#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jri s GLN 12 N 0.00 3.30 0.98 7.34 -0.21 -1.26 -5.12 119.66 124.70 1jri s GLN 12 Ca 0.00 -0.68 -0.13 0.00 0.02 0.00 0.00 55.36 54.57 1jri s GLN 12 Cb 0.00 -2.83 0.18 0.00 1.00 0.00 0.00 33.01 31.36 1jri s GLN 12 CO 0.00 -0.10 1.12 1.03 -2.12 0.00 0.00 175.29 175.23 1jri s ARG 13 N 1.16 0.55 0.09 2.91 0.52 -1.26 -4.76 118.95 118.16 1jri s ARG 13 Ca 0.01 0.31 -0.27 0.00 -0.52 0.00 0.00 55.73 55.27 1jri s ARG 13 Cb -0.14 -1.77 -0.10 0.00 0.52 0.00 0.00 34.95 33.46 1jri s ARG 13 CO -0.03 -2.61 1.43 -1.35 0.02 0.00 0.00 175.30 172.77 1jri h PRO 14 N -1.79 -0.44 -0.79 3.54 0.11 -1.99 -2.70 132.00 127.93 1jri h PRO 14 Ca -0.52 0.03 0.07 0.00 0.11 0.00 0.00 66.00 65.69 1jri h PRO 14 Cb 1.33 0.10 -0.10 0.00 0.11 0.00 0.00 31.00 32.44 1jri h PRO 14 CO 0.57 -0.29 -0.47 1.28 -0.21 0.00 0.00 178.00 178.88 1jri n LEU 15 N -4.81 -0.84 -0.02 2.35 7.99 -1.26 -1.43 117.00 118.98 1jri n LEU 15 Ca -0.05 1.52 -0.05 0.00 -0.01 0.00 0.00 56.01 57.43 1jri n LEU 15 Cb 0.30 -0.24 -0.03 0.00 -0.11 0.00 0.00 43.42 43.34 1jri n LEU 15 CO 0.07 -1.21 0.50 0.44 -1.51 0.00 0.00 177.39 175.68 1jri h ASP 16 N 0.00 -0.57 -0.91 -1.43 3.32 -1.90 -0.36 116.42 114.56 1jri h ASP 16 Ca 0.13 0.07 0.38 0.00 0.02 0.00 0.00 57.03 57.63 1jri h ASP 16 Cb 0.33 0.23 -0.16 0.00 0.22 0.00 0.00 39.33 39.94 1jri h ASP 16 CO -0.75 -0.14 0.48 0.00 -1.72 0.00 0.00 179.24 177.11 1jri n ALA 17 N -2.76 0.93 -0.08 3.45 0.00 -0.67 0.21 120.51 121.59 1jri n ALA 17 Ca -0.02 0.93 -0.02 0.00 0.00 0.00 0.00 53.44 54.33 1jri n ALA 17 Cb 0.12 -0.93 0.22 0.00 0.00 0.00 0.00 19.45 18.86 1jri n ALA 17 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1jri h LEU 18 N 0.00 0.67 -1.28 0.00 5.85 0.11 -2.31 115.31 118.34 1jri h LEU 18 Ca 0.77 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 59.34 1jri h LEU 18 Cb 2.03 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 42.86 1jri h LEU 18 CO -0.71 0.71 0.26 1.23 -0.34 0.00 0.00 178.44 179.59 1jri h GLY 19 N 0.93 0.80 0.78 3.75 0.00 0.29 -1.08 103.07 108.54 1jri h GLY 19 Ca 0.14 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1jri h GLY 19 CO 0.01 0.35 0.00 0.70 0.00 0.00 0.00 176.54 177.60 1jri n ASN 20 N -4.37 0.00 -0.32 0.19 3.02 -0.87 0.44 115.26 113.34 1jri n ASN 20 Ca 0.05 -0.21 0.03 0.00 -0.03 0.00 0.00 54.58 54.41 1jri n ASN 20 Cb 0.13 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.36 1jri n ASN 20 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1jri n SER 21 N -0.89 2.22 -4.68 6.41 7.64 -0.41 -5.02 113.62 118.90 1jri n SER 21 Ca 0.03 -1.78 -0.43 0.00 1.01 0.00 0.00 58.87 57.70 1jri n SER 21 Cb 0.01 -0.09 -0.01 0.00 -1.01 0.00 0.00 64.21 63.11 1jri n SER 21 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1jri n LEU 22 N 0.15 3.27 -3.62 -3.43 4.77 0.17 -2.04 117.00 116.26 1jri n LEU 22 Ca 0.06 1.18 -0.28 0.00 -0.03 0.00 0.00 56.01 56.94 1jri n LEU 22 Cb 0.29 -1.45 0.05 0.00 -2.33 0.00 0.00 43.42 39.98 1jri n LEU 22 CO 0.04 -0.54 -0.06 0.59 -1.33 0.00 0.00 177.39 176.09 1jri n ASN 23 N 1.35 -5.03 -3.65 -1.43 4.13 0.42 -4.96 115.26 106.09 1jri n ASN 23 Ca 0.08 -0.95 -0.14 0.00 1.68 0.00 0.00 54.58 55.25 1jri n ASN 23 Cb 0.34 -3.73 -0.08 0.00 -1.54 0.00 0.00 39.78 34.78 1jri n ASN 23 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1jri s SER 24 N -3.56 -0.70 0.34 6.41 0.01 -0.87 -4.93 113.70 110.41 1jri s SER 24 Ca 0.42 1.34 -0.27 0.00 1.31 0.00 0.00 55.95 58.75 1jri s SER 24 Cb -0.13 1.35 -0.12 0.00 0.21 0.00 0.00 66.02 67.33 1jri s SER 24 CO 0.84 -0.23 1.19 -0.81 0.41 0.00 0.00 173.24 174.64 1jri n PRO 25 N 2.79 1.84 -4.17 12.44 -0.04 -1.26 -2.48 135.00 144.12 1jri n PRO 25 Ca -0.14 0.65 -0.12 0.00 -0.04 0.00 0.00 63.50 63.85 1jri n PRO 25 Cb 0.56 -2.18 -0.09 0.00 -0.04 0.00 0.00 33.50 31.74 1jri n PRO 25 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1jri s VAL 26 N -1.11 0.00 -0.04 0.52 -7.23 0.08 -4.72 120.40 107.89 1jri s VAL 26 Ca 0.57 -1.89 0.06 0.00 -1.81 0.00 0.00 61.98 58.91 1jri s VAL 26 Cb -0.60 -2.45 -0.01 0.00 0.56 0.00 0.00 36.38 33.88 1jri s VAL 26 CO 0.61 0.00 -0.23 -0.63 -0.31 0.00 0.00 175.10 174.54 1jri s ILE 27 N -4.10 1.84 -0.20 -0.62 1.01 0.13 -3.00 121.20 116.25 1jri s ILE 27 Ca 0.36 -0.97 0.01 0.00 0.00 0.00 0.00 60.65 60.05 1jri s ILE 27 Cb 0.05 -1.55 0.05 0.00 0.01 0.00 0.00 42.46 41.03 1jri s ILE 27 CO 0.12 0.52 -0.09 -0.63 0.00 0.00 0.00 174.94 174.86 1jri s ILE 28 N -0.28 1.58 -0.29 2.92 -1.09 0.39 -0.99 121.20 123.44 1jri s ILE 28 Ca 0.02 -1.03 -0.10 0.00 -2.23 0.00 0.00 60.65 57.30 1jri s ILE 28 Cb -0.11 -1.70 -0.03 0.00 -1.58 0.00 0.00 42.46 39.03 1jri s ILE 28 CO 0.01 0.11 0.17 -0.75 -1.23 0.00 0.00 174.94 173.26 1jri s LYS 29 N 1.41 3.66 0.54 2.79 2.47 -0.73 -0.71 119.74 129.17 1jri s LYS 29 Ca -0.02 -0.51 0.05 0.00 -1.56 0.00 0.00 55.97 53.94 1jri s LYS 29 Cb -0.17 -3.61 0.05 0.00 -1.46 0.00 0.00 37.83 32.64 1jri s LYS 29 CO -0.08 -0.29 0.74 -0.51 0.16 0.00 0.00 175.35 175.37 1jri s LEU 30 N 1.69 3.32 0.16 5.43 1.43 0.19 0.36 118.68 131.26 1jri s LEU 30 Ca 0.06 -0.42 -0.31 0.00 -1.03 0.00 0.00 54.13 52.43 1jri s LEU 30 Cb -0.16 -2.35 -0.09 0.00 0.03 0.00 0.00 46.19 43.62 1jri s LEU 30 CO 0.09 -1.17 1.40 -0.54 0.23 0.00 0.00 176.35 176.36 1jri s LYS 31 N -4.65 4.31 0.00 1.70 1.02 0.62 -2.57 119.74 120.17 1jri s LYS 31 Ca 0.59 2.14 0.00 0.00 0.02 0.00 0.00 55.97 58.72 1jri s LYS 31 Cb -0.08 -3.20 0.00 0.00 -0.52 0.00 0.00 37.83 34.02 1jri s LYS 31 CO 0.38 -0.42 0.00 0.41 -0.92 0.00 0.00 175.35 174.80 1jri n GLY 32 N 3.12 0.64 2.47 -3.33 0.00 -1.26 -4.42 105.19 102.40 1jri n GLY 32 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1jri n GLY 32 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jri n ASP 33 N 0.00 0.00 -4.63 1.61 8.00 -1.06 -5.01 116.55 115.46 1jri n ASP 33 Ca 0.00 0.00 -0.48 0.00 0.71 0.00 0.00 54.79 55.02 1jri n ASP 33 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 1jri n ASP 33 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1jri n ARG 34 N -2.00 1.67 -4.37 -1.24 3.00 -1.26 -4.72 116.66 107.74 1jri n ARG 34 Ca 0.00 0.60 -0.24 0.00 -0.00 0.00 0.00 57.85 58.21 1jri n ARG 34 Cb 0.00 -2.27 -0.09 0.00 0.00 0.00 0.00 32.46 30.11 1jri n ARG 34 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.63 175.63 1jri s GLU 35 N 0.34 2.03 -0.18 -0.14 2.12 -1.25 -0.64 118.70 120.97 1jri s GLU 35 Ca 0.78 -1.71 -0.09 0.00 0.36 0.00 0.00 54.97 54.31 1jri s GLU 35 Cb -0.79 -1.92 0.07 0.00 0.26 0.00 0.00 34.13 31.75 1jri s GLU 35 CO 0.45 0.21 0.42 -0.06 -0.54 0.00 0.00 175.26 175.74 1jri s PHE 36 N -2.49 -0.68 -0.01 5.30 0.40 0.11 -2.60 117.98 118.00 1jri s PHE 36 Ca 0.33 1.39 0.02 0.00 -0.60 0.00 0.00 56.93 58.08 1jri s PHE 36 Cb -0.02 0.29 -0.03 0.00 0.51 0.00 0.00 43.02 43.77 1jri s PHE 36 CO 0.18 -0.40 -0.06 1.03 0.70 0.00 0.00 175.22 176.68 1jri s ARG 37 N 1.84 2.63 0.00 0.44 0.52 -0.45 -0.46 118.95 123.47 1jri s ARG 37 Ca -0.07 -0.66 0.00 0.00 -0.52 0.00 0.00 55.73 54.48 1jri s ARG 37 Cb -0.10 -2.55 0.00 0.00 0.52 0.00 0.00 34.95 32.83 1jri s ARG 37 CO -0.13 0.62 0.00 0.41 0.02 0.00 0.00 175.30 176.22 1jri n GLY 38 N 1.68 -1.42 3.30 -3.53 0.00 -1.16 -0.77 105.19 103.28 1jri n GLY 38 Ca -0.16 -1.00 -0.36 0.00 0.00 0.00 0.00 46.02 44.50 1jri n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jri s VAL 39 N -2.57 3.61 0.20 1.61 1.01 -0.99 -0.74 120.40 122.52 1jri s VAL 39 Ca 0.00 -0.81 -0.33 0.00 0.00 0.00 0.00 61.98 60.85 1jri s VAL 39 Cb 0.00 -2.86 -0.14 0.00 0.00 0.00 0.00 36.38 33.38 1jri s VAL 39 CO 0.00 0.11 1.39 -0.11 0.00 0.00 0.00 175.10 176.50 1jri n LEU 40 N 4.80 2.68 0.00 3.92 7.94 -1.04 -2.69 117.00 132.62 1jri n LEU 40 Ca -0.15 1.13 0.00 0.00 -1.11 0.00 0.00 56.01 55.88 1jri n LEU 40 Cb 0.48 -1.37 0.00 0.00 0.53 0.00 0.00 43.42 43.06 1jri n LEU 40 CO 0.30 -0.64 -0.48 0.29 -1.11 0.00 0.00 177.39 175.75 1jri n LYS 41 N 2.33 2.50 -3.53 1.96 4.76 -0.53 0.16 118.16 125.80 1jri n LYS 41 Ca 0.14 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.50 1jri n LYS 41 Cb 0.28 -0.98 -0.02 0.00 -1.84 0.00 0.00 35.03 32.47 1jri n LYS 41 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1jri s SER 42 N -3.29 -0.36 -0.00 4.39 1.04 -1.25 -4.74 113.70 109.48 1jri s SER 42 Ca 0.00 -0.06 -0.28 0.00 0.48 0.00 0.00 55.95 56.09 1jri s SER 42 Cb 0.00 0.42 0.10 0.00 0.10 0.00 0.00 66.02 66.64 1jri s SER 42 CO 0.00 -0.70 0.86 0.72 0.98 0.00 0.00 173.24 175.10 1jri s PHE 43 N -3.22 -0.38 0.32 5.02 -0.12 -1.26 -1.87 117.98 116.47 1jri s PHE 43 Ca 0.06 0.31 0.01 0.00 -0.05 0.00 0.00 56.93 57.25 1jri s PHE 43 Cb -0.01 0.53 0.01 0.00 -0.63 0.00 0.00 43.02 42.92 1jri s PHE 43 CO -0.08 -0.56 0.08 -0.40 -0.05 0.00 0.00 175.22 174.21 1jri n ASP 44 N -0.11 2.63 0.29 1.98 5.68 -1.07 -4.97 116.55 120.97 1jri n ASP 44 Ca -0.10 -2.32 0.16 0.00 -0.50 0.00 0.00 54.79 52.02 1jri n ASP 44 Cb 0.62 0.14 0.85 0.00 -1.14 0.00 0.00 41.12 41.59 1jri n ASP 44 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 1jri h LEU 45 N 0.00 0.00 -0.19 -2.12 3.38 -2.03 0.97 115.31 115.32 1jri h LEU 45 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1jri h LEU 45 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1jri h LEU 45 CO 0.41 0.06 -0.22 1.41 0.09 0.00 0.00 178.44 180.19 1jri n HIS 46 N -3.48 0.00 -1.51 1.13 8.25 -1.26 -4.91 115.22 113.44 1jri n HIS 46 Ca -0.02 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.37 1jri n HIS 46 Cb 0.19 -0.24 -0.02 0.00 1.12 0.00 0.00 29.99 31.04 1jri n HIS 46 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1jri n MET 47 N -1.12 -0.55 -2.12 -0.41 2.81 0.33 -4.26 117.12 111.80 1jri n MET 47 Ca 0.11 0.65 -0.38 0.00 -1.81 0.00 0.00 57.70 56.26 1jri n MET 47 Cb 0.31 -4.50 0.00 0.00 -0.71 0.00 0.00 33.22 28.33 1jri n MET 47 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 1jri s ASN 48 N -2.84 5.98 0.03 7.83 0.01 -1.26 -3.45 114.94 121.24 1jri s ASN 48 Ca 0.00 2.45 -0.17 0.00 -0.71 0.00 0.00 52.86 54.44 1jri s ASN 48 Cb 0.00 -2.61 0.03 0.00 0.41 0.00 0.00 41.25 39.08 1jri s ASN 48 CO 0.00 -1.06 0.37 -1.48 -1.51 0.00 0.00 177.10 173.42 1jri s LEU 49 N -3.06 0.58 -0.13 0.60 0.05 0.14 -2.60 118.68 114.27 1jri s LEU 49 Ca 0.65 -0.01 -0.04 0.00 0.05 0.00 0.00 54.13 54.78 1jri s LEU 49 Cb -0.32 1.57 -0.03 0.00 -2.05 0.00 0.00 46.19 45.36 1jri s LEU 49 CO 0.39 -0.61 0.01 -0.69 -0.55 0.00 0.00 176.35 174.91 1jri s VAL 50 N -2.24 4.40 -0.08 1.48 1.01 -0.78 -0.75 120.40 123.43 1jri s VAL 50 Ca -0.07 -0.20 0.03 0.00 0.00 0.00 0.00 61.98 61.75 1jri s VAL 50 Cb -0.02 -2.90 0.01 0.00 0.00 0.00 0.00 36.38 33.47 1jri s VAL 50 CO -0.01 0.55 -0.19 -0.76 0.00 0.00 0.00 175.10 174.69 1jri s LEU 51 N -0.32 1.89 -0.00 3.92 1.43 -0.17 -1.46 118.68 123.97 1jri s LEU 51 Ca 0.07 -0.44 -0.02 0.00 -1.03 0.00 0.00 54.13 52.71 1jri s LEU 51 Cb -0.12 -1.14 -0.04 0.00 0.03 0.00 0.00 46.19 44.92 1jri s LEU 51 CO 0.02 0.11 0.16 0.20 0.23 0.00 0.00 176.35 177.06 1jri s ASN 52 N 0.45 6.18 -1.16 2.29 0.01 -1.09 -0.62 114.94 121.00 1jri s ASN 52 Ca -0.16 0.29 -0.11 0.00 -0.71 0.00 0.00 52.86 52.17 1jri s ASN 52 Cb -0.17 -1.90 -0.02 0.00 0.41 0.00 0.00 41.25 39.57 1jri s ASN 52 CO 0.06 0.26 0.81 -0.67 -1.51 0.00 0.00 177.10 176.05 1jri n ASP 53 N 0.98 -4.58 -4.86 -1.22 -0.08 -0.90 -2.35 116.55 103.54 1jri n ASP 53 Ca -0.11 -0.87 -0.34 0.00 -1.51 0.00 0.00 54.79 51.95 1jri n ASP 53 Cb 0.53 -4.11 -0.06 0.00 2.34 0.00 0.00 41.12 39.82 1jri n ASP 53 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1jri s ALA 54 N -3.50 3.62 -0.03 -1.67 0.00 0.16 -4.44 121.76 115.89 1jri s ALA 54 Ca 0.34 -0.23 0.03 0.00 0.00 0.00 0.00 51.96 52.09 1jri s ALA 54 Cb -0.09 -2.43 0.00 0.00 0.00 0.00 0.00 23.12 20.60 1jri s ALA 54 CO 0.81 0.50 -0.10 -1.21 0.00 0.00 0.00 175.76 175.76 1jri s GLU 55 N -2.16 1.09 -0.67 0.00 2.02 0.05 -0.28 118.70 118.75 1jri s GLU 55 Ca 0.39 -0.33 -0.20 0.00 0.02 0.00 0.00 54.97 54.85 1jri s GLU 55 Cb -0.14 -1.00 0.10 0.00 0.10 0.00 0.00 34.13 33.19 1jri s GLU 55 CO 0.20 0.11 0.86 -2.00 0.02 0.00 0.00 175.26 174.44 1jri s GLU 56 N 0.26 3.16 0.82 1.61 2.12 0.18 -1.34 118.70 125.50 1jri s GLU 56 Ca -0.05 -1.24 -0.11 0.00 0.36 0.00 0.00 54.97 53.94 1jri s GLU 56 Cb -0.10 -4.34 0.09 0.00 0.26 0.00 0.00 34.13 30.04 1jri s GLU 56 CO 0.01 -1.67 1.11 -0.51 -0.54 0.00 0.00 175.26 173.67 1jri s LEU 57 N 3.11 2.98 -0.44 2.70 1.43 -1.07 -0.80 118.68 126.58 1jri s LEU 57 Ca 0.18 1.97 0.08 0.00 -1.03 0.00 0.00 54.13 55.33 1jri s LEU 57 Cb -0.19 -4.54 0.18 0.00 0.03 0.00 0.00 46.19 41.68 1jri s LEU 57 CO 0.05 -2.42 0.66 -0.70 0.23 0.00 0.00 176.35 174.17 1jri s GLU 58 N -4.78 0.90 -0.71 1.70 2.56 -0.25 -3.97 118.70 114.14 1jri s GLU 58 Ca 0.64 -0.50 -0.02 0.00 0.00 0.00 0.00 54.97 55.08 1jri s GLU 58 Cb -0.19 0.05 -0.03 0.00 2.00 0.00 0.00 34.13 35.96 1jri s GLU 58 CO 0.56 -1.23 0.61 -0.25 -0.56 0.00 0.00 175.26 174.39 1jri n ASP 59 N 3.98 -3.93 0.00 -1.70 9.92 -1.26 -2.87 116.55 120.69 1jri n ASP 59 Ca 0.13 -0.44 0.00 0.00 -0.53 0.00 0.00 54.79 53.95 1jri n ASP 59 Cb 0.57 -3.53 0.00 0.00 -0.64 0.00 0.00 41.12 37.51 1jri n ASP 59 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1jri n GLY 60 N -1.24 0.55 3.19 0.44 0.00 -1.26 -4.94 105.19 101.93 1jri n GLY 60 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 1jri n GLY 60 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jri s GLU 61 N -0.44 3.12 0.20 1.61 2.56 -1.14 -5.09 118.70 119.53 1jri s GLU 61 Ca 0.00 -0.77 -0.32 0.00 0.00 0.00 0.00 54.97 53.88 1jri s GLU 61 Cb 0.00 -2.68 -0.13 0.00 2.00 0.00 0.00 34.13 33.32 1jri s GLU 61 CO 0.00 -0.16 1.67 0.28 -0.56 0.00 0.00 175.26 176.49 1jri n VAL 62 N 4.56 0.08 -0.18 3.70 0.31 -1.26 -1.09 118.33 124.44 1jri n VAL 62 Ca -0.20 -0.02 0.01 0.00 -0.01 0.00 0.00 64.34 64.12 1jri n VAL 62 Cb 0.51 -1.85 0.02 0.00 -0.91 0.00 0.00 33.84 31.60 1jri n VAL 62 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1jri n THR 63 N 3.68 1.07 0.00 2.52 -2.24 0.02 -4.89 114.28 114.43 1jri n THR 63 Ca 0.16 -1.11 0.00 0.00 -2.27 0.00 0.00 64.05 60.82 1jri n THR 63 Cb 0.33 0.43 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 1jri n THR 63 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1jri n ARG 64 N -0.59 0.00 -3.56 -0.78 0.63 -1.24 -4.95 116.66 106.17 1jri n ARG 64 Ca 0.02 0.00 -0.37 0.00 -0.92 0.00 0.00 57.85 56.58 1jri n ARG 64 Cb 0.31 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.16 1jri n ARG 64 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1jri s ARG 65 N 0.00 3.95 0.00 -0.14 1.81 -1.26 0.48 118.95 123.78 1jri s ARG 65 Ca 0.00 0.25 0.00 0.00 -1.72 0.00 0.00 55.73 54.26 1jri s ARG 65 Cb 0.00 -3.28 0.00 0.00 -0.45 0.00 0.00 34.95 31.22 1jri s ARG 65 CO 0.00 0.56 0.52 1.28 -0.68 0.00 0.00 175.30 176.98 1jri n LEU 66 N 2.39 0.70 0.00 2.53 4.77 0.62 -4.97 117.00 123.04 1jri n LEU 66 Ca -0.14 -0.70 0.00 0.00 -0.03 0.00 0.00 56.01 55.14 1jri n LEU 66 Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 1jri n LEU 66 CO 0.37 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 1jri n GLY 67 N -0.13 4.07 3.63 -0.72 0.00 -1.16 -4.42 105.19 106.46 1jri n GLY 67 Ca 0.00 0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1jri n GLY 67 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jri s THR 68 N 0.00 4.93 0.05 2.61 2.01 -1.25 0.38 115.64 124.37 1jri s THR 68 Ca 0.00 1.30 0.04 0.00 0.31 0.00 0.00 61.69 63.34 1jri s THR 68 Cb 0.00 -4.00 -0.03 0.00 0.01 0.00 0.00 72.50 68.48 1jri s THR 68 CO 0.00 -0.01 -0.12 0.54 -0.69 0.00 0.00 174.62 174.34 1jri s VAL 69 N 2.63 0.90 -0.29 3.82 0.11 0.21 -4.97 120.40 122.81 1jri s VAL 69 Ca 0.30 -1.15 -0.06 0.00 -2.93 0.00 0.00 61.98 58.13 1jri s VAL 69 Cb -0.15 -0.89 0.01 0.00 -1.53 0.00 0.00 36.38 33.82 1jri s VAL 69 CO 0.08 -0.23 0.07 -0.22 -3.33 0.00 0.00 175.10 171.47 1jri s LEU 70 N -1.54 3.81 -0.12 2.54 2.96 -1.26 -1.00 118.68 124.06 1jri s LEU 70 Ca -0.04 -0.74 -0.04 0.00 -0.22 0.00 0.00 54.13 53.09 1jri s LEU 70 Cb -0.09 -1.86 -0.03 0.00 0.50 0.00 0.00 46.19 44.70 1jri s LEU 70 CO 0.01 -0.19 0.03 -0.63 -1.32 0.00 0.00 176.35 174.25 1jri s ILE 71 N 1.48 4.50 -0.20 6.68 1.01 0.07 -4.95 121.20 129.79 1jri s ILE 71 Ca 0.02 -0.16 -0.27 0.00 0.00 0.00 0.00 60.65 60.24 1jri s ILE 71 Cb -0.17 -2.95 -0.00 0.00 0.01 0.00 0.00 42.46 39.35 1jri s ILE 71 CO 0.02 0.56 0.94 -0.13 0.00 0.00 0.00 174.94 176.33 1jri s ARG 72 N -0.41 4.27 0.57 2.79 0.52 -1.26 -0.68 118.95 124.75 1jri s ARG 72 Ca 0.08 1.19 0.31 0.00 -0.52 0.00 0.00 55.73 56.79 1jri s ARG 72 Cb -0.12 -3.62 1.43 0.00 0.52 0.00 0.00 34.95 33.16 1jri s ARG 72 CO 0.02 -0.50 1.80 0.78 0.02 0.00 0.00 175.30 177.42 1jri h GLY 73 N 8.97 0.00 1.71 -3.53 0.00 -1.73 -0.89 103.07 107.60 1jri h GLY 73 Ca -0.24 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.11 1jri h GLY 73 CO 0.91 0.00 0.13 -1.80 0.00 0.00 0.00 176.54 175.78 1jri h ASP 74 N 0.00 0.00 0.16 0.19 3.58 -1.88 -0.36 116.42 118.11 1jri h ASP 74 Ca 0.36 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.81 1jri h ASP 74 Cb 1.73 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.78 1jri h ASP 74 CO -0.00 0.00 -0.65 0.59 -2.88 0.00 0.00 179.24 176.29 1jri n ASN 75 N -3.27 1.08 -4.70 2.28 3.02 -0.34 -4.94 115.26 108.39 1jri n ASN 75 Ca -0.02 -0.89 -0.42 0.00 -0.03 0.00 0.00 54.58 53.22 1jri n ASN 75 Cb 0.21 0.57 -0.03 0.00 -0.61 0.00 0.00 39.78 39.92 1jri n ASN 75 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1jri s ILE 76 N -2.82 4.61 -0.19 2.41 1.01 -0.15 -0.28 121.20 125.80 1jri s ILE 76 Ca 0.13 1.88 -0.19 0.00 0.00 0.00 0.00 60.65 62.48 1jri s ILE 76 Cb 0.17 -4.21 -0.15 0.00 0.01 0.00 0.00 42.46 38.28 1jri s ILE 76 CO 0.71 0.08 0.15 0.58 0.00 0.00 0.00 174.94 176.46 1jri h VAL 77 N 4.89 0.74 -3.29 2.92 2.07 -0.36 -3.46 116.25 119.76 1jri h VAL 77 Ca -0.37 -1.89 0.00 0.00 0.82 0.00 0.00 66.70 65.27 1jri h VAL 77 Cb 1.19 1.73 -0.08 0.00 -1.52 0.00 0.00 31.29 32.60 1jri h VAL 77 CO 0.82 0.25 0.06 -0.72 0.02 0.00 0.00 177.57 178.00 1jri s TYR 78 N -2.30 0.00 -0.02 1.57 -0.85 -1.05 -5.02 117.35 109.68 1jri s TYR 78 Ca -0.24 -0.39 0.02 0.00 -0.52 0.00 0.00 57.07 55.94 1jri s TYR 78 Cb 0.04 0.46 0.00 0.00 0.38 0.00 0.00 41.96 42.84 1jri s TYR 78 CO 0.50 -1.07 -0.07 0.42 -1.52 0.00 0.00 175.55 173.80 1jri s ILE 79 N -3.94 0.61 -0.00 -3.49 1.01 -1.26 -1.77 121.20 112.36 1jri s ILE 79 Ca 0.14 -0.29 0.04 0.00 0.00 0.00 0.00 60.65 60.53 1jri s ILE 79 Cb -0.03 -0.54 -0.01 0.00 0.01 0.00 0.00 42.46 41.89 1jri s ILE 79 CO 0.05 0.19 -0.11 -0.55 0.00 0.00 0.00 174.94 174.51 1jri s SER 80 N 0.06 1.34 0.00 3.58 0.15 -0.16 -4.93 113.70 113.74 1jri s SER 80 Ca -0.01 -0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.42 1jri s SER 80 Cb -0.06 -0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.11 1jri s SER 80 CO -0.00 0.12 0.24 -2.11 1.20 0.00 0.00 173.24 172.69