#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jri s ASN 10 N 0.00 6.88 0.00 6.55 3.04 -1.26 -4.87 114.94 125.28 1jri s ASN 10 Ca 0.00 2.42 0.07 0.00 0.04 0.00 0.00 52.86 55.39 1jri s ASN 10 Cb 0.00 -2.61 0.41 0.00 -1.54 0.00 0.00 41.25 37.51 1jri s ASN 10 CO 0.00 -0.53 0.81 1.33 -3.04 0.00 0.00 177.10 175.67 1jri n VAL 11 N 2.57 0.00 0.09 -5.21 0.24 -1.26 -1.52 118.33 113.24 1jri n VAL 11 Ca 0.06 0.00 0.02 0.00 -2.04 0.00 0.00 64.34 62.38 1jri n VAL 11 Cb 0.43 -0.73 -0.02 0.00 -1.47 0.00 0.00 33.84 32.05 1jri n VAL 11 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1jri n GLN 12 N -0.87 3.53 -3.47 7.34 6.02 -1.26 -4.83 117.38 123.83 1jri n GLN 12 Ca 0.05 -0.01 -0.32 0.00 -0.01 0.00 0.00 57.00 56.71 1jri n GLN 12 Cb 0.02 -0.83 -0.07 0.00 1.02 0.00 0.00 30.24 30.39 1jri n GLN 12 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1jri n ARG 13 N -1.30 2.78 -0.11 -1.09 1.74 -0.58 -4.92 116.66 113.18 1jri n ARG 13 Ca 0.00 -4.59 0.17 0.00 -0.77 0.00 0.00 57.85 52.66 1jri n ARG 13 Cb 0.06 -2.34 0.56 0.00 -1.02 0.00 0.00 32.46 29.73 1jri n ARG 13 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1jri h PRO 14 N 4.96 0.28 0.00 5.56 0.13 -1.88 -0.68 132.00 140.37 1jri h PRO 14 Ca 0.18 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1jri h PRO 14 Cb 0.70 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.76 1jri h PRO 14 CO 0.91 0.19 0.00 1.28 -0.23 0.00 0.00 178.00 180.15 1jri n LEU 15 N -4.45 0.00 0.23 1.56 4.77 -1.26 -1.42 117.00 116.44 1jri n LEU 15 Ca 0.13 0.27 0.08 0.00 -0.03 0.00 0.00 56.01 56.46 1jri n LEU 15 Cb 0.54 -0.27 0.54 0.00 -2.33 0.00 0.00 43.42 41.90 1jri n LEU 15 CO 0.34 -0.21 0.86 0.44 -1.33 0.00 0.00 177.39 177.49 1jri h ASP 16 N 0.00 0.00 0.11 -1.43 5.19 -1.50 -1.06 116.42 117.74 1jri h ASP 16 Ca 0.00 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 56.37 1jri h ASP 16 Cb 0.06 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.56 1jri h ASP 16 CO 0.00 0.23 -0.15 0.00 -3.12 0.00 0.00 179.24 176.20 1jri h ALA 17 N 1.77 1.64 -0.01 3.45 0.00 -1.44 -1.01 119.26 123.67 1jri h ALA 17 Ca -0.00 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 1jri h ALA 17 Cb 0.50 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1jri h ALA 17 CO 0.03 0.26 -0.54 -0.07 0.00 0.00 0.00 179.25 178.94 1jri h LEU 18 N 0.08 0.04 -0.51 0.00 3.38 -1.39 -3.08 115.31 113.84 1jri h LEU 18 Ca 0.02 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1jri h LEU 18 Cb 0.32 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1jri h LEU 18 CO 0.02 0.57 -0.57 1.23 0.09 0.00 0.00 178.44 179.78 1jri h GLY 19 N 1.57 0.00 0.85 0.83 0.00 -1.12 -2.93 103.07 102.27 1jri h GLY 19 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1jri h GLY 19 CO 0.07 0.00 -0.00 0.70 0.00 0.00 0.00 176.54 177.31 1jri n ASN 20 N -3.48 0.20 -0.32 0.19 3.02 -0.90 -2.94 115.26 111.03 1jri n ASN 20 Ca 0.00 -1.00 0.03 0.00 -0.03 0.00 0.00 54.58 53.58 1jri n ASN 20 Cb 0.66 -0.02 0.07 0.00 -0.61 0.00 0.00 39.78 39.89 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 -0.87 2.35 -4.67 6.41 7.64 -1.11 -5.01 113.62 118.37 1jri n SER 21 Ca 0.22 -1.90 -0.44 0.00 1.01 0.00 0.00 58.87 57.77 1jri n SER 21 Cb 0.15 -0.10 -0.03 0.00 -1.01 0.00 0.00 64.21 63.22 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 0.07 4.00 0.00 -3.43 4.77 -1.15 -2.10 117.00 119.16 1jri n LEU 22 Ca 0.06 0.91 0.00 0.00 -0.03 0.00 0.00 56.01 56.95 1jri n LEU 22 Cb 0.31 -1.49 0.00 0.00 -2.33 0.00 0.00 43.42 39.92 1jri n LEU 22 CO 0.04 0.14 0.00 0.59 -1.33 0.00 0.00 177.39 176.83 1jri n ASN 23 N 7.36 -2.58 -4.29 -1.43 3.02 0.81 -5.02 115.26 113.12 1jri n ASN 23 Ca 0.21 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.60 1jri n ASN 23 Cb 0.38 -0.43 -0.10 0.00 -0.61 0.00 0.00 39.78 39.02 1jri n ASN 23 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1jri s SER 24 N -2.80 1.84 0.34 6.41 1.04 -0.89 -4.87 113.70 114.76 1jri s SER 24 Ca 0.00 -1.12 -0.29 0.00 0.48 0.00 0.00 55.95 55.02 1jri s SER 24 Cb 0.00 -0.00 -0.11 0.00 0.10 0.00 0.00 66.02 66.01 1jri s SER 24 CO 0.00 -0.42 1.41 -2.16 0.98 0.00 0.00 173.24 173.05 1jri s PRO 25 N -3.80 4.23 0.14 4.02 0.04 -1.26 -1.69 135.00 136.68 1jri s PRO 25 Ca 0.23 2.39 0.00 0.00 0.04 0.00 0.00 61.00 63.66 1jri s PRO 25 Cb 0.04 -3.03 -0.04 0.00 0.04 0.00 0.00 34.50 31.51 1jri s PRO 25 CO 0.05 -0.38 0.02 0.14 0.04 0.00 0.00 177.00 176.87 1jri s VAL 26 N -0.93 0.36 -0.15 -0.36 -7.23 -0.23 -2.62 120.40 109.24 1jri s VAL 26 Ca 0.53 -1.93 0.01 0.00 -1.81 0.00 0.00 61.98 58.78 1jri s VAL 26 Cb -0.43 -2.00 0.02 0.00 0.56 0.00 0.00 36.38 34.53 1jri s VAL 26 CO 0.56 -0.55 -0.18 -0.63 -0.31 0.00 0.00 175.10 173.99 1jri s ILE 27 N -3.86 1.84 -0.27 -0.62 1.01 0.31 -3.05 121.20 116.55 1jri s ILE 27 Ca 0.22 -0.82 -0.04 0.00 0.00 0.00 0.00 60.65 60.00 1jri s ILE 27 Cb 0.07 -1.67 0.02 0.00 0.01 0.00 0.00 42.46 40.88 1jri s ILE 27 CO 0.01 0.51 0.01 -0.63 0.00 0.00 0.00 174.94 174.83 1jri s ILE 28 N 1.20 3.38 -0.24 2.92 1.09 -0.07 -1.37 121.20 128.10 1jri s ILE 28 Ca 0.01 -0.90 -0.10 0.00 -1.10 0.00 0.00 60.65 58.56 1jri s ILE 28 Cb -0.14 -2.74 -0.05 0.00 -1.06 0.00 0.00 42.46 38.47 1jri s ILE 28 CO -0.08 0.12 0.14 -0.75 -0.10 0.00 0.00 174.94 174.27 1jri s LYS 29 N 1.40 4.01 0.35 2.79 2.20 -0.66 -0.71 119.74 129.12 1jri s LYS 29 Ca 0.01 -0.30 0.05 0.00 -0.36 0.00 0.00 55.97 55.36 1jri s LYS 29 Cb -0.17 -3.49 -0.01 0.00 -1.51 0.00 0.00 37.83 32.65 1jri s LYS 29 CO -0.01 0.04 0.51 -0.51 -0.36 0.00 0.00 175.35 175.02 1jri s LEU 30 N 1.10 3.92 0.33 5.43 1.43 -0.10 0.39 118.68 131.18 1jri s LEU 30 Ca 0.07 -0.05 -0.29 0.00 -1.03 0.00 0.00 54.13 52.83 1jri s LEU 30 Cb -0.14 -2.86 -0.10 0.00 0.03 0.00 0.00 46.19 43.12 1jri s LEU 30 CO 0.05 -0.47 1.28 -0.54 0.23 0.00 0.00 176.35 176.90 1jri s LYS 31 N -4.25 4.36 0.00 1.70 1.02 0.02 -1.28 119.74 121.30 1jri s LYS 31 Ca 0.45 2.16 0.00 0.00 0.02 0.00 0.00 55.97 58.60 1jri s LYS 31 Cb -0.10 -3.06 0.00 0.00 -0.52 0.00 0.00 37.83 34.16 1jri s LYS 31 CO 0.33 -0.17 0.00 0.41 -0.92 0.00 0.00 175.35 175.00 1jri n GLY 32 N 0.82 0.68 3.15 -3.33 0.00 -1.26 -4.28 105.19 100.98 1jri n GLY 32 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.28 -4.65 1.61 8.00 -0.40 -5.02 116.55 115.80 1jri n ASP 33 Ca 0.00 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 55.15 1jri n ASP 33 Cb 0.00 -0.63 0.11 0.00 -0.02 0.00 0.00 41.12 40.58 1jri n ASP 33 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1jri n ARG 34 N -2.01 0.38 -4.25 -1.24 5.12 -1.24 -4.71 116.66 108.72 1jri n ARG 34 Ca 0.00 0.20 -0.19 0.00 -1.93 0.00 0.00 57.85 55.93 1jri n ARG 34 Cb 0.01 -2.33 -0.15 0.00 -1.16 0.00 0.00 32.46 28.82 1jri n ARG 34 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 1jri s GLU 35 N -3.70 0.73 0.07 5.56 2.12 -1.11 -0.93 118.70 121.45 1jri s GLU 35 Ca 0.74 -0.21 0.10 0.00 0.36 0.00 0.00 54.97 55.95 1jri s GLU 35 Cb -0.32 -0.71 -0.03 0.00 0.26 0.00 0.00 34.13 33.32 1jri s GLU 35 CO 0.50 0.06 -0.25 -0.06 -0.54 0.00 0.00 175.26 174.97 1jri s PHE 36 N 0.28 2.35 -0.02 5.30 0.40 0.11 0.25 117.98 126.65 1jri s PHE 36 Ca -0.04 -0.38 0.01 0.00 -0.60 0.00 0.00 56.93 55.92 1jri s PHE 36 Cb -0.08 -1.35 0.02 0.00 0.51 0.00 0.00 43.02 42.12 1jri s PHE 36 CO 0.00 0.22 -0.01 1.03 0.70 0.00 0.00 175.22 177.16 1jri s ARG 37 N -1.55 0.28 -0.00 0.44 0.52 0.25 -0.90 118.95 117.99 1jri s ARG 37 Ca 0.13 0.02 -0.00 0.00 -0.52 0.00 0.00 55.73 55.36 1jri s ARG 37 Cb -0.10 -0.40 0.00 0.00 0.52 0.00 0.00 34.95 34.97 1jri s ARG 37 CO 0.04 -0.07 0.02 0.41 0.02 0.00 0.00 175.30 175.72 1jri n GLY 38 N 3.79 0.69 3.69 -3.53 0.00 -1.17 -0.38 105.19 108.28 1jri n GLY 38 Ca -0.23 -0.84 -0.37 0.00 0.00 0.00 0.00 46.02 44.58 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 -2.19 5.26 0.05 1.61 1.01 0.57 -1.07 120.40 125.64 1jri s VAL 39 Ca 0.01 0.59 -0.31 0.00 0.00 0.00 0.00 61.98 62.27 1jri s VAL 39 Cb -0.00 -3.67 -0.06 0.00 0.00 0.00 0.00 36.38 32.65 1jri s VAL 39 CO -0.00 0.32 1.31 -0.22 0.00 0.00 0.00 175.10 176.50 1jri s LEU 40 N 0.95 4.35 -0.06 3.92 2.96 -0.68 -0.86 118.68 129.27 1jri s LEU 40 Ca 0.17 2.12 0.01 0.00 -0.22 0.00 0.00 54.13 56.21 1jri s LEU 40 Cb -0.14 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 1jri s LEU 40 CO 0.06 -0.60 -0.04 0.29 -1.32 0.00 0.00 176.35 174.74 1jri n LYS 41 N 4.39 0.68 -3.50 1.98 4.76 -0.66 -0.13 118.16 125.68 1jri n LYS 41 Ca 0.11 0.03 -0.14 0.00 -2.87 0.00 0.00 58.31 55.44 1jri n LYS 41 Cb 0.44 -1.12 -0.04 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 -4.41 -0.55 0.20 4.39 1.04 -1.24 -4.81 113.70 108.32 1jri s SER 42 Ca -0.07 0.36 -0.17 0.00 0.48 0.00 0.00 55.95 56.55 1jri s SER 42 Cb 0.02 0.50 0.02 0.00 0.10 0.00 0.00 66.02 66.67 1jri s SER 42 CO 0.15 -0.68 0.51 0.72 0.98 0.00 0.00 173.24 174.92 1jri s PHE 43 N -2.22 -0.08 0.28 5.02 -0.71 -1.26 -1.19 117.98 117.83 1jri s PHE 43 Ca -0.04 -0.27 0.04 0.00 -1.04 0.00 0.00 56.93 55.62 1jri s PHE 43 Cb -0.01 0.37 -0.06 0.00 -1.21 0.00 0.00 43.02 42.12 1jri s PHE 43 CO -0.01 -0.92 0.02 0.16 -1.34 0.00 0.00 175.22 173.14 1jri s ASP 44 N -2.88 2.20 0.56 1.98 1.47 -0.82 -4.97 116.67 114.21 1jri s ASP 44 Ca 0.10 -1.30 0.39 0.00 1.18 0.00 0.00 52.55 52.92 1jri s ASP 44 Cb -0.01 -0.06 1.53 0.00 -0.34 0.00 0.00 42.92 44.04 1jri s ASP 44 CO -0.02 -0.54 1.70 0.17 0.68 0.00 0.00 175.17 177.16 1jri h LEU 45 N 2.27 0.00 -0.16 2.11 -0.00 -2.01 0.94 115.31 118.45 1jri h LEU 45 Ca -0.40 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.48 1jri h LEU 45 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.90 1jri h LEU 45 CO 0.67 0.00 -0.05 1.41 -0.00 0.00 0.00 178.44 180.47 1jri n HIS 46 N -3.97 0.00 -1.05 0.17 8.25 -1.26 -4.90 115.22 112.46 1jri n HIS 46 Ca 0.29 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.73 1jri n HIS 46 Cb 1.42 -0.16 -0.01 0.00 1.12 0.00 0.00 29.99 32.37 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 -0.98 -0.21 -2.22 -0.41 2.81 0.33 -4.24 117.12 112.20 1jri n MET 47 Ca 0.17 0.39 -0.38 0.00 -1.81 0.00 0.00 57.70 56.08 1jri n MET 47 Cb 0.23 -3.85 -0.01 0.00 -0.71 0.00 0.00 33.22 28.89 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 -2.61 6.25 0.09 7.83 0.01 -1.25 -3.59 114.94 121.68 1jri s ASN 48 Ca 0.00 2.39 -0.10 0.00 -0.71 0.00 0.00 52.86 54.43 1jri s ASN 48 Cb 0.00 -2.61 0.01 0.00 0.41 0.00 0.00 41.25 39.05 1jri s ASN 48 CO 0.00 -0.86 0.23 -1.48 -1.51 0.00 0.00 177.10 173.47 1jri s LEU 49 N -2.80 1.23 -0.09 0.60 0.05 -0.19 -1.94 118.68 115.53 1jri s LEU 49 Ca 0.61 -0.57 0.04 0.00 0.05 0.00 0.00 54.13 54.26 1jri s LEU 49 Cb -0.31 1.18 -0.01 0.00 -2.05 0.00 0.00 46.19 45.00 1jri s LEU 49 CO 0.38 -0.74 -0.22 -0.69 -0.55 0.00 0.00 176.35 174.54 1jri s VAL 50 N -3.75 2.29 0.07 1.48 1.01 -0.33 -0.23 120.40 120.93 1jri s VAL 50 Ca 0.04 -0.96 0.08 0.00 0.00 0.00 0.00 61.98 61.14 1jri s VAL 50 Cb 0.04 -1.88 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 1jri s VAL 50 CO -0.11 0.56 -0.21 -0.76 0.00 0.00 0.00 175.10 174.58 1jri s LEU 51 N 0.09 2.49 0.06 3.92 1.43 0.16 -1.65 118.68 125.18 1jri s LEU 51 Ca -0.10 -0.53 0.03 0.00 -1.03 0.00 0.00 54.13 52.50 1jri s LEU 51 Cb -0.16 -1.43 -0.04 0.00 0.03 0.00 0.00 46.19 44.59 1jri s LEU 51 CO 0.06 0.23 0.04 0.20 0.23 0.00 0.00 176.35 177.11 1jri s ASN 52 N -1.61 5.30 -1.57 2.29 -0.87 -0.04 -0.93 114.94 117.52 1jri s ASN 52 Ca 0.14 -0.05 -0.14 0.00 -1.57 0.00 0.00 52.86 51.25 1jri s ASN 52 Cb -0.10 -1.37 0.10 0.00 -0.02 0.00 0.00 41.25 39.85 1jri s ASN 52 CO 0.06 0.20 0.87 0.47 -2.57 0.00 0.00 177.10 176.13 1jri n ASP 53 N 0.72 -3.83 -4.65 -1.22 8.00 -0.45 -0.31 116.55 114.80 1jri n ASP 53 Ca -0.11 -0.87 -0.30 0.00 0.71 0.00 0.00 54.79 54.22 1jri n ASP 53 Cb 0.52 -3.47 0.17 0.00 -0.02 0.00 0.00 41.12 38.32 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 -3.36 1.06 -0.29 2.24 0.00 0.24 -4.48 121.76 117.16 1jri s ALA 54 Ca 0.61 0.19 -0.14 0.00 0.00 0.00 0.00 51.96 52.62 1jri s ALA 54 Cb -0.32 -3.31 0.10 0.00 0.00 0.00 0.00 23.12 19.59 1jri s ALA 54 CO 0.87 -2.84 0.68 -2.00 0.00 0.00 0.00 175.76 172.47 1jri s GLU 55 N -4.70 0.67 -0.13 0.00 2.12 0.49 -2.87 118.70 114.27 1jri s GLU 55 Ca 0.66 1.30 -0.09 0.00 0.36 0.00 0.00 54.97 57.20 1jri s GLU 55 Cb -0.21 0.38 -0.04 0.00 0.26 0.00 0.00 34.13 34.51 1jri s GLU 55 CO 0.59 -0.17 0.18 -2.00 -0.54 0.00 0.00 175.26 173.33 1jri s GLU 56 N 2.05 3.77 0.22 4.30 2.12 0.15 -0.58 118.70 130.73 1jri s GLU 56 Ca -0.09 -0.07 0.07 0.00 0.36 0.00 0.00 54.97 55.24 1jri s GLU 56 Cb -0.07 -3.28 -0.05 0.00 0.26 0.00 0.00 34.13 30.99 1jri s GLU 56 CO -0.20 0.59 -0.11 -0.51 -0.54 0.00 0.00 175.26 174.49 1jri s LEU 57 N -0.52 2.51 -0.31 2.70 1.02 0.14 -0.43 118.68 123.80 1jri s LEU 57 Ca 0.14 -1.08 -0.00 0.00 0.02 0.00 0.00 54.13 53.21 1jri s LEU 57 Cb -0.12 -0.62 0.14 0.00 0.02 0.00 0.00 46.19 45.60 1jri s LEU 57 CO 0.03 -0.25 0.30 -1.61 0.02 0.00 0.00 176.35 174.84 1jri s GLU 58 N -3.69 0.38 -0.61 1.70 2.02 0.40 -2.74 118.70 116.16 1jri s GLU 58 Ca 0.24 -0.34 -0.02 0.00 0.02 0.00 0.00 54.97 54.87 1jri s GLU 58 Cb 0.01 -0.72 -0.03 0.00 0.10 0.00 0.00 34.13 33.49 1jri s GLU 58 CO 0.08 -1.07 0.52 -0.25 0.02 0.00 0.00 175.26 174.57 1jri n ASP 59 N 5.07 -3.78 0.00 -0.19 9.92 -1.26 -2.86 116.55 123.45 1jri n ASP 59 Ca 0.01 -0.38 0.00 0.00 -0.53 0.00 0.00 54.79 53.89 1jri n ASP 59 Cb 0.45 -3.09 0.00 0.00 -0.64 0.00 0.00 41.12 37.84 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 -1.26 0.99 3.61 0.44 0.00 -1.26 -4.90 105.19 102.80 1jri n GLY 60 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 1jri n GLY 60 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jri s GLU 61 N 0.00 3.94 -0.02 1.61 2.02 -1.13 -5.03 118.70 120.08 1jri s GLU 61 Ca 0.00 0.49 -0.30 0.00 0.02 0.00 0.00 54.97 55.18 1jri s GLU 61 Cb 0.00 -3.73 -0.05 0.00 0.10 0.00 0.00 34.13 30.45 1jri s GLU 61 CO 0.00 -0.65 1.48 0.08 0.02 0.00 0.00 175.26 176.19 1jri s VAL 62 N 2.85 3.66 -0.11 2.63 1.01 -1.26 -0.45 120.40 128.73 1jri s VAL 62 Ca 0.30 0.98 0.20 0.00 0.00 0.00 0.00 61.98 63.46 1jri s VAL 62 Cb -0.14 -3.63 -0.30 0.00 0.00 0.00 0.00 36.38 32.31 1jri s VAL 62 CO 0.12 -0.03 0.47 0.35 0.00 0.00 0.00 175.10 176.01 1jri n THR 63 N 4.94 0.00 -3.61 3.92 -2.24 0.43 -4.94 114.28 112.79 1jri n THR 63 Ca 0.14 -0.41 -0.11 0.00 -2.27 0.00 0.00 64.05 61.40 1jri n THR 63 Cb 0.43 0.14 -0.07 0.00 -2.10 0.00 0.00 70.33 68.73 1jri n THR 63 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1jri s ARG 64 N -3.32 0.64 -0.19 -0.78 3.52 -1.13 -5.00 118.95 112.70 1jri s ARG 64 Ca -0.06 0.55 -0.03 0.00 -0.13 0.00 0.00 55.73 56.05 1jri s ARG 64 Cb 0.13 0.31 -0.02 0.00 -1.56 0.00 0.00 34.95 33.81 1jri s ARG 64 CO 0.82 -0.12 -0.05 1.03 -0.81 0.00 0.00 175.30 176.17 1jri s ARG 65 N -0.16 3.48 -0.01 5.12 3.00 -1.26 0.32 118.95 129.44 1jri s ARG 65 Ca 0.00 -0.60 0.13 0.00 0.00 0.00 0.00 55.73 55.27 1jri s ARG 65 Cb -0.04 -2.94 -0.18 0.00 0.00 0.00 0.00 34.95 31.80 1jri s ARG 65 CO -0.02 -0.00 0.38 1.28 0.00 0.00 0.00 175.30 176.94 1jri n LEU 66 N 4.22 0.22 0.00 2.53 4.32 -1.14 -4.98 117.00 122.18 1jri n LEU 66 Ca -0.18 -0.18 0.00 0.00 -0.02 0.00 0.00 56.01 55.63 1jri n LEU 66 Cb 0.52 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.32 1jri n LEU 66 CO 0.30 0.06 0.00 0.61 -1.22 0.00 0.00 177.39 177.14 1jri n GLY 67 N 1.59 1.91 3.66 -0.72 0.00 -1.23 -4.65 105.19 105.75 1jri n GLY 67 Ca -0.01 -0.15 -0.38 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 5.22 0.04 2.61 2.01 -1.26 0.79 115.64 125.05 1jri s THR 68 Ca 0.00 0.59 0.01 0.00 0.31 0.00 0.00 61.69 62.60 1jri s THR 68 Cb 0.00 -3.68 -0.03 0.00 0.01 0.00 0.00 72.50 68.80 1jri s THR 68 CO 0.00 0.25 -0.06 0.54 -0.69 0.00 0.00 174.62 174.66 1jri s VAL 69 N 1.42 0.44 -0.28 3.82 0.11 -0.11 -4.96 120.40 120.84 1jri s VAL 69 Ca 0.16 -1.17 -0.05 0.00 -2.93 0.00 0.00 61.98 58.00 1jri s VAL 69 Cb -0.15 -0.68 0.02 0.00 -1.53 0.00 0.00 36.38 34.04 1jri s VAL 69 CO 0.08 -0.49 0.04 -0.22 -3.33 0.00 0.00 175.10 171.17 1jri s LEU 70 N -1.77 3.67 -0.17 2.54 2.96 -1.26 -0.66 118.68 123.98 1jri s LEU 70 Ca -0.08 -0.79 -0.05 0.00 -0.22 0.00 0.00 54.13 52.99 1jri s LEU 70 Cb -0.08 -1.81 -0.03 0.00 0.50 0.00 0.00 46.19 44.77 1jri s LEU 70 CO -0.01 -0.18 -0.00 -0.63 -1.32 0.00 0.00 176.35 174.21 1jri s ILE 71 N 1.44 4.15 0.10 6.68 1.01 0.67 -4.96 121.20 130.29 1jri s ILE 71 Ca 0.01 -0.26 -0.30 0.00 0.00 0.00 0.00 60.65 60.10 1jri s ILE 71 Cb -0.17 -2.84 -0.06 0.00 0.01 0.00 0.00 42.46 39.40 1jri s ILE 71 CO 0.00 0.48 1.17 -0.13 0.00 0.00 0.00 174.94 176.45 1jri s ARG 72 N 0.45 4.48 0.62 2.79 0.52 -1.26 -1.03 118.95 125.52 1jri s ARG 72 Ca -0.01 1.75 0.35 0.00 -0.52 0.00 0.00 55.73 57.29 1jri s ARG 72 Cb -0.14 -3.33 1.99 0.00 0.52 0.00 0.00 34.95 34.00 1jri s ARG 72 CO 0.02 -0.16 2.25 0.78 0.02 0.00 0.00 175.30 178.21 1jri h GLY 73 N 6.26 0.00 0.82 -3.53 0.00 -1.73 -2.96 103.07 101.93 1jri h GLY 73 Ca -0.42 0.00 0.10 0.00 0.00 0.00 0.00 47.33 47.00 1jri h GLY 73 CO 0.78 0.00 0.52 -1.80 0.00 0.00 0.00 176.54 176.04 1jri h ASP 74 N 0.00 0.66 0.92 0.19 -0.00 -1.89 -2.23 116.42 114.07 1jri h ASP 74 Ca 0.02 0.02 0.00 0.00 -0.00 0.00 0.00 57.03 57.06 1jri h ASP 74 Cb 0.13 -0.12 0.00 0.00 -0.00 0.00 0.00 39.33 39.34 1jri h ASP 74 CO -0.00 0.39 -0.45 0.59 -0.00 0.00 0.00 179.24 179.77 1jri n ASN 75 N -4.51 0.64 -4.72 2.28 3.02 -1.12 -4.90 115.26 105.95 1jri n ASN 75 Ca 0.13 0.17 -0.42 0.00 -0.03 0.00 0.00 54.58 54.44 1jri n ASN 75 Cb 0.33 -0.04 -0.03 0.00 -0.61 0.00 0.00 39.78 39.43 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 -3.12 3.47 -0.26 2.41 1.01 -0.84 -0.80 121.20 123.07 1jri s ILE 76 Ca 0.08 1.11 -0.13 0.00 0.00 0.00 0.00 60.65 61.71 1jri s ILE 76 Cb 0.14 -3.71 -0.14 0.00 0.01 0.00 0.00 42.46 38.76 1jri s ILE 76 CO 0.68 0.12 -0.25 0.52 0.00 0.00 0.00 174.94 176.01 1jri n VAL 77 N 3.45 1.53 -3.50 2.92 0.31 0.16 -4.84 118.33 118.37 1jri n VAL 77 Ca 0.09 -0.37 -0.11 0.00 -0.01 0.00 0.00 64.34 63.94 1jri n VAL 77 Cb 0.44 -1.84 -0.02 0.00 -0.91 0.00 0.00 33.84 31.50 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 -2.49 -0.46 -0.03 3.52 -0.85 -1.16 -5.03 117.35 110.83 1jri s TYR 78 Ca -0.37 0.22 0.03 0.00 -0.52 0.00 0.00 57.07 56.43 1jri s TYR 78 Cb 0.13 0.58 0.00 0.00 0.38 0.00 0.00 41.96 43.05 1jri s TYR 78 CO 0.52 -0.88 -0.10 0.42 -1.52 0.00 0.00 175.55 173.99 1jri s ILE 79 N -3.72 0.91 0.10 -3.49 1.01 -1.26 -1.65 121.20 113.10 1jri s ILE 79 Ca 0.03 -0.42 -0.01 0.00 0.00 0.00 0.00 60.65 60.25 1jri s ILE 79 Cb -0.02 -0.81 -0.04 0.00 0.01 0.00 0.00 42.46 41.60 1jri s ILE 79 CO -0.09 0.28 0.02 -0.94 0.00 0.00 0.00 174.94 174.20 1jri s SER 80 N 0.23 0.46 0.49 3.58 1.04 -0.47 -4.97 113.70 114.06 1jri s SER 80 Ca -0.04 -1.12 -0.20 0.00 0.48 0.00 0.00 55.95 55.06 1jri s SER 80 Cb -0.10 0.24 -0.08 0.00 0.10 0.00 0.00 66.02 66.18 1jri s SER 80 CO 0.01 -0.66 1.04 -0.13 0.98 0.00 0.00 173.24 174.48 1jri s ARG 81 N -3.99 3.76 0.00 4.02 0.52 -1.26 0.11 118.95 122.12 1jri s ARG 81 Ca 0.17 1.37 0.00 0.00 -0.52 0.00 0.00 55.73 56.76 1jri s ARG 81 Cb 0.07 -2.09 0.00 0.00 0.52 0.00 0.00 34.95 33.46 1jri s ARG 81 CO -0.03 -0.46 0.00 0.41 0.02 0.00 0.00 175.30 175.24 1jri n GLY 82 N -0.25 6.17 6.54 -3.53 0.00 -1.08 -4.60 105.19 108.45 1jri n GLY 82 Ca 0.09 -2.07 0.00 0.00 0.00 0.00 0.00 46.02 44.04 1jri n GLY 82 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1jri n LYS 83 N -0.04 0.00 0.00 1.61 4.81 -1.26 -4.90 118.16 118.38 1jri n LYS 83 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1jri n LYS 83 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 1jri n LYS 83 CO 0.00 0.00 0.00 1.47 1.17 0.00 0.00 177.40 180.04