -0.30 -0.10 0.71 -0.04 0.00 0.00 175.30 175.58 1u5m s TYR 17 N 2.03 1.39 1.03 5.89 2.02 -0.79 -4.91 117.35 124.02 1u5m s TYR 17 Ca 0.42 -0.57 -0.19 0.00 -0.37 0.00 0.00 57.07 56.35 1u5m s TYR 17 Cb -0.17 -1.08 0.03 0.00 -0.40 0.00 0.00 41.96 40.34 1u5m s TYR 17 CO 0.15 -0.35 -0.36 -1.71 -1.57 0.00 0.00 175.55 171.71 1u5m n ASN 18 N 4.23 -2.67 0.02 2.29 2.85 -1.26 -2.42 115.26 118.30 1u5m n ASN 18 Ca -0.19 -0.15 -0.01 0.00 -0.11 0.00 0.00 54.58 54.11 1u5m n ASN 18 Cb 0.51 -0.76 -0.00 0.00 1.24 0.00 0.00 39.78 40.77 1u5m n ASN 18 CO 0.00 0.00 0.00 -2.24 -2.11 0.00 0.00 177.26 172.91 1u5m h ASP 19 N -1.92 -0.06 -0.04 1.20 2.03 -1.93 -3.22 116.42 112.48 1u5m h ASP 19 Ca -0.40 0.00 0.01 0.00 -0.73 0.00 0.00 57.03 55.91 1u5m h ASP 19 Cb 1.16 0.01 -0.00 0.00 -0.83 0.00 0.00 39.33 39.67 1u5m h ASP 19 CO 0.26 0.01 0.34 0.50 -1.03 0.00 0.00 179.24 179.32 1u5m h LYS 20 N -0.18 0.00 -6.26 4.15 3.64 -1.93 -3.04 116.57 112.96 1u5m h LYS 20 Ca -0.01 0.00 -0.55 0.00 -1.27 0.00 0.00 60.65 58.82 1u5m h LYS 20 Cb 0.05 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1u5m h LYS 20 CO 0.01 0.00 1.20 -0.51 -2.27 0.00 0.00 179.45 177.88 1u5m s ASP 21 N -4.55 6.35 0.13 4.20 1.11 -1.21 -4.93 116.67 117.76 1u5m s ASP 21 Ca -0.03 2.18 0.04 0.00 0.18 0.00 0.00 52.55 54.92 1u5m s ASP 21 Cb 0.10 -2.53 -0.04 0.00 1.07 0.00 0.00 42.92 41.52 1u5m s ASP 21 CO 0.31 -1.20 0.12 0.54 1.18 0.00 0.00 175.17 176.12 1u5m s VAL 22 N 5.07 4.57 -0.01 -1.27 0.11 -1.26 -3.69 120.40 123.92 1u5m s VAL 22 Ca 0.82 -0.91 -0.08 0.00 -2.93 0.00 0.00 61.98 58.88 1u5m s VAL 22 Cb -0.34 -3.28 0.01 0.00 -1.53 0.00 0.00 36.38 31.23 1u5m s VAL 22 CO 0.34 -0.01 0.16 -1.66 -3.33 0.00 0.00 175.10 170.60 1u5m s TRP 23 N -1.60 -0.02 -0.44 1.54 -2.14 -1.03 -5.05 118.94 110.21 1u5m s TRP 23 Ca 0.31 0.00 -0.07 0.00 2.66 0.00 0.00 56.10 58.99 1u5m s TRP 23 Cb -0.11 -0.02 0.11 0.00 -3.10 0.00 0.00 33.47 30.35 1u5m s TRP 23 CO 0.23 -0.26 0.28 0.21 -2.66 0.00 0.00 176.95 174.75 1u5m s LYS 24 N -1.13 2.37 0.08 3.25 2.36 -1.26 -2.59 119.74 122.83 1u5m s LYS 24 Ca -0.12 -1.70 -0.13 0.00 -2.55 0.00 0.00 55.97 51.46 1u5m s LYS 24 Cb -0.06 -3.78 -0.21 0.00 -1.05 0.00 0.00 37.83 32.73 1u5m s LYS 24 CO 0.02 -1.09 1.23 -1.00 1.55 0.00 0.00 175.35 176.05 1u5m h PRO 25 N 8.32 0.74 -4.70 4.03 0.13 -1.90 -3.46 132.00 135.16 1u5m h PRO 25 Ca -0.19 -0.73 -0.34 0.00 -0.87 0.00 0.00 66.00 63.88 1u5m h PRO 25 Cb 1.07 0.19 -0.24 0.00 0.13 0.00 0.00 31.00 32.14 1u5m h PRO 25 CO 0.79 1.31 -0.76 -1.21 -0.23 0.00 0.00 178.00 177.90 1u5m s GLU 26 N -3.47 0.61 -0.23 0.86 2.02 -1.13 -5.03 118.70 112.33 1u5m s GLU 26 Ca -0.10 -0.59 -0.05 0.00 0.02 0.00 0.00 54.97 54.25 1u5m s GLU 26 Cb 0.07 -0.50 -0.18 0.00 0.10 0.00 0.00 34.13 33.62 1u5m s GLU 26 CO 0.92 0.12 2.77 -0.35 0.02 0.00 0.00 175.26 178.73 1u5m n PRO 27 N 2.02 1.74 0.00 0.39 -0.04 -1.26 -2.25 135.00 135.59 1u5m n PRO 27 Ca -0.19 -0.94 0.00 0.00 -0.04 0.00 0.00 63.50 62.33 1u5m n PRO 27 Cb 0.56 -2.01 0.00 0.00 -0.04 0.00 0.00 33.50 32.00 1u5m n PRO 27 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1u5m s ARG 29 N -0.81 2.15 0.22 0.00 6.06 -0.95 -3.49 118.95 122.13 1u5m s ARG 29 Ca 0.00 -0.66 0.07 0.00 -2.50 0.00 0.00 55.73 52.65 1u5m s ARG 29 Cb 0.00 -1.76 -0.04 0.00 0.06 0.00 0.00 34.95 33.21 1u5m s ARG 29 CO 0.00 0.19 0.09 0.96 -2.50 0.00 0.00 175.30 174.04 1u5m s ILE 30 N 0.24 4.03 -0.04 4.11 -5.25 -1.07 -2.82 121.20 120.40 1u5m s ILE 30 Ca -0.10 -1.48 -0.03 0.00 -0.99 0.00 0.00 60.65 58.06 1u5m s ILE 30 Cb -0.14 -3.12 0.02 0.00 2.95 0.00 0.00 42.46 42.17 1u5m s ILE 30 CO 0.04 -0.25 0.10 0.00 -1.79 0.00 0.00 174.94 173.04 1u5m s VAL 32 N 0.44 0.65 -0.33 0.00 0.11 -0.30 -2.46 120.40 118.52 1u5m s VAL 32 Ca -0.03 -1.96 -0.12 0.00 -2.93 0.00 0.00 61.98 56.94 1u5m s VAL 32 Cb -0.05 -1.93 -0.02 0.00 -1.53 0.00 0.00 36.38 32.85 1u5m s VAL 32 CO -0.02 -0.64 0.21 0.00 -3.33 0.00 0.00 175.10 171.33 1u5m s ASP 34 N 1.70 4.67 -1.63 0.00 2.15 0.47 -3.58 116.67 120.45 1u5m s ASP 34 Ca 0.06 -1.24 0.00 0.00 0.43 0.00 0.00 52.55 51.80 1u5m s ASP 34 Cb -0.17 -1.66 0.00 0.00 -0.30 0.00 0.00 42.92 40.79 1u5m s ASP 34 CO 0.10 -0.22 0.00 0.41 -0.17 0.00 0.00 175.17 175.29 1u5m n THR 35 N 4.58 -0.78 -0.56 1.71 -1.04 -1.26 0.33 114.28 117.25 1u5m n THR 35 Ca -0.14 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.87 1u5m n THR 35 Cb 0.44 -2.55 0.00 0.00 -1.82 0.00 0.00 70.33 66.40 1u5m n THR 35 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1u5m n GLY 36 N -0.89 0.74 3.52 3.41 0.00 -1.25 -5.04 105.19 105.67 1u5m n GLY 36 Ca -0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 1u5m n GLY 36 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1u5m s THR 37 N -2.30 4.03 -0.63 2.61 2.01 0.15 -4.74 115.64 116.78 1u5m s THR 37 Ca 0.00 -0.31 -0.24 0.00 0.31 0.00 0.00 61.69 61.45 1u5m s THR 37 Cb 0.00 -2.78 0.05 0.00 0.01 0.00 0.00 72.50 69.78 1u5m s THR 37 CO 0.00 0.49 1.03 -0.69 -0.69 0.00 0.00 174.62 174.75 1u5m s VAL 38 N 0.39 4.22 -0.14 3.82 1.01 -1.26 0.18 120.40 128.63 1u5m s VAL 38 Ca -0.03 0.11 -0.02 0.00 0.00 0.00 0.00 61.98 62.04 1u5m s VAL 38 Cb -0.14 -4.67 -0.02 0.00 0.00 0.00 0.00 36.38 31.55 1u5m s VAL 38 CO 0.02 -1.39 -0.07 -0.76 0.00 0.00 0.00 175.10 172.91 1u5m s LEU 39 N 4.37 3.10 -0.21 3.92 1.02 0.07 -4.93 118.68 126.01 1u5m s LEU 39 Ca 0.29 -0.17 -0.10 0.00 0.02 0.00 0.00 54.13 54.16 1u5m s LEU 39 Cb -0.13 -1.73 -0.05 0.00 0.02 0.00 0.00 46.19 44.30 1u5m s LEU 39 CO 0.16 0.19 0.14 0.00 0.02 0.00 0.00 176.35 176.85 1u5m s ASP 41 N 0.62 4.67 0.74 0.00 -1.08 -0.35 -4.98 116.67 116.29 1u5m s ASP 41 Ca 0.08 -0.40 -0.11 0.00 -0.52 0.00 0.00 52.55 51.60 1u5m s ASP 41 Cb -0.12 -0.97 0.04 0.00 -1.46 0.00 0.00 42.92 40.41 1u5m s ASP 41 CO 0.00 0.11 1.08 -0.62 0.52 0.00 0.00 175.17 176.26 1u5m s ASP 42 N -2.79 4.84 -0.34 -0.34 3.68 -1.26 -2.59 116.67 117.87 1u5m s ASP 42 Ca 0.26 1.71 -0.10 0.00 2.13 0.00 0.00 52.55 56.55 1u5m s ASP 42 Cb -0.10 -2.49 0.01 0.00 -1.45 0.00 0.00 42.92 38.90 1u5m s ASP 42 CO 0.17 -1.80 0.18 -0.63 0.13 0.00 0.00 175.17 173.22 1u5m s ILE 43 N -2.97 4.55 -0.47 4.11 1.01 -1.23 -4.80 121.20 121.40 1u5m s ILE 43 Ca 0.60 -0.67 -0.25 0.00 0.00 0.00 0.00 60.65 60.33 1u5m s ILE 43 Cb -0.16 -3.44 0.03 0.00 0.01 0.00 0.00 42.46 38.90 1u5m s ILE 43 CO 0.56 -0.09 0.91 0.27 0.00 0.00 0.00 174.94 176.58 1u5m s ILE 44 N 1.57 4.49 0.33 2.92 -4.36 -1.26 -4.94 121.20 119.95 1u5m s ILE 44 Ca 0.03 0.68 0.07 0.00 -0.26 0.00 0.00 60.65 61.17 1u5m s ILE 44 Cb -0.18 -4.43 -0.01 0.00 1.25 0.00 0.00 42.46 39.09 1u5m s ILE 44 CO 0.06 -0.84 0.43 0.00 0.24 0.00 0.00 174.94 174.84 1u5m s GLU 46 N -4.14 0.79 0.28 0.00 8.01 -1.26 -5.04 118.70 117.34 1u5m s GLU 46 Ca 0.44 1.04 0.06 0.00 0.01 0.00 0.00 54.97 56.52 1u5m s GLU 46 Cb -0.09 -1.74 -0.02 0.00 -4.31 0.00 0.00 34.13 27.97 1u5m s GLU 46 CO 0.30 -2.63 0.38 -0.51 0.01 0.00 0.00 175.26 172.81 1u5m s ASP 47 N -3.03 6.05 0.17 -0.19 1.01 -1.26 -4.98 116.67 114.44 1u5m s ASP 47 Ca 0.65 -0.09 0.11 0.00 0.71 0.00 0.00 52.55 53.94 1u5m s ASP 47 Cb -0.21 -1.54 -0.04 0.00 1.01 0.00 0.00 42.92 42.14 1u5m s ASP 47 CO 0.59 -0.21 -0.25 0.54 0.21 0.00 0.00 175.17 176.05 1u5m s VAL 48 N -2.08 2.30 -0.49 -1.27 0.11 -1.26 -3.82 120.40 113.87 1u5m s VAL 48 Ca 0.38 -1.93 0.07 0.00 -2.93 0.00 0.00 61.98 57.58 1u5m s VAL 48 Cb -0.09 -2.07 0.26 0.00 -1.53 0.00 0.00 36.38 32.95 1u5m s VAL 48 CO 0.29 -0.05 0.63 0.29 -3.33 0.00 0.00 175.10 172.93 1u5m n LYS 49 N 0.50 1.52 -3.58 1.54 4.76 -1.26 -4.91 118.16 116.74 1u5m n LYS 49 Ca -0.15 -3.86 -0.25 0.00 -2.87 0.00 0.00 58.31 51.19 1u5m n LYS 49 Cb 0.55 -1.68 0.05 0.00 -1.84 0.00 0.00 35.03 32.11 1u5m n LYS 49 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1u5m n ASP 50 N 1.10 -4.74 -3.24 4.39 9.92 -1.26 -4.96 116.55 117.74 1u5m n ASP 50 Ca 0.25 -0.90 -0.21 0.00 -0.53 0.00 0.00 54.79 53.40 1u5m n ASP 50 Cb 0.48 -3.98 0.17 0.00 -0.64 0.00 0.00 41.12 37.16 1u5m n ASP 50 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1u5m h LEU 52 N 0.00 -0.02 -7.65 0.00 3.38 -1.95 -3.47 115.31 105.60 1u5m h LEU 52 Ca -0.29 -0.15 -0.25 0.00 0.09 0.00 0.00 57.88 57.27 1u5m h LEU 52 Cb 0.88 0.01 -0.30 0.00 0.09 0.00 0.00 40.66 41.33 1u5m h LEU 52 CO 0.19 0.55 -0.72 -0.44 0.09 0.00 0.00 178.44 178.12 1u5m s SER 53 N -5.63 0.02 0.23 -0.43 0.01 -1.26 -5.14 113.70 101.50 1u5m s SER 53 Ca -0.03 0.03 -0.30 0.00 1.31 0.00 0.00 55.95 56.96 1u5m s SER 53 Cb -0.00 -0.01 -0.09 0.00 0.21 0.00 0.00 66.02 66.13 1u5m s SER 53 CO 0.12 -0.05 1.10 -2.16 0.41 0.00 0.00 173.24 172.66 1u5m s PRO 54 N 0.41 4.62 -0.29 12.44 0.04 -1.26 -4.24 135.00 146.73 1u5m s PRO 54 Ca -0.03 1.76 -0.10 0.00 0.04 0.00 0.00 61.00 62.66 1u5m s PRO 54 Cb -0.05 -3.23 0.12 0.00 0.04 0.00 0.00 34.50 31.38 1u5m s PRO 54 CO -0.01 0.15 0.62 -2.00 0.04 0.00 0.00 177.00 175.80 1u5m s GLU 55 N -0.91 0.56 -0.04 4.56 2.12 -1.04 -4.79 118.70 119.15 1u5m s GLU 55 Ca 0.47 1.39 -0.30 0.00 0.36 0.00 0.00 54.97 56.89 1u5m s GLU 55 Cb -0.31 0.75 -0.04 0.00 0.26 0.00 0.00 34.13 34.80 1u5m s GLU 55 CO 0.38 -0.20 1.26 -1.50 -0.54 0.00 0.00 175.26 174.66 1u5m s ILE 56 N 2.76 4.10 -0.12 -3.70 2.07 -1.25 -3.87 121.20 121.18 1u5m s ILE 56 Ca -0.06 1.44 -0.29 0.00 -1.41 0.00 0.00 60.65 60.33 1u5m s ILE 56 Cb -0.11 -3.92 -0.02 0.00 0.13 0.00 0.00 42.46 38.53 1u5m s ILE 56 CO -0.18 -0.00 1.25 -2.16 -1.91 0.00 0.00 174.94 171.94 1u5m s PRO 57 N 2.29 4.27 -1.44 3.50 0.04 -1.26 -3.69 135.00 138.71 1u5m s PRO 57 Ca 0.58 1.68 -0.18 0.00 0.04 0.00 0.00 61.00 63.12 1u5m s PRO 57 Cb -0.27 -3.70 0.18 0.00 0.04 0.00 0.00 34.50 30.76 1u5m s PRO 57 CO 0.23 -0.62 0.46 0.34 0.04 0.00 0.00 177.00 177.45 1u5m n PHE 58 N 6.12 -0.90 -2.12 0.56 7.35 -1.26 -3.58 117.46 123.64 1u5m n PHE 58 Ca 0.13 0.53 0.00 0.00 -0.76 0.00 0.00 57.45 57.34 1u5m n PHE 58 Cb 0.45 -1.42 0.00 0.00 0.35 0.00 0.00 39.48 38.86 1u5m n PHE 58 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1u5m n GLY 59 N -0.93 -4.97 0.62 7.13 0.00 -1.24 -5.06 105.19 100.75 1u5m n GLY 59 Ca 0.09 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1u5m n GLY 59 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1u5m n GLU 60 N 1.93 0.00 0.00 1.61 -0.58 -1.23 -5.03 120.64 117.34 1u5m n GLU 60 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1u5m n GLU 60 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1u5m n GLU 60 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1u5m n PRO 63 N 4.85 2.18 -4.51 0.00 -0.04 -1.26 -4.55 135.00 131.67 1u5m n PRO 63 Ca -0.08 -2.32 -0.25 0.00 -0.04 0.00 0.00 63.50 60.80 1u5m n PRO 63 Cb 0.42 -3.19 -0.08 0.00 -0.04 0.00 0.00 33.50 30.61 1u5m n PRO 63 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1u5m s ILE 64 N 4.79 0.67 -0.30 0.52 -4.36 -1.25 -3.69 121.20 117.57 1u5m s ILE 64 Ca 0.54 -2.00 -0.13 0.00 -0.26 0.00 0.00 60.65 58.80 1u5m s ILE 64 Cb 0.12 -2.38 -0.03 0.00 1.25 0.00 0.00 42.46 41.41 1u5m s ILE 64 CO 0.04 0.00 0.28 0.00 0.24 0.00 0.00 174.94 175.49 1u5m s PRO 66 N 1.87 3.80 0.00 0.00 0.04 -1.26 -4.42 135.00 135.03 1u5m s PRO 66 Ca 0.09 1.19 0.00 0.00 0.04 0.00 0.00 61.00 62.33 1u5m s PRO 66 Cb -0.16 -3.94 0.00 0.00 0.04 0.00 0.00 34.50 30.44 1u5m s PRO 66 CO 0.11 -1.27 0.00 0.00 0.04 0.00 0.00 177.00 175.88 1u5m n ALA 67 N 8.05 0.00 -3.30 8.56 0.00 -1.25 -4.78 120.51 127.79 1u5m n ALA 67 Ca 0.16 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.37 1u5m n ALA 67 Cb 0.47 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.84 1u5m n ALA 67 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1u5m s ASP 68 N -2.36 1.16 -0.41 0.00 1.01 -1.26 -5.04 116.67 109.77 1u5m s ASP 68 Ca 0.00 -2.51 0.08 0.00 0.71 0.00 0.00 52.55 50.82 1u5m s ASP 68 Cb 0.00 0.08 0.18 0.00 1.01 0.00 0.00 42.92 44.19 1u5m s ASP 68 CO 0.00 -0.19 0.64 -1.48 0.21 0.00 0.00 175.17 174.36 1u5m s LEU 69 N 0.54 -1.51 -0.26 1.23 2.34 -1.26 -5.04 118.68 114.72 1u5m s LEU 69 Ca 0.28 -0.78 -0.02 0.00 0.06 0.00 0.00 54.13 53.66 1u5m s LEU 69 Cb -0.04 1.93 0.01 0.00 -0.56 0.00 0.00 46.19 47.53 1u5m s LEU 69 CO -0.12 -0.16 0.04 0.00 -1.06 0.00 0.00 176.35 175.05 1u5m n ALA 70 N 4.38 -3.37 0.02 1.48 0.00 -1.26 -4.98 120.51 116.79 1u5m n ALA 70 Ca 0.11 0.79 -0.02 0.00 0.00 0.00 0.00 53.44 54.32 1u5m n ALA 70 Cb 0.57 -1.62 -0.01 0.00 0.00 0.00 0.00 19.45 18.39 1u5m n ALA 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u5m h ALA 71 N 3.34 -0.19 -2.44 0.00 0.00 -1.96 -3.46 119.26 114.55 1u5m h ALA 71 Ca -0.10 -0.03 -0.29 0.00 0.00 0.00 0.00 54.91 54.49 1u5m h ALA 71 Cb 0.31 0.05 -0.35 0.00 0.00 0.00 0.00 17.79 17.81 1u5m h ALA 71 CO 0.07 -0.18 -0.60 0.00 0.00 0.00 0.00 179.25 178.55 1u5m s ALA 72 N -3.05 -0.40 -2.00 0.00 0.00 -1.26 -5.11 121.76 109.94 1u5m s ALA 72 Ca -0.02 0.38 0.31 0.00 0.00 0.00 0.00 51.96 52.63 1u5m s ALA 72 Cb 0.00 -1.36 1.84 0.00 0.00 0.00 0.00 23.12 23.60 1u5m s ALA 72 CO 0.06 -1.19 2.16 0.00 0.00 0.00 0.00 175.76 176.79