#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 0.00 -0.25 -0.72 -7.23 -1.26 -5.04 120.40 105.90 1u5m s VAL 2 Ca 0.00 -1.64 -0.07 0.00 -1.81 0.00 0.00 61.98 58.47 1u5m s VAL 2 Cb 0.00 -2.49 0.01 0.00 0.56 0.00 0.00 36.38 34.45 1u5m s VAL 2 CO 0.00 0.00 0.25 -0.62 -0.31 0.00 0.00 175.10 174.42 1u5m n GLU 3 N -0.47 -1.86 -3.04 4.82 1.02 -1.26 -5.07 120.64 114.79 1u5m n GLU 3 Ca 0.01 1.75 0.02 0.00 -0.02 0.00 0.00 57.16 58.91 1u5m n GLU 3 Cb 0.62 -4.13 -0.00 0.00 -0.02 0.00 0.00 31.44 27.91 1u5m n GLU 3 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 1u5m s PHE 4 N -1.69 -1.14 0.18 -0.32 5.36 -1.26 -5.16 117.98 113.95 1u5m s PHE 4 Ca 0.10 0.26 -0.24 0.00 -0.96 0.00 0.00 56.93 56.10 1u5m s PHE 4 Cb -0.03 0.21 0.06 0.00 -0.34 0.00 0.00 43.02 42.92 1u5m s PHE 4 CO 0.51 -0.75 0.94 1.14 -1.46 0.00 0.00 175.22 175.60 1u5m s GLN 5 N 2.08 1.31 -0.10 10.12 -2.07 -1.26 -5.17 119.66 124.57 1u5m s GLN 5 Ca 0.16 -0.74 -0.04 0.00 -1.82 0.00 0.00 55.36 52.91 1u5m s GLN 5 Cb -0.02 0.43 0.05 0.00 -1.09 0.00 0.00 33.01 32.39 1u5m s GLN 5 CO -0.13 -0.60 0.21 -1.83 -1.32 0.00 0.00 175.29 171.62 1u5m s GLU 6 N -3.21 0.13 -0.24 9.60 4.04 -1.26 -4.96 118.70 122.81 1u5m s GLU 6 Ca 0.13 0.56 -0.08 0.00 0.04 0.00 0.00 54.97 55.62 1u5m s GLU 6 Cb -0.02 -0.14 0.10 0.00 0.02 0.00 0.00 34.13 34.09 1u5m s GLU 6 CO 0.03 -0.22 0.52 0.00 -1.84 0.00 0.00 175.26 173.75 1u5m s ALA 7 N 1.74 -1.52 0.06 -0.84 0.00 -1.26 -5.07 121.76 114.87 1u5m s ALA 7 Ca -0.04 1.86 -0.16 0.00 0.00 0.00 0.00 51.96 53.62 1u5m s ALA 7 Cb -0.11 -1.48 -0.06 0.00 0.00 0.00 0.00 23.12 21.46 1u5m s ALA 7 CO -0.07 -0.79 1.26 0.78 0.00 0.00 0.00 175.76 176.94 1u5m h GLY 8 N 8.02 -1.35 -2.62 0.00 0.00 -1.97 -3.39 103.07 101.76 1u5m h GLY 8 Ca -0.18 0.68 -0.50 0.00 0.00 0.00 0.00 47.33 47.33 1u5m h GLY 8 CO 0.12 -0.41 0.04 -0.56 0.00 0.00 0.00 176.54 175.73 1u5m s SER 9 N -3.64 6.48 -0.17 0.19 0.01 -1.26 -4.45 113.70 110.85 1u5m s SER 9 Ca -0.07 0.99 -0.05 0.00 1.31 0.00 0.00 55.95 58.13 1u5m s SER 9 Cb 0.03 -2.26 -0.03 0.00 0.21 0.00 0.00 66.02 63.97 1u5m s SER 9 CO 0.29 -0.36 0.01 0.00 0.41 0.00 0.00 173.24 173.59 1u5m s VAL 11 N 0.45 5.10 -0.33 0.00 1.01 -1.26 -2.08 120.40 123.29 1u5m s VAL 11 Ca -0.01 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 61.80 1u5m s VAL 11 Cb -0.14 -3.98 0.10 0.00 0.00 0.00 0.00 36.38 32.36 1u5m s VAL 11 CO 0.02 -0.33 0.06 -1.58 0.00 0.00 0.00 175.10 173.27 1u5m s GLN 12 N 2.14 1.24 -0.17 2.72 -0.44 -0.77 -4.68 119.66 119.71 1u5m s GLN 12 Ca 0.13 -1.59 0.00 0.00 -2.50 0.00 0.00 55.36 51.39 1u5m s GLN 12 Cb -0.17 -2.80 0.00 0.00 -1.64 0.00 0.00 33.01 28.41 1u5m s GLN 12 CO 0.13 -0.94 0.00 -3.47 0.50 0.00 0.00 175.29 171.51 1u5m n ASP 13 N 4.46 -4.97 0.00 6.67 -0.08 -1.26 -1.53 116.55 119.83 1u5m n ASP 13 Ca 0.01 0.04 0.00 0.00 -1.51 0.00 0.00 54.79 53.33 1u5m n ASP 13 Cb 0.42 -2.61 0.00 0.00 2.34 0.00 0.00 41.12 41.27 1u5m n ASP 13 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1u5m n GLY 14 N -0.43 1.68 3.13 0.27 0.00 -1.26 -5.09 105.19 103.48 1u5m n GLY 14 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.67 2.96 -0.38 1.61 -0.21 -0.58 -5.09 119.66 117.30 1u5m s GLN 15 Ca 0.00 -0.82 -0.27 0.00 0.02 0.00 0.00 55.36 54.29 1u5m s GLN 15 Cb 0.00 -2.51 0.02 0.00 1.00 0.00 0.00 33.01 31.51 1u5m s GLN 15 CO 0.00 -0.17 0.98 -0.98 -2.12 0.00 0.00 175.29 173.00 1u5m s ARG 16 N 1.20 3.86 0.29 2.91 1.70 -1.25 -1.84 118.95 125.80 1u5m s ARG 16 Ca 0.02 0.65 0.11 0.00 -0.47 0.00 0.00 55.73 56.05 1u5m s ARG 16 Cb -0.14 -3.81 -0.05 0.00 -0.57 0.00 0.00 34.95 30.39 1u5m s ARG 16 CO -0.10 -1.00 -0.12 0.71 -1.08 0.00 0.00 175.30 173.70 1u5m s TYR 17 N 3.63 2.42 0.62 5.89 2.02 -0.88 -4.93 117.35 126.11 1u5m s TYR 17 Ca 0.41 -0.32 -0.09 0.00 -0.37 0.00 0.00 57.07 56.69 1u5m s TYR 17 Cb -0.11 -1.11 0.14 0.00 -0.40 0.00 0.00 41.96 40.48 1u5m s TYR 17 CO 0.20 0.67 0.32 0.09 -1.57 0.00 0.00 175.55 175.26 1u5m n ASN 18 N -0.73 -2.55 0.00 2.29 4.13 -1.26 -2.52 115.26 114.63 1u5m n ASN 18 Ca -0.05 -0.33 -0.01 0.00 1.68 0.00 0.00 54.58 55.87 1u5m n ASN 18 Cb 0.60 -0.44 -0.01 0.00 -1.54 0.00 0.00 39.78 38.40 1u5m n ASN 18 CO 0.00 0.00 0.00 0.44 0.28 0.00 0.00 177.26 177.98 1u5m h ASP 19 N -2.48 -0.06 0.26 6.41 5.19 -1.88 -3.32 116.42 120.53 1u5m h ASP 19 Ca -0.15 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.27 1u5m h ASP 19 Cb 0.49 0.02 0.00 0.00 0.18 0.00 0.00 39.33 40.02 1u5m h ASP 19 CO 0.09 0.22 0.00 1.17 -3.12 0.00 0.00 179.24 177.60 1u5m n LYS 20 N -3.69 0.72 -1.12 3.56 4.81 -1.22 -3.61 118.16 117.62 1u5m n LYS 20 Ca -0.01 0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 57.06 1u5m n LYS 20 Cb 0.03 -1.50 -0.01 0.00 0.02 0.00 0.00 35.03 33.56 1u5m n LYS 20 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1u5m n ASP 21 N -1.13 -1.63 -4.22 3.14 2.03 -1.25 -4.54 116.55 108.96 1u5m n ASP 21 Ca 0.19 0.82 -0.28 0.00 0.52 0.00 0.00 54.79 56.04 1u5m n ASP 21 Cb 0.17 -0.76 -0.16 0.00 -0.72 0.00 0.00 41.12 39.65 1u5m n ASP 21 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1u5m s VAL 22 N -1.07 1.66 -0.07 5.18 1.01 -1.26 -2.30 120.40 123.54 1u5m s VAL 22 Ca 0.51 -0.89 -0.15 0.00 0.00 0.00 0.00 61.98 61.45 1u5m s VAL 22 Cb -0.66 -1.39 0.03 0.00 0.00 0.00 0.00 36.38 34.37 1u5m s VAL 22 CO 0.49 0.47 0.36 -1.66 0.00 0.00 0.00 175.10 174.76 1u5m s TRP 23 N -0.39 -0.31 -0.43 5.22 -2.14 -0.99 -5.05 118.94 114.85 1u5m s TRP 23 Ca 0.05 0.65 -0.06 0.00 2.66 0.00 0.00 56.10 59.41 1u5m s TRP 23 Cb -0.09 0.14 0.11 0.00 -3.10 0.00 0.00 33.47 30.52 1u5m s TRP 23 CO -0.00 -0.32 0.25 0.21 -2.66 0.00 0.00 176.95 174.43 1u5m s LYS 24 N -0.65 2.23 0.09 3.25 2.36 -1.26 -2.30 119.74 123.45 1u5m s LYS 24 Ca -0.08 -1.76 -0.12 0.00 -2.55 0.00 0.00 55.97 51.46 1u5m s LYS 24 Cb -0.04 -3.71 -0.19 0.00 -1.05 0.00 0.00 37.83 32.85 1u5m s LYS 24 CO 0.03 -1.09 1.24 -1.00 1.55 0.00 0.00 175.35 176.08 1u5m h PRO 25 N 8.22 0.71 -6.29 4.03 0.13 -1.89 -3.46 132.00 133.45 1u5m h PRO 25 Ca -0.17 -0.69 -0.58 0.00 -0.87 0.00 0.00 66.00 63.69 1u5m h PRO 25 Cb 1.06 0.18 -0.22 0.00 0.13 0.00 0.00 31.00 32.15 1u5m h PRO 25 CO 0.76 1.28 -0.83 -1.21 -0.23 0.00 0.00 178.00 177.76 1u5m s GLU 26 N -3.47 1.18 0.00 0.86 2.02 -0.77 -5.01 118.70 113.50 1u5m s GLU 26 Ca -0.10 -1.19 0.22 0.00 0.02 0.00 0.00 54.97 53.93 1u5m s GLU 26 Cb 0.08 -1.48 0.95 0.00 0.10 0.00 0.00 34.13 33.78 1u5m s GLU 26 CO 0.91 0.35 1.70 -0.35 0.02 0.00 0.00 175.26 177.89 1u5m n PRO 27 N 1.08 0.04 0.00 0.39 -0.04 -1.26 -2.35 135.00 132.86 1u5m n PRO 27 Ca -0.19 0.12 0.01 0.00 -0.04 0.00 0.00 63.50 63.40 1u5m n PRO 27 Cb 0.53 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.49 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 -1.02 0.70 -0.11 0.00 6.06 -0.99 -3.06 118.95 120.52 1u5m s ARG 29 Ca 0.02 -0.05 0.00 0.00 -2.50 0.00 0.00 55.73 53.20 1u5m s ARG 29 Cb 0.02 -0.77 -0.02 0.00 0.06 0.00 0.00 34.95 34.24 1u5m s ARG 29 CO 0.09 -0.11 -0.10 -1.50 -2.50 0.00 0.00 175.30 171.18 1u5m s ILE 30 N 1.01 3.32 0.00 4.11 2.07 -1.06 -1.85 121.20 128.81 1u5m s ILE 30 Ca -0.10 -0.58 0.05 0.00 -1.41 0.00 0.00 60.65 58.61 1u5m s ILE 30 Cb -0.14 -2.38 -0.03 0.00 0.13 0.00 0.00 42.46 40.03 1u5m s ILE 30 CO -0.01 0.54 -0.14 0.00 -1.91 0.00 0.00 174.94 173.42 1u5m s VAL 32 N -0.88 -0.48 -0.03 0.00 0.11 0.50 -2.35 120.40 117.27 1u5m s VAL 32 Ca 0.14 0.19 -0.30 0.00 -2.93 0.00 0.00 61.98 59.08 1u5m s VAL 32 Cb -0.11 -0.59 -0.04 0.00 -1.53 0.00 0.00 36.38 34.11 1u5m s VAL 32 CO 0.04 0.08 1.22 0.00 -3.33 0.00 0.00 175.10 173.11 1u5m s ASP 34 N 1.46 4.98 -1.92 0.00 -1.08 0.50 -3.44 116.67 117.17 1u5m s ASP 34 Ca 0.57 -2.23 0.00 0.00 -0.52 0.00 0.00 52.55 50.37 1u5m s ASP 34 Cb -0.26 -1.73 0.00 0.00 -1.46 0.00 0.00 42.92 39.47 1u5m s ASP 34 CO 0.23 -0.44 0.00 0.41 0.52 0.00 0.00 175.17 175.90 1u5m n THR 35 N 4.24 -0.34 0.00 1.71 -1.04 -1.25 -0.80 114.28 116.80 1u5m n THR 35 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 1u5m n THR 35 Cb 0.41 -2.23 0.00 0.00 -1.82 0.00 0.00 70.33 66.69 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 -0.74 2.25 3.58 3.41 0.00 -1.26 -4.60 105.19 107.83 1u5m n GLY 36 Ca -0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.33 4.47 -0.85 2.61 2.01 0.02 -4.85 115.64 116.72 1u5m s THR 37 Ca 0.00 0.93 -0.21 0.00 0.31 0.00 0.00 61.69 62.71 1u5m s THR 37 Cb 0.00 -4.43 0.09 0.00 0.01 0.00 0.00 72.50 68.17 1u5m s THR 37 CO 0.00 -0.78 1.16 -0.69 -0.69 0.00 0.00 174.62 173.63 1u5m s VAL 38 N 3.77 4.35 0.12 3.82 1.01 -1.26 0.19 120.40 132.39 1u5m s VAL 38 Ca 0.39 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.54 1u5m s VAL 38 Cb -0.10 -4.82 -0.04 0.00 0.00 0.00 0.00 36.38 31.41 1u5m s VAL 38 CO 0.25 -1.62 0.09 -1.48 0.00 0.00 0.00 175.10 172.34 1u5m s LEU 39 N 3.85 3.75 -0.09 3.92 0.05 -1.03 -4.91 118.68 124.21 1u5m s LEU 39 Ca 0.33 -0.09 0.02 0.00 0.05 0.00 0.00 54.13 54.44 1u5m s LEU 39 Cb -0.08 -2.41 0.01 0.00 -2.05 0.00 0.00 46.19 41.67 1u5m s LEU 39 CO -0.02 0.13 -0.17 0.00 -0.55 0.00 0.00 176.35 175.75 1u5m s ASP 41 N 0.74 5.36 0.68 0.00 1.11 0.32 -4.94 116.67 119.94 1u5m s ASP 41 Ca -0.12 0.02 -0.14 0.00 0.18 0.00 0.00 52.55 52.49 1u5m s ASP 41 Cb -0.16 -1.44 0.01 0.00 1.07 0.00 0.00 42.92 42.40 1u5m s ASP 41 CO 0.02 0.25 1.12 1.51 1.18 0.00 0.00 175.17 179.25 1u5m s ASP 42 N -1.83 4.90 -0.45 0.27 3.84 -1.26 -2.58 116.67 119.56 1u5m s ASP 42 Ca 0.23 2.03 -0.05 0.00 -0.00 0.00 0.00 52.55 54.76 1u5m s ASP 42 Cb -0.12 -2.55 0.12 0.00 -1.38 0.00 0.00 42.92 38.99 1u5m s ASP 42 CO 0.14 -1.77 0.27 -0.63 -0.00 0.00 0.00 175.17 173.18 1u5m s ILE 43 N -2.36 3.61 -0.27 2.11 1.01 -1.17 -4.87 121.20 119.26 1u5m s ILE 43 Ca 0.67 -2.06 0.01 0.00 0.00 0.00 0.00 60.65 59.27 1u5m s ILE 43 Cb -0.21 -3.43 0.05 0.00 0.01 0.00 0.00 42.46 38.88 1u5m s ILE 43 CO 0.44 -0.74 -0.07 0.27 0.00 0.00 0.00 174.94 174.84 1u5m s ILE 44 N 1.10 2.51 0.60 2.92 -4.36 -1.26 -4.65 121.20 118.06 1u5m s ILE 44 Ca 0.08 -1.46 -0.00 0.00 -0.26 0.00 0.00 60.65 59.01 1u5m s ILE 44 Cb -0.23 -2.43 0.05 0.00 1.25 0.00 0.00 42.46 41.10 1u5m s ILE 44 CO -0.03 -0.01 0.84 0.00 0.24 0.00 0.00 174.94 175.98 1u5m s GLU 46 N -4.89 3.01 0.17 0.00 2.02 -1.26 -5.03 118.70 112.72 1u5m s GLU 46 Ca 0.59 -0.87 -0.22 0.00 0.02 0.00 0.00 54.97 54.48 1u5m s GLU 46 Cb -0.10 -2.71 0.08 0.00 0.10 0.00 0.00 34.13 31.50 1u5m s GLU 46 CO 0.40 -0.15 1.06 0.16 0.02 0.00 0.00 175.26 176.76 1u5m s ASP 47 N -4.23 0.01 0.00 -0.19 1.47 -1.26 -4.56 116.67 107.91 1u5m s ASP 47 Ca 0.48 -0.65 0.00 0.00 1.18 0.00 0.00 52.55 53.56 1u5m s ASP 47 Cb -0.10 0.47 0.00 0.00 -0.34 0.00 0.00 42.92 42.96 1u5m s ASP 47 CO 0.34 -0.95 0.00 0.52 0.68 0.00 0.00 175.17 175.76 1u5m n VAL 48 N -0.73 0.00 0.00 2.11 0.31 -1.26 -4.79 118.33 113.96 1u5m n VAL 48 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1u5m n VAL 48 Cb 0.59 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.52 1u5m n VAL 48 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1u5m n LYS 49 N 0.00 0.00 -3.42 5.55 4.76 -1.26 -5.04 118.16 118.75 1u5m n LYS 49 Ca 0.00 0.00 -0.44 0.00 -2.87 0.00 0.00 58.31 55.00 1u5m n LYS 49 Cb 0.00 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.16 1u5m n LYS 49 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1u5m s ASP 50 N 1.83 6.53 0.49 4.39 1.11 -1.26 -5.03 116.67 124.73 1u5m s ASP 50 Ca 0.00 -2.91 0.08 0.00 0.18 0.00 0.00 52.55 49.90 1u5m s ASP 50 Cb 0.00 -2.13 0.08 0.00 1.07 0.00 0.00 42.92 41.94 1u5m s ASP 50 CO 0.00 -0.47 0.68 0.00 1.18 0.00 0.00 175.17 176.55 1u5m n LEU 52 N 0.00 0.00 -3.99 0.00 4.77 -1.26 -4.79 117.00 111.73 1u5m n LEU 52 Ca 0.14 0.03 -0.18 0.00 -0.03 0.00 0.00 56.01 55.97 1u5m n LEU 52 Cb 0.51 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.45 1u5m n LEU 52 CO 0.33 0.00 -0.42 -0.94 -1.33 0.00 0.00 177.39 175.03 1u5m s SER 53 N -2.72 0.93 -0.12 -1.43 1.04 -1.26 -5.10 113.70 105.04 1u5m s SER 53 Ca 0.00 -0.14 -0.30 0.00 0.48 0.00 0.00 55.95 55.99 1u5m s SER 53 Cb 0.00 -0.15 -0.02 0.00 0.10 0.00 0.00 66.02 65.95 1u5m s SER 53 CO 0.00 0.08 1.25 -2.16 0.98 0.00 0.00 173.24 173.39 1u5m s PRO 54 N -0.06 4.28 -0.14 4.02 0.04 -1.26 -4.01 135.00 137.87 1u5m s PRO 54 Ca 0.01 1.68 -0.12 0.00 0.04 0.00 0.00 61.00 62.62 1u5m s PRO 54 Cb -0.04 -3.68 0.04 0.00 0.04 0.00 0.00 34.50 30.86 1u5m s PRO 54 CO -0.00 -0.60 0.37 -1.21 0.04 0.00 0.00 177.00 175.59 1u5m s GLU 55 N 2.97 0.41 -0.28 4.56 2.02 -1.15 -4.62 118.70 122.61 1u5m s GLU 55 Ca 0.56 0.55 -0.29 0.00 0.02 0.00 0.00 54.97 55.81 1u5m s GLU 55 Cb -0.23 0.15 -0.01 0.00 0.10 0.00 0.00 34.13 34.14 1u5m s GLU 55 CO 0.18 -0.07 1.52 -1.50 0.02 0.00 0.00 175.26 175.40 1u5m s ILE 56 N 0.44 3.82 -0.34 -1.63 2.07 -1.26 -3.50 121.20 120.81 1u5m s ILE 56 Ca -0.02 0.91 -0.29 0.00 -1.41 0.00 0.00 60.65 59.84 1u5m s ILE 56 Cb -0.04 -3.90 0.00 0.00 0.13 0.00 0.00 42.46 38.66 1u5m s ILE 56 CO -0.02 -0.42 1.37 -2.16 -1.91 0.00 0.00 174.94 171.80 1u5m s PRO 57 N 4.68 3.77 -0.25 3.50 0.04 -1.26 -4.25 135.00 141.22 1u5m s PRO 57 Ca 0.67 1.16 -0.19 0.00 0.04 0.00 0.00 61.00 62.68 1u5m s PRO 57 Cb -0.21 -3.95 0.03 0.00 0.04 0.00 0.00 34.50 30.41 1u5m s PRO 57 CO 0.28 -1.31 0.34 0.34 0.04 0.00 0.00 177.00 176.70 1u5m n PHE 58 N 8.16 -1.72 -2.01 0.56 7.35 -1.26 -3.73 117.46 124.81 1u5m n PHE 58 Ca 0.16 0.72 0.00 0.00 -0.76 0.00 0.00 57.45 57.57 1u5m n PHE 58 Cb 0.47 -1.75 0.00 0.00 0.35 0.00 0.00 39.48 38.55 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 0.48 0.00 0.64 7.13 0.00 -1.26 -4.97 105.19 107.21 1u5m n GLY 59 Ca -0.03 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.93 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 0.95 1.67 -0.00 1.61 -0.58 -1.24 -5.03 120.64 118.01 1u5m n GLU 60 Ca 0.00 -0.65 0.07 0.00 -0.42 0.00 0.00 57.16 56.16 1u5m n GLU 60 Cb 0.28 0.20 -0.10 0.00 -0.57 0.00 0.00 31.44 31.24 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 4.48 2.19 -4.28 0.00 -0.04 -1.26 -4.25 135.00 131.84 1u5m n PRO 63 Ca -0.02 -1.30 -0.19 0.00 -0.04 0.00 0.00 63.50 61.96 1u5m n PRO 63 Cb 0.41 -2.26 -0.08 0.00 -0.04 0.00 0.00 33.50 31.52 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 2.23 0.00 -0.32 0.52 -4.36 -1.23 -3.70 121.20 114.35 1u5m s ILE 64 Ca 0.52 -2.00 -0.13 0.00 -0.26 0.00 0.00 60.65 58.78 1u5m s ILE 64 Cb 0.18 -2.50 -0.03 0.00 1.25 0.00 0.00 42.46 41.37 1u5m s ILE 64 CO -0.02 0.00 0.26 0.00 0.24 0.00 0.00 174.94 175.41 1u5m n PRO 66 N 5.16 -0.47 -1.48 0.00 -0.04 -1.26 -4.37 135.00 132.53 1u5m n PRO 66 Ca -0.12 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.04 1u5m n PRO 66 Cb 0.50 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.97 1u5m n PRO 66 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1u5m n ALA 67 N -3.00 6.23 -0.03 0.55 0.00 -1.26 -4.08 120.51 118.92 1u5m n ALA 67 Ca 0.00 -3.17 -0.05 0.00 0.00 0.00 0.00 53.44 50.22 1u5m n ALA 67 Cb 0.00 -1.92 -0.03 0.00 0.00 0.00 0.00 19.45 17.51 1u5m n ALA 67 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1u5m n ASP 68 N 0.13 2.30 -4.02 0.00 8.00 -1.26 -4.97 116.55 116.73 1u5m n ASP 68 Ca 0.49 0.01 -0.36 0.00 0.71 0.00 0.00 54.79 55.64 1u5m n ASP 68 Cb 0.48 -0.13 0.04 0.00 -0.02 0.00 0.00 41.12 41.49 1u5m n ASP 68 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1u5m n LEU 69 N -2.92 -5.77 -0.18 0.64 4.77 -1.26 -4.81 117.00 107.48 1u5m n LEU 69 Ca -0.12 0.21 -0.03 0.00 -0.03 0.00 0.00 56.01 56.04 1u5m n LEU 69 Cb 0.60 -0.78 0.18 0.00 -2.33 0.00 0.00 43.42 41.09 1u5m n LEU 69 CO 0.04 -5.93 1.03 0.00 -1.33 0.00 0.00 177.39 171.21 1u5m h ALA 70 N -0.97 1.22 -0.98 -1.18 0.00 -1.96 -3.22 119.26 112.16 1u5m h ALA 70 Ca -0.44 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1u5m h ALA 70 Cb 1.31 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1u5m h ALA 70 CO 0.24 0.56 0.00 0.00 0.00 0.00 0.00 179.25 180.05 1u5m n ALA 71 N -2.45 -0.30 -3.27 0.00 0.00 -1.26 -4.92 120.51 108.31 1u5m n ALA 71 Ca 0.05 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.34 1u5m n ALA 71 Cb 0.19 0.04 0.08 0.00 0.00 0.00 0.00 19.45 19.76 1u5m n ALA 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u5m n ALA 72 N -1.60 -1.83 -0.37 0.00 0.00 -1.22 -5.08 120.51 110.41 1u5m n ALA 72 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1u5m n ALA 72 Cb 0.00 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.09 1u5m n ALA 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50