#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x6d n SER 2 N 0.00 -5.66 -4.21 1.61 2.88 -1.26 -5.03 113.62 101.94 1x6d n SER 2 Ca 0.00 0.84 -0.14 0.00 -1.33 0.00 0.00 58.87 58.24 1x6d n SER 2 Cb 0.00 -3.28 -0.10 0.00 -0.75 0.00 0.00 64.21 60.08 1x6d n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1x6d s SER 3 N -6.40 0.60 0.00 -3.46 1.04 -1.26 -5.17 113.70 99.05 1x6d s SER 3 Ca 0.00 -1.40 0.00 0.00 0.48 0.00 0.00 55.95 55.03 1x6d s SER 3 Cb 0.00 0.31 0.00 0.00 0.10 0.00 0.00 66.02 66.43 1x6d s SER 3 CO 0.00 -0.81 0.00 0.61 0.98 0.00 0.00 173.24 174.02 1x6d n GLY 4 N -0.36 1.76 3.60 7.32 0.00 -1.26 -5.16 105.19 111.09 1x6d n GLY 4 Ca 0.01 -1.91 -0.09 0.00 0.00 0.00 0.00 46.02 44.04 1x6d n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x6d s SER 5 N -1.00 -0.13 0.23 1.61 1.04 -1.26 -5.18 113.70 109.02 1x6d s SER 5 Ca 0.00 -0.83 0.09 0.00 0.48 0.00 0.00 55.95 55.69 1x6d s SER 5 Cb 0.00 0.60 -0.04 0.00 0.10 0.00 0.00 66.02 66.67 1x6d s SER 5 CO 0.00 -1.14 -0.01 -0.55 0.98 0.00 0.00 173.24 172.52 1x6d s SER 6 N -2.98 4.60 0.00 7.02 0.15 -1.26 -4.93 113.70 116.30 1x6d s SER 6 Ca 0.19 -0.57 0.00 0.00 0.70 0.00 0.00 55.95 56.27 1x6d s SER 6 Cb -0.01 -0.89 0.00 0.00 -1.71 0.00 0.00 66.02 63.41 1x6d s SER 6 CO 0.07 0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.15 1x6d n GLY 7 N -0.62 -0.41 3.58 9.45 0.00 -1.26 -5.13 105.19 110.80 1x6d n GLY 7 Ca -0.08 0.17 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1x6d n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x6d s ALA 8 N -1.00 0.42 -0.15 4.61 0.00 -1.26 -5.04 121.76 119.33 1x6d s ALA 8 Ca 0.00 -0.59 -0.00 0.00 0.00 0.00 0.00 51.96 51.37 1x6d s ALA 8 Cb 0.00 -3.04 0.04 0.00 0.00 0.00 0.00 23.12 20.12 1x6d s ALA 8 CO 0.00 -3.44 -0.07 0.99 0.00 0.00 0.00 175.76 173.24 1x6d s THR 9 N -2.84 1.18 -0.15 0.00 2.01 -1.26 -5.10 115.64 109.48 1x6d s THR 9 Ca 0.68 -0.58 -0.03 0.00 0.31 0.00 0.00 61.69 62.07 1x6d s THR 9 Cb -0.16 -1.28 0.05 0.00 0.01 0.00 0.00 72.50 71.12 1x6d s THR 9 CO 0.58 0.23 0.05 -0.76 -0.69 0.00 0.00 174.62 174.03 1x6d s LEU 10 N 1.62 0.70 -0.12 4.42 1.43 -1.26 -5.12 118.68 120.35 1x6d s LEU 10 Ca 0.02 -0.56 0.01 0.00 -1.03 0.00 0.00 54.13 52.57 1x6d s LEU 10 Cb -0.14 -0.41 0.02 0.00 0.03 0.00 0.00 46.19 45.69 1x6d s LEU 10 CO -0.08 -0.30 -0.14 -0.54 0.23 0.00 0.00 176.35 175.52 1x6d s LYS 11 N 2.00 2.11 0.04 1.70 3.01 -1.26 -5.13 119.74 122.22 1x6d s LYS 11 Ca 0.01 -0.50 0.06 0.00 -1.01 0.00 0.00 55.97 54.53 1x6d s LYS 11 Cb -0.16 -1.88 -0.02 0.00 -1.01 0.00 0.00 37.83 34.76 1x6d s LYS 11 CO -0.08 -0.14 -0.17 -1.14 0.51 0.00 0.00 175.35 174.34 1x6d s GLN 12 N 1.23 1.11 1.08 1.68 0.74 -1.26 -5.15 119.66 119.10 1x6d s GLN 12 Ca -0.02 -0.83 -0.17 0.00 0.05 0.00 0.00 55.36 54.39 1x6d s GLN 12 Cb -0.14 -1.17 0.24 0.00 1.10 0.00 0.00 33.01 33.04 1x6d s GLN 12 CO -0.05 0.29 1.21 -0.51 -0.55 0.00 0.00 175.29 175.69 1x6d s LEU 13 N -1.15 1.71 -0.94 3.68 2.01 -1.26 -4.96 118.68 117.78 1x6d s LEU 13 Ca 0.04 0.46 -0.17 0.00 0.01 0.00 0.00 54.13 54.48 1x6d s LEU 13 Cb -0.08 -2.36 0.17 0.00 0.01 0.00 0.00 46.19 43.92 1x6d s LEU 13 CO 0.01 -3.40 1.06 -1.81 1.01 0.00 0.00 176.35 173.22 1x6d s ASP 14 N -4.38 6.74 -1.25 2.29 1.11 -1.26 -4.50 116.67 115.41 1x6d s ASP 14 Ca 0.72 -2.38 -0.11 0.00 0.18 0.00 0.00 52.55 50.96 1x6d s ASP 14 Cb -0.07 -2.34 -0.00 0.00 1.07 0.00 0.00 42.92 41.58 1x6d s ASP 14 CO 0.54 -0.87 0.65 0.61 1.18 0.00 0.00 175.17 177.29 1x6d n GLY 15 N 4.83 -0.64 3.17 0.21 0.00 -1.26 -4.96 105.19 106.54 1x6d n GLY 15 Ca 0.22 0.31 -0.33 0.00 0.00 0.00 0.00 46.02 46.22 1x6d n GLY 15 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x6d s ILE 16 N -3.66 2.28 -0.10 -0.61 -1.09 -1.26 -3.91 121.20 112.84 1x6d s ILE 16 Ca 0.26 -0.88 0.02 0.00 -2.23 0.00 0.00 60.65 57.81 1x6d s ILE 16 Cb -0.09 -1.96 0.02 0.00 -1.58 0.00 0.00 42.46 38.85 1x6d s ILE 16 CO 0.87 0.53 -0.14 -2.28 -1.23 0.00 0.00 174.94 172.69 1x6d s HIS 17 N 1.14 1.80 0.41 3.97 5.65 -1.00 -4.88 115.29 122.38 1x6d s HIS 17 Ca 0.01 -0.82 -0.18 0.00 0.25 0.00 0.00 55.06 54.32 1x6d s HIS 17 Cb -0.14 -1.32 -0.10 0.00 -1.18 0.00 0.00 32.58 29.84 1x6d s HIS 17 CO -0.08 -0.44 0.88 0.54 -0.65 0.00 0.00 174.74 175.00 1x6d s VAL 18 N 1.00 4.52 -0.21 0.89 0.11 -1.26 -3.68 120.40 121.77 1x6d s VAL 18 Ca -0.07 1.23 -0.02 0.00 -2.93 0.00 0.00 61.98 60.19 1x6d s VAL 18 Cb -0.15 -3.63 0.06 0.00 -1.53 0.00 0.00 36.38 31.14 1x6d s VAL 18 CO -0.01 -0.35 0.03 -0.89 -3.33 0.00 0.00 175.10 170.55 1x6d s THR 19 N -2.20 0.70 -0.47 5.04 2.01 -1.16 -5.03 115.64 114.53 1x6d s THR 19 Ca 0.59 -0.73 -0.23 0.00 0.31 0.00 0.00 61.69 61.62 1x6d s THR 19 Cb -0.10 -1.20 0.03 0.00 0.01 0.00 0.00 72.50 71.24 1x6d s THR 19 CO 0.18 -0.23 0.81 -0.63 -0.69 0.00 0.00 174.62 174.06 1x6d s ILE 20 N 1.77 4.61 -0.22 1.82 -1.09 -1.26 -3.54 121.20 123.29 1x6d s ILE 20 Ca -0.01 0.38 -0.17 0.00 -2.23 0.00 0.00 60.65 58.63 1x6d s ILE 20 Cb -0.17 -4.36 -0.03 0.00 -1.58 0.00 0.00 42.46 36.31 1x6d s ILE 20 CO -0.09 -0.78 0.46 -0.76 -1.23 0.00 0.00 174.94 172.53 1x6d s LEU 21 N 3.38 4.12 -0.46 2.97 1.02 -0.81 -4.95 118.68 123.95 1x6d s LEU 21 Ca 0.30 0.54 -0.15 0.00 0.02 0.00 0.00 54.13 54.84 1x6d s LEU 21 Cb -0.12 -2.59 0.07 0.00 0.02 0.00 0.00 46.19 43.56 1x6d s LEU 21 CO 0.22 -0.16 0.37 -1.00 0.02 0.00 0.00 176.35 175.79 1x6d s HIS 22 N 1.70 3.26 0.24 0.29 3.76 -1.26 -2.23 115.29 121.05 1x6d s HIS 22 Ca 0.21 -0.99 0.01 0.00 -0.15 0.00 0.00 55.06 54.13 1x6d s HIS 22 Cb -0.15 -3.10 -0.05 0.00 1.11 0.00 0.00 32.58 30.39 1x6d s HIS 22 CO 0.09 -0.79 0.11 -1.59 -0.85 0.00 0.00 174.74 171.71 1x6d s LYS 23 N 1.61 1.36 0.65 1.40 0.00 0.21 -5.03 119.74 119.95 1x6d s LYS 23 Ca 0.04 -1.74 -0.05 0.00 0.00 0.00 0.00 55.97 54.22 1x6d s LYS 23 Cb -0.24 -0.08 0.04 0.00 0.00 0.00 0.00 37.83 37.56 1x6d s LYS 23 CO 0.06 -0.34 0.95 -1.21 0.00 0.00 0.00 175.35 174.81 1x6d s GLU 24 N -4.05 2.45 -0.46 1.78 2.02 -1.26 -4.04 118.70 115.14 1x6d s GLU 24 Ca 0.38 -0.25 -0.27 0.00 0.02 0.00 0.00 54.97 54.85 1x6d s GLU 24 Cb 0.07 -2.24 -0.08 0.00 0.10 0.00 0.00 34.13 31.99 1x6d s GLU 24 CO 0.14 -1.01 2.39 0.39 0.02 0.00 0.00 175.26 177.18 1x6d n GLU 25 N -2.75 1.18 -1.14 1.61 1.02 -1.26 0.16 120.64 119.46 1x6d n GLU 25 Ca 0.07 0.12 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 1x6d n GLU 25 Cb 0.60 -3.26 0.00 0.00 -0.02 0.00 0.00 31.44 28.75 1x6d n GLU 25 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1x6d n GLY 26 N 6.01 0.73 0.09 0.62 0.00 -0.16 -4.96 105.19 107.52 1x6d n GLY 26 Ca 0.37 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 1x6d n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x6d h ALA 27 N 0.00 0.21 0.00 4.61 0.00 -0.39 -3.50 119.26 120.19 1x6d h ALA 27 Ca 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 54.91 54.03 1x6d h ALA 27 Cb 0.43 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1x6d h ALA 27 CO 0.00 1.05 0.00 0.41 0.00 0.00 0.00 179.25 180.71 1x6d n GLY 28 N 1.42 0.80 0.13 0.00 0.00 -1.26 -4.88 105.19 101.39 1x6d n GLY 28 Ca -0.05 -1.85 -0.23 0.00 0.00 0.00 0.00 46.02 43.88 1x6d n GLY 28 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x6d n LEU 29 N -0.52 2.27 0.00 0.99 4.77 -1.26 -4.82 117.00 118.42 1x6d n LEU 29 Ca 0.00 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 1x6d n LEU 29 Cb 0.00 -0.97 0.00 0.00 -2.33 0.00 0.00 43.42 40.12 1x6d n LEU 29 CO 0.00 0.60 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 1x6d n GLY 30 N 1.68 1.30 3.34 -0.72 0.00 -1.26 -0.71 105.19 108.81 1x6d n GLY 30 Ca -0.39 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.46 1x6d n GLY 30 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1x6d s PHE 31 N -1.95 1.61 0.39 1.61 -0.71 -1.26 0.37 117.98 118.04 1x6d s PHE 31 Ca 0.00 -0.98 0.08 0.00 -1.04 0.00 0.00 56.93 54.99 1x6d s PHE 31 Cb 0.00 -0.96 -0.07 0.00 -1.21 0.00 0.00 43.02 40.78 1x6d s PHE 31 CO 0.00 -0.09 0.01 0.45 -1.34 0.00 0.00 175.22 174.25 1x6d s SER 32 N -3.33 3.94 0.26 1.98 0.15 -0.12 -4.98 113.70 111.60 1x6d s SER 32 Ca 0.31 -1.27 0.03 0.00 0.70 0.00 0.00 55.95 55.72 1x6d s SER 32 Cb 0.07 -0.41 -0.03 0.00 -1.71 0.00 0.00 66.02 63.93 1x6d s SER 32 CO 0.10 -0.39 0.42 -0.76 1.20 0.00 0.00 173.24 173.81 1x6d s LEU 33 N -3.71 4.22 -0.04 3.45 1.43 -1.26 -1.48 118.68 121.28 1x6d s LEU 33 Ca 0.35 0.23 -0.09 0.00 -1.03 0.00 0.00 54.13 53.59 1x6d s LEU 33 Cb 0.07 -3.04 0.01 0.00 0.03 0.00 0.00 46.19 43.27 1x6d s LEU 33 CO 0.18 -0.13 0.21 0.00 0.23 0.00 0.00 176.35 176.85 1x6d s ALA 34 N -2.06 -0.53 0.00 4.21 0.00 0.50 -4.14 121.76 119.74 1x6d s ALA 34 Ca 0.36 0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.62 1x6d s ALA 34 Cb -0.10 -0.11 0.00 0.00 0.00 0.00 0.00 23.12 22.92 1x6d s ALA 34 CO 0.31 -0.18 0.00 0.41 0.00 0.00 0.00 175.76 176.30 1x6d n GLY 35 N 2.06 -2.65 0.00 0.00 0.00 -1.26 0.20 105.19 103.54 1x6d n GLY 35 Ca -0.18 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.08 1x6d n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x6d n GLY 36 N -0.31 -2.80 0.15 -0.02 0.00 0.46 -4.36 105.19 98.31 1x6d n GLY 36 Ca 0.00 -1.35 0.06 0.00 0.00 0.00 0.00 46.02 44.73 1x6d n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x6d h ALA 37 N 0.00 0.74 0.00 4.61 0.00 -1.52 -2.98 119.26 120.10 1x6d h ALA 37 Ca 0.00 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1x6d h ALA 37 Cb 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1x6d h ALA 37 CO 0.00 0.41 -0.07 0.22 0.00 0.00 0.00 179.25 179.81 1x6d h ASP 38 N 0.00 0.00 0.00 0.00 1.82 -1.87 -3.44 116.42 112.93 1x6d h ASP 38 Ca -0.03 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.61 1x6d h ASP 38 Cb 1.25 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.26 1x6d h ASP 38 CO 0.03 0.07 0.00 0.18 -1.61 0.00 0.00 179.24 177.91 1x6d n LEU 39 N -3.17 0.00 -0.09 2.28 7.99 -1.18 -5.01 117.00 117.81 1x6d n LEU 39 Ca 0.01 0.00 -0.12 0.00 -0.01 0.00 0.00 56.01 55.89 1x6d n LEU 39 Cb 0.38 0.00 -0.15 0.00 -0.11 0.00 0.00 43.42 43.55 1x6d n LEU 39 CO 0.30 0.00 -1.08 -0.62 -1.51 0.00 0.00 177.39 174.48 1x6d n GLU 40 N 0.00 0.68 -2.63 3.23 -0.58 -1.26 -4.74 120.64 115.33 1x6d n GLU 40 Ca 0.00 0.09 -0.42 0.00 -0.42 0.00 0.00 57.16 56.42 1x6d n GLU 40 Cb 0.00 -1.57 -0.03 0.00 -0.57 0.00 0.00 31.44 29.27 1x6d n GLU 40 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 1x6d s ASN 41 N -5.91 6.46 0.21 1.62 0.01 -1.25 -4.83 114.94 111.25 1x6d s ASN 41 Ca -0.16 -1.39 -0.09 0.00 -0.71 0.00 0.00 52.86 50.50 1x6d s ASN 41 Cb 0.07 -2.53 0.25 0.00 0.41 0.00 0.00 41.25 39.45 1x6d s ASN 41 CO 0.77 -1.48 1.78 0.11 -1.51 0.00 0.00 177.10 176.77 1x6d h LYS 42 N 9.67 0.54 -6.29 -0.60 1.79 -1.82 1.34 116.57 121.20 1x6d h LYS 42 Ca 0.11 -0.03 -0.54 0.00 -2.18 0.00 0.00 60.65 58.00 1x6d h LYS 42 Cb 1.02 -0.12 -0.04 0.00 -1.58 0.00 0.00 32.23 31.51 1x6d h LYS 42 CO 1.35 0.35 0.20 0.54 -1.08 0.00 0.00 179.45 180.82 1x6d s VAL 43 N -6.09 4.80 0.28 0.50 0.11 -1.26 -4.08 120.40 114.67 1x6d s VAL 43 Ca -0.13 1.71 -0.28 0.00 -2.93 0.00 0.00 61.98 60.35 1x6d s VAL 43 Cb 0.16 -4.16 -0.09 0.00 -1.53 0.00 0.00 36.38 30.76 1x6d s VAL 43 CO 0.75 0.30 0.97 -0.63 -3.33 0.00 0.00 175.10 173.15 1x6d s ILE 44 N 0.34 4.03 0.35 7.04 1.09 -1.26 -4.38 121.20 128.42 1x6d s ILE 44 Ca 0.42 1.88 0.04 0.00 -1.10 0.00 0.00 60.65 61.88 1x6d s ILE 44 Cb -0.20 -4.13 -0.06 0.00 -1.06 0.00 0.00 42.46 37.01 1x6d s ILE 44 CO 0.23 0.32 0.06 0.42 -0.10 0.00 0.00 174.94 175.88 1x6d s THR 45 N -1.36 1.16 -0.68 2.92 -4.23 0.53 -1.47 115.64 112.51 1x6d s THR 45 Ca 0.46 -2.00 -0.27 0.00 -1.18 0.00 0.00 61.69 58.70 1x6d s THR 45 Cb -0.24 -2.71 0.02 0.00 1.34 0.00 0.00 72.50 70.91 1x6d s THR 45 CO 0.30 0.00 1.43 -0.69 -0.54 0.00 0.00 174.62 175.12 1x6d s VAL 46 N -3.22 3.66 0.08 2.29 1.01 -1.03 0.19 120.40 123.38 1x6d s VAL 46 Ca 0.33 0.42 -0.32 0.00 0.00 0.00 0.00 61.98 62.40 1x6d s VAL 46 Cb 0.08 -4.62 -0.16 0.00 0.00 0.00 0.00 36.38 31.68 1x6d s VAL 46 CO 0.15 -1.53 1.50 -0.74 0.00 0.00 0.00 175.10 174.48 1x6d h HIS 47 N 11.27 -1.27 -3.53 5.22 2.76 -1.42 0.14 115.15 128.32 1x6d h HIS 47 Ca -0.27 0.01 -0.09 0.00 -2.20 0.00 0.00 60.37 57.82 1x6d h HIS 47 Cb 1.08 0.49 -0.15 0.00 1.55 0.00 0.00 27.41 30.38 1x6d h HIS 47 CO 1.09 -0.61 -0.28 1.03 -1.30 0.00 0.00 177.93 177.86 1x6d s ARG 48 N -5.56 0.85 -0.39 5.26 3.00 -1.25 -4.54 118.95 116.32 1x6d s ARG 48 Ca -0.16 -0.71 0.02 0.00 0.00 0.00 0.00 55.73 54.88 1x6d s ARG 48 Cb 0.04 0.36 0.11 0.00 0.00 0.00 0.00 34.95 35.46 1x6d s ARG 48 CO 0.54 -0.28 0.14 0.08 0.00 0.00 0.00 175.30 175.78 1x6d s VAL 49 N -3.21 1.74 0.64 3.52 1.01 -1.26 -0.95 120.40 121.89 1x6d s VAL 49 Ca -0.00 -2.31 -0.16 0.00 0.00 0.00 0.00 61.98 59.51 1x6d s VAL 49 Cb 0.02 -2.26 -0.13 0.00 0.00 0.00 0.00 36.38 34.00 1x6d s VAL 49 CO -0.07 -0.73 -0.38 0.49 0.00 0.00 0.00 175.10 174.41 1x6d n PHE 50 N 4.05 -3.47 0.09 5.22 3.72 0.16 -4.86 117.46 122.36 1x6d n PHE 50 Ca 0.04 0.21 -0.07 0.00 -0.05 0.00 0.00 57.45 57.58 1x6d n PHE 50 Cb 0.38 -1.39 0.03 0.00 -0.94 0.00 0.00 39.48 37.56 1x6d n PHE 50 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1x6d h PRO 51 N -0.39 0.18 -3.39 -1.08 0.13 -2.00 -3.38 132.00 122.08 1x6d h PRO 51 Ca -0.37 -0.17 -0.67 0.00 -0.87 0.00 0.00 66.00 63.91 1x6d h PRO 51 Cb 1.22 0.05 -0.38 0.00 0.13 0.00 0.00 31.00 32.02 1x6d h PRO 51 CO 0.30 0.89 -0.41 -0.80 -0.23 0.00 0.00 178.00 177.74 1x6d s ASN 52 N -6.90 5.07 0.01 1.44 0.01 -1.26 -4.89 114.94 108.41 1x6d s ASN 52 Ca -0.03 -3.24 -0.00 0.00 -0.71 0.00 0.00 52.86 48.88 1x6d s ASN 52 Cb 0.11 -1.77 0.00 0.00 0.41 0.00 0.00 41.25 39.99 1x6d s ASN 52 CO 0.82 -0.25 0.01 0.61 -1.51 0.00 0.00 177.10 176.78 1x6d n GLY 53 N 2.89 2.33 0.13 0.66 0.00 -1.26 -4.95 105.19 104.99 1x6d n GLY 53 Ca 0.12 -1.13 -0.23 0.00 0.00 0.00 0.00 46.02 44.77 1x6d n GLY 53 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x6d n LEU 54 N 0.00 2.29 -0.26 0.99 4.77 -0.16 -3.21 117.00 121.42 1x6d n LEU 54 Ca -0.00 0.23 0.06 0.00 -0.03 0.00 0.00 56.01 56.27 1x6d n LEU 54 Cb 0.01 -0.94 0.20 0.00 -2.33 0.00 0.00 43.42 40.37 1x6d n LEU 54 CO 0.01 0.63 1.01 0.00 -1.33 0.00 0.00 177.39 177.71 1x6d h ALA 55 N -0.43 1.10 -0.22 -1.18 0.00 -1.24 0.34 119.26 117.62 1x6d h ALA 55 Ca -0.53 0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 1x6d h ALA 55 Cb 1.68 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.58 1x6d h ALA 55 CO -0.19 -0.24 -0.21 1.03 0.00 0.00 0.00 179.25 179.63 1x6d h SER 56 N 0.41 0.57 -0.46 0.00 0.87 -1.78 -2.67 113.55 110.49 1x6d h SER 56 Ca 0.44 -0.47 0.08 0.00 -1.23 0.00 0.00 61.79 60.61 1x6d h SER 56 Cb 0.70 -0.16 -0.07 0.00 -0.44 0.00 0.00 62.40 62.43 1x6d h SER 56 CO -0.44 0.92 0.04 1.56 -0.53 0.00 0.00 176.83 178.39 1x6d h GLN 57 N 0.22 0.16 -1.00 2.24 1.08 -0.96 -0.35 115.11 116.50 1x6d h GLN 57 Ca 0.04 -0.01 0.04 0.00 -1.45 0.00 0.00 58.65 57.27 1x6d h GLN 57 Cb 0.76 -0.04 -0.06 0.00 -0.05 0.00 0.00 27.48 28.09 1x6d h GLN 57 CO 0.05 0.10 0.65 1.49 -0.95 0.00 0.00 178.83 180.18 1x6d h GLU 58 N 0.16 1.21 0.00 1.46 4.57 -0.40 -3.46 114.58 118.13 1x6d h GLU 58 Ca 0.23 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 1x6d h GLU 58 Cb 0.32 -0.27 0.00 0.00 -0.16 0.00 0.00 28.75 28.63 1x6d h GLU 58 CO -0.34 0.80 0.00 0.41 -1.18 0.00 0.00 179.01 178.70 1x6d n GLY 59 N -1.37 0.73 0.11 1.92 0.00 -0.14 -4.88 105.19 101.55 1x6d n GLY 59 Ca 0.14 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.96 1x6d n GLY 59 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1x6d h THR 60 N 0.00 1.14 -2.68 2.61 2.02 -1.84 -3.42 112.91 110.74 1x6d h THR 60 Ca 0.00 -2.32 -0.67 0.00 0.77 0.00 0.00 66.41 64.19 1x6d h THR 60 Cb 0.02 2.69 -0.17 0.00 -1.74 0.00 0.00 68.15 68.95 1x6d h THR 60 CO 0.00 0.56 0.51 -0.63 0.37 0.00 0.00 175.52 176.33 1x6d s ILE 61 N -2.39 4.59 -0.14 3.11 1.01 -1.25 -4.94 121.20 121.19 1x6d s ILE 61 Ca -0.23 -0.92 -0.02 0.00 0.00 0.00 0.00 60.65 59.49 1x6d s ILE 61 Cb 0.03 -4.66 -0.02 0.00 0.01 0.00 0.00 42.46 37.82 1x6d s ILE 61 CO 0.69 -1.38 -0.07 -1.10 0.00 0.00 0.00 174.94 173.09 1x6d s GLN 62 N 3.23 3.48 0.06 2.79 -0.21 -1.26 -4.47 119.66 123.28 1x6d s GLN 62 Ca 0.22 -0.57 -0.33 0.00 0.02 0.00 0.00 55.36 54.71 1x6d s GLN 62 Cb -0.15 -2.79 -0.17 0.00 1.00 0.00 0.00 33.01 30.89 1x6d s GLN 62 CO 0.03 0.29 0.81 0.36 -2.12 0.00 0.00 175.29 174.66 1x6d n LYS 63 N 3.36 0.00 0.00 2.91 2.85 -1.26 0.21 118.16 126.23 1x6d n LYS 63 Ca -0.18 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.08 1x6d n LYS 63 Cb 0.53 -1.22 0.00 0.00 -0.65 0.00 0.00 35.03 33.69 1x6d n LYS 63 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1x6d n GLY 64 N 1.53 1.72 3.54 2.58 0.00 0.48 -4.97 105.19 110.08 1x6d n GLY 64 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1x6d n GLY 64 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1x6d s ASN 65 N -1.79 1.23 -0.17 1.61 0.02 0.13 -4.74 114.94 111.23 1x6d s ASN 65 Ca 0.00 1.19 -0.07 0.00 -1.02 0.00 0.00 52.86 52.96 1x6d s ASN 65 Cb 0.00 -1.84 -0.04 0.00 0.02 0.00 0.00 41.25 39.39 1x6d s ASN 65 CO 0.00 -4.00 0.08 -0.70 0.02 0.00 0.00 177.10 172.50 1x6d s GLU 66 N -4.82 3.83 -0.77 -0.60 2.56 -1.26 -2.45 118.70 115.19 1x6d s GLU 66 Ca 0.68 -0.29 -0.09 0.00 0.00 0.00 0.00 54.97 55.27 1x6d s GLU 66 Cb -0.20 -3.20 0.20 0.00 2.00 0.00 0.00 34.13 32.93 1x6d s GLU 66 CO 0.61 0.40 0.66 0.08 -0.56 0.00 0.00 175.26 176.45 1x6d s VAL 67 N 0.01 4.85 0.08 3.70 1.01 -0.54 -4.07 120.40 125.44 1x6d s VAL 67 Ca 0.07 -2.80 -0.23 0.00 0.00 0.00 0.00 61.98 59.02 1x6d s VAL 67 Cb -0.12 -4.04 -0.15 0.00 0.00 0.00 0.00 36.38 32.08 1x6d s VAL 67 CO 0.01 -0.98 1.67 -0.07 0.00 0.00 0.00 175.10 175.72 1x6d h LEU 68 N 7.32 0.03 -8.20 3.92 3.38 -1.44 -3.39 115.31 116.94 1x6d h LEU 68 Ca 0.07 -0.08 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1x6d h LEU 68 Cb 0.98 -0.01 -0.10 0.00 0.09 0.00 0.00 40.66 41.62 1x6d h LEU 68 CO 0.75 0.10 -0.18 -0.94 0.09 0.00 0.00 178.44 178.26 1x6d s SER 69 N -5.30 -0.06 -0.11 -0.43 1.04 -1.25 -3.12 113.70 104.47 1x6d s SER 69 Ca -0.13 -0.92 -0.04 0.00 0.48 0.00 0.00 55.95 55.33 1x6d s SER 69 Cb 0.06 0.54 0.06 0.00 0.10 0.00 0.00 66.02 66.78 1x6d s SER 69 CO 0.67 -1.07 0.21 -0.63 0.98 0.00 0.00 173.24 173.40 1x6d s ILE 70 N -4.01 -0.33 0.00 -1.02 1.01 -0.82 -2.86 121.20 113.17 1x6d s ILE 70 Ca 0.22 0.28 0.00 0.00 0.00 0.00 0.00 60.65 61.15 1x6d s ILE 70 Cb 0.01 -0.39 0.00 0.00 0.01 0.00 0.00 42.46 42.08 1x6d s ILE 70 CO 0.07 0.10 0.00 -3.20 0.00 0.00 0.00 174.94 171.91 1x6d n ASN 71 N 5.33 -0.30 0.00 3.58 2.85 0.50 -2.76 115.26 124.47 1x6d n ASN 71 Ca -0.05 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.42 1x6d n ASN 71 Cb 0.50 -0.05 0.00 0.00 1.24 0.00 0.00 39.78 41.47 1x6d n ASN 71 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1x6d n GLY 72 N -2.10 0.83 3.39 8.20 0.00 -1.24 -4.79 105.19 109.48 1x6d n GLY 72 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1x6d n GLY 72 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1x6d s LYS 73 N -0.88 3.28 0.62 1.61 2.20 -1.11 -5.08 119.74 120.38 1x6d s LYS 73 Ca 0.00 -0.73 -0.15 0.00 -0.36 0.00 0.00 55.97 54.73 1x6d s LYS 73 Cb 0.00 -3.40 -0.02 0.00 -1.51 0.00 0.00 37.83 32.90 1x6d s LYS 73 CO 0.00 -0.37 1.07 -1.12 -0.36 0.00 0.00 175.35 174.56 1x6d s SER 74 N 1.55 5.60 -0.42 1.43 0.01 -1.26 -1.95 113.70 118.66 1x6d s SER 74 Ca 0.04 1.83 -0.22 0.00 1.31 0.00 0.00 55.95 58.91 1x6d s SER 74 Cb -0.17 -2.53 0.02 0.00 0.21 0.00 0.00 66.02 63.55 1x6d s SER 74 CO 0.03 -1.29 0.73 -0.76 0.41 0.00 0.00 173.24 172.36 1x6d s LEU 75 N -4.69 4.30 -0.02 2.44 1.43 -1.18 -4.88 118.68 116.08 1x6d s LEU 75 Ca 0.64 -0.08 0.08 0.00 -1.03 0.00 0.00 54.13 53.73 1x6d s LEU 75 Cb -0.17 -2.89 0.28 0.00 0.03 0.00 0.00 46.19 43.45 1x6d s LEU 75 CO 0.40 -0.82 1.17 2.29 0.23 0.00 0.00 176.35 179.62 1x6d n LYS 76 N 6.48 1.88 0.00 1.70 0.00 -1.26 -4.72 118.16 122.24 1x6d n LYS 76 Ca 0.01 -1.11 0.00 0.00 -0.00 0.00 0.00 58.31 57.21 1x6d n LYS 76 Cb 0.48 -1.36 0.00 0.00 -0.00 0.00 0.00 35.03 34.15 1x6d n LYS 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1x6d n GLY 77 N 0.81 1.92 3.56 2.58 0.00 -1.26 -5.09 105.19 107.70 1x6d n GLY 77 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1x6d n GLY 77 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1x6d n THR 78 N -0.31 2.34 -1.36 2.61 -1.04 -1.26 -4.14 114.28 111.11 1x6d n THR 78 Ca 0.00 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.05 61.22 1x6d n THR 78 Cb 0.00 -0.94 0.18 0.00 -1.82 0.00 0.00 70.33 67.75 1x6d n THR 78 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1x6d s THR 79 N -1.36 1.90 0.17 12.58 -4.23 -1.26 -1.90 115.64 121.54 1x6d s THR 79 Ca 0.64 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 61.02 1x6d s THR 79 Cb -0.56 -2.64 0.07 0.00 1.34 0.00 0.00 72.50 70.71 1x6d s THR 79 CO 0.56 0.00 1.76 -0.74 -0.54 0.00 0.00 174.62 175.66 1x6d h HIS 80 N -1.91 0.34 0.39 3.99 2.76 -1.88 0.99 115.15 119.83 1x6d h HIS 80 Ca -0.50 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 57.67 1x6d h HIS 80 Cb 1.31 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 30.19 1x6d h HIS 80 CO -0.46 0.14 -0.19 1.25 -1.30 0.00 0.00 177.93 177.38 1x6d h HIS 81 N 0.38 -0.49 -1.81 5.26 -0.00 -1.92 -0.15 115.15 116.42 1x6d h HIS 81 Ca 0.21 -0.01 0.53 0.00 -0.00 0.00 0.00 60.37 61.10 1x6d h HIS 81 Cb 0.18 0.16 -0.07 0.00 -0.00 0.00 0.00 27.41 27.68 1x6d h HIS 81 CO -0.14 -0.30 1.34 -0.44 -0.00 0.00 0.00 177.93 178.39 1x6d h ASP 82 N -1.05 0.00 0.00 3.26 3.32 -1.90 0.45 116.42 120.49 1x6d h ASP 82 Ca -0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1x6d h ASP 82 Cb 0.40 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.95 1x6d h ASP 82 CO 0.09 0.00 -0.01 0.00 -1.72 0.00 0.00 179.24 177.59 1x6d h ALA 83 N 1.03 0.00 -0.95 3.45 0.00 -0.70 -2.85 119.26 119.24 1x6d h ALA 83 Ca 0.86 -0.02 0.30 0.00 0.00 0.00 0.00 54.91 56.05 1x6d h ALA 83 Cb 3.52 0.01 -0.16 0.00 0.00 0.00 0.00 17.79 21.17 1x6d h ALA 83 CO -0.01 0.01 0.30 -0.07 0.00 0.00 0.00 179.25 179.48 1x6d h LEU 84 N -0.90 0.02 0.52 0.00 3.38 0.16 0.56 115.31 119.06 1x6d h LEU 84 Ca 0.00 0.23 -0.03 0.00 0.09 0.00 0.00 57.88 58.18 1x6d h LEU 84 Cb 0.01 0.31 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1x6d h LEU 84 CO 0.00 -0.27 -0.25 0.00 0.09 0.00 0.00 178.44 178.01 1x6d h ALA 85 N 1.89 -0.70 -0.72 1.53 0.00 -0.47 -1.43 119.26 119.35 1x6d h ALA 85 Ca 0.66 -0.15 0.14 0.00 0.00 0.00 0.00 54.91 55.56 1x6d h ALA 85 Cb 1.48 0.28 -0.14 0.00 0.00 0.00 0.00 17.79 19.41 1x6d h ALA 85 CO -0.74 -0.90 -0.21 0.82 0.00 0.00 0.00 179.25 178.22 1x6d h ILE 86 N -0.70 0.25 -0.52 0.00 2.04 0.29 1.77 117.51 120.63 1x6d h ILE 86 Ca -0.07 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.88 1x6d h ILE 86 Cb 0.54 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 1x6d h ILE 86 CO 0.11 0.00 0.35 0.25 0.00 0.00 0.00 178.15 178.87 1x6d h LEU 87 N -0.02 0.29 -0.69 1.44 7.12 -0.73 0.66 115.31 123.38 1x6d h LEU 87 Ca 0.34 0.01 -0.11 0.00 0.13 0.00 0.00 57.88 58.24 1x6d h LEU 87 Cb 0.54 -0.06 -0.02 0.00 -0.53 0.00 0.00 40.66 40.60 1x6d h LEU 87 CO -0.75 0.18 -0.52 0.08 -0.13 0.00 0.00 178.44 177.30 1x6d h ARG 88 N 0.32 0.00 0.00 1.25 0.11 0.36 -2.93 114.38 113.49 1x6d h ARG 88 Ca 0.24 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 60.12 1x6d h ARG 88 Cb 0.52 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.57 1x6d h ARG 88 CO -0.06 0.52 -1.17 1.96 0.10 0.00 0.00 179.97 181.33 1x6d h GLN 89 N 0.00 0.00 0.00 0.08 4.20 0.31 -3.20 115.11 116.50 1x6d h GLN 89 Ca -0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1x6d h GLN 89 Cb 1.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.87 1x6d h GLN 89 CO 0.07 0.58 0.00 0.00 -0.67 0.00 0.00 178.83 178.81 1x6d n ALA 90 N -2.38 2.12 1.05 3.87 0.00 0.19 -1.97 120.51 123.38 1x6d n ALA 90 Ca -0.06 -0.09 0.11 0.00 0.00 0.00 0.00 53.44 53.40 1x6d n ALA 90 Cb 0.89 -1.37 0.06 0.00 0.00 0.00 0.00 19.45 19.03 1x6d n ALA 90 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1x6d n ARG 91 N -1.39 1.05 -0.06 0.00 1.85 -1.12 -4.22 116.66 112.77 1x6d n ARG 91 Ca 0.08 -0.83 -0.14 0.00 -1.00 0.00 0.00 57.85 55.96 1x6d n ARG 91 Cb 0.22 -1.48 -0.06 0.00 -1.05 0.00 0.00 32.46 30.09 1x6d n ARG 91 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 1x6d h GLU 92 N 2.02 0.60 0.00 2.89 5.08 -1.49 -0.41 114.58 123.27 1x6d h GLU 92 Ca 0.00 -0.38 -0.38 0.00 -1.00 0.00 0.00 59.36 57.60 1x6d h GLU 92 Cb 0.69 0.04 0.17 0.00 0.50 0.00 0.00 28.75 30.16 1x6d h GLU 92 CO 0.00 0.99 0.25 -0.35 -1.00 0.00 0.00 179.01 178.91 1x6d n PRO 93 N -4.27 -2.08 0.00 2.33 -0.04 -1.26 -3.25 135.00 126.43 1x6d n PRO 93 Ca -0.06 -1.77 0.11 0.00 -0.04 0.00 0.00 63.50 61.74 1x6d n PRO 93 Cb 0.51 -1.39 -0.03 0.00 -0.04 0.00 0.00 33.50 32.55 1x6d n PRO 93 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1x6d n ARG 94 N -4.10 0.32 -4.31 0.54 3.00 -1.26 -4.04 116.66 106.81 1x6d n ARG 94 Ca 0.15 -0.26 -0.19 0.00 -0.01 0.00 0.00 57.85 57.54 1x6d n ARG 94 Cb 0.54 -1.49 -0.13 0.00 0.00 0.00 0.00 32.46 31.38 1x6d n ARG 94 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 1x6d s GLN 95 N -2.86 0.88 -0.02 5.56 0.74 -1.26 0.64 119.66 123.34 1x6d s GLN 95 Ca 0.11 -0.76 0.01 0.00 0.05 0.00 0.00 55.36 54.78 1x6d s GLN 95 Cb 0.17 -0.87 0.01 0.00 1.10 0.00 0.00 33.01 33.42 1x6d s GLN 95 CO 0.77 0.21 -0.02 0.00 -0.55 0.00 0.00 175.29 175.70 1x6d s ALA 96 N -0.90 0.35 -0.23 1.58 0.00 -0.95 -4.95 121.76 116.66 1x6d s ALA 96 Ca 0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 51.96 51.93 1x6d s ALA 96 Cb -0.08 -0.21 0.02 0.00 0.00 0.00 0.00 23.12 22.85 1x6d s ALA 96 CO 0.01 0.01 -0.08 0.08 0.00 0.00 0.00 175.76 175.78 1x6d s VAL 97 N 0.45 2.83 -0.13 0.00 1.01 -1.26 -1.93 120.40 121.37 1x6d s VAL 97 Ca -0.05 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.01 1x6d s VAL 97 Cb -0.08 -2.38 0.02 0.00 0.00 0.00 0.00 36.38 33.94 1x6d s VAL 97 CO -0.01 0.28 -0.15 -0.63 0.00 0.00 0.00 175.10 174.60 1x6d s ILE 98 N 1.34 1.53 -0.36 2.22 1.09 -1.23 0.19 121.20 125.98 1x6d s ILE 98 Ca 0.02 -0.63 -0.13 0.00 -1.10 0.00 0.00 60.65 58.80 1x6d s ILE 98 Cb -0.16 -1.42 -0.00 0.00 -1.06 0.00 0.00 42.46 39.82 1x6d s ILE 98 CO -0.06 0.45 0.25 -0.69 -0.10 0.00 0.00 174.94 174.80 1x6d s VAL 99 N 1.23 5.23 0.17 2.92 1.01 -1.14 -3.01 120.40 126.82 1x6d s VAL 99 Ca -0.01 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.60 1x6d s VAL 99 Cb -0.14 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 1x6d s VAL 99 CO -0.06 -0.10 0.04 0.42 0.00 0.00 0.00 175.10 175.40 1x6d s THR 100 N 1.70 0.39 0.13 3.92 -4.23 -1.24 -1.25 115.64 115.05 1x6d s THR 100 Ca 0.06 -1.96 0.06 0.00 -1.18 0.00 0.00 61.69 58.67 1x6d s THR 100 Cb -0.18 -2.18 -0.04 0.00 1.34 0.00 0.00 72.50 71.44 1x6d s THR 100 CO 0.10 -0.38 -0.15 0.00 -0.54 0.00 0.00 174.62 173.66 1x6d s ARG 101 N -4.00 1.05 -0.28 3.99 3.03 -1.26 -2.38 118.95 119.10 1x6d s ARG 101 Ca 0.27 -1.25 -0.29 0.00 2.03 0.00 0.00 55.73 56.49 1x6d s ARG 101 Cb 0.07 -0.96 -0.02 0.00 -1.03 0.00 0.00 34.95 33.00 1x6d s ARG 101 CO 0.05 0.19 1.71 0.15 -1.13 0.00 0.00 175.30 176.27 1x6d s LYS 102 N -2.65 3.56 -0.09 3.89 -0.14 -1.25 -4.37 119.74 118.69 1x6d s LYS 102 Ca 0.09 1.53 0.00 0.00 -1.36 0.00 0.00 55.97 56.24 1x6d s LYS 102 Cb -0.05 -4.12 -0.03 0.00 -1.68 0.00 0.00 37.83 31.95 1x6d s LYS 102 CO 0.03 -1.59 -0.08 -0.51 -0.76 0.00 0.00 175.35 172.45 1x6d s LEU 103 N 6.06 3.06 0.95 3.17 1.43 -1.26 -5.09 118.68 126.99 1x6d s LEU 103 Ca 0.76 -0.10 -0.16 0.00 -1.03 0.00 0.00 54.13 53.60 1x6d s LEU 103 Cb -0.24 -1.68 -0.08 0.00 0.03 0.00 0.00 46.19 44.23 1x6d s LEU 103 CO 0.32 0.30 -0.31 0.35 0.23 0.00 0.00 176.35 177.24 1x6d n THR 104 N 2.63 0.08 -1.52 5.49 -2.24 -1.26 -4.95 114.28 112.51 1x6d n THR 104 Ca -0.18 -0.39 -0.30 0.00 -2.27 0.00 0.00 64.05 60.92 1x6d n THR 104 Cb 0.53 -0.24 0.19 0.00 -2.10 0.00 0.00 70.33 68.71 1x6d n THR 104 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1x6d s PRO 105 N -2.55 0.08 -0.04 -0.78 0.04 -1.26 -5.03 135.00 125.46 1x6d s PRO 105 Ca 0.48 -0.11 -0.06 0.00 0.04 0.00 0.00 61.00 61.34 1x6d s PRO 105 Cb -0.21 -1.75 -0.02 0.00 0.04 0.00 0.00 34.50 32.56 1x6d s PRO 105 CO 0.76 -2.84 -0.12 0.39 0.04 0.00 0.00 177.00 175.23 1x6d n GLU 106 N -4.13 0.19 -3.80 4.56 1.02 -1.26 -5.13 120.64 112.08 1x6d n GLU 106 Ca 0.12 0.07 -0.05 0.00 -0.02 0.00 0.00 57.16 57.29 1x6d n GLU 106 Cb 0.59 -0.74 -0.00 0.00 -0.02 0.00 0.00 31.44 31.26 1x6d n GLU 106 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1x6d s ALA 107 N -2.53 -1.46 -0.08 0.62 0.00 -1.26 -5.16 121.76 111.89 1x6d s ALA 107 Ca -0.10 -0.14 -0.00 0.00 0.00 0.00 0.00 51.96 51.72 1x6d s ALA 107 Cb 0.01 0.70 0.02 0.00 0.00 0.00 0.00 23.12 23.86 1x6d s ALA 107 CO 0.15 -1.04 -0.05 1.41 0.00 0.00 0.00 175.76 176.23 1x6d s MET 108 N -3.08 1.09 0.93 0.00 1.75 -1.26 -5.14 119.30 113.58 1x6d s MET 108 Ca 0.14 -0.12 -0.13 0.00 -1.25 0.00 0.00 55.69 54.33 1x6d s MET 108 Cb -0.03 -1.20 0.15 0.00 2.84 0.00 0.00 34.83 36.59 1x6d s MET 108 CO 0.05 -0.21 1.14 -1.25 -0.65 0.00 0.00 175.02 174.11 1x6d s PRO 109 N 1.51 1.02 -0.27 4.11 0.04 -1.26 -5.09 135.00 135.06 1x6d s PRO 109 Ca -0.01 0.24 -0.13 0.00 0.04 0.00 0.00 61.00 61.15 1x6d s PRO 109 Cb -0.13 -1.83 0.09 0.00 0.04 0.00 0.00 34.50 32.67 1x6d s PRO 109 CO -0.04 -2.27 0.63 0.34 0.04 0.00 0.00 177.00 175.69 1x6d s ASP 110 N -4.06 -0.90 1.40 6.66 -1.08 -1.26 -5.16 116.67 112.26 1x6d s ASP 110 Ca 0.65 1.42 -0.20 0.00 -0.52 0.00 0.00 52.55 53.89 1x6d s ASP 110 Cb -0.14 1.53 0.32 0.00 -1.46 0.00 0.00 42.92 43.17 1x6d s ASP 110 CO 0.53 -0.23 0.71 0.18 0.52 0.00 0.00 175.17 176.89 1x6d n LEU 111 N 4.66 0.00 -4.22 -1.34 4.77 -1.26 -5.06 117.00 114.54 1x6d n LEU 111 Ca -0.18 -0.72 -0.13 0.00 -0.03 0.00 0.00 56.01 54.95 1x6d n LEU 111 Cb 0.55 -0.83 -0.10 0.00 -2.33 0.00 0.00 43.42 40.72 1x6d n LEU 111 CO -0.01 -2.63 -0.31 0.20 -1.33 0.00 0.00 177.39 173.31 1x6d s ASN 112 N -2.88 0.92 0.42 -1.43 0.01 -1.26 -5.17 114.94 105.54 1x6d s ASN 112 Ca 0.55 -1.21 0.08 0.00 -0.71 0.00 0.00 52.86 51.57 1x6d s ASN 112 Cb -0.10 0.18 0.01 0.00 0.41 0.00 0.00 41.25 41.75 1x6d s ASN 112 CO 0.46 -0.64 0.57 -0.44 -1.51 0.00 0.00 177.10 175.54 1x6d s SER 113 N -3.15 5.66 0.22 -1.22 0.01 -1.26 -5.05 113.70 108.91 1x6d s SER 113 Ca 0.26 -0.41 0.00 0.00 1.31 0.00 0.00 55.95 57.10 1x6d s SER 113 Cb 0.07 -0.67 0.00 0.00 0.21 0.00 0.00 66.02 65.63 1x6d s SER 113 CO 0.05 -0.76 0.00 -0.24 0.41 0.00 0.00 173.24 172.70 1x6d n SER 114 N -1.85 0.04 0.00 2.44 2.88 -1.26 -5.18 113.62 110.68 1x6d n SER 114 Ca 0.08 0.37 0.00 0.00 -1.33 0.00 0.00 58.87 57.99 1x6d n SER 114 Cb 0.59 0.25 0.00 0.00 -0.75 0.00 0.00 64.21 64.30 1x6d n SER 114 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x6d n GLY 115 N 1.86 2.02 3.77 0.46 0.00 -1.26 -5.12 105.19 106.92 1x6d n GLY 115 Ca 0.00 -2.01 -0.29 0.00 0.00 0.00 0.00 46.02 43.72 1x6d n GLY 115 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x6d s PRO 116 N -1.53 0.36 -0.26 1.61 0.04 -1.26 -5.09 135.00 128.86 1x6d s PRO 116 Ca 0.00 0.00 -0.28 0.00 0.04 0.00 0.00 61.00 60.76 1x6d s PRO 116 Cb 0.00 -1.78 0.17 0.00 0.04 0.00 0.00 34.50 32.94 1x6d s PRO 116 CO 0.00 -2.67 1.29 0.45 0.04 0.00 0.00 177.00 176.11 1x6d s SER 117 N -4.23 -0.13 0.46 6.66 0.15 -1.26 -5.16 113.70 110.19 1x6d s SER 117 Ca 0.68 0.18 0.00 0.00 0.70 0.00 0.00 55.95 57.52 1x6d s SER 117 Cb -0.10 0.16 0.00 0.00 -1.71 0.00 0.00 66.02 64.36 1x6d s SER 117 CO 0.54 -0.10 0.00 -0.24 1.20 0.00 0.00 173.24 174.64 1x6d n SER 118 N 0.92 -6.17 0.00 5.45 2.88 -1.26 -5.34 113.62 110.10 1x6d n SER 118 Ca -0.05 1.05 0.00 0.00 -1.33 0.00 0.00 58.87 58.54 1x6d n SER 118 Cb 0.58 -3.77 0.00 0.00 -0.75 0.00 0.00 64.21 60.27 1x6d n SER 118 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42