#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 4.46 0.87 7.34 -0.21 -1.26 -5.05 119.66 125.81 1jri s GLN 12 Ca 0.00 1.06 -0.12 0.00 0.02 0.00 0.00 55.36 56.33 1jri s GLN 12 Cb 0.00 -3.47 0.11 0.00 1.00 0.00 0.00 33.01 30.66 1jri s GLN 12 CO 0.00 -0.02 1.11 1.03 -2.12 0.00 0.00 175.29 175.28 1jri s ARG 13 N 1.05 1.45 0.16 2.91 1.81 -1.26 -4.83 118.95 120.24 1jri s ARG 13 Ca 0.42 0.53 -0.11 0.00 -1.72 0.00 0.00 55.73 54.86 1jri s ARG 13 Cb -0.19 -1.85 0.17 0.00 -0.45 0.00 0.00 34.95 32.63 1jri s ARG 13 CO 0.20 -2.03 1.03 -2.30 -0.68 0.00 0.00 175.30 171.52 1jri n PRO 14 N -3.70 -0.15 0.00 3.54 -0.02 -1.26 -1.16 135.00 132.26 1jri n PRO 14 Ca 0.07 1.02 0.10 0.00 -2.02 0.00 0.00 63.50 62.67 1jri n PRO 14 Cb 0.57 -1.52 0.59 0.00 -0.02 0.00 0.00 33.50 33.12 1jri n PRO 14 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1jri n LEU 15 N -4.99 0.00 0.04 2.45 4.32 -1.26 -2.84 117.00 114.73 1jri n LEU 15 Ca 0.07 0.11 -0.22 0.00 -0.02 0.00 0.00 56.01 55.96 1jri n LEU 15 Cb 0.27 -0.11 -0.14 0.00 -1.62 0.00 0.00 43.42 41.82 1jri n LEU 15 CO -0.09 -0.04 -0.32 0.44 -1.22 0.00 0.00 177.39 176.16 1jri h ASP 16 N 0.00 0.47 -0.08 -1.43 3.45 -1.47 -2.90 116.42 114.46 1jri h ASP 16 Ca 0.00 -0.89 0.02 0.00 0.43 0.00 0.00 57.03 56.59 1jri h ASP 16 Cb 0.07 -0.15 -0.00 0.00 -0.56 0.00 0.00 39.33 38.69 1jri h ASP 16 CO 0.00 1.60 0.20 0.00 -1.57 0.00 0.00 179.24 179.48 1jri h ALA 17 N 0.02 1.42 0.08 3.45 0.00 -1.60 1.05 119.26 123.68 1jri h ALA 17 Ca -0.27 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.45 1jri h ALA 17 Cb 1.82 0.01 0.02 0.00 0.00 0.00 0.00 17.79 19.63 1jri h ALA 17 CO 0.11 -0.24 -0.77 1.25 0.00 0.00 0.00 179.25 179.60 1jri h LEU 18 N 0.00 0.54 -1.30 0.00 5.85 -1.58 -3.20 115.31 115.62 1jri h LEU 18 Ca 0.04 -0.86 0.13 0.00 0.84 0.00 0.00 57.88 58.02 1jri h LEU 18 Cb 0.44 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 41.24 1jri h LEU 18 CO -0.00 1.34 0.56 1.23 -0.34 0.00 0.00 178.44 181.23 1jri h GLY 19 N -0.19 1.16 0.71 3.75 0.00 0.13 0.02 103.07 108.65 1jri h GLY 19 Ca -0.12 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1jri h GLY 19 CO 0.15 0.13 0.00 0.70 0.00 0.00 0.00 176.54 177.51 1jri n ASN 20 N -4.54 0.00 -0.40 0.19 5.03 -0.21 -2.17 115.26 113.16 1jri n ASN 20 Ca 0.16 -0.79 0.05 0.00 0.87 0.00 0.00 54.58 54.87 1jri n ASN 20 Cb 0.41 0.00 0.05 0.00 -1.02 0.00 0.00 39.78 39.22 1jri n ASN 20 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1jri n SER 21 N -0.86 1.88 -4.67 6.41 7.64 -0.01 -4.95 113.62 119.06 1jri n SER 21 Ca 0.10 -1.45 -0.46 0.00 1.01 0.00 0.00 58.87 58.08 1jri n SER 21 Cb 0.05 -0.02 -0.04 0.00 -1.01 0.00 0.00 64.21 63.19 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 0.53 3.72 0.00 -3.43 4.77 -0.92 -0.33 117.00 121.34 1jri n LEU 22 Ca 0.06 0.92 0.00 0.00 -0.03 0.00 0.00 56.01 56.96 1jri n LEU 22 Cb 0.25 -1.43 0.00 0.00 -2.33 0.00 0.00 43.42 39.91 1jri n LEU 22 CO 0.06 0.03 0.00 0.59 -1.33 0.00 0.00 177.39 176.74 1jri n ASN 23 N 7.17 -2.74 -4.57 -1.43 5.03 0.72 -5.02 115.26 114.43 1jri n ASN 23 Ca 0.22 0.00 -0.26 0.00 0.87 0.00 0.00 54.58 55.41 1jri n ASN 23 Cb 0.34 -0.46 -0.09 0.00 -1.02 0.00 0.00 39.78 38.56 1jri n ASN 23 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 1jri s SER 24 N -2.40 4.22 0.39 6.41 0.01 0.56 -4.86 113.70 118.02 1jri s SER 24 Ca 0.00 -0.65 -0.25 0.00 1.31 0.00 0.00 55.95 56.36 1jri s SER 24 Cb 0.00 -0.69 -0.09 0.00 0.21 0.00 0.00 66.02 65.45 1jri s SER 24 CO 0.00 0.08 1.11 -2.16 0.41 0.00 0.00 173.24 172.67 1jri s PRO 25 N -3.07 4.16 0.25 12.44 0.04 -1.26 -1.78 135.00 145.78 1jri s PRO 25 Ca 0.27 1.68 0.01 0.00 0.04 0.00 0.00 61.00 63.00 1jri s PRO 25 Cb -0.08 -2.66 -0.04 0.00 0.04 0.00 0.00 34.50 31.76 1jri s PRO 25 CO 0.16 -0.19 0.14 0.14 0.04 0.00 0.00 177.00 177.29 1jri s VAL 26 N -1.50 0.23 -0.14 -0.36 -7.23 0.36 -0.10 120.40 111.66 1jri s VAL 26 Ca 0.56 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.73 1jri s VAL 26 Cb -0.27 -2.54 0.02 0.00 0.56 0.00 0.00 36.38 34.15 1jri s VAL 26 CO 0.34 0.00 -0.11 -0.63 -0.31 0.00 0.00 175.10 174.38 1jri s ILE 27 N -3.88 1.36 -0.19 -0.62 1.01 0.13 -2.78 121.20 116.22 1jri s ILE 27 Ca 0.38 -0.53 -0.06 0.00 0.00 0.00 0.00 60.65 60.45 1jri s ILE 27 Cb 0.07 -1.32 -0.03 0.00 0.01 0.00 0.00 42.46 41.18 1jri s ILE 27 CO 0.15 0.40 0.02 -0.63 0.00 0.00 0.00 174.94 174.87 1jri s ILE 28 N 1.57 4.22 -0.24 2.92 -1.09 -0.55 -0.07 121.20 127.96 1jri s ILE 28 Ca 0.05 -0.23 -0.03 0.00 -2.23 0.00 0.00 60.65 58.21 1jri s ILE 28 Cb -0.13 -2.90 0.01 0.00 -1.58 0.00 0.00 42.46 37.86 1jri s ILE 28 CO -0.10 0.44 -0.04 -0.75 -1.23 0.00 0.00 174.94 173.26 1jri s LYS 29 N 0.72 3.11 0.44 2.79 2.47 -0.24 -1.25 119.74 127.79 1jri s LYS 29 Ca 0.01 -0.80 0.02 0.00 -1.56 0.00 0.00 55.97 53.63 1jri s LYS 29 Cb -0.14 -3.02 0.00 0.00 -1.46 0.00 0.00 37.83 33.21 1jri s LYS 29 CO 0.02 -0.31 0.65 -0.51 0.16 0.00 0.00 175.35 175.36 1jri s LEU 30 N 1.41 3.65 0.26 5.43 1.43 -0.32 0.34 118.68 130.88 1jri s LEU 30 Ca 0.03 0.16 -0.29 0.00 -1.03 0.00 0.00 54.13 53.00 1jri s LEU 30 Cb -0.15 -3.05 -0.09 0.00 0.03 0.00 0.00 46.19 42.92 1jri s LEU 30 CO -0.04 -0.72 1.21 -0.54 0.23 0.00 0.00 176.35 176.49 1jri s LYS 31 N -4.52 4.49 0.00 1.70 1.02 -0.21 -2.02 119.74 120.20 1jri s LYS 31 Ca 0.49 1.96 0.00 0.00 0.02 0.00 0.00 55.97 58.44 1jri s LYS 31 Cb -0.10 -3.17 0.00 0.00 -0.52 0.00 0.00 37.83 34.04 1jri s LYS 31 CO 0.37 -0.03 0.00 0.41 -0.92 0.00 0.00 175.35 175.18 1jri n GLY 32 N 1.51 0.78 2.76 -3.33 0.00 -1.26 -4.44 105.19 101.21 1jri n GLY 32 Ca 0.02 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -5.30 -4.77 1.61 8.00 -0.86 -4.98 116.55 110.25 1jri n ASP 33 Ca 0.00 0.01 -0.38 0.00 0.71 0.00 0.00 54.79 55.13 1jri n ASP 33 Cb 0.00 -2.83 -0.02 0.00 -0.02 0.00 0.00 41.12 38.25 1jri n ASP 33 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1jri s ARG 34 N -1.58 4.09 0.10 -1.24 3.52 -1.24 -4.83 118.95 117.77 1jri s ARG 34 Ca 0.00 1.79 0.09 0.00 -0.13 0.00 0.00 55.73 57.47 1jri s ARG 34 Cb 0.00 -2.67 -0.03 0.00 -1.56 0.00 0.00 34.95 30.68 1jri s ARG 34 CO 0.00 -0.27 -0.22 -2.00 -0.81 0.00 0.00 175.30 171.99 1jri s GLU 35 N -2.29 1.24 0.05 5.12 2.12 -1.26 -1.17 118.70 122.51 1jri s GLU 35 Ca 0.57 -1.17 0.00 0.00 0.36 0.00 0.00 54.97 54.73 1jri s GLU 35 Cb -0.29 -1.53 -0.03 0.00 0.26 0.00 0.00 34.13 32.54 1jri s GLU 35 CO 0.37 0.36 -0.05 -0.06 -0.54 0.00 0.00 175.26 175.35 1jri s PHE 36 N -1.08 0.55 0.02 5.30 0.40 -0.38 -0.09 117.98 122.70 1jri s PHE 36 Ca 0.08 -0.77 0.01 0.00 -0.60 0.00 0.00 56.93 55.65 1jri s PHE 36 Cb -0.10 -0.36 -0.02 0.00 0.51 0.00 0.00 43.02 43.05 1jri s PHE 36 CO 0.04 -0.22 -0.04 1.03 0.70 0.00 0.00 175.22 176.73 1jri s ARG 37 N -2.74 0.32 0.00 0.44 1.81 -0.09 -1.48 118.95 117.20 1jri s ARG 37 Ca -0.02 -0.51 0.00 0.00 -1.72 0.00 0.00 55.73 53.48 1jri s ARG 37 Cb -0.01 -0.04 0.00 0.00 -0.45 0.00 0.00 34.95 34.45 1jri s ARG 37 CO -0.04 -0.01 0.00 0.41 -0.68 0.00 0.00 175.30 174.98 1jri n GLY 38 N 1.92 1.33 3.67 -3.53 0.00 -1.12 -0.58 105.19 106.89 1jri n GLY 38 Ca -0.21 -1.01 -0.41 0.00 0.00 0.00 0.00 46.02 44.39 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 -2.00 4.89 -0.03 1.61 1.01 -0.32 -0.49 120.40 125.07 1jri s VAL 39 Ca 0.00 1.59 -0.30 0.00 0.00 0.00 0.00 61.98 63.27 1jri s VAL 39 Cb 0.00 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.21 1jri s VAL 39 CO 0.00 0.02 1.51 -0.22 0.00 0.00 0.00 175.10 176.41 1jri s LEU 40 N 2.20 4.31 -0.18 3.92 2.96 -0.73 -1.08 118.68 130.08 1jri s LEU 40 Ca 0.37 2.16 0.04 0.00 -0.22 0.00 0.00 54.13 56.48 1jri s LEU 40 Cb -0.16 -3.55 -0.14 0.00 0.50 0.00 0.00 46.19 42.84 1jri s LEU 40 CO 0.12 -0.82 -0.12 0.29 -1.32 0.00 0.00 176.35 174.50 1jri n LYS 41 N 6.11 0.73 -3.66 1.98 4.76 0.39 -0.20 118.16 128.27 1jri n LYS 41 Ca 0.15 0.08 -0.08 0.00 -2.87 0.00 0.00 58.31 55.59 1jri n LYS 41 Cb 0.43 -1.38 -0.02 0.00 -1.84 0.00 0.00 35.03 32.22 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 -5.60 -0.36 -0.04 4.39 1.04 -1.22 -4.81 113.70 107.09 1jri s SER 42 Ca -0.21 -0.31 -0.29 0.00 0.48 0.00 0.00 55.95 55.61 1jri s SER 42 Cb 0.06 0.62 0.11 0.00 0.10 0.00 0.00 66.02 66.90 1jri s SER 42 CO 0.47 -1.09 0.89 0.72 0.98 0.00 0.00 173.24 175.22 1jri s PHE 43 N -3.70 -0.39 0.52 5.02 -0.12 -1.26 -1.51 117.98 116.55 1jri s PHE 43 Ca 0.07 0.40 0.01 0.00 -0.05 0.00 0.00 56.93 57.36 1jri s PHE 43 Cb -0.03 0.51 -0.00 0.00 -0.63 0.00 0.00 43.02 42.86 1jri s PHE 43 CO -0.02 -0.51 0.02 0.16 -0.05 0.00 0.00 175.22 174.82 1jri s ASP 44 N -2.02 4.18 0.57 1.98 3.84 -0.85 -4.97 116.67 119.40 1jri s ASP 44 Ca 0.02 -1.67 0.26 0.00 -0.00 0.00 0.00 52.55 51.16 1jri s ASP 44 Cb -0.01 0.63 1.54 0.00 -1.38 0.00 0.00 42.92 43.70 1jri s ASP 44 CO -0.05 -0.91 2.08 -0.07 -0.00 0.00 0.00 175.17 176.22 1jri h LEU 45 N 1.27 0.00 -0.40 2.11 3.38 -2.02 0.32 115.31 119.97 1jri h LEU 45 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1jri h LEU 45 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1jri h LEU 45 CO 0.73 0.00 -0.01 1.41 0.09 0.00 0.00 178.44 180.65 1jri n HIS 46 N -4.03 0.00 -1.11 1.13 8.25 -1.26 -4.89 115.22 113.31 1jri n HIS 46 Ca 0.03 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.45 1jri n HIS 46 Cb 0.37 -0.02 -0.02 0.00 1.12 0.00 0.00 29.99 31.44 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 -0.54 -0.62 -1.92 -0.41 2.81 0.11 -4.13 117.12 112.42 1jri n MET 47 Ca 0.21 0.48 -0.42 0.00 -1.81 0.00 0.00 57.70 56.16 1jri n MET 47 Cb 0.23 -4.17 -0.02 0.00 -0.71 0.00 0.00 33.22 28.54 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 -2.47 6.56 0.12 7.83 0.02 -1.26 -3.57 114.94 122.17 1jri s ASN 48 Ca 0.00 2.72 -0.04 0.00 -1.02 0.00 0.00 52.86 54.52 1jri s ASN 48 Cb 0.00 -2.61 -0.03 0.00 0.02 0.00 0.00 41.25 38.63 1jri s ASN 48 CO 0.00 -0.81 0.11 -1.48 0.02 0.00 0.00 177.10 174.95 1jri s LEU 49 N 0.27 1.64 -0.07 0.60 0.05 0.22 -2.00 118.68 119.40 1jri s LEU 49 Ca 0.65 -1.04 0.05 0.00 0.05 0.00 0.00 54.13 53.85 1jri s LEU 49 Cb -0.44 0.58 -0.01 0.00 -2.05 0.00 0.00 46.19 44.27 1jri s LEU 49 CO 0.39 -0.75 -0.23 -0.69 -0.55 0.00 0.00 176.35 174.51 1jri s VAL 50 N -3.99 1.94 -0.02 1.48 1.01 -0.57 0.10 120.40 120.36 1jri s VAL 50 Ca 0.18 -0.99 0.07 0.00 0.00 0.00 0.00 61.98 61.24 1jri s VAL 50 Cb 0.06 -1.66 -0.02 0.00 0.00 0.00 0.00 36.38 34.77 1jri s VAL 50 CO -0.02 0.54 -0.24 -0.76 0.00 0.00 0.00 175.10 174.62 1jri s LEU 51 N 0.01 2.05 0.09 3.92 1.43 0.26 -0.46 118.68 125.97 1jri s LEU 51 Ca -0.08 -0.44 0.04 0.00 -1.03 0.00 0.00 54.13 52.63 1jri s LEU 51 Cb -0.15 -1.24 -0.04 0.00 0.03 0.00 0.00 46.19 44.79 1jri s LEU 51 CO 0.05 0.29 0.03 0.20 0.23 0.00 0.00 176.35 177.15 1jri s ASN 52 N -0.55 5.23 -1.38 2.29 0.02 -0.24 -0.57 114.94 119.73 1jri s ASN 52 Ca 0.09 -0.11 -0.10 0.00 -1.02 0.00 0.00 52.86 51.72 1jri s ASN 52 Cb -0.09 -1.31 0.02 0.00 0.02 0.00 0.00 41.25 39.89 1jri s ASN 52 CO -0.01 0.17 1.16 0.47 0.02 0.00 0.00 177.10 178.91 1jri n ASP 53 N 0.50 -6.12 -4.78 -1.22 8.00 -0.65 -1.18 116.55 111.11 1jri n ASP 53 Ca -0.10 -0.58 -0.35 0.00 0.71 0.00 0.00 54.79 54.48 1jri n ASP 53 Cb 0.52 -4.87 -0.01 0.00 -0.02 0.00 0.00 41.12 36.74 1jri n ASP 53 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jri s ALA 54 N -3.32 2.74 -0.11 2.24 0.00 0.55 -4.44 121.76 119.42 1jri s ALA 54 Ca 0.59 0.79 -0.06 0.00 0.00 0.00 0.00 51.96 53.29 1jri s ALA 54 Cb -0.27 -3.34 0.05 0.00 0.00 0.00 0.00 23.12 19.56 1jri s ALA 54 CO 0.74 -0.68 0.27 -1.21 0.00 0.00 0.00 175.76 174.88 1jri s GLU 55 N -3.24 0.23 0.14 0.00 2.02 0.25 -1.63 118.70 116.48 1jri s GLU 55 Ca 0.71 0.57 -0.15 0.00 0.02 0.00 0.00 54.97 56.13 1jri s GLU 55 Cb -0.23 -0.11 -0.07 0.00 0.10 0.00 0.00 34.13 33.83 1jri s GLU 55 CO 0.26 -0.17 0.56 -2.00 0.02 0.00 0.00 175.26 173.93 1jri s GLU 56 N 1.31 4.01 0.18 1.61 2.12 -0.39 -0.92 118.70 126.62 1jri s GLU 56 Ca -0.09 0.53 0.08 0.00 0.36 0.00 0.00 54.97 55.85 1jri s GLU 56 Cb -0.10 -2.95 -0.04 0.00 0.26 0.00 0.00 34.13 31.29 1jri s GLU 56 CO -0.09 0.49 -0.07 -0.51 -0.54 0.00 0.00 175.26 174.54 1jri s LEU 57 N -1.89 3.07 -0.48 2.70 1.02 0.87 -1.00 118.68 122.97 1jri s LEU 57 Ca 0.37 -0.52 0.03 0.00 0.02 0.00 0.00 54.13 54.03 1jri s LEU 57 Cb -0.15 -1.75 0.13 0.00 0.02 0.00 0.00 46.19 44.44 1jri s LEU 57 CO 0.19 0.10 0.25 -0.70 0.02 0.00 0.00 176.35 176.22 1jri s GLU 58 N -2.84 1.64 -1.19 1.70 2.56 0.67 -4.00 118.70 117.25 1jri s GLU 58 Ca 0.25 -2.33 -0.28 0.00 0.00 0.00 0.00 54.97 52.61 1jri s GLU 58 Cb -0.09 -2.83 0.02 0.00 2.00 0.00 0.00 34.13 33.23 1jri s GLU 58 CO 0.16 -1.14 0.73 -3.47 -0.56 0.00 0.00 175.26 170.98 1jri n ASP 59 N 3.30 -4.60 -0.61 -1.70 -0.08 -1.26 -1.45 116.55 110.14 1jri n ASP 59 Ca 0.07 -1.17 -0.07 0.00 -1.51 0.00 0.00 54.79 52.11 1jri n ASP 59 Cb 0.33 -2.47 -0.03 0.00 2.34 0.00 0.00 41.12 41.30 1jri n ASP 59 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1jri n GLY 60 N -1.91 0.80 2.81 0.27 0.00 -1.26 -5.02 105.19 100.89 1jri n GLY 60 Ca -0.11 -0.69 -0.25 0.00 0.00 0.00 0.00 46.02 44.97 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 -2.92 0.92 0.04 1.61 2.56 -0.53 -5.11 118.70 115.28 1jri s GLU 61 Ca 0.00 -0.14 -0.35 0.00 0.00 0.00 0.00 54.97 54.48 1jri s GLU 61 Cb 0.00 -1.43 -0.14 0.00 2.00 0.00 0.00 34.13 34.56 1jri s GLU 61 CO 0.00 -0.37 1.67 0.28 -0.56 0.00 0.00 175.26 176.28 1jri n VAL 62 N 5.05 0.22 -0.01 3.70 0.31 -1.26 -0.23 118.33 126.11 1jri n VAL 62 Ca -0.09 -0.04 0.03 0.00 -0.01 0.00 0.00 64.34 64.23 1jri n VAL 62 Cb 0.49 -1.56 -0.06 0.00 -0.91 0.00 0.00 33.84 31.81 1jri n VAL 62 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1jri n THR 63 N 4.00 0.07 -3.64 2.52 5.66 -0.17 -4.85 114.28 117.88 1jri n THR 63 Ca 0.20 -0.19 -0.08 0.00 -3.05 0.00 0.00 64.05 60.93 1jri n THR 63 Cb 0.27 0.16 -0.07 0.00 -1.55 0.00 0.00 70.33 69.14 1jri n THR 63 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 1jri s ARG 64 N -2.47 0.60 -0.30 1.09 3.52 -1.21 -4.97 118.95 115.21 1jri s ARG 64 Ca -0.03 0.88 -0.11 0.00 -0.13 0.00 0.00 55.73 56.34 1jri s ARG 64 Cb 0.04 0.20 -0.04 0.00 -1.56 0.00 0.00 34.95 33.60 1jri s ARG 64 CO 0.31 -0.10 0.20 1.03 -0.81 0.00 0.00 175.30 175.93 1jri s ARG 65 N 0.96 3.83 0.00 5.12 0.52 -1.26 -1.27 118.95 126.85 1jri s ARG 65 Ca -0.04 -0.40 0.18 0.00 -0.52 0.00 0.00 55.73 54.94 1jri s ARG 65 Cb -0.05 -3.70 -0.15 0.00 0.52 0.00 0.00 34.95 31.58 1jri s ARG 65 CO -0.11 -0.25 0.79 1.28 0.02 0.00 0.00 175.30 177.03 1jri n LEU 66 N 5.07 1.05 0.00 2.53 4.77 -0.65 -5.01 117.00 124.76 1jri n LEU 66 Ca -0.14 -0.56 0.00 0.00 -0.03 0.00 0.00 56.01 55.28 1jri n LEU 66 Cb 0.51 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 1jri n LEU 66 CO 0.34 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 1jri n GLY 67 N 1.38 3.05 3.70 -0.72 0.00 -1.23 -4.56 105.19 106.81 1jri n GLY 67 Ca 0.04 -0.19 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 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 5.11 -0.01 2.61 2.01 -1.26 -0.33 115.64 123.77 1jri s THR 68 Ca 0.00 1.12 -0.01 0.00 0.31 0.00 0.00 61.69 63.12 1jri s THR 68 Cb 0.00 -3.90 0.00 0.00 0.01 0.00 0.00 72.50 68.61 1jri s THR 68 CO 0.00 0.25 0.02 0.54 -0.69 0.00 0.00 174.62 174.73 1jri s VAL 69 N 1.05 -0.00 -0.33 3.82 0.11 0.26 -4.98 120.40 120.34 1jri s VAL 69 Ca 0.29 0.01 -0.10 0.00 -2.93 0.00 0.00 61.98 59.25 1jri s VAL 69 Cb -0.16 -0.04 -0.00 0.00 -1.53 0.00 0.00 36.38 34.65 1jri s VAL 69 CO 0.12 0.00 0.18 -0.22 -3.33 0.00 0.00 175.10 171.85 1jri s LEU 70 N 0.06 4.29 -0.29 2.54 2.96 -1.26 -0.57 118.68 126.40 1jri s LEU 70 Ca -0.00 -0.61 -0.09 0.00 -0.22 0.00 0.00 54.13 53.21 1jri s LEU 70 Cb -0.01 -2.03 -0.02 0.00 0.50 0.00 0.00 46.19 44.64 1jri s LEU 70 CO -0.00 -0.24 0.14 -0.63 -1.32 0.00 0.00 176.35 174.30 1jri s ILE 71 N 1.62 4.60 0.09 6.68 1.01 0.28 -4.94 121.20 130.54 1jri s ILE 71 Ca 0.04 -0.32 -0.31 0.00 0.00 0.00 0.00 60.65 60.07 1jri s ILE 71 Cb -0.18 -3.29 -0.09 0.00 0.01 0.00 0.00 42.46 38.92 1jri s ILE 71 CO 0.07 0.14 1.66 -0.13 0.00 0.00 0.00 174.94 176.68 1jri s ARG 72 N 1.63 4.19 0.35 2.79 0.52 -1.26 -0.61 118.95 126.56 1jri s ARG 72 Ca 0.05 2.36 0.08 0.00 -0.52 0.00 0.00 55.73 57.70 1jri s ARG 72 Cb -0.17 -3.55 0.77 0.00 0.52 0.00 0.00 34.95 32.53 1jri s ARG 72 CO 0.06 -0.73 1.87 0.78 0.02 0.00 0.00 175.30 177.31 1jri h GLY 73 N 8.36 1.23 0.50 -3.53 0.00 -1.71 -2.70 103.07 105.21 1jri h GLY 73 Ca -0.43 -0.32 0.18 0.00 0.00 0.00 0.00 47.33 46.77 1jri h GLY 73 CO 0.93 0.12 0.57 -1.80 0.00 0.00 0.00 176.54 176.36 1jri h ASP 74 N 0.74 0.00 0.23 0.19 3.58 -1.89 0.18 116.42 119.45 1jri h ASP 74 Ca 0.44 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.89 1jri h ASP 74 Cb 0.64 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.69 1jri h ASP 74 CO -0.20 0.00 -0.22 0.59 -2.88 0.00 0.00 179.24 176.53 1jri n ASN 75 N -3.91 1.00 -4.78 2.28 3.02 -1.02 -4.92 115.26 106.93 1jri n ASN 75 Ca 0.13 -0.90 -0.37 0.00 -0.03 0.00 0.00 54.58 53.40 1jri n ASN 75 Cb 0.81 0.10 -0.06 0.00 -0.61 0.00 0.00 39.78 40.02 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 -2.46 4.25 -0.12 2.41 1.01 0.64 -1.05 121.20 125.89 1jri s ILE 76 Ca 0.26 1.76 -0.10 0.00 0.00 0.00 0.00 60.65 62.57 1jri s ILE 76 Cb 0.19 -4.00 -0.06 0.00 0.01 0.00 0.00 42.46 38.61 1jri s ILE 76 CO 0.50 0.16 -0.23 0.52 0.00 0.00 0.00 174.94 175.90 1jri n VAL 77 N 0.61 1.22 -3.91 2.92 0.31 0.15 -4.79 118.33 114.84 1jri n VAL 77 Ca 0.01 0.02 -0.09 0.00 -0.01 0.00 0.00 64.34 64.27 1jri n VAL 77 Cb 0.50 -1.93 -0.07 0.00 -0.91 0.00 0.00 33.84 31.43 1jri n VAL 77 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 1jri s TYR 78 N -2.47 0.28 -0.05 3.52 -0.85 -1.13 -5.01 117.35 111.64 1jri s TYR 78 Ca -0.21 -0.66 0.02 0.00 -0.52 0.00 0.00 57.07 55.70 1jri s TYR 78 Cb 0.06 -0.03 0.01 0.00 0.38 0.00 0.00 41.96 42.38 1jri s TYR 78 CO 0.29 -0.68 -0.09 0.42 -1.52 0.00 0.00 175.55 173.97 1jri s ILE 79 N -3.93 0.89 0.20 -3.49 1.01 -1.26 -1.08 121.20 113.55 1jri s ILE 79 Ca 0.13 -0.35 0.07 0.00 0.00 0.00 0.00 60.65 60.50 1jri s ILE 79 Cb 0.04 -0.84 -0.05 0.00 0.01 0.00 0.00 42.46 41.62 1jri s ILE 79 CO -0.04 0.30 -0.12 -0.94 0.00 0.00 0.00 174.94 174.14 1jri s SER 80 N 0.68 2.43 0.55 3.58 1.04 0.89 -4.94 113.70 117.93 1jri s SER 80 Ca -0.12 -1.04 -0.19 0.00 0.48 0.00 0.00 55.95 55.07 1jri s SER 80 Cb -0.14 -0.11 -0.05 0.00 0.10 0.00 0.00 66.02 65.81 1jri s SER 80 CO 0.02 -0.23 1.15 -0.13 0.98 0.00 0.00 173.24 175.04 1jri s ARG 81 N -3.68 3.28 0.55 4.02 0.52 -1.26 0.17 118.95 122.55 1jri s ARG 81 Ca 0.22 1.67 0.07 0.00 -0.52 0.00 0.00 55.73 57.18 1jri s ARG 81 Cb 0.01 -2.00 0.06 0.00 0.52 0.00 0.00 34.95 33.53 1jri s ARG 81 CO 0.06 -0.92 0.58 0.20 0.02 0.00 0.00 175.30 175.24 1jri s GLY 82 N -1.71 2.07 0.00 -3.53 0.00 0.86 -4.52 107.32 100.49 1jri s GLY 82 Ca 0.74 -1.69 0.25 0.00 0.00 0.00 0.00 44.72 44.02 1jri s GLY 82 CO 0.29 -1.81 1.38 0.28 0.00 0.00 0.00 173.10 173.24