#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 0.00 0.00 1.61 7.64 -1.26 -5.19 113.62 116.42 1x6d n SER 2 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1x6d n SER 2 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1x6d n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1x6d n SER 3 N 0.00 0.00 0.00 6.43 2.88 -1.26 -5.18 113.62 116.49 1x6d n SER 3 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1x6d n SER 3 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1x6d n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x6d n GLY 4 N -0.18 4.69 0.00 0.46 0.00 -1.26 -5.17 105.19 103.72 1x6d n GLY 4 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.90 1x6d n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1x6d n SER 5 N 0.00 0.00 -3.63 1.61 7.64 -1.26 -5.19 113.62 112.79 1x6d n SER 5 Ca 0.00 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.85 1x6d n SER 5 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 1x6d n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1x6d s SER 6 N 0.00 -0.16 0.00 6.43 0.15 -1.26 -5.18 113.70 113.69 1x6d s SER 6 Ca 0.00 -0.16 0.00 0.00 0.70 0.00 0.00 55.95 56.49 1x6d s SER 6 Cb 0.00 0.28 0.00 0.00 -1.71 0.00 0.00 66.02 64.59 1x6d s SER 6 CO 0.00 -0.50 0.00 0.61 1.20 0.00 0.00 173.24 174.55 1x6d n GLY 7 N -0.36 3.48 3.61 9.45 0.00 -1.26 -5.18 105.19 114.94 1x6d n GLY 7 Ca -0.06 -0.12 -0.13 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.06 -1.82 -0.49 4.61 0.00 -1.26 -5.11 121.76 117.62 1x6d s ALA 8 Ca 0.00 1.88 0.06 0.00 0.00 0.00 0.00 51.96 53.90 1x6d s ALA 8 Cb 0.00 -1.05 0.19 0.00 0.00 0.00 0.00 23.12 22.26 1x6d s ALA 8 CO 0.00 -0.32 0.74 0.99 0.00 0.00 0.00 175.76 177.17 1x6d s THR 9 N 0.07 -0.95 0.04 0.00 2.01 -1.26 -5.14 115.64 110.42 1x6d s THR 9 Ca -0.01 -0.82 -0.22 0.00 0.31 0.00 0.00 61.69 60.96 1x6d s THR 9 Cb -0.04 0.00 -0.06 0.00 0.01 0.00 0.00 72.50 72.41 1x6d s THR 9 CO 0.01 0.00 0.64 -0.76 -0.69 0.00 0.00 174.62 173.82 1x6d s LEU 10 N 1.01 4.47 0.00 4.42 1.43 -1.26 -5.04 118.68 123.70 1x6d s LEU 10 Ca 0.28 1.29 -0.01 0.00 -1.03 0.00 0.00 54.13 54.66 1x6d s LEU 10 Cb 0.00 -3.01 0.00 0.00 0.03 0.00 0.00 46.19 43.22 1x6d s LEU 10 CO -0.06 0.14 0.12 0.29 0.23 0.00 0.00 176.35 177.07 1x6d n LYS 11 N 2.39 0.17 -3.53 1.70 5.02 -1.26 -5.10 118.16 117.55 1x6d n LYS 11 Ca -0.07 -0.59 -0.40 0.00 -2.02 0.00 0.00 58.31 55.23 1x6d n LYS 11 Cb 0.51 0.59 -0.04 0.00 -0.02 0.00 0.00 35.03 36.06 1x6d n LYS 11 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1x6d s GLN 12 N -2.15 3.51 0.00 1.97 -0.21 -1.26 -4.97 119.66 116.55 1x6d s GLN 12 Ca 0.06 -3.11 0.00 0.00 0.02 0.00 0.00 55.36 52.33 1x6d s GLN 12 Cb -0.00 -4.16 0.00 0.00 1.00 0.00 0.00 33.01 29.85 1x6d s GLN 12 CO 0.04 -1.25 0.00 1.47 -2.12 0.00 0.00 175.29 173.43 1x6d n LEU 13 N 2.71 0.00 0.00 2.90 -0.00 -1.26 -5.03 117.00 116.32 1x6d n LEU 13 Ca 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.21 1x6d n LEU 13 Cb 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.81 1x6d n LEU 13 CO 0.39 0.00 0.00 -0.67 -0.00 0.00 0.00 177.39 177.11 1x6d n ASP 14 N 0.00 0.00 0.00 1.45 2.03 -1.26 -4.41 116.55 114.36 1x6d n ASP 14 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1x6d n ASP 14 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1x6d n ASP 14 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1x6d n GLY 15 N 0.00 0.86 3.79 0.27 0.00 -1.26 -5.03 105.19 103.82 1x6d n GLY 15 Ca 0.00 -0.28 -0.39 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.00 4.58 -0.11 -0.61 -1.09 -1.26 -3.77 121.20 116.93 1x6d s ILE 16 Ca 0.00 1.45 -0.00 0.00 -2.23 0.00 0.00 60.65 59.87 1x6d s ILE 16 Cb 0.00 -4.01 0.02 0.00 -1.58 0.00 0.00 42.46 36.89 1x6d s ILE 16 CO 0.00 0.53 -0.08 -2.28 -1.23 0.00 0.00 174.94 171.88 1x6d s HIS 17 N -1.06 1.50 0.01 3.97 2.46 0.51 -5.00 115.29 117.67 1x6d s HIS 17 Ca 0.32 -0.73 -0.13 0.00 0.47 0.00 0.00 55.06 54.99 1x6d s HIS 17 Cb -0.21 -1.22 -0.06 0.00 -0.13 0.00 0.00 32.58 30.96 1x6d s HIS 17 CO 0.22 -0.49 0.39 0.08 -2.47 0.00 0.00 174.74 172.48 1x6d s VAL 18 N 1.57 5.07 -0.08 0.89 1.01 -1.26 -2.57 120.40 125.03 1x6d s VAL 18 Ca 0.03 0.74 0.01 0.00 0.00 0.00 0.00 61.98 62.76 1x6d s VAL 18 Cb -0.13 -3.68 0.02 0.00 0.00 0.00 0.00 36.38 32.59 1x6d s VAL 18 CO -0.07 0.54 -0.10 -0.89 0.00 0.00 0.00 175.10 174.58 1x6d s THR 19 N -1.13 1.00 -0.41 3.92 2.01 -1.15 -5.03 115.64 114.86 1x6d s THR 19 Ca 0.25 -0.36 -0.13 0.00 0.31 0.00 0.00 61.69 61.76 1x6d s THR 19 Cb -0.16 -0.96 0.04 0.00 0.01 0.00 0.00 72.50 71.43 1x6d s THR 19 CO 0.13 0.34 0.28 -0.63 -0.69 0.00 0.00 174.62 174.06 1x6d s ILE 20 N 1.04 4.87 -0.14 1.82 -1.09 -1.26 -3.11 121.20 123.33 1x6d s ILE 20 Ca -0.08 -0.93 -0.21 0.00 -2.23 0.00 0.00 60.65 57.20 1x6d s ILE 20 Cb -0.15 -3.80 -0.03 0.00 -1.58 0.00 0.00 42.46 36.91 1x6d s ILE 20 CO -0.01 -0.37 0.62 -0.76 -1.23 0.00 0.00 174.94 173.20 1x6d s LEU 21 N 1.59 4.22 -0.44 2.97 1.02 -0.66 -4.93 118.68 122.46 1x6d s LEU 21 Ca 0.03 0.94 -0.12 0.00 0.02 0.00 0.00 54.13 55.01 1x6d s LEU 21 Cb -0.21 -2.92 0.07 0.00 0.02 0.00 0.00 46.19 43.16 1x6d s LEU 21 CO 0.07 -0.17 0.31 -1.00 0.02 0.00 0.00 176.35 175.58 1x6d s HIS 22 N 1.31 3.30 0.29 0.29 3.76 -1.26 -2.07 115.29 120.91 1x6d s HIS 22 Ca 0.31 -1.27 0.04 0.00 -0.15 0.00 0.00 55.06 53.98 1x6d s HIS 22 Cb -0.16 -3.01 -0.03 0.00 1.11 0.00 0.00 32.58 30.48 1x6d s HIS 22 CO 0.13 -0.82 0.20 -1.59 -0.85 0.00 0.00 174.74 171.81 1x6d s LYS 23 N 1.51 1.56 0.53 1.40 0.00 0.37 -5.03 119.74 120.09 1x6d s LYS 23 Ca 0.03 -1.89 -0.02 0.00 0.00 0.00 0.00 55.97 54.10 1x6d s LYS 23 Cb -0.23 0.17 0.01 0.00 0.00 0.00 0.00 37.83 37.78 1x6d s LYS 23 CO 0.04 -0.52 0.79 -1.21 0.00 0.00 0.00 175.35 174.45 1x6d s GLU 24 N -3.75 2.82 -0.48 1.78 2.02 -1.26 -4.01 118.70 115.82 1x6d s GLU 24 Ca 0.38 -0.41 -0.28 0.00 0.02 0.00 0.00 54.97 54.68 1x6d s GLU 24 Cb 0.04 -2.43 -0.09 0.00 0.10 0.00 0.00 34.13 31.76 1x6d s GLU 24 CO 0.20 -0.58 2.39 0.39 0.02 0.00 0.00 175.26 177.68 1x6d n GLU 25 N -2.35 1.12 -1.25 1.61 1.02 -1.26 0.34 120.64 119.86 1x6d n GLU 25 Ca 0.04 0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 1x6d n GLU 25 Cb 0.58 -3.10 0.00 0.00 -0.02 0.00 0.00 31.44 28.90 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 6.07 0.80 0.09 0.62 0.00 -0.18 -4.96 105.19 107.62 1x6d n GLY 26 Ca 0.39 -0.65 -0.12 0.00 0.00 0.00 0.00 46.02 45.64 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 0.38 0.00 4.61 0.00 -0.21 -3.50 119.26 120.54 1x6d h ALA 27 Ca 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 54.91 53.81 1x6d h ALA 27 Cb 0.55 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1x6d h ALA 27 CO 0.00 1.24 0.00 0.41 0.00 0.00 0.00 179.25 180.90 1x6d n GLY 28 N 1.54 0.08 0.12 0.00 0.00 -1.26 -4.85 105.19 100.81 1x6d n GLY 28 Ca -0.11 -1.73 -0.17 0.00 0.00 0.00 0.00 46.02 44.01 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 -0.93 2.18 0.00 0.99 4.77 -1.26 -4.78 117.00 117.98 1x6d n LEU 29 Ca 0.00 0.17 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 1x6d n LEU 29 Cb 0.00 -0.72 0.00 0.00 -2.33 0.00 0.00 43.42 40.37 1x6d n LEU 29 CO 0.00 0.76 0.00 0.61 -1.33 0.00 0.00 177.39 177.43 1x6d n GLY 30 N 1.94 1.08 3.23 -0.72 0.00 -1.26 0.06 105.19 109.53 1x6d n GLY 30 Ca -0.32 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.00 1.23 0.48 1.61 -0.71 -1.26 0.12 117.98 117.45 1x6d s PHE 31 Ca 0.00 -1.22 0.02 0.00 -1.04 0.00 0.00 56.93 54.69 1x6d s PHE 31 Cb 0.00 -0.68 -0.02 0.00 -1.21 0.00 0.00 43.02 41.11 1x6d s PHE 31 CO 0.00 -0.44 0.02 0.45 -1.34 0.00 0.00 175.22 173.91 1x6d s SER 32 N -3.19 3.89 0.20 1.98 0.15 -0.62 -4.98 113.70 111.14 1x6d s SER 32 Ca 0.33 -1.62 0.04 0.00 0.70 0.00 0.00 55.95 55.40 1x6d s SER 32 Cb 0.07 0.39 -0.03 0.00 -1.71 0.00 0.00 66.02 64.74 1x6d s SER 32 CO 0.09 -0.81 0.30 -0.76 1.20 0.00 0.00 173.24 173.26 1x6d s LEU 33 N -3.81 4.26 0.02 3.45 1.43 -1.26 -2.39 118.68 120.37 1x6d s LEU 33 Ca 0.12 0.08 -0.01 0.00 -1.03 0.00 0.00 54.13 53.29 1x6d s LEU 33 Cb 0.03 -2.82 -0.02 0.00 0.03 0.00 0.00 46.19 43.42 1x6d s LEU 33 CO 0.07 -0.01 -0.01 0.00 0.23 0.00 0.00 176.35 176.63 1x6d s ALA 34 N -1.88 0.05 0.00 4.21 0.00 0.50 -4.16 121.76 120.48 1x6d s ALA 34 Ca 0.34 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.78 1x6d s ALA 34 Cb -0.10 0.14 0.00 0.00 0.00 0.00 0.00 23.12 23.16 1x6d s ALA 34 CO 0.28 -0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.29 1x6d n GLY 35 N 1.60 -1.36 0.00 0.00 0.00 -1.26 0.84 105.19 105.01 1x6d n GLY 35 Ca -0.24 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.23 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 -1.31 1.19 0.14 -0.02 0.00 -1.02 -4.05 105.19 100.11 1x6d n GLY 36 Ca 0.00 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 45.02 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 2.00 0.05 0.00 4.61 0.00 -1.57 -3.14 119.26 121.22 1x6d h ALA 37 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 54.91 53.91 1x6d h ALA 37 Cb 0.00 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1x6d h ALA 37 CO 0.00 0.80 0.00 0.22 0.00 0.00 0.00 179.25 180.27 1x6d h ASP 38 N -0.06 0.00 -3.47 0.00 3.58 -1.87 -3.45 116.42 111.16 1x6d h ASP 38 Ca -0.29 0.00 -0.28 0.00 0.42 0.00 0.00 57.03 56.88 1x6d h ASP 38 Cb 1.96 0.00 0.10 0.00 1.72 0.00 0.00 39.33 43.11 1x6d h ASP 38 CO 0.16 0.00 0.24 0.18 -2.88 0.00 0.00 179.24 176.94 1x6d n LEU 39 N -2.87 0.00 0.10 2.28 4.32 -1.23 -5.00 117.00 114.59 1x6d n LEU 39 Ca 0.02 -1.02 -0.16 0.00 -0.02 0.00 0.00 56.01 54.83 1x6d n LEU 39 Cb 0.34 -0.61 -0.14 0.00 -1.62 0.00 0.00 43.42 41.39 1x6d n LEU 39 CO 0.27 -1.06 -0.09 -0.33 -1.22 0.00 0.00 177.39 174.96 1x6d h GLU 40 N 0.00 0.28 -5.09 3.23 4.39 -1.86 -3.40 114.58 112.14 1x6d h GLU 40 Ca -0.27 -0.48 -0.69 0.00 0.34 0.00 0.00 59.36 58.26 1x6d h GLU 40 Cb 0.77 0.18 -0.17 0.00 -0.10 0.00 0.00 28.75 29.43 1x6d h GLU 40 CO 0.20 1.22 1.06 0.54 -1.16 0.00 0.00 179.01 180.86 1x6d s ASN 41 N -7.14 6.72 0.52 1.42 2.20 -1.26 -4.82 114.94 112.58 1x6d s ASN 41 Ca -0.05 -2.22 0.26 0.00 -0.94 0.00 0.00 52.86 49.91 1x6d s ASN 41 Cb 0.07 -2.42 1.38 0.00 -2.00 0.00 0.00 41.25 38.27 1x6d s ASN 41 CO 0.88 -1.03 1.94 0.50 -2.94 0.00 0.00 177.10 176.45 1x6d h LYS 42 N 8.50 0.07 -5.22 3.55 1.63 -1.76 -2.71 116.57 120.63 1x6d h LYS 42 Ca 0.21 -0.00 -0.65 0.00 -0.85 0.00 0.00 60.65 59.35 1x6d h LYS 42 Cb 0.98 -0.01 -0.16 0.00 -0.60 0.00 0.00 32.23 32.44 1x6d h LYS 42 CO 1.18 0.04 -0.05 0.54 -3.45 0.00 0.00 179.45 177.71 1x6d s VAL 43 N -5.07 5.00 0.40 2.00 0.11 -1.26 -4.49 120.40 117.10 1x6d s VAL 43 Ca -0.06 0.23 -0.27 0.00 -2.93 0.00 0.00 61.98 58.96 1x6d s VAL 43 Cb 0.21 -4.00 -0.10 0.00 -1.53 0.00 0.00 36.38 30.96 1x6d s VAL 43 CO 0.75 -0.28 1.46 -0.63 -3.33 0.00 0.00 175.10 173.06 1x6d s ILE 44 N 2.41 2.10 0.42 7.04 1.09 -1.26 -4.78 121.20 128.22 1x6d s ILE 44 Ca 0.18 0.10 0.03 0.00 -1.10 0.00 0.00 60.65 59.86 1x6d s ILE 44 Cb -0.15 -3.06 -0.03 0.00 -1.06 0.00 0.00 42.46 38.16 1x6d s ILE 44 CO 0.14 0.02 0.08 0.42 -0.10 0.00 0.00 174.94 175.50 1x6d s THR 45 N -1.15 0.89 -0.62 2.92 -4.23 0.25 -1.04 115.64 112.67 1x6d s THR 45 Ca 0.55 -2.00 -0.28 0.00 -1.18 0.00 0.00 61.69 58.79 1x6d s THR 45 Cb -0.45 -2.41 0.02 0.00 1.34 0.00 0.00 72.50 71.00 1x6d s THR 45 CO 0.60 0.00 1.34 -0.69 -0.54 0.00 0.00 174.62 175.33 1x6d s VAL 46 N -3.13 3.81 0.06 2.29 1.01 -1.12 0.19 120.40 123.51 1x6d s VAL 46 Ca 0.22 0.64 -0.33 0.00 0.00 0.00 0.00 61.98 62.52 1x6d s VAL 46 Cb 0.04 -4.62 -0.17 0.00 0.00 0.00 0.00 36.38 31.63 1x6d s VAL 46 CO 0.12 -1.38 1.50 -0.74 0.00 0.00 0.00 175.10 174.60 1x6d h HIS 47 N 10.58 -1.18 -3.37 5.22 2.76 -1.63 -2.46 115.15 125.06 1x6d h HIS 47 Ca -0.27 -0.01 -0.09 0.00 -2.20 0.00 0.00 60.37 57.80 1x6d h HIS 47 Cb 1.07 0.42 -0.16 0.00 1.55 0.00 0.00 27.41 30.29 1x6d h HIS 47 CO 1.06 -0.66 -0.26 1.03 -1.30 0.00 0.00 177.93 177.80 1x6d s ARG 48 N -5.60 0.83 -0.37 5.26 3.00 -1.26 -4.73 118.95 116.08 1x6d s ARG 48 Ca -0.17 -0.57 0.03 0.00 0.00 0.00 0.00 55.73 55.02 1x6d s ARG 48 Cb 0.03 0.35 0.11 0.00 0.00 0.00 0.00 34.95 35.44 1x6d s ARG 48 CO 0.53 -0.27 0.10 0.08 0.00 0.00 0.00 175.30 175.75 1x6d s VAL 49 N -2.78 1.93 0.72 3.52 1.01 -1.26 -1.58 120.40 121.96 1x6d s VAL 49 Ca -0.03 -2.29 -0.17 0.00 0.00 0.00 0.00 61.98 59.49 1x6d s VAL 49 Cb -0.00 -2.42 -0.15 0.00 0.00 0.00 0.00 36.38 33.81 1x6d s VAL 49 CO -0.05 -0.67 -0.43 0.49 0.00 0.00 0.00 175.10 174.45 1x6d n PHE 50 N 4.17 -3.91 0.11 5.22 3.72 0.34 -4.86 117.46 122.25 1x6d n PHE 50 Ca 0.03 0.23 -0.03 0.00 -0.05 0.00 0.00 57.45 57.63 1x6d n PHE 50 Cb 0.40 -1.56 0.08 0.00 -0.94 0.00 0.00 39.48 37.46 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 -0.45 0.00 -3.35 -1.08 0.13 -2.00 -3.38 132.00 121.88 1x6d h PRO 51 Ca -0.42 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.05 1x6d h PRO 51 Cb 1.37 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 32.11 1x6d h PRO 51 CO 0.33 0.74 -0.47 -0.80 -0.23 0.00 0.00 178.00 177.57 1x6d s ASN 52 N -6.79 4.92 0.11 1.44 0.01 -1.26 -4.96 114.94 108.42 1x6d s ASN 52 Ca -0.00 -3.28 -0.04 0.00 -0.71 0.00 0.00 52.86 48.83 1x6d s ASN 52 Cb 0.12 -1.74 0.02 0.00 0.41 0.00 0.00 41.25 40.06 1x6d s ASN 52 CO 0.78 -0.22 0.22 0.61 -1.51 0.00 0.00 177.10 176.98 1x6d n GLY 53 N 2.82 1.86 0.12 0.66 0.00 -1.26 -4.90 105.19 104.48 1x6d n GLY 53 Ca 0.12 -1.14 -0.22 0.00 0.00 0.00 0.00 46.02 44.78 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 2.16 -0.37 0.99 4.77 0.11 -3.13 117.00 121.53 1x6d n LEU 54 Ca -0.02 0.33 0.31 0.00 -0.03 0.00 0.00 56.01 56.60 1x6d n LEU 54 Cb 0.17 -1.01 0.62 0.00 -2.33 0.00 0.00 43.42 40.87 1x6d n LEU 54 CO 0.08 0.51 1.26 0.00 -1.33 0.00 0.00 177.39 177.91 1x6d h ALA 55 N -0.31 2.67 0.14 -1.18 0.00 -0.95 0.82 119.26 120.44 1x6d h ALA 55 Ca -0.40 0.04 -0.25 0.00 0.00 0.00 0.00 54.91 54.30 1x6d h ALA 55 Cb 1.59 0.09 0.03 0.00 0.00 0.00 0.00 17.79 19.50 1x6d h ALA 55 CO -0.11 -1.12 -1.06 0.77 0.00 0.00 0.00 179.25 177.73 1x6d h SER 56 N 0.20 0.69 -0.32 0.00 0.02 -1.81 -2.50 113.55 109.83 1x6d h SER 56 Ca 0.66 -0.88 0.03 0.00 -0.84 0.00 0.00 61.79 60.77 1x6d h SER 56 Cb 2.08 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 64.37 1x6d h SER 56 CO -0.24 1.51 0.13 1.56 -1.14 0.00 0.00 176.83 178.64 1x6d h GLN 57 N -0.02 0.27 -0.61 3.45 4.20 0.47 -2.28 115.11 120.60 1x6d h GLN 57 Ca -0.17 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.48 1x6d h GLN 57 Cb 1.79 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 29.48 1x6d h GLN 57 CO 0.20 0.18 0.20 1.49 -0.67 0.00 0.00 178.83 180.23 1x6d h GLU 58 N 0.28 0.94 -0.03 1.46 4.57 -0.39 -3.46 114.58 117.95 1x6d h GLU 58 Ca 0.14 -0.20 -0.01 0.00 -1.18 0.00 0.00 59.36 58.11 1x6d h GLU 58 Cb 0.09 -0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 28.54 1x6d h GLU 58 CO -0.13 0.83 -0.01 0.41 -1.18 0.00 0.00 179.01 178.93 1x6d n GLY 59 N -0.73 0.48 0.11 1.92 0.00 -0.86 -4.91 105.19 101.20 1x6d n GLY 59 Ca 0.03 -0.34 -0.22 0.00 0.00 0.00 0.00 46.02 45.49 1x6d n GLY 59 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1x6d n THR 60 N -2.93 1.57 -2.95 2.61 -1.04 -1.25 -4.70 114.28 105.58 1x6d n THR 60 Ca -0.01 -0.11 -0.44 0.00 -2.04 0.00 0.00 64.05 61.46 1x6d n THR 60 Cb 0.04 -2.00 -0.04 0.00 -1.82 0.00 0.00 70.33 66.51 1x6d n THR 60 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1x6d s ILE 61 N -2.39 4.57 -0.11 12.58 1.01 -1.25 -5.00 121.20 130.60 1x6d s ILE 61 Ca -0.28 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 59.57 1x6d s ILE 61 Cb 0.06 -4.64 -0.01 0.00 0.01 0.00 0.00 42.46 37.88 1x6d s ILE 61 CO 0.61 -1.36 -0.15 -1.10 0.00 0.00 0.00 174.94 172.94 1x6d s GLN 62 N 3.34 3.20 -0.48 2.79 -0.21 -1.26 -4.58 119.66 122.46 1x6d s GLN 62 Ca 0.21 -0.72 -0.46 0.00 0.02 0.00 0.00 55.36 54.41 1x6d s GLN 62 Cb -0.17 -2.54 -0.19 0.00 1.00 0.00 0.00 33.01 31.11 1x6d s GLN 62 CO 0.05 0.27 1.55 1.17 -2.12 0.00 0.00 175.29 176.20 1x6d n LYS 63 N 3.35 0.00 0.00 2.91 4.81 -1.26 -0.08 118.16 127.89 1x6d n LYS 63 Ca -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.26 1x6d n LYS 63 Cb 0.53 -1.46 0.00 0.00 0.02 0.00 0.00 35.03 34.12 1x6d n LYS 63 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x6d n GLY 64 N 3.85 2.11 3.54 3.14 0.00 -0.92 -4.99 105.19 111.92 1x6d n GLY 64 Ca 0.30 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.57 1.45 -0.32 1.61 0.02 0.89 -4.78 114.94 112.24 1x6d s ASN 65 Ca 0.00 1.57 -0.10 0.00 -1.02 0.00 0.00 52.86 53.31 1x6d s ASN 65 Cb 0.00 -2.29 0.00 0.00 0.02 0.00 0.00 41.25 38.99 1x6d s ASN 65 CO 0.00 -3.92 0.16 -0.70 0.02 0.00 0.00 177.10 172.66 1x6d s GLU 66 N -4.55 3.18 -0.57 -0.60 2.12 -1.26 -2.79 118.70 114.21 1x6d s GLU 66 Ca 0.68 -0.83 -0.25 0.00 0.36 0.00 0.00 54.97 54.93 1x6d s GLU 66 Cb -0.24 -3.58 0.04 0.00 0.26 0.00 0.00 34.13 30.61 1x6d s GLU 66 CO 0.63 -0.49 1.02 0.08 -0.54 0.00 0.00 175.26 175.96 1x6d s VAL 67 N 1.58 4.26 -0.08 3.70 1.01 -0.20 -4.11 120.40 126.56 1x6d s VAL 67 Ca 0.04 0.39 -0.26 0.00 0.00 0.00 0.00 61.98 62.15 1x6d s VAL 67 Cb -0.18 -4.61 -0.24 0.00 0.00 0.00 0.00 36.38 31.35 1x6d s VAL 67 CO 0.06 -1.23 0.97 -0.07 0.00 0.00 0.00 175.10 174.83 1x6d h LEU 68 N 11.33 0.14 -7.74 3.92 3.38 -1.52 -3.37 115.31 121.45 1x6d h LEU 68 Ca -0.26 -0.82 -0.02 0.00 0.09 0.00 0.00 57.88 56.86 1x6d h LEU 68 Cb 1.07 -0.04 -0.10 0.00 0.09 0.00 0.00 40.66 41.67 1x6d h LEU 68 CO 1.13 0.95 0.01 -0.94 0.09 0.00 0.00 178.44 179.68 1x6d s SER 69 N -6.25 -0.23 -0.06 -0.43 1.04 -1.25 -3.14 113.70 103.37 1x6d s SER 69 Ca -0.17 -0.53 -0.03 0.00 0.48 0.00 0.00 55.95 55.70 1x6d s SER 69 Cb -0.00 0.58 0.04 0.00 0.10 0.00 0.00 66.02 66.73 1x6d s SER 69 CO 0.72 -1.06 0.12 -0.63 0.98 0.00 0.00 173.24 173.37 1x6d s ILE 70 N -3.89 -0.15 0.00 -1.02 1.01 -0.91 -2.64 121.20 113.60 1x6d s ILE 70 Ca 0.10 0.31 0.00 0.00 0.00 0.00 0.00 60.65 61.07 1x6d s ILE 70 Cb -0.01 -0.23 0.00 0.00 0.01 0.00 0.00 42.46 42.23 1x6d s ILE 70 CO -0.02 0.13 0.00 -3.20 0.00 0.00 0.00 174.94 171.85 1x6d n ASN 71 N 4.90 -0.45 0.00 3.58 4.05 0.45 -2.22 115.26 125.57 1x6d n ASN 71 Ca -0.13 0.00 0.00 0.00 0.45 0.00 0.00 54.58 54.90 1x6d n ASN 71 Cb 0.50 -0.42 0.00 0.00 1.23 0.00 0.00 39.78 41.10 1x6d n ASN 71 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1x6d n GLY 72 N -2.06 0.82 3.50 8.20 0.00 -1.25 -4.82 105.19 109.57 1x6d n GLY 72 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 3.31 0.45 1.61 2.20 -0.94 -5.07 119.74 120.42 1x6d s LYS 73 Ca 0.00 -0.77 -0.21 0.00 -0.36 0.00 0.00 55.97 54.63 1x6d s LYS 73 Cb 0.00 -3.84 -0.10 0.00 -1.51 0.00 0.00 37.83 32.38 1x6d s LYS 73 CO 0.00 -0.54 1.00 -1.12 -0.36 0.00 0.00 175.35 174.33 1x6d s SER 74 N 1.70 6.64 -0.60 1.43 0.01 -1.26 -2.14 113.70 119.47 1x6d s SER 74 Ca 0.06 1.84 -0.26 0.00 1.31 0.00 0.00 55.95 58.90 1x6d s SER 74 Cb -0.18 -2.55 0.04 0.00 0.21 0.00 0.00 66.02 63.53 1x6d s SER 74 CO 0.10 -0.57 1.09 -0.76 0.41 0.00 0.00 173.24 173.51 1x6d s LEU 75 N -3.26 3.73 -0.04 2.44 1.43 -1.19 -4.84 118.68 116.96 1x6d s LEU 75 Ca 0.64 -0.26 0.09 0.00 -1.03 0.00 0.00 54.13 53.57 1x6d s LEU 75 Cb -0.14 -2.87 0.31 0.00 0.03 0.00 0.00 46.19 43.52 1x6d s LEU 75 CO 0.18 -1.45 1.17 2.29 0.23 0.00 0.00 176.35 178.77 1x6d n LYS 76 N 8.17 2.06 0.00 1.70 -0.00 -1.26 -4.71 118.16 124.13 1x6d n LYS 76 Ca 0.04 -1.22 0.00 0.00 -0.00 0.00 0.00 58.31 57.13 1x6d n LYS 76 Cb 0.48 -1.45 0.00 0.00 -0.00 0.00 0.00 35.03 34.06 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 0.76 1.92 3.69 2.58 0.00 -1.26 -5.10 105.19 107.78 1x6d n GLY 77 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.28 3.50 -1.77 2.61 -1.04 -1.26 -4.26 114.28 111.78 1x6d n THR 78 Ca 0.00 -0.50 -0.32 0.00 -2.04 0.00 0.00 64.05 61.19 1x6d n THR 78 Cb 0.00 -1.46 0.03 0.00 -1.82 0.00 0.00 70.33 67.09 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 -1.33 3.86 0.25 12.58 -4.23 -1.26 -1.96 115.64 123.54 1x6d s THR 79 Ca 0.71 0.73 -0.09 0.00 -1.18 0.00 0.00 61.69 61.86 1x6d s THR 79 Cb -0.44 -3.35 0.34 0.00 1.34 0.00 0.00 72.50 70.38 1x6d s THR 79 CO 0.50 -0.67 1.60 -0.74 -0.54 0.00 0.00 174.62 174.78 1x6d h HIS 80 N -0.20 -0.32 0.56 3.99 2.76 -1.89 0.85 115.15 120.90 1x6d h HIS 80 Ca -0.45 0.07 -0.03 0.00 -2.20 0.00 0.00 60.37 57.76 1x6d h HIS 80 Cb 1.22 0.27 0.01 0.00 1.55 0.00 0.00 27.41 30.45 1x6d h HIS 80 CO 0.60 -0.34 -0.27 1.25 -1.30 0.00 0.00 177.93 177.88 1x6d h HIS 81 N 0.02 -0.69 -1.35 5.26 -0.00 -1.91 0.11 115.15 116.58 1x6d h HIS 81 Ca 0.41 -0.02 0.39 0.00 -0.00 0.00 0.00 60.37 61.16 1x6d h HIS 81 Cb 0.68 0.23 -0.05 0.00 -0.00 0.00 0.00 27.41 28.26 1x6d h HIS 81 CO -0.59 -0.43 1.13 -0.44 -0.00 0.00 0.00 177.93 177.60 1x6d h ASP 82 N -1.06 0.00 0.00 3.26 5.19 -1.64 1.01 116.42 123.18 1x6d h ASP 82 Ca -0.08 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.32 1x6d h ASP 82 Cb 0.57 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.08 1x6d h ASP 82 CO 0.13 0.00 -0.06 0.00 -3.12 0.00 0.00 179.24 176.19 1x6d h ALA 83 N 1.01 0.01 -0.56 3.45 0.00 0.96 -2.12 119.26 122.02 1x6d h ALA 83 Ca 0.64 -0.47 0.11 0.00 0.00 0.00 0.00 54.91 55.19 1x6d h ALA 83 Cb 2.89 0.03 -0.09 0.00 0.00 0.00 0.00 17.79 20.63 1x6d h ALA 83 CO -0.01 0.03 0.06 -0.07 0.00 0.00 0.00 179.25 179.26 1x6d h LEU 84 N -1.00 -0.13 0.46 0.00 3.38 0.35 0.26 115.31 118.64 1x6d h LEU 84 Ca -0.01 0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1x6d h LEU 84 Cb 0.89 0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1x6d h LEU 84 CO -0.01 -0.04 -0.22 0.00 0.09 0.00 0.00 178.44 178.26 1x6d h ALA 85 N 1.47 -0.62 -1.12 1.53 0.00 -0.60 -0.15 119.26 119.78 1x6d h ALA 85 Ca 0.29 -0.16 0.31 0.00 0.00 0.00 0.00 54.91 55.35 1x6d h ALA 85 Cb 0.43 0.24 -0.09 0.00 0.00 0.00 0.00 17.79 18.37 1x6d h ALA 85 CO -0.42 -0.80 0.74 0.82 0.00 0.00 0.00 179.25 179.58 1x6d h ILE 86 N -0.72 0.43 -0.13 0.00 2.04 -0.60 1.55 117.51 120.08 1x6d h ILE 86 Ca -0.06 -0.09 -0.18 0.00 1.00 0.00 0.00 64.86 65.53 1x6d h ILE 86 Cb 0.52 0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1x6d h ILE 86 CO 0.10 0.05 -0.66 0.25 0.00 0.00 0.00 178.15 177.89 1x6d h LEU 87 N 0.26 0.59 -0.01 1.44 7.12 0.17 -2.14 115.31 122.75 1x6d h LEU 87 Ca 0.63 -0.36 0.00 0.00 0.13 0.00 0.00 57.88 58.28 1x6d h LEU 87 Cb 1.84 -0.17 0.00 0.00 -0.53 0.00 0.00 40.66 41.80 1x6d h LEU 87 CO -0.26 1.09 0.00 0.54 -0.13 0.00 0.00 178.44 179.69 1x6d n ARG 88 N -3.90 0.00 -0.03 1.25 1.74 0.50 -2.39 116.66 113.84 1x6d n ARG 88 Ca -0.04 0.16 -0.02 0.00 -0.77 0.00 0.00 57.85 57.18 1x6d n ARG 88 Cb 0.67 -1.51 -0.13 0.00 -1.02 0.00 0.00 32.46 30.47 1x6d n ARG 88 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1x6d n GLN 89 N -1.51 0.66 0.00 5.56 6.02 0.38 -3.92 117.38 124.55 1x6d n GLN 89 Ca 0.05 0.06 0.14 0.00 -0.01 0.00 0.00 57.00 57.24 1x6d n GLN 89 Cb 0.23 -1.64 0.69 0.00 1.02 0.00 0.00 30.24 30.54 1x6d n GLN 89 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1x6d n ALA 90 N -2.52 2.39 1.04 -1.58 0.00 -0.84 -2.50 120.51 116.49 1x6d n ALA 90 Ca -0.18 -0.12 0.11 0.00 0.00 0.00 0.00 53.44 53.25 1x6d n ALA 90 Cb 0.93 -1.47 0.08 0.00 0.00 0.00 0.00 19.45 18.99 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 -1.37 0.37 -0.16 0.00 1.85 -1.16 -4.16 116.66 112.03 1x6d n ARG 91 Ca 0.11 -0.27 -0.09 0.00 -1.00 0.00 0.00 57.85 56.60 1x6d n ARG 91 Cb 0.27 -1.49 -0.00 0.00 -1.05 0.00 0.00 32.46 30.19 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 0.66 0.73 -7.59 2.89 5.08 -1.64 -0.47 114.58 114.24 1x6d h GLU 92 Ca 0.00 -0.18 -0.44 0.00 -1.00 0.00 0.00 59.36 57.74 1x6d h GLU 92 Cb 0.55 -0.09 0.17 0.00 0.50 0.00 0.00 28.75 29.88 1x6d h GLU 92 CO 0.00 0.74 0.29 -1.25 -1.00 0.00 0.00 179.01 177.78 1x6d s PRO 93 N -5.25 -0.01 0.00 2.33 0.04 -1.26 -2.94 135.00 127.91 1x6d s PRO 93 Ca -0.13 -0.14 0.27 0.00 0.04 0.00 0.00 61.00 61.03 1x6d s PRO 93 Cb 0.11 -1.75 0.76 0.00 0.04 0.00 0.00 34.50 33.67 1x6d s PRO 93 CO 0.78 -2.89 1.57 0.54 0.04 0.00 0.00 177.00 177.05 1x6d n ARG 94 N -4.16 1.28 -4.23 4.56 1.74 -1.26 -4.19 116.66 110.41 1x6d n ARG 94 Ca 0.13 -0.81 -0.17 0.00 -0.77 0.00 0.00 57.85 56.22 1x6d n ARG 94 Cb 0.59 -1.48 -0.13 0.00 -1.02 0.00 0.00 32.46 30.42 1x6d n ARG 94 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1x6d s GLN 95 N -2.28 0.72 -0.02 5.56 0.74 -1.26 -0.48 119.66 122.65 1x6d s GLN 95 Ca 0.29 -0.66 0.01 0.00 0.05 0.00 0.00 55.36 55.05 1x6d s GLN 95 Cb 0.20 -0.66 0.01 0.00 1.10 0.00 0.00 33.01 33.66 1x6d s GLN 95 CO 0.44 0.16 -0.02 0.00 -0.55 0.00 0.00 175.29 175.32 1x6d s ALA 96 N -0.89 0.31 -0.19 1.58 0.00 -0.88 -4.87 121.76 116.82 1x6d s ALA 96 Ca -0.02 0.01 -0.02 0.00 0.00 0.00 0.00 51.96 51.94 1x6d s ALA 96 Cb -0.07 -0.21 -0.00 0.00 0.00 0.00 0.00 23.12 22.84 1x6d s ALA 96 CO 0.01 -0.00 -0.11 0.08 0.00 0.00 0.00 175.76 175.74 1x6d s VAL 97 N 0.50 2.89 -0.14 0.00 1.01 -1.26 -1.65 120.40 121.75 1x6d s VAL 97 Ca -0.05 -0.67 -0.00 0.00 0.00 0.00 0.00 61.98 61.26 1x6d s VAL 97 Cb -0.08 -2.27 0.03 0.00 0.00 0.00 0.00 36.38 34.06 1x6d s VAL 97 CO -0.01 0.48 -0.06 -0.63 0.00 0.00 0.00 175.10 174.87 1x6d s ILE 98 N 1.25 1.06 -0.35 2.22 1.09 -1.18 0.17 121.20 125.46 1x6d s ILE 98 Ca 0.03 -0.45 -0.15 0.00 -1.10 0.00 0.00 60.65 58.98 1x6d s ILE 98 Cb -0.14 -1.15 -0.01 0.00 -1.06 0.00 0.00 42.46 40.09 1x6d s ILE 98 CO -0.05 0.25 0.37 -0.69 -0.10 0.00 0.00 174.94 174.72 1x6d s VAL 99 N 1.68 5.16 0.07 2.92 1.01 -1.08 -2.95 120.40 127.21 1x6d s VAL 99 Ca 0.03 0.02 -0.00 0.00 0.00 0.00 0.00 61.98 62.03 1x6d s VAL 99 Cb -0.14 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 1x6d s VAL 99 CO -0.08 -0.12 -0.04 0.42 0.00 0.00 0.00 175.10 175.28 1x6d s THR 100 N 2.03 0.38 0.22 3.92 -4.23 -1.06 -1.53 115.64 115.36 1x6d s THR 100 Ca 0.12 -1.84 0.10 0.00 -1.18 0.00 0.00 61.69 58.88 1x6d s THR 100 Cb -0.17 -1.56 -0.05 0.00 1.34 0.00 0.00 72.50 72.06 1x6d s THR 100 CO 0.12 -0.95 -0.18 0.00 -0.54 0.00 0.00 174.62 173.06 1x6d s ARG 101 N -3.87 1.45 -0.34 3.99 1.70 -1.26 -0.36 118.95 120.26 1x6d s ARG 101 Ca 0.08 -1.60 -0.29 0.00 -0.47 0.00 0.00 55.73 53.45 1x6d s ARG 101 Cb 0.07 -1.45 0.02 0.00 -0.57 0.00 0.00 34.95 33.01 1x6d s ARG 101 CO -0.08 0.27 1.14 0.15 -1.08 0.00 0.00 175.30 175.70 1x6d s LYS 102 N -3.32 3.97 0.00 3.89 -0.14 -1.25 -4.47 119.74 118.43 1x6d s LYS 102 Ca 0.23 1.03 0.00 0.00 -1.36 0.00 0.00 55.97 55.87 1x6d s LYS 102 Cb -0.04 -3.80 0.00 0.00 -1.68 0.00 0.00 37.83 32.31 1x6d s LYS 102 CO 0.10 -1.04 0.00 1.28 -0.76 0.00 0.00 175.35 174.93 1x6d n LEU 103 N 7.23 0.00 -4.66 3.17 4.77 -1.26 -5.09 117.00 121.16 1x6d n LEU 103 Ca 0.13 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.80 1x6d n LEU 103 Cb 0.47 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.74 1x6d n LEU 103 CO 0.62 -0.11 0.66 0.35 -1.33 0.00 0.00 177.39 177.59 1x6d n THR 104 N -0.21 0.00 -1.25 -5.08 -2.24 -1.26 -5.01 114.28 99.22 1x6d n THR 104 Ca 0.00 -0.02 -0.20 0.00 -2.27 0.00 0.00 64.05 61.56 1x6d n THR 104 Cb 0.00 -0.99 0.15 0.00 -2.10 0.00 0.00 70.33 67.39 1x6d n THR 104 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1x6d n PRO 105 N -4.25 -1.64 -4.54 -0.78 -0.04 -1.26 -5.04 135.00 117.44 1x6d n PRO 105 Ca 0.12 -1.28 -0.25 0.00 -0.04 0.00 0.00 63.50 62.04 1x6d n PRO 105 Cb 0.52 -1.01 -0.10 0.00 -0.04 0.00 0.00 33.50 32.88 1x6d n PRO 105 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1x6d s GLU 106 N -4.82 1.85 0.21 0.54 0.41 -1.26 -5.08 118.70 110.55 1x6d s GLU 106 Ca 0.49 -2.08 0.00 0.00 -0.41 0.00 0.00 54.97 52.97 1x6d s GLU 106 Cb -0.03 -1.00 0.00 0.00 -1.78 0.00 0.00 34.13 31.32 1x6d s GLU 106 CO 0.36 -0.27 0.00 0.00 -0.49 0.00 0.00 175.26 174.86 1x6d n ALA 107 N -0.87 3.00 -3.08 5.21 0.00 -1.26 -5.11 120.51 118.40 1x6d n ALA 107 Ca -0.06 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.38 1x6d n ALA 107 Cb 0.66 0.10 -0.00 0.00 0.00 0.00 0.00 19.45 20.21 1x6d n ALA 107 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1x6d n MET 108 N -3.45 -1.09 -1.51 0.00 0.00 -1.26 -4.95 117.12 104.85 1x6d n MET 108 Ca 0.00 1.24 -0.30 0.00 0.00 0.00 0.00 57.70 58.65 1x6d n MET 108 Cb 0.01 -1.66 0.21 0.00 0.00 0.00 0.00 33.22 31.78 1x6d n MET 108 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 1x6d s PRO 109 N -0.83 -0.15 -0.88 2.12 0.04 -1.26 -4.91 135.00 129.13 1x6d s PRO 109 Ca -0.01 -0.19 -0.25 0.00 0.04 0.00 0.00 61.00 60.59 1x6d s PRO 109 Cb 0.00 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.81 1x6d s PRO 109 CO 0.13 -2.98 1.64 -0.51 0.04 0.00 0.00 177.00 175.33 1x6d s ASP 110 N -4.37 5.82 0.08 6.66 1.01 -1.26 -4.85 116.67 119.77 1x6d s ASP 110 Ca 0.72 -0.77 -0.23 0.00 0.71 0.00 0.00 52.55 52.97 1x6d s ASP 110 Cb -0.07 -2.56 -0.09 0.00 1.01 0.00 0.00 42.92 41.21 1x6d s ASP 110 CO 0.54 -2.09 1.38 -0.07 0.21 0.00 0.00 175.17 175.14 1x6d h LEU 111 N 15.02 -1.22-10.42 1.23 4.07 -2.02 -3.41 115.31 118.56 1x6d h LEU 111 Ca 0.02 0.15 -0.47 0.00 0.08 0.00 0.00 57.88 57.66 1x6d h LEU 111 Cb 1.04 0.48 0.05 0.00 1.08 0.00 0.00 40.66 43.31 1x6d h LEU 111 CO 1.30 -0.32 0.10 0.21 -1.08 0.00 0.00 178.44 178.66 1x6d s ASN 112 N -4.19 5.62 -0.43 -0.43 3.84 -1.26 -5.07 114.94 113.02 1x6d s ASN 112 Ca -0.10 0.58 0.00 0.00 0.21 0.00 0.00 52.86 53.55 1x6d s ASN 112 Cb 0.05 -1.62 0.20 0.00 -0.55 0.00 0.00 41.25 39.33 1x6d s ASN 112 CO 0.42 -0.99 0.91 -0.44 -2.79 0.00 0.00 177.10 174.20 1x6d s SER 113 N -4.29 -0.89 0.55 -4.21 0.01 -1.26 -5.16 113.70 98.44 1x6d s SER 113 Ca 0.53 -1.06 0.00 0.00 1.31 0.00 0.00 55.95 56.72 1x6d s SER 113 Cb -0.10 1.17 0.03 0.00 0.21 0.00 0.00 66.02 67.32 1x6d s SER 113 CO 0.43 -0.03 0.78 -0.44 0.41 0.00 0.00 173.24 174.39 1x6d s SER 114 N 0.93 5.35 0.06 2.44 0.01 -1.26 -5.12 113.70 116.10 1x6d s SER 114 Ca 0.27 0.11 -0.06 0.00 1.31 0.00 0.00 55.95 57.58 1x6d s SER 114 Cb 0.06 -1.05 -0.01 0.00 0.21 0.00 0.00 66.02 65.23 1x6d s SER 114 CO -0.08 -1.10 0.12 -0.83 0.41 0.00 0.00 173.24 171.77 1x6d s GLY 115 N -4.39 0.17 0.82 3.44 0.00 -1.26 -5.17 107.32 100.94 1x6d s GLY 115 Ca 0.56 -0.64 -0.12 0.00 0.00 0.00 0.00 44.72 44.52 1x6d s GLY 115 CO 0.39 -0.80 1.11 2.56 0.00 0.00 0.00 173.10 176.36 1x6d s PRO 116 N -3.25 1.89 -0.06 2.90 0.04 -1.26 -5.08 135.00 130.18 1x6d s PRO 116 Ca 0.00 0.56 -0.32 0.00 0.04 0.00 0.00 61.00 61.29 1x6d s PRO 116 Cb 0.02 -1.90 0.13 0.00 0.04 0.00 0.00 34.50 32.79 1x6d s PRO 116 CO -0.08 -1.74 1.26 -1.12 0.04 0.00 0.00 177.00 175.37 1x6d s SER 117 N -3.94 -0.08 -0.10 6.66 0.01 -1.26 -5.19 113.70 109.80 1x6d s SER 117 Ca 0.61 -0.10 -0.33 0.00 1.31 0.00 0.00 55.95 57.44 1x6d s SER 117 Cb -0.14 0.16 0.13 0.00 0.21 0.00 0.00 66.02 66.38 1x6d s SER 117 CO 0.54 -0.29 1.29 -0.55 0.41 0.00 0.00 173.24 174.64 1x6d s SER 118 N -2.75 -0.07 0.00 2.44 0.15 -1.26 -5.37 113.70 106.84 1x6d s SER 118 Ca 0.13 -0.07 0.00 0.00 0.70 0.00 0.00 55.95 56.71 1x6d s SER 118 Cb 0.03 0.13 0.00 0.00 -1.71 0.00 0.00 66.02 64.47 1x6d s SER 118 CO -0.04 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.78