#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 -1.40 1.61 7.64 -1.26 -5.16 113.62 115.05 1x6d n SER 2 Ca 0.00 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.01 1x6d n SER 2 Cb 0.00 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.13 1x6d n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1x6d n SER 3 N 0.00 -7.59 0.00 6.43 7.64 -1.26 -5.08 113.62 113.76 1x6d n SER 3 Ca 0.00 1.49 0.00 0.00 1.01 0.00 0.00 58.87 61.37 1x6d n SER 3 Cb 0.00 -4.76 0.00 0.00 -1.01 0.00 0.00 64.21 58.44 1x6d n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x6d n GLY 4 N -3.88 2.11 3.57 0.23 0.00 -1.26 -5.19 105.19 100.77 1x6d n GLY 4 Ca -0.07 -0.51 -0.05 0.00 0.00 0.00 0.00 46.02 45.38 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 0.00 -0.21 0.00 1.61 1.04 -1.26 -5.17 113.70 109.70 1x6d s SER 5 Ca 0.00 -0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.41 1x6d s SER 5 Cb 0.00 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.36 1x6d s SER 5 CO 0.00 -0.40 0.00 -0.24 0.98 0.00 0.00 173.24 173.58 1x6d n SER 6 N -0.18 0.00 0.00 7.02 2.88 -1.26 -5.02 113.62 117.06 1x6d n SER 6 Ca -0.03 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.51 1x6d n SER 6 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 1x6d n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x6d n GLY 7 N 0.00 0.67 3.04 0.46 0.00 -1.25 -4.97 105.19 103.14 1x6d n GLY 7 Ca 0.00 0.62 -0.32 0.00 0.00 0.00 0.00 46.02 46.32 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 0.00 2.55 -0.12 4.61 0.00 -1.26 -3.36 121.76 124.19 1x6d s ALA 8 Ca 0.00 -1.88 -0.26 0.00 0.00 0.00 0.00 51.96 49.81 1x6d s ALA 8 Cb 0.00 -1.65 0.06 0.00 0.00 0.00 0.00 23.12 21.53 1x6d s ALA 8 CO 0.00 -1.31 0.63 0.99 0.00 0.00 0.00 175.76 176.07 1x6d s THR 9 N 1.10 0.01 -1.34 0.00 2.01 -1.26 -5.06 115.64 111.10 1x6d s THR 9 Ca -0.04 -0.05 -0.16 0.00 0.31 0.00 0.00 61.69 61.75 1x6d s THR 9 Cb -0.20 -0.93 0.01 0.00 0.01 0.00 0.00 72.50 71.40 1x6d s THR 9 CO -0.06 -0.03 2.11 0.18 -0.69 0.00 0.00 174.62 176.14 1x6d n LEU 10 N 1.59 6.14 -3.76 4.42 4.77 -1.26 -4.77 117.00 124.12 1x6d n LEU 10 Ca -0.17 -3.92 0.01 0.00 -0.03 0.00 0.00 56.01 51.89 1x6d n LEU 10 Cb 0.56 -1.60 0.00 0.00 -2.33 0.00 0.00 43.42 40.05 1x6d n LEU 10 CO 0.17 0.71 0.99 -0.54 -1.33 0.00 0.00 177.39 177.39 1x6d s LYS 11 N 3.66 0.62 -0.98 3.23 1.02 -1.26 -5.08 119.74 120.96 1x6d s LYS 11 Ca 0.50 -0.37 -0.23 0.00 0.02 0.00 0.00 55.97 55.88 1x6d s LYS 11 Cb 0.12 0.20 0.01 0.00 -0.52 0.00 0.00 37.83 37.64 1x6d s LYS 11 CO -0.03 -0.29 1.64 -0.65 -0.92 0.00 0.00 175.35 175.10 1x6d s GLN 12 N -2.40 3.20 -0.30 1.68 -1.52 -1.26 -4.80 119.66 114.26 1x6d s GLN 12 Ca 0.19 -0.83 -0.18 0.00 -1.95 0.00 0.00 55.36 52.59 1x6d s GLN 12 Cb 0.02 -5.25 0.18 0.00 -0.22 0.00 0.00 33.01 27.74 1x6d s GLN 12 CO -0.01 -2.66 1.18 -1.17 -0.25 0.00 0.00 175.29 172.38 1x6d s LEU 13 N 6.92 -0.25 0.41 2.90 1.98 -1.26 -5.15 118.68 124.24 1x6d s LEU 13 Ca 0.55 0.33 0.00 0.00 -2.89 0.00 0.00 54.13 52.12 1x6d s LEU 13 Cb -0.02 1.28 0.00 0.00 0.66 0.00 0.00 46.19 48.10 1x6d s LEU 13 CO -0.06 -0.05 0.00 0.47 -1.89 0.00 0.00 176.35 174.82 1x6d n ASP 14 N 4.76 -8.37 -2.30 3.68 9.92 -1.26 -4.64 116.55 118.33 1x6d n ASP 14 Ca -0.07 0.82 -0.03 0.00 -0.53 0.00 0.00 54.79 54.97 1x6d n ASP 14 Cb 0.54 -4.46 0.09 0.00 -0.64 0.00 0.00 41.12 36.65 1x6d n ASP 14 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1x6d n GLY 15 N -4.18 1.71 3.22 0.44 0.00 -1.25 -4.97 105.19 100.15 1x6d n GLY 15 Ca -0.02 -0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 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 0.10 3.18 -0.19 -0.61 -1.09 -1.21 -3.82 121.20 117.55 1x6d s ILE 16 Ca 0.07 -1.08 0.01 0.00 -2.23 0.00 0.00 60.65 57.43 1x6d s ILE 16 Cb 0.35 -2.69 0.02 0.00 -1.58 0.00 0.00 42.46 38.56 1x6d s ILE 16 CO -0.10 0.06 -0.18 -2.28 -1.23 0.00 0.00 174.94 171.21 1x6d s HIS 17 N 1.34 2.85 0.25 3.97 2.46 -1.26 -3.76 115.29 121.14 1x6d s HIS 17 Ca -0.01 -1.72 -0.30 0.00 0.47 0.00 0.00 55.06 53.50 1x6d s HIS 17 Cb -0.18 -1.93 -0.09 0.00 -0.13 0.00 0.00 32.58 30.25 1x6d s HIS 17 CO -0.02 -0.81 1.23 0.08 -2.47 0.00 0.00 174.74 172.75 1x6d s VAL 18 N 1.27 3.25 -0.36 0.89 1.01 -1.26 -4.50 120.40 120.70 1x6d s VAL 18 Ca 0.03 1.14 -0.02 0.00 0.00 0.00 0.00 61.98 63.13 1x6d s VAL 18 Cb -0.14 -3.73 0.08 0.00 0.00 0.00 0.00 36.38 32.60 1x6d s VAL 18 CO -0.12 0.22 0.11 -0.89 0.00 0.00 0.00 175.10 174.43 1x6d s THR 19 N -0.55 3.11 -0.48 3.92 2.01 -1.17 -5.04 115.64 117.43 1x6d s THR 19 Ca 0.51 -1.78 -0.21 0.00 0.31 0.00 0.00 61.69 60.52 1x6d s THR 19 Cb -0.35 -3.00 0.04 0.00 0.01 0.00 0.00 72.50 69.20 1x6d s THR 19 CO 0.42 -0.44 0.68 -0.63 -0.69 0.00 0.00 174.62 173.96 1x6d s ILE 20 N 1.17 4.78 -0.16 1.82 -1.09 -1.26 -3.67 121.20 122.79 1x6d s ILE 20 Ca 0.03 -0.09 -0.11 0.00 -2.23 0.00 0.00 60.65 58.24 1x6d s ILE 20 Cb -0.21 -4.29 -0.05 0.00 -1.58 0.00 0.00 42.46 36.33 1x6d s ILE 20 CO -0.03 -0.75 0.22 -0.76 -1.23 0.00 0.00 174.94 172.39 1x6d s LEU 21 N 2.91 4.27 -0.40 2.97 2.01 -1.14 -4.99 118.68 124.32 1x6d s LEU 21 Ca 0.21 0.43 -0.05 0.00 0.01 0.00 0.00 54.13 54.73 1x6d s LEU 21 Cb -0.16 -2.23 0.09 0.00 0.01 0.00 0.00 46.19 43.90 1x6d s LEU 21 CO 0.16 0.19 0.19 -1.00 1.01 0.00 0.00 176.35 176.91 1x6d s HIS 22 N 0.09 3.45 0.21 0.29 3.76 -1.26 -2.60 115.29 119.23 1x6d s HIS 22 Ca 0.14 -2.03 0.02 0.00 -0.15 0.00 0.00 55.06 53.04 1x6d s HIS 22 Cb -0.12 -2.96 -0.01 0.00 1.11 0.00 0.00 32.58 30.60 1x6d s HIS 22 CO 0.02 -0.91 0.07 0.36 -0.85 0.00 0.00 174.74 173.44 1x6d n LYS 23 N 4.71 0.79 -2.33 1.40 0.00 0.47 -5.01 118.16 118.19 1x6d n LYS 23 Ca -0.07 -1.78 -0.25 0.00 -0.00 0.00 0.00 58.31 56.21 1x6d n LYS 23 Cb 0.42 0.94 0.06 0.00 -0.00 0.00 0.00 35.03 36.45 1x6d n LYS 23 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 1x6d s GLU 24 N -2.81 2.34 -0.55 -1.58 -1.05 -1.26 -4.28 118.70 109.51 1x6d s GLU 24 Ca 0.10 -0.37 -0.27 0.00 -0.15 0.00 0.00 54.97 54.28 1x6d s GLU 24 Cb 0.00 -2.26 -0.03 0.00 -0.44 0.00 0.00 34.13 31.40 1x6d s GLU 24 CO 0.07 -1.06 1.97 -1.21 0.95 0.00 0.00 175.26 175.98 1x6d s GLU 25 N -5.10 2.60 0.00 -4.83 2.02 -1.26 -1.14 118.70 111.00 1x6d s GLU 25 Ca 0.59 0.87 0.00 0.00 0.02 0.00 0.00 54.97 56.45 1x6d s GLU 25 Cb -0.11 -4.41 0.00 0.00 0.10 0.00 0.00 34.13 29.72 1x6d s GLU 25 CO 0.43 -2.74 0.00 0.41 0.02 0.00 0.00 175.26 173.38 1x6d n GLY 26 N 5.73 0.75 0.26 -1.39 0.00 0.19 -4.94 105.19 105.79 1x6d n GLY 26 Ca 0.24 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.25 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 1.38 0.00 4.61 0.00 -1.25 -3.49 119.26 120.52 1x6d h ALA 27 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1x6d h ALA 27 Cb 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1x6d h ALA 27 CO 0.00 0.42 0.00 0.41 0.00 0.00 0.00 179.25 180.08 1x6d n GLY 28 N -0.81 2.34 0.10 0.00 0.00 -1.26 -4.90 105.19 100.65 1x6d n GLY 28 Ca 0.01 -1.88 -0.19 0.00 0.00 0.00 0.00 46.02 43.95 1x6d n GLY 28 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1x6d h LEU 29 N 0.00 0.17 0.00 0.99 3.38 -1.92 -3.46 115.31 114.46 1x6d h LEU 29 Ca 0.00 -0.82 0.00 0.00 0.09 0.00 0.00 57.88 57.15 1x6d h LEU 29 Cb 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1x6d h LEU 29 CO 0.00 1.35 0.00 0.61 0.09 0.00 0.00 178.44 180.49 1x6d n GLY 30 N 1.61 1.01 3.23 0.83 0.00 -1.26 -1.59 105.19 109.02 1x6d n GLY 30 Ca -0.20 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.63 1.19 0.31 1.61 -0.71 -1.26 0.19 117.98 117.68 1x6d s PHE 31 Ca 0.00 -1.20 0.09 0.00 -1.04 0.00 0.00 56.93 54.78 1x6d s PHE 31 Cb 0.00 -0.66 -0.06 0.00 -1.21 0.00 0.00 43.02 41.09 1x6d s PHE 31 CO 0.00 -0.42 -0.11 0.45 -1.34 0.00 0.00 175.22 173.80 1x6d s SER 32 N -3.17 3.40 0.36 1.98 0.15 0.10 -4.97 113.70 111.55 1x6d s SER 32 Ca 0.31 -1.15 -0.02 0.00 0.70 0.00 0.00 55.95 55.80 1x6d s SER 32 Cb 0.07 -0.28 -0.04 0.00 -1.71 0.00 0.00 66.02 64.06 1x6d s SER 32 CO 0.08 -0.18 0.60 -0.76 1.20 0.00 0.00 173.24 174.17 1x6d s LEU 33 N -3.53 3.95 0.01 3.45 1.43 -1.26 -0.99 118.68 121.73 1x6d s LEU 33 Ca 0.31 0.59 -0.07 0.00 -1.03 0.00 0.00 54.13 53.93 1x6d s LEU 33 Cb 0.01 -3.47 -0.00 0.00 0.03 0.00 0.00 46.19 42.76 1x6d s LEU 33 CO 0.14 -0.33 0.13 0.00 0.23 0.00 0.00 176.35 176.52 1x6d s ALA 34 N -2.36 -0.30 0.00 4.21 0.00 0.49 -4.15 121.76 119.66 1x6d s ALA 34 Ca 0.42 -0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.21 1x6d s ALA 34 Cb -0.10 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.14 1x6d s ALA 34 CO 0.37 -0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.33 1x6d n GLY 35 N 1.43 -1.38 0.00 0.00 0.00 -1.26 0.15 105.19 104.12 1x6d n GLY 35 Ca -0.23 -1.56 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 -1.42 1.04 0.11 -0.02 0.00 0.22 -4.44 105.19 100.67 1x6d n GLY 36 Ca 0.00 -0.80 -0.20 0.00 0.00 0.00 0.00 46.02 45.03 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 0.06 0.00 4.61 0.00 -1.60 -2.98 119.26 121.35 1x6d h ALA 37 Ca 0.00 -0.86 -0.04 0.00 0.00 0.00 0.00 54.91 54.01 1x6d h ALA 37 Cb 0.00 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1x6d h ALA 37 CO 0.00 0.52 -0.18 0.22 0.00 0.00 0.00 179.25 179.81 1x6d h ASP 38 N -0.51 0.00 -3.98 0.00 1.82 -1.86 -3.45 116.42 108.44 1x6d h ASP 38 Ca -0.20 0.00 -0.44 0.00 -0.39 0.00 0.00 57.03 56.00 1x6d h ASP 38 Cb 1.55 0.00 0.17 0.00 0.68 0.00 0.00 39.33 41.73 1x6d h ASP 38 CO 0.06 0.18 0.40 -0.76 -1.61 0.00 0.00 179.24 177.51 1x6d s LEU 39 N -6.59 2.55 0.12 2.28 1.02 -1.24 -4.98 118.68 111.83 1x6d s LEU 39 Ca 0.01 0.30 -0.12 0.00 0.02 0.00 0.00 54.13 54.34 1x6d s LEU 39 Cb 0.09 -2.31 -0.09 0.00 0.02 0.00 0.00 46.19 43.90 1x6d s LEU 39 CO 0.63 -2.85 1.41 1.05 0.02 0.00 0.00 176.35 176.60 1x6d h GLU 40 N -1.73 0.84 -5.88 1.70 4.11 -1.86 -3.39 114.58 108.38 1x6d h GLU 40 Ca -0.44 -0.51 -0.60 0.00 0.07 0.00 0.00 59.36 57.87 1x6d h GLU 40 Cb 1.24 0.05 -0.11 0.00 0.50 0.00 0.00 28.75 30.43 1x6d h GLU 40 CO 0.38 1.15 1.07 -0.80 0.07 0.00 0.00 179.01 180.88 1x6d s ASN 41 N -6.85 6.35 0.19 3.06 0.01 -1.26 -4.85 114.94 111.60 1x6d s ASN 41 Ca -0.11 -1.15 -0.12 0.00 -0.71 0.00 0.00 52.86 50.77 1x6d s ASN 41 Cb 0.10 -2.51 0.18 0.00 0.41 0.00 0.00 41.25 39.43 1x6d s ASN 41 CO 0.88 -1.52 1.78 0.11 -1.51 0.00 0.00 177.10 176.83 1x6d h LYS 42 N 9.67 0.47 -5.68 -0.60 1.79 -1.72 0.65 116.57 121.15 1x6d h LYS 42 Ca -0.05 -0.03 -0.60 0.00 -2.18 0.00 0.00 60.65 57.79 1x6d h LYS 42 Cb 1.04 -0.11 -0.10 0.00 -1.58 0.00 0.00 32.23 31.48 1x6d h LYS 42 CO 1.28 0.31 0.33 0.54 -1.08 0.00 0.00 179.45 180.84 1x6d s VAL 43 N -6.12 4.88 0.42 0.50 0.11 -1.26 -4.22 120.40 114.72 1x6d s VAL 43 Ca -0.13 1.27 -0.26 0.00 -2.93 0.00 0.00 61.98 59.93 1x6d s VAL 43 Cb 0.15 -4.06 -0.09 0.00 -1.53 0.00 0.00 36.38 30.85 1x6d s VAL 43 CO 0.74 -0.10 1.46 -0.63 -3.33 0.00 0.00 175.10 173.25 1x6d s ILE 44 N 2.75 2.02 0.37 7.04 1.09 -1.26 -4.74 121.20 128.47 1x6d s ILE 44 Ca 0.31 0.02 0.04 0.00 -1.10 0.00 0.00 60.65 59.91 1x6d s ILE 44 Cb -0.15 -3.01 -0.05 0.00 -1.06 0.00 0.00 42.46 38.19 1x6d s ILE 44 CO 0.09 0.00 0.07 0.42 -0.10 0.00 0.00 174.94 175.43 1x6d s THR 45 N -1.17 1.05 -0.57 2.92 -4.23 0.39 -1.39 115.64 112.64 1x6d s THR 45 Ca 0.58 -2.00 -0.28 0.00 -1.18 0.00 0.00 61.69 58.81 1x6d s THR 45 Cb -0.45 -2.62 0.02 0.00 1.34 0.00 0.00 72.50 70.79 1x6d s THR 45 CO 0.60 0.00 1.38 -0.69 -0.54 0.00 0.00 174.62 175.37 1x6d s VAL 46 N -3.21 3.82 0.05 2.29 1.01 -1.24 0.19 120.40 123.31 1x6d s VAL 46 Ca 0.30 0.70 -0.32 0.00 0.00 0.00 0.00 61.98 62.65 1x6d s VAL 46 Cb 0.06 -4.48 -0.18 0.00 0.00 0.00 0.00 36.38 31.78 1x6d s VAL 46 CO 0.14 -1.20 1.49 -0.74 0.00 0.00 0.00 175.10 174.79 1x6d h HIS 47 N 10.84 -1.09 -3.04 5.22 2.76 -1.22 -3.18 115.15 125.43 1x6d h HIS 47 Ca -0.27 -0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 57.78 1x6d h HIS 47 Cb 1.09 0.36 -0.19 0.00 1.55 0.00 0.00 27.41 30.22 1x6d h HIS 47 CO 1.04 -0.67 -0.21 1.03 -1.30 0.00 0.00 177.93 177.81 1x6d s ARG 48 N -5.54 0.77 -0.31 5.26 3.00 -1.24 -4.82 118.95 116.06 1x6d s ARG 48 Ca -0.17 -0.28 0.04 0.00 0.00 0.00 0.00 55.73 55.32 1x6d s ARG 48 Cb 0.02 0.34 0.08 0.00 0.00 0.00 0.00 34.95 35.39 1x6d s ARG 48 CO 0.51 -0.23 -0.01 0.08 0.00 0.00 0.00 175.30 175.65 1x6d s VAL 49 N -1.83 2.23 0.75 3.52 1.01 -1.26 -0.72 120.40 124.09 1x6d s VAL 49 Ca -0.10 -2.08 -0.17 0.00 0.00 0.00 0.00 61.98 59.64 1x6d s VAL 49 Cb -0.03 -2.53 -0.09 0.00 0.00 0.00 0.00 36.38 33.73 1x6d s VAL 49 CO 0.02 -0.39 -0.01 0.49 0.00 0.00 0.00 175.10 175.21 1x6d n PHE 50 N 4.32 -2.59 0.12 5.22 3.72 0.51 -4.88 117.46 123.88 1x6d n PHE 50 Ca -0.03 0.27 -0.02 0.00 -0.05 0.00 0.00 57.45 57.62 1x6d n PHE 50 Cb 0.42 -1.72 0.08 0.00 -0.94 0.00 0.00 39.48 37.33 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 -0.51 0.00 -3.36 -1.08 0.13 -1.99 -3.38 132.00 121.81 1x6d h PRO 51 Ca -0.44 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.03 1x6d h PRO 51 Cb 1.36 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 32.11 1x6d h PRO 51 CO 0.37 0.72 -0.44 -0.80 -0.23 0.00 0.00 178.00 177.62 1x6d s ASN 52 N -6.76 5.01 0.00 1.44 0.01 -1.26 -4.93 114.94 108.45 1x6d s ASN 52 Ca -0.00 -3.29 0.00 0.00 -0.71 0.00 0.00 52.86 48.85 1x6d s ASN 52 Cb 0.12 -1.75 0.00 0.00 0.41 0.00 0.00 41.25 40.02 1x6d s ASN 52 CO 0.77 -0.23 0.00 0.61 -1.51 0.00 0.00 177.10 176.75 1x6d n GLY 53 N 2.81 2.37 0.11 0.66 0.00 -1.26 -4.89 105.19 104.99 1x6d n GLY 53 Ca 0.12 -0.97 -0.19 0.00 0.00 0.00 0.00 46.02 44.98 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 1.90 -0.54 0.99 4.77 -0.62 -3.13 117.00 120.37 1x6d n LEU 54 Ca 0.00 0.42 0.45 0.00 -0.03 0.00 0.00 56.01 56.85 1x6d n LEU 54 Cb 0.00 -0.86 0.74 0.00 -2.33 0.00 0.00 43.42 40.98 1x6d n LEU 54 CO 0.00 0.14 1.42 0.00 -1.33 0.00 0.00 177.39 177.62 1x6d h ALA 55 N -0.85 3.55 0.08 -1.18 0.00 -1.87 1.47 119.26 120.45 1x6d h ALA 55 Ca -0.34 -0.06 -0.22 0.00 0.00 0.00 0.00 54.91 54.29 1x6d h ALA 55 Cb 1.21 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 1x6d h ALA 55 CO -0.21 -2.12 -1.16 1.03 0.00 0.00 0.00 179.25 176.80 1x6d h SER 56 N 0.00 0.26 -0.52 0.00 0.87 -1.79 -2.95 113.55 109.42 1x6d h SER 56 Ca 0.78 -0.81 0.03 0.00 -1.23 0.00 0.00 61.79 60.56 1x6d h SER 56 Cb 3.31 -0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 65.15 1x6d h SER 56 CO -0.01 1.50 0.29 1.56 -0.53 0.00 0.00 176.83 179.64 1x6d h GLN 57 N -0.53 0.56 0.84 2.24 4.20 0.17 -3.01 115.11 119.57 1x6d h GLN 57 Ca -0.26 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.37 1x6d h GLN 57 Cb 1.56 -0.13 0.01 0.00 0.30 0.00 0.00 27.48 29.22 1x6d h GLN 57 CO 0.00 0.37 -0.40 1.49 -0.67 0.00 0.00 178.83 179.63 1x6d h GLU 58 N 0.58 -1.08 0.00 1.46 4.22 0.14 -3.48 114.58 116.42 1x6d h GLU 58 Ca 0.21 0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.73 1x6d h GLU 58 Cb 0.06 0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1x6d h GLU 58 CO -0.12 -0.71 0.00 0.41 -2.18 0.00 0.00 179.01 176.41 1x6d n GLY 59 N -1.23 1.02 0.11 1.92 0.00 -1.12 -4.99 105.19 100.91 1x6d n GLY 59 Ca -0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.94 1.56 -3.03 2.61 -1.04 -1.25 -4.73 114.28 106.45 1x6d n THR 60 Ca 0.00 -0.16 -0.44 0.00 -2.04 0.00 0.00 64.05 61.41 1x6d n THR 60 Cb 0.00 -1.97 -0.04 0.00 -1.82 0.00 0.00 70.33 66.49 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 -2.41 4.69 -0.14 12.58 1.01 -1.24 -4.97 121.20 130.72 1x6d s ILE 61 Ca -0.30 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 59.47 1x6d s ILE 61 Cb 0.07 -4.57 -0.00 0.00 0.01 0.00 0.00 42.46 37.97 1x6d s ILE 61 CO 0.59 -1.25 -0.17 -1.10 0.00 0.00 0.00 174.94 173.01 1x6d s GLN 62 N 3.03 3.18 -0.54 2.79 -0.21 -1.26 -4.50 119.66 122.14 1x6d s GLN 62 Ca 0.16 -0.78 -0.41 0.00 0.02 0.00 0.00 55.36 54.36 1x6d s GLN 62 Cb -0.20 -2.55 -0.18 0.00 1.00 0.00 0.00 33.01 31.08 1x6d s GLN 62 CO 0.06 0.05 2.23 1.17 -2.12 0.00 0.00 175.29 176.67 1x6d n LYS 63 N 3.94 0.19 0.00 2.91 4.81 -1.26 -0.26 118.16 128.49 1x6d n LYS 63 Ca -0.19 0.05 0.00 0.00 -0.87 0.00 0.00 58.31 57.30 1x6d n LYS 63 Cb 0.52 -1.69 0.00 0.00 0.02 0.00 0.00 35.03 33.88 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 7.19 1.16 2.75 3.14 0.00 -1.20 -5.03 105.19 113.19 1x6d n GLY 64 Ca 0.54 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.35 1x6d n GLY 64 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1x6d n ASN 65 N 0.00 -0.12 -4.32 1.61 4.13 0.64 -4.93 115.26 112.27 1x6d n ASN 65 Ca 0.00 -1.31 -0.33 0.00 1.68 0.00 0.00 54.58 54.62 1x6d n ASN 65 Cb 0.00 -0.73 -0.15 0.00 -1.54 0.00 0.00 39.78 37.36 1x6d n ASN 65 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1x6d s GLU 66 N -5.06 3.31 -0.30 3.52 2.12 -1.26 -3.65 118.70 117.38 1x6d s GLU 66 Ca 0.54 -0.71 -0.15 0.00 0.36 0.00 0.00 54.97 55.00 1x6d s GLU 66 Cb -0.02 -2.65 -0.02 0.00 0.26 0.00 0.00 34.13 31.70 1x6d s GLU 66 CO 0.38 0.10 0.39 0.08 -0.54 0.00 0.00 175.26 175.68 1x6d s VAL 67 N 0.62 5.15 -0.18 3.70 1.01 -0.49 -3.13 120.40 127.08 1x6d s VAL 67 Ca -0.08 0.40 -0.21 0.00 0.00 0.00 0.00 61.98 62.09 1x6d s VAL 67 Cb -0.16 -3.78 -0.22 0.00 0.00 0.00 0.00 36.38 32.23 1x6d s VAL 67 CO 0.03 0.03 0.36 -0.07 0.00 0.00 0.00 175.10 175.45 1x6d h LEU 68 N 8.72 0.08 -7.71 3.92 3.38 -1.21 -3.37 115.31 119.12 1x6d h LEU 68 Ca -0.30 -0.66 -0.00 0.00 0.09 0.00 0.00 57.88 57.00 1x6d h LEU 68 Cb 1.15 -0.03 -0.09 0.00 0.09 0.00 0.00 40.66 41.79 1x6d h LEU 68 CO 0.68 1.45 0.10 -0.44 0.09 0.00 0.00 178.44 180.32 1x6d s SER 69 N -6.79 -0.29 -0.05 -0.43 0.01 -1.23 -2.94 113.70 101.98 1x6d s SER 69 Ca -0.26 -0.48 -0.02 0.00 1.31 0.00 0.00 55.95 56.50 1x6d s SER 69 Cb 0.04 0.62 0.03 0.00 0.21 0.00 0.00 66.02 66.93 1x6d s SER 69 CO 0.64 -1.13 0.11 -0.63 0.41 0.00 0.00 173.24 172.65 1x6d s ILE 70 N -3.88 -0.05 -0.43 1.44 1.01 -0.91 -2.35 121.20 116.03 1x6d s ILE 70 Ca 0.10 0.17 0.00 0.00 0.00 0.00 0.00 60.65 60.91 1x6d s ILE 70 Cb -0.02 -0.19 0.00 0.00 0.01 0.00 0.00 42.46 42.25 1x6d s ILE 70 CO -0.01 0.07 0.00 -3.20 0.00 0.00 0.00 174.94 171.80 1x6d n ASN 71 N 4.07 -5.17 0.00 3.58 2.85 0.51 -0.35 115.26 120.74 1x6d n ASN 71 Ca -0.25 0.10 0.00 0.00 -0.11 0.00 0.00 54.58 54.32 1x6d n ASN 71 Cb 0.52 -3.03 0.00 0.00 1.24 0.00 0.00 39.78 38.51 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 -0.25 0.77 3.48 8.20 0.00 -1.25 -4.87 105.19 111.26 1x6d n GLY 72 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 1x6d n GLY 72 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x6d s LYS 73 N -0.64 3.20 0.18 1.61 1.02 0.52 -5.03 119.74 120.60 1x6d s LYS 73 Ca 0.00 -0.65 -0.30 0.00 0.02 0.00 0.00 55.97 55.04 1x6d s LYS 73 Cb 0.00 -4.05 -0.08 0.00 -0.52 0.00 0.00 37.83 33.18 1x6d s LYS 73 CO 0.00 -1.21 1.14 -1.12 -0.92 0.00 0.00 175.35 173.23 1x6d s SER 74 N 2.54 7.20 -0.83 2.83 0.01 -1.26 -2.13 113.70 122.06 1x6d s SER 74 Ca 0.20 2.15 -0.25 0.00 1.31 0.00 0.00 55.95 59.35 1x6d s SER 74 Cb -0.17 -2.61 0.02 0.00 0.21 0.00 0.00 66.02 63.47 1x6d s SER 74 CO 0.15 -0.27 1.54 -0.76 0.41 0.00 0.00 173.24 174.30 1x6d s LEU 75 N -0.37 3.29 -0.03 2.44 1.43 -1.15 -4.77 118.68 119.52 1x6d s LEU 75 Ca 0.50 -0.67 0.08 0.00 -1.03 0.00 0.00 54.13 53.01 1x6d s LEU 75 Cb -0.31 -2.56 0.29 0.00 0.03 0.00 0.00 46.19 43.64 1x6d s LEU 75 CO 0.36 -1.97 1.15 2.29 0.23 0.00 0.00 176.35 178.41 1x6d n LYS 76 N 9.11 1.98 0.00 1.70 0.00 -1.26 -4.70 118.16 124.98 1x6d n LYS 76 Ca 0.21 -1.14 0.00 0.00 -0.00 0.00 0.00 58.31 57.39 1x6d n LYS 76 Cb 0.50 -1.42 0.00 0.00 -0.00 0.00 0.00 35.03 34.11 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 0.74 1.93 3.69 2.58 0.00 -1.26 -5.10 105.19 107.77 1x6d n GLY 77 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.27 2.97 -1.45 2.61 -1.04 -1.26 -4.25 114.28 111.59 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 -1.51 0.17 0.00 -1.82 0.00 0.00 70.33 67.17 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 -1.26 1.92 0.19 12.58 -4.23 -1.26 -2.15 115.64 121.42 1x6d s THR 79 Ca 0.65 0.00 -0.12 0.00 -1.18 0.00 0.00 61.69 61.05 1x6d s THR 79 Cb -0.48 -2.70 0.10 0.00 1.34 0.00 0.00 72.50 70.76 1x6d s THR 79 CO 0.55 0.00 1.78 -0.74 -0.54 0.00 0.00 174.62 175.67 1x6d h HIS 80 N -1.80 0.48 0.45 3.99 2.76 -1.92 0.25 115.15 119.36 1x6d h HIS 80 Ca -0.49 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 57.68 1x6d h HIS 80 Cb 1.31 -0.13 0.00 0.00 1.55 0.00 0.00 27.41 30.14 1x6d h HIS 80 CO -0.42 0.21 -0.22 1.25 -1.30 0.00 0.00 177.93 177.45 1x6d h HIS 81 N 0.50 -0.56 -1.02 5.26 -0.00 -1.92 0.30 115.15 117.72 1x6d h HIS 81 Ca 0.25 -0.01 0.30 0.00 -0.00 0.00 0.00 60.37 60.90 1x6d h HIS 81 Cb 0.19 0.19 -0.04 0.00 -0.00 0.00 0.00 27.41 27.75 1x6d h HIS 81 CO -0.11 -0.35 0.96 -0.44 -0.00 0.00 0.00 177.93 177.99 1x6d h ASP 82 N -1.16 0.00 0.00 3.26 3.32 -1.89 0.41 116.42 120.36 1x6d h ASP 82 Ca -0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1x6d h ASP 82 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1x6d h ASP 82 CO 0.10 0.00 -0.19 0.00 -1.72 0.00 0.00 179.24 177.43 1x6d h ALA 83 N 1.03 0.00 -0.93 3.45 0.00 -0.36 -2.84 119.26 119.61 1x6d h ALA 83 Ca 0.48 -0.21 0.26 0.00 0.00 0.00 0.00 54.91 55.45 1x6d h ALA 83 Cb 2.40 0.19 -0.17 0.00 0.00 0.00 0.00 17.79 20.22 1x6d h ALA 83 CO -0.01 0.19 0.12 -0.07 0.00 0.00 0.00 179.25 179.49 1x6d h LEU 84 N -0.86 -0.27 0.66 0.00 3.38 0.18 0.42 115.31 118.82 1x6d h LEU 84 Ca 0.00 0.25 -0.03 0.00 0.09 0.00 0.00 57.88 58.18 1x6d h LEU 84 Cb 0.19 0.40 0.01 0.00 0.09 0.00 0.00 40.66 41.34 1x6d h LEU 84 CO 0.00 -0.29 -0.32 0.00 0.09 0.00 0.00 178.44 177.92 1x6d h ALA 85 N 1.90 -0.89 -1.02 1.53 0.00 -0.45 -0.14 119.26 120.19 1x6d h ALA 85 Ca 0.59 -0.21 0.29 0.00 0.00 0.00 0.00 54.91 55.58 1x6d h ALA 85 Cb 1.22 0.35 -0.13 0.00 0.00 0.00 0.00 17.79 19.22 1x6d h ALA 85 CO -0.81 -0.96 0.60 0.82 0.00 0.00 0.00 179.25 178.90 1x6d h ILE 86 N -0.97 0.41 -0.32 0.00 2.04 -0.12 1.71 117.51 120.26 1x6d h ILE 86 Ca -0.09 -0.15 -0.10 0.00 1.00 0.00 0.00 64.86 65.52 1x6d h ILE 86 Cb 0.71 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 1x6d h ILE 86 CO 0.15 0.08 -0.23 0.25 0.00 0.00 0.00 178.15 178.40 1x6d h LEU 87 N 0.43 0.62 -0.66 1.44 7.12 0.13 -1.20 115.31 123.18 1x6d h LEU 87 Ca 0.69 -0.21 0.00 0.00 0.13 0.00 0.00 57.88 58.49 1x6d h LEU 87 Cb 1.51 -0.17 0.00 0.00 -0.53 0.00 0.00 40.66 41.48 1x6d h LEU 87 CO -0.52 0.84 0.00 0.03 -0.13 0.00 0.00 178.44 178.66 1x6d h ARG 88 N 0.54 0.00 0.00 1.25 3.08 0.43 -2.71 114.38 116.97 1x6d h ARG 88 Ca 0.08 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.88 1x6d h ARG 88 Cb 0.68 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.69 1x6d h ARG 88 CO 0.05 0.00 -1.57 1.96 -1.07 0.00 0.00 179.97 179.34 1x6d h GLN 89 N 0.00 0.00 0.00 0.04 4.20 0.25 -3.29 115.11 116.32 1x6d h GLN 89 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1x6d h GLN 89 Cb 0.52 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.30 1x6d h GLN 89 CO 0.00 0.45 0.00 0.00 -0.67 0.00 0.00 178.83 178.61 1x6d n ALA 90 N -2.49 2.18 1.01 3.87 0.00 -0.54 -2.17 120.51 122.36 1x6d n ALA 90 Ca -0.14 -0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.31 1x6d n ALA 90 Cb 0.98 -1.40 -0.03 0.00 0.00 0.00 0.00 19.45 19.00 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 0.13 -0.14 0.00 1.85 -1.15 -4.24 116.66 111.72 1x6d n ARG 91 Ca 0.09 -0.10 -0.10 0.00 -1.00 0.00 0.00 57.85 56.73 1x6d n ARG 91 Cb 0.24 -1.50 -0.01 0.00 -1.05 0.00 0.00 32.46 30.14 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 0.25 0.67 0.00 2.89 4.39 -1.53 0.57 114.58 121.82 1x6d h GLU 92 Ca 0.00 -0.19 -0.35 0.00 0.34 0.00 0.00 59.36 59.15 1x6d h GLU 92 Cb 0.52 -0.07 0.16 0.00 -0.10 0.00 0.00 28.75 29.26 1x6d h GLU 92 CO 0.00 0.74 0.23 -0.35 -1.16 0.00 0.00 179.01 178.47 1x6d n PRO 93 N -4.50 -1.95 0.06 2.33 -0.04 -1.26 -2.61 135.00 127.02 1x6d n PRO 93 Ca -0.01 -1.62 0.11 0.00 -0.04 0.00 0.00 63.50 61.94 1x6d n PRO 93 Cb 0.25 -1.28 -0.00 0.00 -0.04 0.00 0.00 33.50 32.43 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 -3.86 0.48 -4.35 0.54 1.74 -1.26 -3.73 116.66 106.21 1x6d n ARG 94 Ca 0.14 0.03 -0.21 0.00 -0.77 0.00 0.00 57.85 57.04 1x6d n ARG 94 Cb 0.50 -1.69 -0.13 0.00 -1.02 0.00 0.00 32.46 30.12 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 -3.31 0.99 0.03 5.56 0.74 -1.26 0.18 119.66 122.59 1x6d s GLN 95 Ca 0.00 -0.87 0.03 0.00 0.05 0.00 0.00 55.36 54.57 1x6d s GLN 95 Cb 0.12 -1.04 -0.02 0.00 1.10 0.00 0.00 33.01 33.17 1x6d s GLN 95 CO 0.81 0.25 -0.09 0.00 -0.55 0.00 0.00 175.29 175.71 1x6d s ALA 96 N -0.97 0.70 -0.20 1.58 0.00 -1.07 -4.93 121.76 116.86 1x6d s ALA 96 Ca 0.02 -0.68 0.01 0.00 0.00 0.00 0.00 51.96 51.32 1x6d s ALA 96 Cb -0.09 -0.04 0.03 0.00 0.00 0.00 0.00 23.12 23.02 1x6d s ALA 96 CO 0.02 0.07 -0.17 0.08 0.00 0.00 0.00 175.76 175.75 1x6d s VAL 97 N -1.00 2.14 -0.08 0.00 1.01 -1.26 -2.88 120.40 118.34 1x6d s VAL 97 Ca -0.05 -1.07 0.03 0.00 0.00 0.00 0.00 61.98 60.89 1x6d s VAL 97 Cb -0.08 -1.98 0.01 0.00 0.00 0.00 0.00 36.38 34.33 1x6d s VAL 97 CO 0.01 0.42 -0.15 -0.63 0.00 0.00 0.00 175.10 174.74 1x6d s ILE 98 N 1.26 1.39 -0.29 2.22 1.09 -1.24 0.19 121.20 125.82 1x6d s ILE 98 Ca 0.02 -0.62 -0.04 0.00 -1.10 0.00 0.00 60.65 58.90 1x6d s ILE 98 Cb -0.15 -1.24 0.02 0.00 -1.06 0.00 0.00 42.46 40.04 1x6d s ILE 98 CO -0.11 0.41 0.03 -0.69 -0.10 0.00 0.00 174.94 174.48 1x6d s VAL 99 N 0.59 3.46 0.05 2.92 1.01 -0.99 -3.06 120.40 124.37 1x6d s VAL 99 Ca -0.16 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 60.90 1x6d s VAL 99 Cb -0.16 -2.83 -0.03 0.00 0.00 0.00 0.00 36.38 33.36 1x6d s VAL 99 CO 0.05 0.06 -0.09 0.42 0.00 0.00 0.00 175.10 175.54 1x6d s THR 100 N 1.40 0.65 0.02 3.92 -4.23 -1.26 -0.77 115.64 115.37 1x6d s THR 100 Ca 0.00 -1.17 -0.00 0.00 -1.18 0.00 0.00 61.69 59.34 1x6d s THR 100 Cb -0.18 -0.75 -0.04 0.00 1.34 0.00 0.00 72.50 72.88 1x6d s THR 100 CO -0.00 -0.38 0.13 -0.13 -0.54 0.00 0.00 174.62 173.70 1x6d s ARG 101 N -1.73 3.20 0.37 3.99 3.00 -1.18 -4.15 118.95 122.45 1x6d s ARG 101 Ca -0.07 -0.47 0.27 0.00 0.00 0.00 0.00 55.73 55.46 1x6d s ARG 101 Cb -0.09 -2.93 0.99 0.00 0.00 0.00 0.00 34.95 32.91 1x6d s ARG 101 CO 0.01 0.63 1.80 1.57 0.00 0.00 0.00 175.30 179.31 1x6d h LYS 102 N 3.71 0.00 0.00 3.54 5.09 -1.94 -3.34 116.57 123.63 1x6d h LYS 102 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.26 1x6d h LYS 102 Cb 1.18 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.51 1x6d h LYS 102 CO 0.67 0.00 0.00 1.28 -2.09 0.00 0.00 179.45 179.31 1x6d n LEU 103 N -2.65 0.00 -4.89 7.07 4.77 -1.26 -4.52 117.00 115.52 1x6d n LEU 103 Ca 0.02 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.72 1x6d n LEU 103 Cb 0.33 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.43 1x6d n LEU 103 CO 0.26 0.00 0.58 0.42 -1.33 0.00 0.00 177.39 177.32 1x6d s THR 104 N 0.00 4.59 0.91 -5.08 -4.23 -1.26 -5.07 115.64 105.50 1x6d s THR 104 Ca 0.00 0.45 -0.12 0.00 -1.18 0.00 0.00 61.69 60.83 1x6d s THR 104 Cb 0.00 -3.79 0.14 0.00 1.34 0.00 0.00 72.50 70.19 1x6d s THR 104 CO 0.00 -0.90 1.14 -2.16 -0.54 0.00 0.00 174.62 172.16 1x6d s PRO 105 N -4.98 1.11 -0.36 3.99 0.04 -1.26 -5.03 135.00 128.50 1x6d s PRO 105 Ca 0.52 0.28 0.13 0.00 0.04 0.00 0.00 61.00 61.97 1x6d s PRO 105 Cb -0.11 -1.84 0.38 0.00 0.04 0.00 0.00 34.50 32.98 1x6d s PRO 105 CO 0.49 -2.22 0.84 -0.85 0.04 0.00 0.00 177.00 175.30 1x6d n GLU 106 N -3.78 1.03 -3.10 4.56 0.28 -1.26 -5.01 120.64 113.36 1x6d n GLU 106 Ca 0.07 -3.19 0.04 0.00 -0.16 0.00 0.00 57.16 53.91 1x6d n GLU 106 Cb 0.59 -1.47 -0.00 0.00 1.43 0.00 0.00 31.44 31.99 1x6d n GLU 106 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1x6d s ALA 107 N -2.36 -3.42 0.86 -1.84 0.00 -1.26 -5.16 121.76 108.57 1x6d s ALA 107 Ca 0.34 1.14 -0.17 0.00 0.00 0.00 0.00 51.96 53.28 1x6d s ALA 107 Cb 0.38 -2.76 -0.12 0.00 0.00 0.00 0.00 23.12 20.62 1x6d s ALA 107 CO -0.04 -2.08 -0.42 0.00 0.00 0.00 0.00 175.76 173.22 1x6d n MET 108 N 4.94 -0.00 -2.40 0.00 0.00 -1.26 -4.81 117.12 113.60 1x6d n MET 108 Ca 0.08 0.01 -0.43 0.00 0.00 0.00 0.00 57.70 57.36 1x6d n MET 108 Cb 0.57 -1.15 -0.02 0.00 0.00 0.00 0.00 33.22 32.62 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 -1.99 4.07 -0.69 3.17 0.04 -1.26 -4.97 135.00 133.36 1x6d s PRO 109 Ca 0.48 1.49 -0.12 0.00 0.04 0.00 0.00 61.00 62.89 1x6d s PRO 109 Cb -0.27 -3.84 0.18 0.00 0.04 0.00 0.00 34.50 30.61 1x6d s PRO 109 CO 0.75 -0.92 0.61 0.34 0.04 0.00 0.00 177.00 177.82 1x6d s ASP 110 N 2.49 6.30 -1.29 6.66 2.15 -1.26 -4.94 116.67 126.79 1x6d s ASP 110 Ca 0.57 -2.42 -0.06 0.00 0.43 0.00 0.00 52.55 51.06 1x6d s ASP 110 Cb -0.20 -2.14 0.05 0.00 -0.30 0.00 0.00 42.92 40.33 1x6d s ASP 110 CO 0.19 -0.62 2.60 0.18 -0.17 0.00 0.00 175.17 177.35 1x6d n LEU 111 N 4.30 8.03 0.00 -1.34 4.32 -1.26 -4.55 117.00 126.50 1x6d n LEU 111 Ca 0.04 -4.64 0.00 0.00 -0.02 0.00 0.00 56.01 51.39 1x6d n LEU 111 Cb 0.43 -1.40 0.00 0.00 -1.62 0.00 0.00 43.42 40.83 1x6d n LEU 111 CO 0.39 2.03 0.00 -3.20 -1.22 0.00 0.00 177.39 175.39 1x6d n ASN 112 N 2.15 0.00 -4.09 -1.43 2.85 -1.26 -5.16 115.26 108.31 1x6d n ASN 112 Ca 0.65 0.00 -0.26 0.00 -0.11 0.00 0.00 54.58 54.86 1x6d n ASN 112 Cb 0.29 0.00 -0.16 0.00 1.24 0.00 0.00 39.78 41.14 1x6d n ASN 112 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1x6d s SER 113 N 0.00 2.12 0.17 1.20 0.15 -1.26 -5.14 113.70 110.94 1x6d s SER 113 Ca 0.00 -0.36 0.08 0.00 0.70 0.00 0.00 55.95 56.37 1x6d s SER 113 Cb 0.00 -0.86 -0.04 0.00 -1.71 0.00 0.00 66.02 63.41 1x6d s SER 113 CO 0.00 0.09 -0.07 -0.44 1.20 0.00 0.00 173.24 174.02 1x6d s SER 114 N 0.41 4.40 0.00 5.45 0.01 -1.26 -5.03 113.70 117.68 1x6d s SER 114 Ca -0.12 -0.51 0.00 0.00 1.31 0.00 0.00 55.95 56.63 1x6d s SER 114 Cb -0.15 -0.81 0.00 0.00 0.21 0.00 0.00 66.02 65.27 1x6d s SER 114 CO 0.04 0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.41 1x6d n GLY 115 N 0.11 -1.07 0.17 3.44 0.00 -1.26 -5.07 105.19 101.51 1x6d n GLY 115 Ca -0.11 0.42 -0.18 0.00 0.00 0.00 0.00 46.02 46.16 1x6d n GLY 115 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x6d h PRO 116 N 0.00 0.53 -3.06 1.61 0.13 -2.09 -3.50 132.00 125.62 1x6d h PRO 116 Ca 0.00 -0.51 0.34 0.00 -0.87 0.00 0.00 66.00 64.95 1x6d h PRO 116 Cb 0.00 0.13 -0.13 0.00 0.13 0.00 0.00 31.00 31.13 1x6d h PRO 116 CO 0.00 1.15 -0.84 0.43 -0.23 0.00 0.00 178.00 178.51 1x6d n SER 117 N -4.13 -7.86 -1.54 1.44 7.64 -1.26 -5.02 113.62 102.90 1x6d n SER 117 Ca -0.10 0.96 0.02 0.00 1.01 0.00 0.00 58.87 60.76 1x6d n SER 117 Cb 0.70 -4.26 -0.01 0.00 -1.01 0.00 0.00 64.21 59.63 1x6d n SER 117 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1x6d n SER 118 N -4.15 -8.29 0.00 6.43 2.88 -1.26 -5.34 113.62 103.90 1x6d n SER 118 Ca -0.04 1.82 0.00 0.00 -1.33 0.00 0.00 58.87 59.32 1x6d n SER 118 Cb 0.61 -4.99 0.00 0.00 -0.75 0.00 0.00 64.21 59.08 1x6d n SER 118 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42