#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 4.08 -4.77 3.42 2.85 -1.26 -5.02 115.26 114.55 1utd n ASN 6 Ca 0.00 -3.50 -0.30 0.00 -0.11 0.00 0.00 54.58 50.67 1utd n ASN 6 Cb 0.00 -0.82 0.10 0.00 1.24 0.00 0.00 39.78 40.31 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 -1.21 4.25 0.97 1.20 0.01 -1.26 -5.03 113.70 112.63 1utd s SER 7 Ca 0.57 1.47 -0.12 0.00 1.31 0.00 0.00 55.95 59.18 1utd s SER 7 Cb 0.47 -2.20 0.17 0.00 0.21 0.00 0.00 66.02 64.67 1utd s SER 7 CO 0.12 -2.15 1.08 -0.62 0.41 0.00 0.00 173.24 172.09 1utd s ASP 8 N -3.66 2.73 0.21 2.44 -1.08 -1.26 -4.81 116.67 111.24 1utd s ASP 8 Ca 0.61 1.48 -0.05 0.00 -0.52 0.00 0.00 52.55 54.08 1utd s ASP 8 Cb -0.16 -2.15 -0.03 0.00 -1.46 0.00 0.00 42.92 39.12 1utd s ASP 8 CO 0.55 -3.10 0.23 0.72 0.52 0.00 0.00 175.17 174.09 1utd s PHE 9 N -2.83 0.90 0.03 -5.34 -0.12 -1.26 -1.79 117.98 107.57 1utd s PHE 9 Ca 0.65 -1.17 0.04 0.00 -0.05 0.00 0.00 56.93 56.40 1utd s PHE 9 Cb -0.20 -0.33 -0.02 0.00 -0.63 0.00 0.00 43.02 41.84 1utd s PHE 9 CO 0.59 -0.73 -0.12 0.14 -0.05 0.00 0.00 175.22 175.04 1utd s VAL 10 N -4.11 0.97 -0.17 -2.49 -7.23 -0.31 -4.59 120.40 102.47 1utd s VAL 10 Ca 0.33 -0.87 -0.05 0.00 -1.81 0.00 0.00 61.98 59.58 1utd s VAL 10 Cb 0.05 -0.88 -0.03 0.00 0.56 0.00 0.00 36.38 36.08 1utd s VAL 10 CO 0.10 0.02 0.00 -0.69 -0.31 0.00 0.00 175.10 174.22 1utd s VAL 11 N -0.75 4.20 -0.14 1.32 1.01 -0.54 -0.82 120.40 124.68 1utd s VAL 11 Ca 0.01 -0.24 -0.00 0.00 0.00 0.00 0.00 61.98 61.74 1utd s VAL 11 Cb -0.07 -2.87 0.03 0.00 0.00 0.00 0.00 36.38 33.47 1utd s VAL 11 CO 0.01 0.47 -0.08 -0.63 0.00 0.00 0.00 175.10 174.87 1utd s ILE 12 N 0.46 1.16 -0.24 2.22 1.01 0.11 -1.17 121.20 124.75 1utd s ILE 12 Ca -0.01 -0.49 -0.07 0.00 0.00 0.00 0.00 60.65 60.08 1utd s ILE 12 Cb -0.14 -1.22 -0.03 0.00 0.01 0.00 0.00 42.46 41.09 1utd s ILE 12 CO 0.02 0.29 0.06 -0.75 0.00 0.00 0.00 174.94 174.56 1utd s LYS 13 N 1.64 3.64 0.15 2.79 2.20 0.55 -0.51 119.74 130.20 1utd s LYS 13 Ca 0.03 -0.49 -0.30 0.00 -0.36 0.00 0.00 55.97 54.85 1utd s LYS 13 Cb -0.14 -3.29 -0.08 0.00 -1.51 0.00 0.00 37.83 32.82 1utd s LYS 13 CO -0.08 -0.17 1.32 0.00 -0.36 0.00 0.00 175.35 176.05 1utd s ALA 14 N 1.55 3.53 -1.99 3.13 0.00 -0.74 -0.14 121.76 127.10 1utd s ALA 14 Ca 0.06 1.07 0.18 0.00 0.00 0.00 0.00 51.96 53.27 1utd s ALA 14 Cb -0.15 -3.49 0.29 0.00 0.00 0.00 0.00 23.12 19.77 1utd s ALA 14 CO 0.03 -0.54 1.22 1.28 0.00 0.00 0.00 175.76 177.75 1utd n LEU 15 N 3.21 2.94 -3.90 0.00 4.77 0.39 -0.35 117.00 124.06 1utd n LEU 15 Ca 0.08 -1.41 -0.08 0.00 -0.03 0.00 0.00 56.01 54.57 1utd n LEU 15 Cb 0.43 -0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 41.33 1utd n LEU 15 CO 0.58 0.62 0.38 -1.83 -1.33 0.00 0.00 177.39 175.81 1utd s GLU 16 N -1.31 1.72 0.53 3.23 -1.05 -1.21 -4.89 118.70 115.70 1utd s GLU 16 Ca 0.28 -1.07 -0.20 0.00 -0.15 0.00 0.00 54.97 53.84 1utd s GLU 16 Cb 0.17 0.57 -0.06 0.00 -0.44 0.00 0.00 34.13 34.37 1utd s GLU 16 CO 0.24 -0.77 1.12 -0.51 0.95 0.00 0.00 175.26 176.30 1utd s ASP 17 N -2.95 5.84 -0.40 0.83 1.01 -1.26 -3.24 116.67 116.50 1utd s ASP 17 Ca 0.14 2.16 0.00 0.00 0.71 0.00 0.00 52.55 55.56 1utd s ASP 17 Cb -0.04 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.31 1utd s ASP 17 CO 0.08 -1.13 0.00 0.61 0.21 0.00 0.00 175.17 174.93 1utd n GLY 18 N 0.14 0.46 3.77 0.21 0.00 -0.91 -4.89 105.19 103.98 1utd n GLY 18 Ca 0.11 -0.80 -0.41 0.00 0.00 0.00 0.00 46.02 44.92 1utd n GLY 18 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1utd s VAL 19 N -2.18 2.90 -0.14 1.61 1.01 -0.59 -4.84 120.40 118.17 1utd s VAL 19 Ca 0.00 0.90 -0.00 0.00 0.00 0.00 0.00 61.98 62.87 1utd s VAL 19 Cb 0.00 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.80 1utd s VAL 19 CO 0.00 0.21 -0.13 0.20 0.00 0.00 0.00 175.10 175.38 1utd s ASN 20 N -0.53 3.90 -0.38 3.32 0.01 -0.37 -0.38 114.94 120.52 1utd s ASN 20 Ca 0.48 -0.38 -0.08 0.00 -0.71 0.00 0.00 52.86 52.17 1utd s ASN 20 Cb -0.38 -1.60 0.06 0.00 0.41 0.00 0.00 41.25 39.73 1utd s ASN 20 CO 0.50 0.13 0.18 -0.69 -1.51 0.00 0.00 177.10 175.70 1utd s VAL 21 N 0.58 4.03 -0.19 1.60 1.01 -0.00 -0.95 120.40 126.48 1utd s VAL 21 Ca -0.08 -1.23 -0.06 0.00 0.00 0.00 0.00 61.98 60.60 1utd s VAL 21 Cb -0.16 -3.37 -0.03 0.00 0.00 0.00 0.00 36.38 32.82 1utd s VAL 21 CO 0.03 -0.33 0.03 -0.63 0.00 0.00 0.00 175.10 174.21 1utd s ILE 22 N 1.42 4.37 -0.23 2.22 1.01 0.45 -0.90 121.20 129.55 1utd s ILE 22 Ca 0.01 -0.18 -0.20 0.00 0.00 0.00 0.00 60.65 60.29 1utd s ILE 22 Cb -0.21 -2.97 -0.02 0.00 0.01 0.00 0.00 42.46 39.26 1utd s ILE 22 CO 0.03 0.44 0.60 -0.83 0.00 0.00 0.00 174.94 175.17 1utd s GLY 23 N 0.72 1.94 0.01 6.18 0.00 0.68 -1.25 107.32 115.61 1utd s GLY 23 Ca 0.02 -0.39 -0.18 0.00 0.00 0.00 0.00 44.72 44.17 1utd s GLY 23 CO 0.02 1.31 0.52 1.08 0.00 0.00 0.00 173.10 176.03 1utd s LEU 24 N 2.12 4.46 0.32 0.66 1.02 -0.17 -1.11 118.68 125.99 1utd s LEU 24 Ca 0.26 1.10 -0.29 0.00 0.02 0.00 0.00 54.13 55.22 1utd s LEU 24 Cb -0.16 -2.79 -0.11 0.00 0.02 0.00 0.00 46.19 43.16 1utd s LEU 24 CO 0.09 0.22 1.44 0.42 0.02 0.00 0.00 176.35 178.54 1utd s THR 25 N -0.69 2.40 0.48 5.49 -4.23 -0.45 -2.67 115.64 115.97 1utd s THR 25 Ca 0.27 0.37 -0.23 0.00 -1.18 0.00 0.00 61.69 60.93 1utd s THR 25 Cb -0.18 -3.24 -0.07 0.00 1.34 0.00 0.00 72.50 70.36 1utd s THR 25 CO 0.16 0.08 1.23 -0.60 -0.54 0.00 0.00 174.62 174.94 1utd s ARG 26 N -1.31 3.57 0.00 3.99 3.52 -0.66 -4.54 118.95 123.52 1utd s ARG 26 Ca 0.55 1.92 0.00 0.00 -0.13 0.00 0.00 55.73 58.07 1utd s ARG 26 Cb -0.44 -2.37 0.00 0.00 -1.56 0.00 0.00 34.95 30.59 1utd s ARG 26 CO 0.53 -0.74 0.00 0.41 -0.81 0.00 0.00 175.30 174.68 1utd n GLY 27 N 0.53 -0.15 0.26 8.12 0.00 -1.26 -4.65 105.19 108.04 1utd n GLY 27 Ca 0.08 -2.21 0.03 0.00 0.00 0.00 0.00 46.02 43.92 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 0.93 -2.68 4.61 0.00 -2.05 -3.42 119.26 116.65 1utd h ALA 28 Ca 0.00 0.12 -0.60 0.00 0.00 0.00 0.00 54.91 54.43 1utd h ALA 28 Cb 0.00 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 1utd h ALA 28 CO 0.00 -0.24 -0.28 0.34 0.00 0.00 0.00 179.25 179.07 1utd s ASP 29 N -5.33 6.61 -0.52 0.00 2.15 -1.26 -5.06 116.67 113.26 1utd s ASP 29 Ca -0.13 0.74 0.04 0.00 0.43 0.00 0.00 52.55 53.63 1utd s ASP 29 Cb 0.19 -2.16 0.14 0.00 -0.30 0.00 0.00 42.92 40.80 1utd s ASP 29 CO 0.75 0.21 0.30 -0.89 -0.17 0.00 0.00 175.17 175.37 1utd s THR 30 N -1.35 2.16 0.47 1.71 2.01 -1.26 -4.53 115.64 114.85 1utd s THR 30 Ca 0.31 -3.22 0.02 0.00 0.31 0.00 0.00 61.69 59.11 1utd s THR 30 Cb -0.14 -2.48 -0.01 0.00 0.01 0.00 0.00 72.50 69.88 1utd s THR 30 CO 0.17 -0.89 0.08 -2.11 -0.69 0.00 0.00 174.62 171.18 1utd n ARG 31 N 3.02 0.66 -3.02 4.92 1.85 -1.26 -4.89 116.66 117.94 1utd n ARG 31 Ca 0.10 -3.64 -0.40 0.00 -1.00 0.00 0.00 57.85 52.91 1utd n ARG 31 Cb 0.34 1.47 -0.05 0.00 -1.05 0.00 0.00 32.46 33.17 1utd n ARG 31 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1utd s PHE 32 N -2.99 3.47 -0.03 2.89 0.08 -1.26 -1.34 117.98 118.80 1utd s PHE 32 Ca 0.11 1.15 0.21 0.00 0.12 0.00 0.00 56.93 58.52 1utd s PHE 32 Cb 0.01 -2.86 -0.32 0.00 -0.57 0.00 0.00 43.02 39.27 1utd s PHE 32 CO 0.08 -0.09 0.45 -2.39 -0.10 0.00 0.00 175.22 173.17 1utd n HIS 33 N 4.60 0.00 -3.63 0.36 1.44 -0.27 -4.91 115.22 112.81 1utd n HIS 33 Ca 0.00 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.59 1utd n HIS 33 Cb 0.50 -0.48 -0.07 0.00 0.12 0.00 0.00 29.99 30.06 1utd n HIS 33 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 1utd s HIS 34 N -3.44 -0.82 -0.18 -1.40 5.65 -1.24 -5.01 115.29 108.85 1utd s HIS 34 Ca -0.08 1.92 0.01 0.00 0.25 0.00 0.00 55.06 57.17 1utd s HIS 34 Cb 0.13 0.33 0.03 0.00 -1.18 0.00 0.00 32.58 31.89 1utd s HIS 34 CO 0.87 -0.39 -0.15 -1.54 -0.65 0.00 0.00 174.74 172.87 1utd s SER 35 N 0.56 3.20 -0.27 9.88 1.04 -1.26 -0.23 113.70 126.62 1utd s SER 35 Ca -0.01 -0.74 -0.16 0.00 0.48 0.00 0.00 55.95 55.52 1utd s SER 35 Cb -0.05 -1.33 -0.03 0.00 0.10 0.00 0.00 66.02 64.71 1utd s SER 35 CO -0.02 -0.08 0.41 -0.70 0.98 0.00 0.00 173.24 173.83 1utd s GLU 36 N 1.36 4.01 -0.10 4.02 2.56 -0.07 -4.90 118.70 125.57 1utd s GLU 36 Ca 0.02 0.09 -0.28 0.00 0.00 0.00 0.00 54.97 54.79 1utd s GLU 36 Cb -0.15 -3.66 -0.02 0.00 2.00 0.00 0.00 34.13 32.31 1utd s GLU 36 CO -0.10 -0.31 0.95 0.21 -0.56 0.00 0.00 175.26 175.45 1utd s LYS 37 N 2.13 4.42 -0.07 4.30 2.20 -1.26 -0.82 119.74 130.64 1utd s LYS 37 Ca 0.16 1.30 0.04 0.00 -0.36 0.00 0.00 55.97 57.11 1utd s LYS 37 Cb -0.16 -3.53 -0.01 0.00 -1.51 0.00 0.00 37.83 32.62 1utd s LYS 37 CO 0.10 -0.26 -0.20 -0.51 -0.36 0.00 0.00 175.35 174.12 1utd s LEU 38 N 1.83 2.34 0.53 5.43 1.43 0.49 -4.98 118.68 125.75 1utd s LEU 38 Ca 0.46 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 53.17 1utd s LEU 38 Cb -0.18 -1.46 0.03 0.00 0.03 0.00 0.00 46.19 44.60 1utd s LEU 38 CO 0.18 0.25 0.74 -1.81 0.23 0.00 0.00 176.35 175.94 1utd s ASP 39 N -0.15 5.37 0.09 2.29 1.01 -1.26 -1.54 116.67 122.48 1utd s ASP 39 Ca -0.03 -0.05 -0.34 0.00 0.71 0.00 0.00 52.55 52.85 1utd s ASP 39 Cb -0.14 -0.89 -0.13 0.00 1.01 0.00 0.00 42.92 42.77 1utd s ASP 39 CO 0.04 -1.06 1.66 1.17 0.21 0.00 0.00 175.17 177.18 1utd n LYS 40 N -2.26 2.13 0.00 8.23 4.81 -1.20 -1.38 118.16 128.49 1utd n LYS 40 Ca 0.07 0.77 0.00 0.00 -0.87 0.00 0.00 58.31 58.29 1utd n LYS 40 Cb 0.59 -2.56 0.00 0.00 0.02 0.00 0.00 35.03 33.09 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 3.67 2.46 3.77 3.14 0.00 0.53 -4.97 105.19 113.79 1utd n GLY 41 Ca 0.19 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 -0.48 3.96 -0.09 1.61 2.02 -0.48 -4.77 118.70 120.48 1utd s GLU 42 Ca 0.00 1.87 0.03 0.00 0.02 0.00 0.00 54.97 56.89 1utd s GLU 42 Cb 0.00 -2.62 -0.01 0.00 0.10 0.00 0.00 34.13 31.60 1utd s GLU 42 CO 0.00 -0.41 -0.20 0.08 0.02 0.00 0.00 175.26 174.76 1utd s VAL 43 N -1.42 2.50 -0.09 2.63 1.01 -1.26 -1.79 120.40 121.98 1utd s VAL 43 Ca 0.59 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.71 1utd s VAL 43 Cb -0.31 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.08 1utd s VAL 43 CO 0.39 0.56 -0.19 -0.22 0.00 0.00 0.00 175.10 175.64 1utd s LEU 44 N 0.03 2.40 -0.20 3.92 2.96 0.34 -4.99 118.68 123.14 1utd s LEU 44 Ca -0.07 -0.41 0.01 0.00 -0.22 0.00 0.00 54.13 53.44 1utd s LEU 44 Cb -0.15 -1.49 0.03 0.00 0.50 0.00 0.00 46.19 45.08 1utd s LEU 44 CO 0.05 0.21 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.48 1utd s ILE 45 N 0.05 2.10 -0.03 6.68 1.01 -1.26 0.08 121.20 129.83 1utd s ILE 45 Ca -0.08 -1.07 -0.01 0.00 0.00 0.00 0.00 60.65 59.50 1utd s ILE 45 Cb -0.15 -1.95 0.03 0.00 0.01 0.00 0.00 42.46 40.40 1utd s ILE 45 CO 0.05 0.43 0.03 0.00 0.00 0.00 0.00 174.94 175.45 1utd s ALA 46 N 1.26 0.25 0.59 9.38 0.00 0.00 -4.96 121.76 128.28 1utd s ALA 46 Ca 0.02 0.19 -0.10 0.00 0.00 0.00 0.00 51.96 52.08 1utd s ALA 46 Cb -0.14 -0.43 -0.04 0.00 0.00 0.00 0.00 23.12 22.51 1utd s ALA 46 CO -0.11 -0.25 0.97 -0.65 0.00 0.00 0.00 175.76 175.72 1utd s GLN 47 N 1.47 3.55 0.35 0.00 -0.21 -1.26 -1.17 119.66 122.39 1utd s GLN 47 Ca -0.04 0.60 -0.26 0.00 0.02 0.00 0.00 55.36 55.68 1utd s GLN 47 Cb -0.13 -2.15 -0.10 0.00 1.00 0.00 0.00 33.01 31.63 1utd s GLN 47 CO -0.03 -0.50 1.00 -0.06 -2.12 0.00 0.00 175.29 173.58 1utd s PHE 48 N -3.07 3.53 0.32 0.91 0.08 -0.74 -4.94 117.98 114.06 1utd s PHE 48 Ca 0.53 1.73 0.03 0.00 0.12 0.00 0.00 56.93 59.34 1utd s PHE 48 Cb -0.11 -3.03 -0.01 0.00 -0.57 0.00 0.00 43.02 39.30 1utd s PHE 48 CO 0.52 -0.16 0.35 0.25 -0.10 0.00 0.00 175.22 176.07 1utd n THR 49 N 0.39 0.00 -0.34 0.64 -2.24 -0.39 -4.68 114.28 107.67 1utd n THR 49 Ca 0.03 -1.99 0.14 0.00 -2.27 0.00 0.00 64.05 59.96 1utd n THR 49 Cb 0.49 1.08 0.33 0.00 -2.10 0.00 0.00 70.33 70.14 1utd n THR 49 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1utd h GLU 50 N 0.00 0.62 0.00 -0.78 4.81 -2.03 -3.05 114.58 114.14 1utd h GLU 50 Ca -0.23 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 1utd h GLU 50 Cb 1.11 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.35 1utd h GLU 50 CO 0.33 0.41 -1.34 0.72 -0.73 0.00 0.00 179.01 178.40 1utd n HIS 51 N -4.86 0.16 -3.98 0.92 8.25 -1.26 -4.59 115.22 109.87 1utd n HIS 51 Ca 0.24 0.05 -0.30 0.00 -0.26 0.00 0.00 57.72 57.45 1utd n HIS 51 Cb 0.63 -0.39 -0.16 0.00 1.12 0.00 0.00 29.99 31.19 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 -3.27 1.49 -0.65 1.59 2.01 -1.15 -1.66 115.64 114.00 1utd s THR 52 Ca 0.01 -0.78 0.06 0.00 0.31 0.00 0.00 61.69 61.28 1utd s THR 52 Cb 0.14 -1.52 0.03 0.00 0.01 0.00 0.00 72.50 71.16 1utd s THR 52 CO 0.85 0.27 0.60 -1.54 -0.69 0.00 0.00 174.62 174.11 1utd n SER 53 N 4.76 1.27 -3.60 3.53 3.41 -1.09 -1.26 113.62 120.64 1utd n SER 53 Ca -0.15 -1.14 -0.16 0.00 -0.26 0.00 0.00 58.87 57.17 1utd n SER 53 Cb 0.48 0.18 -0.07 0.00 -0.26 0.00 0.00 64.21 64.54 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 -0.66 -1.61 -0.07 7.33 0.00 -1.25 -5.03 121.76 120.48 1utd s ALA 54 Ca 0.06 1.41 0.01 0.00 0.00 0.00 0.00 51.96 53.44 1utd s ALA 54 Cb 0.05 -0.39 0.02 0.00 0.00 0.00 0.00 23.12 22.79 1utd s ALA 54 CO 0.10 -0.34 -0.09 0.42 0.00 0.00 0.00 175.76 175.85 1utd s ILE 55 N -0.63 0.96 -0.11 0.00 1.01 -1.26 -0.99 121.20 120.17 1utd s ILE 55 Ca -0.07 -0.35 -0.01 0.00 0.00 0.00 0.00 60.65 60.22 1utd s ILE 55 Cb -0.02 -0.92 -0.03 0.00 0.01 0.00 0.00 42.46 41.50 1utd s ILE 55 CO 0.06 0.33 -0.05 -0.75 0.00 0.00 0.00 174.94 174.53 1utd s LYS 56 N 0.97 3.19 -0.19 2.79 2.20 -0.38 -4.95 119.74 123.38 1utd s LYS 56 Ca -0.09 -0.52 -0.02 0.00 -0.36 0.00 0.00 55.97 54.98 1utd s LYS 56 Cb -0.15 -2.75 -0.00 0.00 -1.51 0.00 0.00 37.83 33.41 1utd s LYS 56 CO 0.00 0.48 -0.10 0.08 -0.36 0.00 0.00 175.35 175.45 1utd s VAL 57 N -0.29 3.03 -0.13 4.02 1.01 -1.26 -0.41 120.40 126.37 1utd s VAL 57 Ca 0.05 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.40 1utd s VAL 57 Cb -0.13 -2.33 -0.01 0.00 0.00 0.00 0.00 36.38 33.91 1utd s VAL 57 CO 0.02 0.48 -0.14 -0.13 0.00 0.00 0.00 175.10 175.33 1utd s ARG 58 N 1.10 3.35 0.00 2.72 0.52 -0.12 -4.95 118.95 121.57 1utd s ARG 58 Ca 0.01 -0.70 0.00 0.00 -0.52 0.00 0.00 55.73 54.51 1utd s ARG 58 Cb -0.15 -2.60 0.00 0.00 0.52 0.00 0.00 34.95 32.73 1utd s ARG 58 CO -0.02 0.21 0.00 0.41 0.02 0.00 0.00 175.30 175.92 1utd n GLY 59 N 3.53 1.66 3.66 -3.53 0.00 -1.26 -1.24 105.19 108.01 1utd n GLY 59 Ca -0.18 -2.05 -0.43 0.00 0.00 0.00 0.00 46.02 43.36 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 -1.98 4.23 0.02 1.61 2.20 -1.26 -3.99 119.74 120.57 1utd s LYS 60 Ca 0.00 1.42 -0.20 0.00 -0.36 0.00 0.00 55.97 56.83 1utd s LYS 60 Cb 0.00 -3.69 0.04 0.00 -1.51 0.00 0.00 37.83 32.67 1utd s LYS 60 CO 0.00 -0.68 0.45 0.00 -0.36 0.00 0.00 175.35 174.76 1utd s ALA 61 N 3.35 -1.13 -0.13 3.13 0.00 -1.13 -0.46 121.76 125.38 1utd s ALA 61 Ca 0.47 0.49 -0.03 0.00 0.00 0.00 0.00 51.96 52.90 1utd s ALA 61 Cb -0.17 0.26 -0.03 0.00 0.00 0.00 0.00 23.12 23.19 1utd s ALA 61 CO 0.09 -0.42 -0.04 -0.47 0.00 0.00 0.00 175.76 174.93 1utd s TYR 62 N -2.10 3.03 -0.06 0.00 5.04 0.80 -0.95 117.35 123.11 1utd s TYR 62 Ca -0.07 -0.18 0.02 0.00 -2.44 0.00 0.00 57.07 54.40 1utd s TYR 62 Cb -0.01 -1.90 0.01 0.00 0.35 0.00 0.00 41.96 40.41 1utd s TYR 62 CO 0.01 0.09 -0.11 0.42 -1.34 0.00 0.00 175.55 174.61 1utd s ILE 63 N 0.03 1.05 -0.09 3.14 1.01 0.44 -0.33 121.20 126.45 1utd s ILE 63 Ca 0.01 -0.42 0.02 0.00 0.00 0.00 0.00 60.65 60.25 1utd s ILE 63 Cb -0.13 -0.98 -0.02 0.00 0.01 0.00 0.00 42.46 41.34 1utd s ILE 63 CO 0.03 0.34 -0.14 -1.10 0.00 0.00 0.00 174.94 174.06 1utd s GLN 64 N 0.75 2.90 0.36 2.79 -0.21 -0.32 -1.19 119.66 124.75 1utd s GLN 64 Ca -0.13 -0.70 0.06 0.00 0.02 0.00 0.00 55.36 54.61 1utd s GLN 64 Cb -0.15 -2.48 -0.03 0.00 1.00 0.00 0.00 33.01 31.34 1utd s GLN 64 CO 0.03 0.43 0.22 0.95 -2.12 0.00 0.00 175.29 174.80 1utd s THR 65 N -0.22 0.20 0.54 -0.19 -4.23 -0.02 -1.47 115.64 110.25 1utd s THR 65 Ca 0.01 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 58.79 1utd s THR 65 Cb -0.13 -2.43 0.42 0.00 1.34 0.00 0.00 72.50 71.70 1utd s THR 65 CO 0.03 0.00 1.96 -0.09 -0.54 0.00 0.00 174.62 175.98 1utd h ARG 66 N 2.02 0.00 -0.01 3.99 2.43 -2.01 -2.30 114.38 118.50 1utd h ARG 66 Ca -0.29 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 1utd h ARG 66 Cb 1.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1utd h ARG 66 CO 0.44 0.00 -0.04 0.72 -1.51 0.00 0.00 179.97 179.57 1utd n HIS 67 N -4.28 0.00 0.00 2.20 8.25 -1.26 -5.04 115.22 115.08 1utd n HIS 67 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.58 1utd n HIS 67 Cb 0.72 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.80 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 1.19 0.69 3.63 -1.41 0.00 -0.87 -5.09 105.19 103.33 1utd n GLY 68 Ca 0.18 -2.10 -0.27 0.00 0.00 0.00 0.00 46.02 43.82 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 -1.23 3.54 -0.05 1.61 -7.23 -1.26 -0.84 120.40 114.94 1utd s VAL 69 Ca 0.00 -1.42 -0.30 0.00 -1.81 0.00 0.00 61.98 58.44 1utd s VAL 69 Cb 0.00 -2.75 0.08 0.00 0.56 0.00 0.00 36.38 34.27 1utd s VAL 69 CO 0.00 -0.05 0.72 -0.51 -0.31 0.00 0.00 175.10 174.94 1utd s ILE 70 N -1.60 0.00 -0.15 -0.62 2.07 -0.33 -5.01 121.20 115.56 1utd s ILE 70 Ca 0.26 0.00 -0.03 0.00 -1.41 0.00 0.00 60.65 59.47 1utd s ILE 70 Cb -0.10 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.47 1utd s ILE 70 CO 0.17 0.00 -0.06 -1.61 -1.91 0.00 0.00 174.94 171.53 1utd s GLU 71 N -1.34 3.59 0.57 3.50 2.02 -1.26 -0.42 118.70 125.36 1utd s GLU 71 Ca -0.09 -0.55 -0.14 0.00 0.02 0.00 0.00 54.97 54.21 1utd s GLU 71 Cb -0.00 -2.85 -0.06 0.00 0.10 0.00 0.00 34.13 31.32 1utd s GLU 71 CO 0.08 0.25 1.01 -1.54 0.02 0.00 0.00 175.26 175.08 1utd s SER 72 N 0.31 6.33 0.02 -0.19 1.04 -0.12 -4.93 113.70 116.15 1utd s SER 72 Ca -0.05 1.55 0.05 0.00 0.48 0.00 0.00 55.95 57.98 1utd s SER 72 Cb -0.14 -2.50 -0.02 0.00 0.10 0.00 0.00 66.02 63.46 1utd s SER 72 CO 0.03 -0.80 -0.16 -1.61 0.98 0.00 0.00 173.24 171.69 1utd s GLU 73 N -4.51 1.17 0.00 4.02 2.02 -1.26 -2.84 118.70 117.30 1utd s GLU 73 Ca 0.58 -0.70 0.03 0.00 0.02 0.00 0.00 54.97 54.90 1utd s GLU 73 Cb -0.11 -1.17 0.02 0.00 0.10 0.00 0.00 34.13 32.97 1utd s GLU 73 CO 0.41 0.31 0.59 0.41 0.02 0.00 0.00 175.26 176.99