#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tbr n GLY 2 N 0.00 0.86 0.59 8.31 0.00 -1.26 -5.06 105.19 108.62 1tbr n GLY 2 Ca 0.00 -0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1tbr n GLY 2 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tbr n GLY 3 N 4.97 -0.25 0.28 -0.02 0.00 -1.26 -4.73 105.19 104.19 1tbr n GLY 3 Ca 0.00 -0.11 0.03 0.00 0.00 0.00 0.00 46.02 45.94 1tbr n GLY 3 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1tbr n GLU 4 N -3.77 -0.09 -0.09 1.61 2.13 -1.26 -0.70 120.64 118.47 1tbr n GLU 4 Ca -0.17 1.19 0.00 0.00 0.66 0.00 0.00 57.16 58.84 1tbr n GLU 4 Cb 0.48 -1.78 0.29 0.00 0.27 0.00 0.00 31.44 30.70 1tbr n GLU 4 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 1tbr h PRO 5 N 0.00 0.72 -0.20 5.31 0.11 -1.97 -2.85 132.00 133.12 1tbr h PRO 5 Ca 0.34 -0.09 0.00 0.00 0.11 0.00 0.00 66.00 66.36 1tbr h PRO 5 Cb 0.54 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.51 1tbr h PRO 5 CO -0.78 0.58 0.00 0.00 -0.21 0.00 0.00 178.00 177.58 1tbr s ALA 7 N -1.76 2.84 0.01 0.00 0.00 -0.18 -4.95 121.76 117.73 1tbr s ALA 7 Ca 0.34 -0.73 0.05 0.00 0.00 0.00 0.00 51.96 51.62 1tbr s ALA 7 Cb 0.21 -4.10 -0.02 0.00 0.00 0.00 0.00 23.12 19.22 1tbr s ALA 7 CO 0.31 -2.89 -0.17 0.00 0.00 0.00 0.00 175.76 173.01 1tbr s PRO 9 N -0.75 4.13 -0.12 0.00 0.02 -1.26 -4.94 135.00 132.07 1tbr s PRO 9 Ca 0.05 1.67 -0.01 0.00 0.02 0.00 0.00 61.00 62.74 1tbr s PRO 9 Cb -0.07 -2.63 0.06 0.00 0.02 0.00 0.00 34.50 31.88 1tbr s PRO 9 CO 0.00 -0.21 2.10 0.72 -0.33 0.00 0.00 177.00 179.28 1tbr n HIS 10 N 0.05 0.58 -4.03 6.54 8.25 -1.26 -4.91 115.22 120.43 1tbr n HIS 10 Ca 0.04 -1.38 -0.25 0.00 -0.26 0.00 0.00 57.72 55.87 1tbr n HIS 10 Cb 0.48 -0.73 -0.04 0.00 1.12 0.00 0.00 29.99 30.82 1tbr n HIS 10 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1tbr s ALA 11 N -0.63 3.73 -0.09 -1.41 0.00 -1.26 -5.10 121.76 117.00 1tbr s ALA 11 Ca 0.15 -1.19 -0.13 0.00 0.00 0.00 0.00 51.96 50.80 1tbr s ALA 11 Cb 0.11 -1.52 -0.05 0.00 0.00 0.00 0.00 23.12 21.66 1tbr s ALA 11 CO -0.01 0.46 0.32 -0.51 0.00 0.00 0.00 175.76 176.02 1tbr s LEU 12 N -3.32 4.36 -0.42 0.00 1.43 -1.26 -4.64 118.68 114.83 1tbr s LEU 12 Ca 0.33 0.69 0.06 0.00 -1.03 0.00 0.00 54.13 54.17 1tbr s LEU 12 Cb -0.10 -2.41 0.32 0.00 0.03 0.00 0.00 46.19 44.03 1tbr s LEU 12 CO 0.26 0.24 1.20 1.57 0.23 0.00 0.00 176.35 179.85 1tbr n HIS 13 N 2.59 -2.21 -1.60 0.29 -0.00 0.95 -4.99 115.22 110.26 1tbr n HIS 13 Ca -0.14 -1.75 -0.41 0.00 0.46 0.00 0.00 57.72 55.88 1tbr n HIS 13 Cb 0.53 1.52 0.01 0.00 -0.12 0.00 0.00 29.99 31.92 1tbr n HIS 13 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 1tbr n ARG 14 N 0.36 1.25 -3.99 1.57 1.74 -1.07 -3.81 116.66 112.72 1tbr n ARG 14 Ca 0.02 0.45 -0.09 0.00 -0.77 0.00 0.00 57.85 57.46 1tbr n ARG 14 Cb 0.72 -1.99 -0.08 0.00 -1.02 0.00 0.00 32.46 30.09 1tbr n ARG 14 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1tbr s VAL 15 N -1.30 0.09 -0.19 1.55 -7.23 -0.88 -1.48 120.40 110.96 1tbr s VAL 15 Ca 0.64 -1.48 -0.03 0.00 -1.81 0.00 0.00 61.98 59.30 1tbr s VAL 15 Cb -0.56 -1.81 -0.01 0.00 0.56 0.00 0.00 36.38 34.56 1tbr s VAL 15 CO 0.56 -0.39 -0.07 0.00 -0.31 0.00 0.00 175.10 174.89 1tbr s GLY 17 N 1.06 1.65 0.55 0.00 0.00 -0.93 -0.36 107.32 109.28 1tbr s GLY 17 Ca 0.00 -1.26 0.35 0.00 0.00 0.00 0.00 44.72 43.81 1tbr s GLY 17 CO -0.01 -1.09 1.80 1.48 0.00 0.00 0.00 173.10 175.29 1tbr h SER 18 N 0.48 0.00 -0.01 1.64 4.64 -0.47 0.16 113.55 119.99 1tbr h SER 18 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1tbr h SER 18 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1tbr h SER 18 CO 0.54 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.60 1tbr n ASP 19 N -4.08 0.17 -0.75 4.97 5.68 -1.26 -4.88 116.55 116.40 1tbr n ASP 19 Ca 0.22 -1.16 -0.06 0.00 -0.50 0.00 0.00 54.79 53.29 1tbr n ASP 19 Cb 1.15 -0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 41.13 1tbr n ASP 19 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1tbr n GLY 20 N 0.97 0.12 3.19 6.12 0.00 0.56 -5.04 105.19 111.11 1tbr n GLY 20 Ca 0.21 -0.61 -0.24 0.00 0.00 0.00 0.00 46.02 45.38 1tbr n GLY 20 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tbr s GLU 21 N -4.35 1.31 0.13 1.61 2.02 -1.25 -4.95 118.70 113.22 1tbr s GLU 21 Ca 0.00 -0.74 -0.28 0.00 0.02 0.00 0.00 54.97 53.97 1tbr s GLU 21 Cb -0.00 -1.33 -0.07 0.00 0.10 0.00 0.00 34.13 32.84 1tbr s GLU 21 CO 0.01 0.35 0.87 0.99 0.02 0.00 0.00 175.26 177.49 1tbr s THR 22 N -0.61 4.45 -0.09 3.63 2.01 -1.26 -2.19 115.64 121.58 1tbr s THR 22 Ca 0.06 1.89 0.02 0.00 0.31 0.00 0.00 61.69 63.97 1tbr s THR 22 Cb -0.08 -4.23 -0.02 0.00 0.01 0.00 0.00 72.50 68.18 1tbr s THR 22 CO 0.00 0.41 -0.15 -0.31 -0.69 0.00 0.00 174.62 173.88 1tbr s TYR 23 N -0.47 2.71 0.54 4.92 2.02 -0.57 -4.98 117.35 121.52 1tbr s TYR 23 Ca 0.41 -0.46 0.30 0.00 -0.37 0.00 0.00 57.07 56.95 1tbr s TYR 23 Cb -0.23 -1.72 1.47 0.00 -0.40 0.00 0.00 41.96 41.07 1tbr s TYR 23 CO 0.28 -0.05 1.91 0.77 -1.57 0.00 0.00 175.55 176.88 1tbr h SER 24 N 6.07 0.00 -5.19 2.29 0.02 -1.88 -2.34 113.55 112.51 1tbr h SER 24 Ca -0.35 0.00 0.25 0.00 -0.84 0.00 0.00 61.79 60.85 1tbr h SER 24 Cb 1.18 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 63.59 1tbr h SER 24 CO 0.52 0.00 0.70 0.54 -1.14 0.00 0.00 176.83 177.46 1tbr s ASN 25 N -5.70 -0.14 0.27 3.07 2.20 -1.25 -0.03 114.94 113.36 1tbr s ASN 25 Ca -0.05 -0.15 0.00 0.00 -0.94 0.00 0.00 52.86 51.72 1tbr s ASN 25 Cb 0.21 0.26 0.54 0.00 -2.00 0.00 0.00 41.25 40.25 1tbr s ASN 25 CO 0.75 -0.46 1.81 -0.65 -2.94 0.00 0.00 177.10 175.61 1tbr h PRO 26 N 2.00 0.85 -0.99 3.55 0.11 -1.87 -1.54 132.00 134.11 1tbr h PRO 26 Ca -0.23 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 65.87 1tbr h PRO 26 Cb 1.21 -0.19 -0.06 0.00 0.11 0.00 0.00 31.00 32.07 1tbr h PRO 26 CO 0.27 0.56 0.65 0.00 -0.21 0.00 0.00 178.00 179.27 1tbr h THR 28 N 1.24 1.23 -0.16 0.00 2.02 -1.65 -0.24 112.91 115.35 1tbr h THR 28 Ca 0.40 -0.81 -0.14 0.00 0.77 0.00 0.00 66.41 66.63 1tbr h THR 28 Cb 0.03 0.61 0.00 0.00 -1.74 0.00 0.00 68.15 67.05 1tbr h THR 28 CO -0.13 0.31 -0.46 0.25 0.37 0.00 0.00 175.52 175.86 1tbr h LEU 29 N 0.86 0.67 -0.29 2.58 6.46 -0.40 -3.07 115.31 122.12 1tbr h LEU 29 Ca 0.19 -0.59 -0.07 0.00 -0.12 0.00 0.00 57.88 57.29 1tbr h LEU 29 Cb 0.28 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 40.00 1tbr h LEU 29 CO -0.01 1.14 -0.08 -1.13 -0.62 0.00 0.00 178.44 177.75 1tbr h ASN 30 N 0.23 0.57 -0.55 1.25 -0.00 -0.63 -2.41 115.58 114.04 1tbr h ASN 30 Ca -0.01 -0.37 0.12 0.00 -0.00 0.00 0.00 56.30 56.04 1tbr h ASN 30 Cb 1.07 -0.16 -0.03 0.00 -0.00 0.00 0.00 38.32 39.21 1tbr h ASN 30 CO 0.10 0.81 0.38 0.00 -0.00 0.00 0.00 177.43 178.72 1tbr h ALA 32 N 1.73 0.30 -0.25 0.00 0.00 -1.38 -3.26 119.26 116.40 1tbr h ALA 32 Ca 0.26 -0.65 0.05 0.00 0.00 0.00 0.00 54.91 54.57 1tbr h ALA 32 Cb 0.77 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 1tbr h ALA 32 CO -0.04 0.72 -0.05 -0.22 0.00 0.00 0.00 179.25 179.65 1tbr h LYS 33 N 0.41 0.01 -1.00 0.00 3.64 -0.68 -0.88 116.57 118.07 1tbr h LYS 33 Ca -0.08 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1tbr h LYS 33 Cb 1.51 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.33 1tbr h LYS 33 CO 0.17 0.01 0.00 1.19 -2.27 0.00 0.00 179.45 178.55 1tbr n PHE 34 N -5.22 0.00 -2.73 1.91 3.72 -0.94 -3.33 117.46 110.87 1tbr n PHE 34 Ca -0.01 -0.21 -0.01 0.00 -0.05 0.00 0.00 57.45 57.16 1tbr n PHE 34 Cb 0.15 -0.16 0.10 0.00 -0.94 0.00 0.00 39.48 38.63 1tbr n PHE 34 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1tbr n ASN 35 N 0.34 -0.47 0.00 4.37 3.02 -0.34 -4.26 115.26 117.92 1tbr n ASN 35 Ca 0.00 -2.16 0.00 0.00 -0.03 0.00 0.00 54.58 52.39 1tbr n ASN 35 Cb 0.31 0.30 0.00 0.00 -0.61 0.00 0.00 39.78 39.79 1tbr n ASN 35 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1tbr n GLY 36 N -1.24 4.22 3.04 7.41 0.00 -1.22 -4.99 105.19 112.42 1tbr n GLY 36 Ca -0.10 -0.77 -0.34 0.00 0.00 0.00 0.00 46.02 44.81 1tbr n GLY 36 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1tbr n LYS 37 N 0.00 2.54 0.00 1.61 5.02 -1.21 -4.89 118.16 121.23 1tbr n LYS 37 Ca 0.00 -4.49 0.07 0.00 -2.02 0.00 0.00 58.31 51.86 1tbr n LYS 37 Cb 0.00 -2.39 0.32 0.00 -0.02 0.00 0.00 35.03 32.95 1tbr n LYS 37 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1tbr n PRO 38 N 2.15 0.13 0.02 1.97 -0.02 -1.22 -1.51 135.00 136.52 1tbr n PRO 38 Ca 0.22 0.19 0.12 0.00 -2.02 0.00 0.00 63.50 62.01 1tbr n PRO 38 Cb 0.37 -1.50 0.18 0.00 -0.02 0.00 0.00 33.50 32.53 1tbr n PRO 38 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1tbr n GLU 39 N -1.35 0.13 -1.78 -0.52 4.07 -1.26 -4.93 120.64 115.00 1tbr n GLU 39 Ca 0.05 0.02 -0.42 0.00 -0.06 0.00 0.00 57.16 56.76 1tbr n GLU 39 Cb 0.12 -1.57 -0.03 0.00 -0.06 0.00 0.00 31.44 29.91 1tbr n GLU 39 CO 0.00 0.00 0.00 -1.17 -0.06 0.00 0.00 177.13 175.90 1tbr s LEU 40 N -3.50 4.36 0.03 4.31 2.96 -0.57 -4.90 118.68 121.38 1tbr s LEU 40 Ca 0.08 2.85 -0.23 0.00 -0.22 0.00 0.00 54.13 56.61 1tbr s LEU 40 Cb 0.16 -3.61 0.05 0.00 0.50 0.00 0.00 46.19 43.29 1tbr s LEU 40 CO 0.73 -0.93 0.52 0.54 -1.32 0.00 0.00 176.35 175.89 1tbr s VAL 41 N 0.83 0.03 0.06 1.68 0.11 -1.26 -4.94 120.40 116.91 1tbr s VAL 41 Ca 0.71 -0.23 -0.30 0.00 -2.93 0.00 0.00 61.98 59.22 1tbr s VAL 41 Cb -0.48 -0.95 -0.05 0.00 -1.53 0.00 0.00 36.38 33.36 1tbr s VAL 41 CO 0.36 -0.13 1.15 -0.75 -3.33 0.00 0.00 175.10 172.41 1tbr s LYS 42 N -2.23 4.47 -0.16 1.54 2.20 -1.26 0.31 119.74 124.60 1tbr s LYS 42 Ca -0.06 1.71 -0.14 0.00 -0.36 0.00 0.00 55.97 57.11 1tbr s LYS 42 Cb -0.01 -3.36 -0.10 0.00 -1.51 0.00 0.00 37.83 32.85 1tbr s LYS 42 CO 0.00 -0.19 0.06 0.28 -0.36 0.00 0.00 175.35 175.14 1tbr h VAL 43 N 4.49 0.48 -3.36 4.02 2.07 -0.98 -3.46 116.25 119.51 1tbr h VAL 43 Ca -0.42 -1.54 -0.02 0.00 0.82 0.00 0.00 66.70 65.55 1tbr h VAL 43 Cb 1.21 1.09 -0.06 0.00 -1.52 0.00 0.00 31.29 32.01 1tbr h VAL 43 CO 0.79 0.16 0.05 -1.38 0.02 0.00 0.00 177.57 177.22 1tbr s HIS 44 N -2.20 0.16 0.68 1.57 0.00 -1.07 -5.02 115.29 109.40 1tbr s HIS 44 Ca -0.19 -0.59 -0.09 0.00 -3.00 0.00 0.00 55.06 51.20 1tbr s HIS 44 Cb 0.03 0.44 0.03 0.00 -4.00 0.00 0.00 32.58 29.08 1tbr s HIS 44 CO 0.37 -1.16 1.02 -0.51 -1.00 0.00 0.00 174.74 173.47 1tbr s ASP 45 N -3.00 5.21 0.02 7.38 1.11 -1.26 -0.10 116.67 126.03 1tbr s ASP 45 Ca 0.18 0.78 0.00 0.00 0.18 0.00 0.00 52.55 53.69 1tbr s ASP 45 Cb -0.03 -1.56 0.00 0.00 1.07 0.00 0.00 42.92 42.40 1tbr s ASP 45 CO 0.09 -1.39 0.00 0.61 1.18 0.00 0.00 175.17 175.66 1tbr n GLY 46 N -2.89 -2.63 3.71 0.21 0.00 -0.55 -4.51 105.19 98.52 1tbr n GLY 46 Ca 0.07 -1.44 -0.32 0.00 0.00 0.00 0.00 46.02 44.33 1tbr n GLY 46 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1tbr s PRO 47 N -3.03 1.56 0.06 1.61 0.04 -1.26 -1.86 135.00 132.13 1tbr s PRO 47 Ca 0.00 1.52 -0.24 0.00 0.04 0.00 0.00 61.00 62.32 1tbr s PRO 47 Cb 0.00 -1.79 -0.16 0.00 0.04 0.00 0.00 34.50 32.59 1tbr s PRO 47 CO 0.00 -2.22 1.61 0.00 0.04 0.00 0.00 177.00 176.43 1tbr s GLU 49 N -5.66 2.55 0.86 0.00 8.01 -1.26 -5.09 118.70 118.11 1tbr s GLU 49 Ca -0.14 -0.79 -0.10 0.00 0.01 0.00 0.00 54.97 53.95 1tbr s GLU 49 Cb 0.05 -2.53 0.11 0.00 -4.31 0.00 0.00 34.13 27.45 1tbr s GLU 49 CO 0.67 0.57 1.12 -2.14 0.01 0.00 0.00 175.26 175.49 1tbr s PRO 50 N -1.94 1.48 0.46 0.39 0.02 -1.26 -5.02 135.00 129.13 1tbr s PRO 50 Ca 0.22 1.39 -0.09 0.00 0.02 0.00 0.00 61.00 62.54 1tbr s PRO 50 Cb -0.11 -1.79 -0.05 0.00 0.02 0.00 0.00 34.50 32.56 1tbr s PRO 50 CO 0.14 -2.26 0.81 -0.51 -0.33 0.00 0.00 177.00 174.85 1tbr s ASP 51 N -2.96 6.40 0.13 2.53 1.01 -1.26 -4.99 116.67 117.53 1tbr s ASP 51 Ca 0.65 1.11 -0.33 0.00 0.71 0.00 0.00 52.55 54.68 1tbr s ASP 51 Cb -0.21 -2.32 -0.13 0.00 1.01 0.00 0.00 42.92 41.28 1tbr s ASP 51 CO 0.57 -0.53 1.68 -0.62 0.21 0.00 0.00 175.17 176.48 1tbr n GLU 52 N -1.83 2.36 -0.92 8.23 -0.58 -1.26 -4.80 120.64 121.84 1tbr n GLU 52 Ca 0.02 0.85 -0.20 0.00 -0.42 0.00 0.00 57.16 57.42 1tbr n GLU 52 Cb 0.54 -2.66 -0.08 0.00 -0.57 0.00 0.00 31.44 28.67 1tbr n GLU 52 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1tbr n ASP 53 N 4.21 5.54 -4.42 1.62 2.03 -1.26 -4.93 116.55 119.34 1tbr n ASP 53 Ca 0.18 -2.37 -0.42 0.00 0.52 0.00 0.00 54.79 52.70 1tbr n ASP 53 Cb 0.31 -1.24 0.00 0.00 -0.72 0.00 0.00 41.12 39.48 1tbr n ASP 53 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1tbr n GLU 54 N 3.20 0.43 -2.68 -0.67 1.02 -1.26 -4.82 120.64 115.86 1tbr n GLU 54 Ca 0.48 0.16 -0.43 0.00 -0.02 0.00 0.00 57.16 57.35 1tbr n GLU 54 Cb 0.47 -1.38 -0.01 0.00 -0.02 0.00 0.00 31.44 30.51 1tbr n GLU 54 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1tbr s ASP 55 N -0.95 6.81 0.18 1.62 2.15 -1.26 -4.80 116.67 120.41 1tbr s ASP 55 Ca 0.62 -2.34 0.25 0.00 0.43 0.00 0.00 52.55 51.51 1tbr s ASP 55 Cb -0.63 -2.52 0.91 0.00 -0.30 0.00 0.00 42.92 40.37 1tbr s ASP 55 CO 0.59 -1.14 1.75 1.33 -0.17 0.00 0.00 175.17 177.54 1tbr n VAL 56 N 6.03 0.62 -0.11 1.11 0.24 -1.26 -3.45 118.33 121.51 1tbr n VAL 56 Ca 0.41 -0.05 0.09 0.00 -2.04 0.00 0.00 64.34 62.75 1tbr n VAL 56 Cb 0.47 -0.79 0.21 0.00 -1.47 0.00 0.00 33.84 32.26 1tbr n VAL 56 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1tbr h GLN 58 N 3.24 0.00 0.00 0.00 3.07 -1.98 0.42 115.11 119.86 1tbr h GLN 58 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1tbr h GLN 58 Cb 0.84 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.40 1tbr h GLN 58 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 178.83 179.85 1tbr h GLU 59 N 0.00 0.00 0.00 0.06 5.08 -1.89 -2.05 114.58 115.78 1tbr h GLU 59 Ca 0.29 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.52 1tbr h GLU 59 Cb 1.63 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.87 1tbr h GLU 59 CO -0.00 0.00 -0.67 0.00 -1.00 0.00 0.00 179.01 177.33 1tbr n ASP 61 N -3.20 0.42 0.00 0.00 9.92 -0.77 -1.39 116.55 121.53 1tbr n ASP 61 Ca 0.00 1.16 0.00 0.00 -0.53 0.00 0.00 54.79 55.42 1tbr n ASP 61 Cb 0.77 -0.94 0.00 0.00 -0.64 0.00 0.00 41.12 40.31 1tbr n ASP 61 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1tbr n GLY 62 N 2.13 2.26 3.65 0.44 0.00 -1.26 -5.02 105.19 107.38 1tbr n GLY 62 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 1tbr n GLY 62 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1tbr n ASP 63 N 0.00 2.02 -4.76 1.61 9.92 -0.48 -4.91 116.55 119.94 1tbr n ASP 63 Ca 0.00 1.14 -0.38 0.00 -0.53 0.00 0.00 54.79 55.02 1tbr n ASP 63 Cb 0.00 -1.41 0.01 0.00 -0.64 0.00 0.00 41.12 39.08 1tbr n ASP 63 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 1tbr s GLU 64 N -1.90 3.59 -0.11 -1.24 2.12 -1.26 -4.93 118.70 114.97 1tbr s GLU 64 Ca 0.59 2.09 -0.29 0.00 0.36 0.00 0.00 54.97 57.71 1tbr s GLU 64 Cb -0.58 -2.47 -0.03 0.00 0.26 0.00 0.00 34.13 31.31 1tbr s GLU 64 CO 0.60 -0.78 1.33 -0.47 -0.54 0.00 0.00 175.26 175.40 1tbr s TYR 65 N -1.36 2.75 -0.43 5.30 5.04 -1.26 -4.72 117.35 122.67 1tbr s TYR 65 Ca 0.64 0.88 0.06 0.00 -2.44 0.00 0.00 57.07 56.21 1tbr s TYR 65 Cb -0.36 -3.58 0.17 0.00 0.35 0.00 0.00 41.96 38.54 1tbr s TYR 65 CO 0.45 -2.08 0.55 0.15 -1.34 0.00 0.00 175.55 173.27 1tbr s LYS 66 N 3.29 0.84 0.50 4.97 1.02 0.14 -5.02 119.74 125.48 1tbr s LYS 66 Ca 0.59 -0.85 -0.23 0.00 0.02 0.00 0.00 55.97 55.49 1tbr s LYS 66 Cb -0.25 -0.36 -0.06 0.00 -0.52 0.00 0.00 37.83 36.64 1tbr s LYS 66 CO 0.19 -1.25 1.39 -0.35 -0.92 0.00 0.00 175.35 174.42 1tbr n PRO 67 N 3.82 1.94 -4.16 -1.68 -0.04 -1.19 -3.40 135.00 130.29 1tbr n PRO 67 Ca 0.15 0.70 -0.16 0.00 -0.04 0.00 0.00 63.50 64.15 1tbr n PRO 67 Cb 0.52 -2.60 -0.12 0.00 -0.04 0.00 0.00 33.50 31.25 1tbr n PRO 67 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1tbr s VAL 68 N -1.24 0.71 -0.22 0.52 -7.23 -0.56 -1.18 120.40 111.19 1tbr s VAL 68 Ca 0.67 -0.92 -0.09 0.00 -1.81 0.00 0.00 61.98 59.83 1tbr s VAL 68 Cb -0.43 -0.70 -0.04 0.00 0.56 0.00 0.00 36.38 35.76 1tbr s VAL 68 CO 0.53 -0.18 0.11 0.00 -0.31 0.00 0.00 175.10 175.25 1tbr s GLY 70 N 0.89 1.93 0.23 0.00 0.00 -0.49 -1.09 107.32 108.80 1tbr s GLY 70 Ca 0.06 -0.51 0.09 0.00 0.00 0.00 0.00 44.72 44.36 1tbr s GLY 70 CO 0.03 -0.39 1.13 -1.14 0.00 0.00 0.00 173.10 172.72 1tbr n SER 71 N -0.80 0.23 -0.55 1.64 3.41 0.47 0.13 113.62 118.15 1tbr n SER 71 Ca -0.01 0.46 0.11 0.00 -0.26 0.00 0.00 58.87 59.17 1tbr n SER 71 Cb 0.54 -0.42 0.38 0.00 -0.26 0.00 0.00 64.21 64.45 1tbr n SER 71 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1tbr n ASP 72 N -1.81 1.65 -3.41 4.04 5.75 -1.26 -4.92 116.55 116.58 1tbr n ASP 72 Ca -0.01 -1.70 -0.19 0.00 -0.01 0.00 0.00 54.79 52.88 1tbr n ASP 72 Cb 0.31 -0.10 0.08 0.00 -1.03 0.00 0.00 41.12 40.38 1tbr n ASP 72 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1tbr n ASP 73 N 0.31 -3.61 -3.95 -1.12 8.00 0.35 -5.02 116.55 111.51 1tbr n ASP 73 Ca 0.16 -0.57 -0.19 0.00 0.71 0.00 0.00 54.79 54.90 1tbr n ASP 73 Cb 0.33 -4.96 -0.16 0.00 -0.02 0.00 0.00 41.12 36.32 1tbr n ASP 73 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1tbr s ILE 74 N -3.33 0.58 0.01 0.53 1.01 -1.24 -4.98 121.20 113.79 1tbr s ILE 74 Ca 0.21 -0.23 -0.20 0.00 0.00 0.00 0.00 60.65 60.43 1tbr s ILE 74 Cb -0.09 -0.55 -0.06 0.00 0.01 0.00 0.00 42.46 41.77 1tbr s ILE 74 CO 0.71 0.20 0.58 -0.89 0.00 0.00 0.00 174.94 175.54 1tbr s THR 75 N 0.38 4.88 0.04 2.92 2.01 -1.26 -1.39 115.64 123.22 1tbr s THR 75 Ca -0.05 1.22 0.08 0.00 0.31 0.00 0.00 61.69 63.25 1tbr s THR 75 Cb -0.09 -3.91 -0.03 0.00 0.01 0.00 0.00 72.50 68.47 1tbr s THR 75 CO 0.00 0.45 -0.22 -0.31 -0.69 0.00 0.00 174.62 173.86 1tbr s TYR 76 N -0.39 2.46 0.30 4.92 2.02 -0.23 -4.97 117.35 121.47 1tbr s TYR 76 Ca 0.30 -0.32 0.36 0.00 -0.37 0.00 0.00 57.07 57.04 1tbr s TYR 76 Cb -0.18 -1.44 1.90 0.00 -0.40 0.00 0.00 41.96 41.84 1tbr s TYR 76 CO 0.17 0.19 2.09 -0.44 -1.57 0.00 0.00 175.55 175.99 1tbr h ASP 77 N 4.71 0.00 -5.87 2.29 3.32 -1.86 -1.50 116.42 117.50 1tbr h ASP 77 Ca -0.47 0.00 0.36 0.00 0.02 0.00 0.00 57.03 56.94 1tbr h ASP 77 Cb 1.15 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.61 1tbr h ASP 77 CO 0.46 0.00 0.92 0.54 -1.72 0.00 0.00 179.24 179.44 1tbr s ASN 78 N -4.79 -0.01 0.14 6.45 2.20 -1.22 0.26 114.94 117.98 1tbr s ASN 78 Ca -0.03 -0.13 -0.13 0.00 -0.94 0.00 0.00 52.86 51.63 1tbr s ASN 78 Cb 0.10 0.10 0.01 0.00 -2.00 0.00 0.00 41.25 39.46 1tbr s ASN 78 CO 0.35 -0.20 1.58 0.78 -2.94 0.00 0.00 177.10 176.67 1tbr h ASN 79 N 2.00 0.83 -1.01 3.54 4.21 -1.88 -2.93 115.58 120.34 1tbr h ASN 79 Ca -0.25 -0.32 0.23 0.00 1.21 0.00 0.00 56.30 57.18 1tbr h ASN 79 Cb 1.19 -0.22 -0.12 0.00 -1.12 0.00 0.00 38.32 38.05 1tbr h ASN 79 CO 0.30 0.95 0.61 0.00 -1.29 0.00 0.00 177.43 178.00 1tbr h ARG 81 N 0.60 0.00 0.33 0.00 2.47 -1.91 -1.69 114.38 114.18 1tbr h ARG 81 Ca 0.62 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 59.32 1tbr h ARG 81 Cb 1.18 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.51 1tbr h ARG 81 CO -0.42 0.63 -0.16 1.25 0.56 0.00 0.00 179.97 181.83 1tbr h LEU 82 N 0.00 -0.37 -1.53 3.04 5.85 -0.29 -1.79 115.31 120.22 1tbr h LEU 82 Ca -0.01 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 1tbr h LEU 82 Cb 1.25 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.36 1tbr h LEU 82 CO 0.08 0.07 0.20 -0.33 -0.34 0.00 0.00 178.44 178.13 1tbr h GLU 83 N -0.95 0.51 0.00 1.25 5.08 -1.03 0.15 114.58 119.59 1tbr h GLU 83 Ca -0.05 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.23 1tbr h GLU 83 Cb 0.51 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 1tbr h GLU 83 CO 0.07 0.38 -0.19 0.00 -1.00 0.00 0.00 179.01 178.28 1tbr h ALA 85 N 1.81 0.65 0.00 0.00 0.00 0.20 -3.28 119.26 118.64 1tbr h ALA 85 Ca -0.00 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1tbr h ALA 85 Cb 0.84 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1tbr h ALA 85 CO 0.02 0.83 0.00 -1.13 0.00 0.00 0.00 179.25 178.98 1tbr n SER 86 N -3.38 0.00 -0.07 0.00 3.41 -0.77 -1.03 113.62 111.78 1tbr n SER 86 Ca 0.01 0.44 0.02 0.00 -0.26 0.00 0.00 58.87 59.07 1tbr n SER 86 Cb 0.75 -0.45 0.03 0.00 -0.26 0.00 0.00 64.21 64.28 1tbr n SER 86 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1tbr n ILE 87 N -1.45 0.87 0.00 -1.33 -5.35 -1.24 -0.46 119.36 110.40 1tbr n ILE 87 Ca 0.01 -0.95 0.00 0.00 -0.27 0.00 0.00 62.75 61.54 1tbr n ILE 87 Cb 0.05 0.45 0.00 0.00 -1.74 0.00 0.00 39.64 38.40 1tbr n ILE 87 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1tbr n SER 88 N -0.54 0.00 -0.30 7.28 3.41 -0.19 -4.95 113.62 118.32 1tbr n SER 88 Ca 0.03 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.74 1tbr n SER 88 Cb 0.43 0.00 0.32 0.00 -0.26 0.00 0.00 64.21 64.70 1tbr n SER 88 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1tbr h SER 89 N 0.00 0.77 -2.18 4.04 4.64 -1.78 -3.28 113.55 115.76 1tbr h SER 89 Ca 0.00 0.04 -0.58 0.00 -0.47 0.00 0.00 61.79 60.78 1tbr h SER 89 Cb 0.00 -0.11 -0.39 0.00 -0.31 0.00 0.00 62.40 61.59 1tbr h SER 89 CO 0.00 0.41 -1.03 -0.24 -0.87 0.00 0.00 176.83 175.10 1tbr n SER 90 N -4.58 0.09 -4.60 4.97 2.88 -0.26 -5.06 113.62 107.07 1tbr n SER 90 Ca 0.17 -2.60 -0.61 0.00 -1.33 0.00 0.00 58.87 54.51 1tbr n SER 90 Cb 0.40 -0.61 -0.09 0.00 -0.75 0.00 0.00 64.21 63.17 1tbr n SER 90 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1tbr n PRO 91 N 1.99 0.54 -0.26 -1.46 -0.02 -1.21 -1.62 135.00 132.97 1tbr n PRO 91 Ca 0.25 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 1tbr n PRO 91 Cb 0.50 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 1tbr n PRO 91 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1tbr n GLY 92 N 5.06 0.93 3.50 -1.23 0.00 0.39 -4.97 105.19 108.87 1tbr n GLY 92 Ca 0.35 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.98 1tbr n GLY 92 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1tbr n VAL 93 N -2.00 2.39 -4.07 1.61 0.24 -0.64 -4.98 118.33 110.88 1tbr n VAL 93 Ca 0.00 -0.50 -0.12 0.00 -2.04 0.00 0.00 64.34 61.68 1tbr n VAL 93 Cb 0.00 -0.77 -0.11 0.00 -1.47 0.00 0.00 33.84 31.48 1tbr n VAL 93 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1tbr s GLU 94 N -2.08 0.54 -0.25 7.34 2.02 -1.26 -4.72 118.70 120.29 1tbr s GLU 94 Ca 0.68 -0.80 -0.29 0.00 0.02 0.00 0.00 54.97 54.58 1tbr s GLU 94 Cb -0.48 -0.25 -0.03 0.00 0.10 0.00 0.00 34.13 33.47 1tbr s GLU 94 CO 0.54 0.04 1.79 -1.17 0.02 0.00 0.00 175.26 176.48 1tbr s LEU 95 N -1.72 3.70 -0.08 1.80 2.96 -1.26 -0.39 118.68 123.69 1tbr s LEU 95 Ca -0.08 1.59 -0.00 0.00 -0.22 0.00 0.00 54.13 55.41 1tbr s LEU 95 Cb -0.08 -3.53 -0.00 0.00 0.50 0.00 0.00 46.19 43.08 1tbr s LEU 95 CO -0.00 -1.52 -0.00 0.50 -1.32 0.00 0.00 176.35 174.00 1tbr h LYS 96 N 12.16 0.00 -3.02 1.98 3.64 -1.40 -3.46 116.57 126.47 1tbr h LYS 96 Ca -0.36 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 58.96 1tbr h LYS 96 Cb 1.18 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 32.84 1tbr h LYS 96 CO 1.00 0.00 -0.02 -3.38 -2.27 0.00 0.00 179.45 174.79 1tbr s HIS 97 N -1.45 -0.33 0.83 1.91 -3.43 -1.12 -5.03 115.29 106.66 1tbr s HIS 97 Ca -0.00 0.24 -0.11 0.00 -0.80 0.00 0.00 55.06 54.38 1tbr s HIS 97 Cb 0.00 0.30 0.09 0.00 -1.43 0.00 0.00 32.58 31.54 1tbr s HIS 97 CO 0.00 -0.66 1.09 -1.21 -2.00 0.00 0.00 174.74 171.97 1tbr s GLU 98 N -2.92 1.79 0.00 -0.38 2.02 -1.26 -0.27 118.70 117.68 1tbr s GLU 98 Ca -0.03 0.99 0.00 0.00 0.02 0.00 0.00 54.97 55.95 1tbr s GLU 98 Cb -0.00 -1.86 0.00 0.00 0.10 0.00 0.00 34.13 32.37 1tbr s GLU 98 CO -0.06 -1.92 0.00 0.41 0.02 0.00 0.00 175.26 173.72 1tbr n GLY 99 N -1.20 -1.65 3.70 -1.39 0.00 -0.33 -4.60 105.19 99.71 1tbr n GLY 99 Ca 0.08 -1.54 -0.31 0.00 0.00 0.00 0.00 46.02 44.25 1tbr n GLY 99 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1tbr s PRO 100 N -1.91 1.29 0.11 1.61 0.02 -1.26 -2.18 135.00 132.68 1tbr s PRO 100 Ca 0.00 1.27 -0.31 0.00 0.02 0.00 0.00 61.00 61.98 1tbr s PRO 100 Cb 0.00 -1.78 -0.07 0.00 0.02 0.00 0.00 34.50 32.67 1tbr s PRO 100 CO 0.00 -2.35 1.27 0.00 -0.33 0.00 0.00 177.00 175.60 1tbr n ARG 102 N 3.66 2.22 0.00 0.00 1.74 -1.26 -5.02 116.66 118.00 1tbr n ARG 102 Ca 0.09 -2.13 0.00 0.00 -0.77 0.00 0.00 57.85 55.04 1tbr n ARG 102 Cb 0.44 -1.98 0.00 0.00 -1.02 0.00 0.00 32.46 29.91 1tbr n ARG 102 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36