#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1utd n ASN 6 N 0.00 3.96 -4.75 3.42 2.85 -1.26 -5.02 115.26 114.46 1utd n ASN 6 Ca 0.00 -3.44 -0.31 0.00 -0.11 0.00 0.00 54.58 50.72 1utd n ASN 6 Cb 0.00 -0.80 0.11 0.00 1.24 0.00 0.00 39.78 40.33 1utd n ASN 6 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1utd s SER 7 N -1.12 4.11 0.88 1.20 0.01 -1.26 -5.02 113.70 112.50 1utd s SER 7 Ca 0.54 1.83 -0.12 0.00 1.31 0.00 0.00 55.95 59.51 1utd s SER 7 Cb 0.45 -2.48 0.08 0.00 0.21 0.00 0.00 66.02 64.27 1utd s SER 7 CO 0.11 -2.29 0.85 0.47 0.41 0.00 0.00 173.24 172.79 1utd n ASP 8 N -3.68 -0.48 -4.07 2.44 8.00 -1.26 -4.80 116.55 112.71 1utd n ASP 8 Ca 0.09 0.45 -0.09 0.00 0.71 0.00 0.00 54.79 55.95 1utd n ASP 8 Cb 0.53 -1.37 -0.09 0.00 -0.02 0.00 0.00 41.12 40.17 1utd n ASP 8 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1utd s PHE 9 N -2.35 0.59 0.12 1.24 -0.12 -1.26 -1.52 117.98 114.67 1utd s PHE 9 Ca 0.65 -1.03 0.11 0.00 -0.05 0.00 0.00 56.93 56.60 1utd s PHE 9 Cb -0.25 -0.34 -0.04 0.00 -0.63 0.00 0.00 43.02 41.76 1utd s PHE 9 CO 0.59 -0.50 -0.26 0.14 -0.05 0.00 0.00 175.22 175.14 1utd s VAL 10 N -3.97 2.28 -0.19 -2.49 -7.23 -0.11 -4.64 120.40 104.04 1utd s VAL 10 Ca 0.15 -1.68 -0.04 0.00 -1.81 0.00 0.00 61.98 58.60 1utd s VAL 10 Cb 0.07 -1.99 -0.02 0.00 0.56 0.00 0.00 36.38 35.00 1utd s VAL 10 CO -0.04 0.14 -0.03 -0.69 -0.31 0.00 0.00 175.10 174.16 1utd s VAL 11 N -1.02 3.68 -0.13 1.32 1.01 -0.23 -1.25 120.40 123.78 1utd s VAL 11 Ca 0.14 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.72 1utd s VAL 11 Cb -0.10 -2.65 0.02 0.00 0.00 0.00 0.00 36.38 33.65 1utd s VAL 11 CO 0.06 0.45 -0.14 -0.63 0.00 0.00 0.00 175.10 174.83 1utd s ILE 12 N 0.94 1.50 -0.24 2.22 1.01 0.41 -0.84 121.20 126.21 1utd s ILE 12 Ca 0.00 -0.61 -0.04 0.00 0.00 0.00 0.00 60.65 60.00 1utd s ILE 12 Cb -0.15 -1.40 0.00 0.00 0.01 0.00 0.00 42.46 40.93 1utd s ILE 12 CO 0.01 0.44 -0.03 -0.75 0.00 0.00 0.00 174.94 174.62 1utd s LYS 13 N 1.27 3.23 0.16 2.79 2.20 0.91 -1.17 119.74 129.14 1utd s LYS 13 Ca -0.00 -0.72 -0.31 0.00 -0.36 0.00 0.00 55.97 54.57 1utd s LYS 13 Cb -0.14 -3.06 -0.09 0.00 -1.51 0.00 0.00 37.83 33.03 1utd s LYS 13 CO -0.06 -0.27 1.43 0.00 -0.36 0.00 0.00 175.35 176.09 1utd s ALA 14 N 1.45 3.64 -2.76 3.13 0.00 -0.87 -0.17 121.76 126.18 1utd s ALA 14 Ca 0.04 1.21 0.23 0.00 0.00 0.00 0.00 51.96 53.44 1utd s ALA 14 Cb -0.15 -3.55 0.21 0.00 0.00 0.00 0.00 23.12 19.63 1utd s ALA 14 CO -0.03 -0.66 1.24 1.28 0.00 0.00 0.00 175.76 177.59 1utd n LEU 15 N 3.57 2.97 -3.80 0.00 4.77 -0.08 -0.79 117.00 123.64 1utd n LEU 15 Ca 0.11 -1.08 -0.09 0.00 -0.03 0.00 0.00 56.01 54.92 1utd n LEU 15 Cb 0.41 -0.04 -0.04 0.00 -2.33 0.00 0.00 43.42 41.42 1utd n LEU 15 CO 0.59 0.52 0.22 -1.83 -1.33 0.00 0.00 177.39 175.57 1utd s GLU 16 N -1.82 1.36 0.58 3.23 -1.05 -1.23 -4.86 118.70 114.91 1utd s GLU 16 Ca 0.28 -0.95 -0.18 0.00 -0.15 0.00 0.00 54.97 53.97 1utd s GLU 16 Cb 0.19 0.49 -0.04 0.00 -0.44 0.00 0.00 34.13 34.34 1utd s GLU 16 CO 0.29 -0.57 1.12 -0.51 0.95 0.00 0.00 175.26 176.54 1utd s ASP 17 N -2.90 5.50 0.00 0.83 1.01 -1.26 -3.05 116.67 116.79 1utd s ASP 17 Ca 0.12 2.12 0.00 0.00 0.71 0.00 0.00 52.55 55.50 1utd s ASP 17 Cb -0.00 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.36 1utd s ASP 17 CO -0.01 -1.37 0.00 0.61 0.21 0.00 0.00 175.17 174.61 1utd n GLY 18 N -0.07 0.50 3.74 0.21 0.00 -0.79 -4.87 105.19 103.91 1utd n GLY 18 Ca 0.11 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1utd n GLY 18 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1utd n VAL 19 N -2.95 1.16 -4.08 1.61 0.31 -0.86 -4.78 118.33 108.74 1utd n VAL 19 Ca 0.00 -0.29 -0.35 0.00 -0.01 0.00 0.00 64.34 63.69 1utd n VAL 19 Cb 0.00 -1.89 -0.14 0.00 -0.91 0.00 0.00 33.84 30.90 1utd n VAL 19 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1utd s ASN 20 N 0.37 4.27 -0.32 4.52 0.01 -0.48 -0.52 114.94 122.78 1utd s ASN 20 Ca 0.63 -0.37 -0.07 0.00 -0.71 0.00 0.00 52.86 52.34 1utd s ASN 20 Cb -0.52 -1.72 0.02 0.00 0.41 0.00 0.00 41.25 39.45 1utd s ASN 20 CO 0.51 0.02 0.11 -0.69 -1.51 0.00 0.00 177.10 175.54 1utd s VAL 21 N 1.21 4.06 -0.19 1.60 1.01 -0.50 -1.14 120.40 126.46 1utd s VAL 21 Ca 0.03 -0.79 -0.02 0.00 0.00 0.00 0.00 61.98 61.19 1utd s VAL 21 Cb -0.14 -3.16 -0.01 0.00 0.00 0.00 0.00 36.38 33.07 1utd s VAL 21 CO -0.02 -0.02 -0.09 -0.63 0.00 0.00 0.00 175.10 174.34 1utd s ILE 22 N 1.49 3.07 -0.17 2.22 1.01 0.21 -1.02 121.20 128.01 1utd s ILE 22 Ca 0.02 -0.61 -0.19 0.00 0.00 0.00 0.00 60.65 59.86 1utd s ILE 22 Cb -0.18 -2.35 -0.03 0.00 0.01 0.00 0.00 42.46 39.91 1utd s ILE 22 CO 0.03 0.47 0.55 -0.83 0.00 0.00 0.00 174.94 175.16 1utd s GLY 23 N 1.12 2.18 -0.02 6.18 0.00 -0.09 -0.86 107.32 115.83 1utd s GLY 23 Ca 0.01 -0.29 -0.13 0.00 0.00 0.00 0.00 44.72 44.31 1utd s GLY 23 CO -0.02 1.07 0.36 1.08 0.00 0.00 0.00 173.10 175.59 1utd s LEU 24 N 1.42 4.46 0.31 0.66 1.02 0.07 -0.25 118.68 126.36 1utd s LEU 24 Ca 0.26 0.87 -0.29 0.00 0.02 0.00 0.00 54.13 54.99 1utd s LEU 24 Cb -0.16 -2.49 -0.10 0.00 0.02 0.00 0.00 46.19 43.46 1utd s LEU 24 CO 0.10 0.34 1.40 0.42 0.02 0.00 0.00 176.35 178.64 1utd s THR 25 N -1.07 2.54 0.41 5.49 -4.23 -0.10 -2.69 115.64 115.99 1utd s THR 25 Ca 0.22 0.50 -0.26 0.00 -1.18 0.00 0.00 61.69 60.97 1utd s THR 25 Cb -0.16 -3.32 -0.09 0.00 1.34 0.00 0.00 72.50 70.27 1utd s THR 25 CO 0.12 0.10 1.32 -0.60 -0.54 0.00 0.00 174.62 175.02 1utd s ARG 26 N -1.26 3.95 0.00 3.99 3.52 -0.52 -4.54 118.95 124.10 1utd s ARG 26 Ca 0.54 2.20 0.00 0.00 -0.13 0.00 0.00 55.73 58.34 1utd s ARG 26 Cb -0.42 -2.76 0.00 0.00 -1.56 0.00 0.00 34.95 30.20 1utd s ARG 26 CO 0.51 -0.52 0.00 0.41 -0.81 0.00 0.00 175.30 174.89 1utd n GLY 27 N 0.65 0.60 0.34 8.12 0.00 -1.26 -4.70 105.19 108.95 1utd n GLY 27 Ca 0.04 -2.24 0.00 0.00 0.00 0.00 0.00 46.02 43.82 1utd n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1utd h ALA 28 N 0.00 1.46 -2.67 4.61 0.00 -2.05 -3.42 119.26 117.18 1utd h ALA 28 Ca 0.00 -0.06 -0.62 0.00 0.00 0.00 0.00 54.91 54.23 1utd h ALA 28 Cb 0.00 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 17.44 1utd h ALA 28 CO 0.00 0.49 -0.28 0.34 0.00 0.00 0.00 179.25 179.80 1utd s ASP 29 N -6.39 6.66 -0.56 0.00 2.15 -1.26 -5.06 116.67 112.21 1utd s ASP 29 Ca -0.11 0.79 0.04 0.00 0.43 0.00 0.00 52.55 53.71 1utd s ASP 29 Cb 0.18 -2.18 0.14 0.00 -0.30 0.00 0.00 42.92 40.75 1utd s ASP 29 CO 0.78 0.29 0.32 -0.89 -0.17 0.00 0.00 175.17 175.50 1utd s THR 30 N -1.17 2.48 0.43 1.71 2.01 -1.26 -4.57 115.64 115.26 1utd s THR 30 Ca 0.25 -3.47 0.03 0.00 0.31 0.00 0.00 61.69 58.81 1utd s THR 30 Cb -0.15 -2.69 -0.03 0.00 0.01 0.00 0.00 72.50 69.64 1utd s THR 30 CO 0.13 -0.87 0.09 0.00 -0.69 0.00 0.00 174.62 173.27 1utd s ARG 31 N -0.51 1.98 -0.07 4.92 1.70 -1.26 -4.88 118.95 120.83 1utd s ARG 31 Ca 0.19 -2.21 -0.30 0.00 -0.47 0.00 0.00 55.73 52.95 1utd s ARG 31 Cb -0.20 -0.91 -0.03 0.00 -0.57 0.00 0.00 34.95 33.25 1utd s ARG 31 CO -0.05 -0.41 1.16 -0.06 -1.08 0.00 0.00 175.30 174.86 1utd s PHE 32 N -3.11 3.26 -0.16 5.89 0.40 -1.26 -0.92 117.98 122.06 1utd s PHE 32 Ca 0.21 1.29 -0.18 0.00 -0.60 0.00 0.00 56.93 57.65 1utd s PHE 32 Cb 0.03 -3.37 -0.23 0.00 0.51 0.00 0.00 43.02 39.96 1utd s PHE 32 CO 0.12 -1.08 0.35 1.25 0.70 0.00 0.00 175.22 176.55 1utd h HIS 33 N 7.39 0.19 -2.24 0.36 -0.00 -0.94 -3.46 115.15 116.44 1utd h HIS 33 Ca -0.33 -0.14 -0.07 0.00 -0.00 0.00 0.00 60.37 59.83 1utd h HIS 33 Cb 1.16 -0.01 -0.19 0.00 -0.00 0.00 0.00 27.41 28.36 1utd h HIS 33 CO 0.73 1.53 0.08 -1.58 -0.00 0.00 0.00 177.93 178.69 1utd s HIS 34 N -2.42 -0.56 -0.20 5.26 5.65 -1.19 -5.00 115.29 116.83 1utd s HIS 34 Ca -0.25 0.99 0.01 0.00 0.25 0.00 0.00 55.06 56.05 1utd s HIS 34 Cb 0.05 0.33 0.04 0.00 -1.18 0.00 0.00 32.58 31.83 1utd s HIS 34 CO 0.67 -0.54 -0.10 0.45 -0.65 0.00 0.00 174.74 174.57 1utd s SER 35 N -1.11 3.41 -0.26 9.88 0.15 -1.26 -0.91 113.70 123.60 1utd s SER 35 Ca -0.11 -0.90 -0.15 0.00 0.70 0.00 0.00 55.95 55.49 1utd s SER 35 Cb -0.01 -1.22 -0.04 0.00 -1.71 0.00 0.00 66.02 63.04 1utd s SER 35 CO 0.08 -0.15 0.37 -0.70 1.20 0.00 0.00 173.24 174.03 1utd s GLU 36 N 1.40 4.05 -0.08 5.44 2.56 -0.19 -4.93 118.70 126.96 1utd s GLU 36 Ca -0.02 0.05 -0.21 0.00 0.00 0.00 0.00 54.97 54.80 1utd s GLU 36 Cb -0.16 -3.63 -0.04 0.00 2.00 0.00 0.00 34.13 32.30 1utd s GLU 36 CO -0.08 -0.21 0.61 0.15 -0.56 0.00 0.00 175.26 175.16 1utd s LYS 37 N 1.87 4.39 -0.07 4.30 -0.14 -1.26 -1.41 119.74 127.41 1utd s LYS 37 Ca 0.15 0.71 0.05 0.00 -1.36 0.00 0.00 55.97 55.52 1utd s LYS 37 Cb -0.15 -3.43 -0.01 0.00 -1.68 0.00 0.00 37.83 32.56 1utd s LYS 37 CO 0.09 0.14 -0.25 -0.51 -0.76 0.00 0.00 175.35 174.07 1utd s LEU 38 N 0.59 2.07 0.52 3.17 1.43 0.32 -4.99 118.68 121.79 1utd s LEU 38 Ca 0.33 -0.53 -0.03 0.00 -1.03 0.00 0.00 54.13 52.87 1utd s LEU 38 Cb -0.17 -1.38 -0.00 0.00 0.03 0.00 0.00 46.19 44.67 1utd s LEU 38 CO 0.15 0.21 0.78 -1.81 0.23 0.00 0.00 176.35 175.92 1utd s ASP 39 N 0.04 5.76 0.10 2.29 1.01 -1.26 -1.88 116.67 122.73 1utd s ASP 39 Ca -0.10 0.54 -0.36 0.00 0.71 0.00 0.00 52.55 53.35 1utd s ASP 39 Cb -0.15 -1.68 -0.15 0.00 1.01 0.00 0.00 42.92 41.94 1utd s ASP 39 CO 0.06 -0.85 1.45 1.17 0.21 0.00 0.00 175.17 177.21 1utd n LYS 40 N -2.32 1.55 0.00 8.23 4.81 -1.17 -1.83 118.16 127.43 1utd n LYS 40 Ca 0.03 0.56 0.00 0.00 -0.87 0.00 0.00 58.31 58.03 1utd n LYS 40 Cb 0.57 -2.26 0.00 0.00 0.02 0.00 0.00 35.03 33.37 1utd n LYS 40 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1utd n GLY 41 N 2.95 3.22 3.77 3.14 0.00 0.03 -4.96 105.19 113.33 1utd n GLY 41 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 1utd n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1utd s GLU 42 N -0.50 3.76 -0.07 1.61 2.02 -0.76 -4.77 118.70 119.98 1utd s GLU 42 Ca 0.00 1.99 0.05 0.00 0.02 0.00 0.00 54.97 57.03 1utd s GLU 42 Cb 0.00 -2.53 -0.01 0.00 0.10 0.00 0.00 34.13 31.69 1utd s GLU 42 CO 0.00 -0.61 -0.24 0.08 0.02 0.00 0.00 175.26 174.51 1utd s VAL 43 N -1.39 2.14 -0.11 2.63 1.01 -1.26 -2.06 120.40 121.36 1utd s VAL 43 Ca 0.62 -1.02 0.02 0.00 0.00 0.00 0.00 61.98 61.60 1utd s VAL 43 Cb -0.34 -1.80 0.01 0.00 0.00 0.00 0.00 36.38 34.26 1utd s VAL 43 CO 0.42 0.57 -0.19 -0.22 0.00 0.00 0.00 175.10 175.68 1utd s LEU 44 N 0.01 1.91 -0.25 3.92 2.96 -0.31 -5.00 118.68 121.91 1utd s LEU 44 Ca -0.08 -0.50 -0.00 0.00 -0.22 0.00 0.00 54.13 53.33 1utd s LEU 44 Cb -0.15 -1.24 0.04 0.00 0.50 0.00 0.00 46.19 45.34 1utd s LEU 44 CO 0.05 0.07 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.44 1utd s ILE 45 N 0.76 2.61 -0.06 6.68 1.01 -1.26 -0.44 121.20 130.50 1utd s ILE 45 Ca -0.10 -1.24 0.01 0.00 0.00 0.00 0.00 60.65 59.31 1utd s ILE 45 Cb -0.16 -2.39 0.02 0.00 0.01 0.00 0.00 42.46 39.94 1utd s ILE 45 CO 0.01 0.12 -0.07 0.00 0.00 0.00 0.00 174.94 175.00 1utd s ALA 46 N 1.25 0.96 0.58 9.38 0.00 -0.38 -4.95 121.76 128.60 1utd s ALA 46 Ca -0.03 -0.25 -0.09 0.00 0.00 0.00 0.00 51.96 51.59 1utd s ALA 46 Cb -0.18 -0.58 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 1utd s ALA 46 CO -0.05 -0.08 0.95 -0.65 0.00 0.00 0.00 175.76 175.93 1utd s GLN 47 N 1.06 3.53 0.37 0.00 -0.21 -1.26 -0.94 119.66 122.21 1utd s GLN 47 Ca -0.08 0.54 -0.25 0.00 0.02 0.00 0.00 55.36 55.59 1utd s GLN 47 Cb -0.14 -2.18 -0.09 0.00 1.00 0.00 0.00 33.01 31.60 1utd s GLN 47 CO -0.01 -0.48 1.01 -0.06 -2.12 0.00 0.00 175.29 173.64 1utd s PHE 48 N -3.04 3.43 0.34 0.91 0.08 -0.57 -4.94 117.98 114.18 1utd s PHE 48 Ca 0.53 1.69 0.06 0.00 0.12 0.00 0.00 56.93 59.33 1utd s PHE 48 Cb -0.11 -3.06 -0.02 0.00 -0.57 0.00 0.00 43.02 39.26 1utd s PHE 48 CO 0.51 -0.32 0.32 0.95 -0.10 0.00 0.00 175.22 176.58 1utd s THR 49 N -1.63 0.00 0.31 0.64 -4.23 -0.36 -4.70 115.64 105.67 1utd s THR 49 Ca 0.54 -1.92 0.08 0.00 -1.18 0.00 0.00 61.69 59.22 1utd s THR 49 Cb -0.21 -2.54 0.30 0.00 1.34 0.00 0.00 72.50 71.40 1utd s THR 49 CO 0.27 0.00 1.72 -0.08 -0.54 0.00 0.00 174.62 175.99 1utd h GLU 50 N 2.12 0.52 0.00 3.99 4.81 -2.03 -2.99 114.58 121.01 1utd h GLU 50 Ca -0.25 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1utd h GLU 50 Cb 1.23 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1utd h GLU 50 CO 0.37 0.34 -1.28 0.72 -0.73 0.00 0.00 179.01 178.43 1utd n HIS 51 N -4.93 0.24 -3.88 0.92 8.25 -1.26 -4.59 115.22 109.98 1utd n HIS 51 Ca 0.26 0.07 -0.28 0.00 -0.26 0.00 0.00 57.72 57.51 1utd n HIS 51 Cb 0.72 -0.46 -0.16 0.00 1.12 0.00 0.00 29.99 31.21 1utd n HIS 51 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1utd s THR 52 N -3.28 1.08 -0.17 1.59 2.01 -1.13 -1.44 115.64 114.31 1utd s THR 52 Ca 0.01 -0.65 0.02 0.00 0.31 0.00 0.00 61.69 61.37 1utd s THR 52 Cb 0.14 -1.29 0.01 0.00 0.01 0.00 0.00 72.50 71.37 1utd s THR 52 CO 0.84 0.09 0.48 -1.54 -0.69 0.00 0.00 174.62 173.79 1utd n SER 53 N 4.88 0.97 -3.77 3.53 3.41 -1.09 -1.22 113.62 120.32 1utd n SER 53 Ca -0.12 -0.99 -0.13 0.00 -0.26 0.00 0.00 58.87 57.38 1utd n SER 53 Cb 0.47 0.15 -0.09 0.00 -0.26 0.00 0.00 64.21 64.48 1utd n SER 53 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1utd s ALA 54 N -0.27 -0.73 -0.07 7.33 0.00 -1.24 -5.01 121.76 121.77 1utd s ALA 54 Ca 0.02 0.32 0.02 0.00 0.00 0.00 0.00 51.96 52.32 1utd s ALA 54 Cb 0.01 0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.18 1utd s ALA 54 CO 0.02 -0.25 -0.13 0.42 0.00 0.00 0.00 175.76 175.83 1utd s ILE 55 N -1.21 1.20 -0.14 0.00 1.01 -1.26 -0.75 121.20 120.04 1utd s ILE 55 Ca -0.13 -0.51 -0.01 0.00 0.00 0.00 0.00 60.65 60.00 1utd s ILE 55 Cb -0.05 -1.09 -0.02 0.00 0.01 0.00 0.00 42.46 41.31 1utd s ILE 55 CO 0.04 0.37 -0.10 -0.75 0.00 0.00 0.00 174.94 174.50 1utd s LYS 56 N 0.66 3.47 -0.19 2.79 2.20 -0.04 -4.95 119.74 123.68 1utd s LYS 56 Ca -0.15 -0.63 -0.04 0.00 -0.36 0.00 0.00 55.97 54.79 1utd s LYS 56 Cb -0.16 -2.73 -0.02 0.00 -1.51 0.00 0.00 37.83 33.41 1utd s LYS 56 CO 0.04 0.20 -0.02 0.08 -0.36 0.00 0.00 175.35 175.29 1utd s VAL 57 N 0.41 3.82 -0.11 4.02 1.01 -1.26 -0.62 120.40 127.67 1utd s VAL 57 Ca -0.08 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.54 1utd s VAL 57 Cb -0.15 -2.71 -0.02 0.00 0.00 0.00 0.00 36.38 33.50 1utd s VAL 57 CO 0.04 0.45 -0.12 -0.13 0.00 0.00 0.00 175.10 175.34 1utd s ARG 58 N 0.90 3.16 0.00 2.72 0.52 -0.29 -4.94 118.95 121.02 1utd s ARG 58 Ca 0.00 -0.66 0.00 0.00 -0.52 0.00 0.00 55.73 54.55 1utd s ARG 58 Cb -0.14 -2.59 0.00 0.00 0.52 0.00 0.00 34.95 32.73 1utd s ARG 58 CO 0.02 0.34 0.00 0.41 0.02 0.00 0.00 175.30 176.09 1utd n GLY 59 N 3.15 1.30 3.65 -3.53 0.00 -1.26 -1.39 105.19 107.12 1utd n GLY 59 Ca -0.18 -2.07 -0.43 0.00 0.00 0.00 0.00 46.02 43.35 1utd n GLY 59 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1utd s LYS 60 N -1.73 4.19 -0.02 1.61 2.20 -1.26 -3.93 119.74 120.80 1utd s LYS 60 Ca 0.00 1.24 -0.17 0.00 -0.36 0.00 0.00 55.97 56.68 1utd s LYS 60 Cb 0.00 -3.67 0.03 0.00 -1.51 0.00 0.00 37.83 32.68 1utd s LYS 60 CO 0.00 -0.70 0.36 0.00 -0.36 0.00 0.00 175.35 174.65 1utd s ALA 61 N 3.30 -0.91 -0.17 3.13 0.00 -1.07 -0.91 121.76 125.14 1utd s ALA 61 Ca 0.44 0.45 -0.07 0.00 0.00 0.00 0.00 51.96 52.77 1utd s ALA 61 Cb -0.14 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 1utd s ALA 61 CO 0.09 -0.28 0.07 -0.47 0.00 0.00 0.00 175.76 175.17 1utd s TYR 62 N -1.33 3.28 -0.06 0.00 5.04 0.76 -0.93 117.35 124.10 1utd s TYR 62 Ca -0.13 0.12 0.02 0.00 -2.44 0.00 0.00 57.07 54.64 1utd s TYR 62 Cb -0.04 -2.06 0.01 0.00 0.35 0.00 0.00 41.96 40.22 1utd s TYR 62 CO 0.05 0.22 -0.11 0.42 -1.34 0.00 0.00 175.55 174.78 1utd s ILE 63 N 0.20 1.07 -0.12 3.14 1.01 0.39 -0.06 121.20 126.82 1utd s ILE 63 Ca 0.05 -0.44 0.03 0.00 0.00 0.00 0.00 60.65 60.28 1utd s ILE 63 Cb -0.12 -0.98 0.00 0.00 0.01 0.00 0.00 42.46 41.37 1utd s ILE 63 CO 0.00 0.34 -0.21 -1.10 0.00 0.00 0.00 174.94 173.97 1utd s GLN 64 N 0.67 3.09 0.41 2.79 -0.21 -0.02 -1.34 119.66 125.06 1utd s GLN 64 Ca -0.14 -0.84 0.04 0.00 0.02 0.00 0.00 55.36 54.44 1utd s GLN 64 Cb -0.15 -2.41 -0.02 0.00 1.00 0.00 0.00 33.01 31.42 1utd s GLN 64 CO 0.03 0.11 0.14 0.95 -2.12 0.00 0.00 175.29 174.40 1utd s THR 65 N 0.53 0.53 0.61 -0.19 -4.23 -0.33 -1.06 115.64 111.50 1utd s THR 65 Ca -0.13 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 58.69 1utd s THR 65 Cb -0.17 -2.32 0.36 0.00 1.34 0.00 0.00 72.50 71.72 1utd s THR 65 CO 0.04 0.00 2.10 -0.09 -0.54 0.00 0.00 174.62 176.14 1utd h ARG 66 N 1.77 0.00 -0.02 3.99 2.43 -2.00 -2.15 114.38 118.40 1utd h ARG 66 Ca -0.34 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 1utd h ARG 66 Cb 1.27 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.82 1utd h ARG 66 CO 0.55 0.00 -0.12 0.72 -1.51 0.00 0.00 179.97 179.61 1utd n HIS 67 N -3.61 0.00 0.00 2.20 8.25 -1.26 -5.04 115.22 115.75 1utd n HIS 67 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1utd n HIS 67 Cb 0.31 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.40 1utd n HIS 67 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1utd n GLY 68 N 1.29 0.60 3.57 -1.41 0.00 -0.81 -5.10 105.19 103.33 1utd n GLY 68 Ca 0.15 -2.06 -0.25 0.00 0.00 0.00 0.00 46.02 43.86 1utd n GLY 68 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1utd s VAL 69 N -1.16 3.09 -0.05 1.61 -7.23 -1.26 -1.19 120.40 114.21 1utd s VAL 69 Ca 0.00 -1.91 -0.30 0.00 -1.81 0.00 0.00 61.98 57.96 1utd s VAL 69 Cb 0.00 -2.59 0.08 0.00 0.56 0.00 0.00 36.38 34.43 1utd s VAL 69 CO 0.00 -0.26 0.74 -0.51 -0.31 0.00 0.00 175.10 174.77 1utd s ILE 70 N -2.06 0.00 -0.12 -0.62 2.07 -0.45 -5.02 121.20 115.00 1utd s ILE 70 Ca 0.28 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.53 1utd s ILE 70 Cb -0.07 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.50 1utd s ILE 70 CO 0.16 0.00 -0.14 -1.61 -1.91 0.00 0.00 174.94 171.44 1utd s GLU 71 N -1.52 3.24 0.43 3.50 2.02 -1.26 -0.47 118.70 124.65 1utd s GLU 71 Ca -0.07 -0.71 -0.11 0.00 0.02 0.00 0.00 54.97 54.10 1utd s GLU 71 Cb -0.00 -2.56 -0.06 0.00 0.10 0.00 0.00 34.13 31.60 1utd s GLU 71 CO 0.05 0.26 0.81 -1.54 0.02 0.00 0.00 175.26 174.87 1utd s SER 72 N 0.21 6.51 -0.00 -0.19 1.04 -0.11 -4.94 113.70 116.22 1utd s SER 72 Ca -0.09 1.20 0.05 0.00 0.48 0.00 0.00 55.95 57.59 1utd s SER 72 Cb -0.15 -2.35 -0.01 0.00 0.10 0.00 0.00 66.02 63.60 1utd s SER 72 CO 0.05 -0.46 -0.17 -1.61 0.98 0.00 0.00 173.24 172.03 1utd s GLU 73 N -3.99 1.35 0.00 4.02 2.02 -1.25 -2.59 118.70 118.27 1utd s GLU 73 Ca 0.52 -0.66 0.16 0.00 0.02 0.00 0.00 54.97 55.02 1utd s GLU 73 Cb -0.10 -1.33 0.13 0.00 0.10 0.00 0.00 34.13 32.93 1utd s GLU 73 CO 0.33 0.36 1.01 0.41 0.02 0.00 0.00 175.26 177.39