#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x6d s SER 2 N 0.00 1.02 0.29 1.61 1.04 -1.26 -5.07 113.70 111.33 1x6d s SER 2 Ca 0.00 -0.98 0.00 0.00 0.48 0.00 0.00 55.95 55.45 1x6d s SER 2 Cb 0.00 0.11 0.00 0.00 0.10 0.00 0.00 66.02 66.23 1x6d s SER 2 CO 0.00 -0.47 0.00 -0.24 0.98 0.00 0.00 173.24 173.51 1x6d n SER 3 N 0.06 -8.45 0.00 7.02 2.88 -1.26 -5.07 113.62 108.80 1x6d n SER 3 Ca -0.13 1.20 0.00 0.00 -1.33 0.00 0.00 58.87 58.61 1x6d n SER 3 Cb 0.60 -4.43 0.00 0.00 -0.75 0.00 0.00 64.21 59.63 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 0.83 -0.47 3.64 0.46 0.00 -1.26 -5.18 105.19 103.20 1x6d n GLY 4 Ca 0.00 0.25 -0.07 0.00 0.00 0.00 0.00 46.02 46.20 1x6d n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x6d s SER 5 N 0.00 -0.32 -0.20 1.61 0.15 -1.26 -5.17 113.70 108.51 1x6d s SER 5 Ca 0.00 0.60 -0.11 0.00 0.70 0.00 0.00 55.95 57.14 1x6d s SER 5 Cb 0.00 0.60 0.07 0.00 -1.71 0.00 0.00 66.02 64.97 1x6d s SER 5 CO 0.00 -0.13 0.48 -0.44 1.20 0.00 0.00 173.24 174.36 1x6d s SER 6 N 0.03 -0.62 0.07 5.45 0.01 -1.26 -5.17 113.70 112.21 1x6d s SER 6 Ca 0.04 1.06 -0.11 0.00 1.31 0.00 0.00 55.95 58.25 1x6d s SER 6 Cb -0.05 0.97 0.01 0.00 0.21 0.00 0.00 66.02 67.16 1x6d s SER 6 CO -0.08 -0.21 0.26 -0.83 0.41 0.00 0.00 173.24 172.79 1x6d s GLY 7 N 1.52 -0.04 -0.13 3.44 0.00 -1.26 -5.17 107.32 105.69 1x6d s GLY 7 Ca -0.09 -0.26 -0.11 0.00 0.00 0.00 0.00 44.72 44.26 1x6d s GLY 7 CO -0.15 -0.46 0.33 0.00 0.00 0.00 0.00 173.10 172.82 1x6d s ALA 8 N -3.13 -0.83 -0.57 3.20 0.00 -1.26 -4.97 121.76 114.21 1x6d s ALA 8 Ca -0.01 1.00 -0.02 0.00 0.00 0.00 0.00 51.96 52.94 1x6d s ALA 8 Cb 0.01 -0.59 0.00 0.00 0.00 0.00 0.00 23.12 22.54 1x6d s ALA 8 CO -0.07 -0.17 0.56 2.41 0.00 0.00 0.00 175.76 178.49 1x6d n THR 9 N 3.14 -8.63 -3.70 0.00 -1.04 -1.26 -5.03 114.28 97.76 1x6d n THR 9 Ca -0.15 -0.06 -0.29 0.00 -2.04 0.00 0.00 64.05 61.51 1x6d n THR 9 Cb 0.57 -6.36 -0.15 0.00 -1.82 0.00 0.00 70.33 62.56 1x6d n THR 9 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1x6d s LEU 10 N -3.43 1.75 -0.05 -4.42 1.43 -1.26 -5.12 118.68 107.58 1x6d s LEU 10 Ca 0.03 -1.45 -0.11 0.00 -1.03 0.00 0.00 54.13 51.57 1x6d s LEU 10 Cb -0.01 -0.73 -0.05 0.00 0.03 0.00 0.00 46.19 45.44 1x6d s LEU 10 CO 0.61 -0.40 0.29 -0.54 0.23 0.00 0.00 176.35 176.54 1x6d s LYS 11 N 1.75 3.70 0.00 1.70 1.02 -1.26 -5.01 119.74 121.64 1x6d s LYS 11 Ca 0.08 0.16 0.00 0.00 0.02 0.00 0.00 55.97 56.23 1x6d s LYS 11 Cb -0.17 -3.20 0.00 0.00 -0.52 0.00 0.00 37.83 33.94 1x6d s LYS 11 CO -0.25 0.73 0.00 1.04 -0.92 0.00 0.00 175.35 175.95 1x6d n GLN 12 N 1.87 0.00 -1.84 1.68 6.02 -1.26 -5.11 117.38 118.73 1x6d n GLN 12 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.82 1x6d n GLN 12 Cb 0.54 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.80 1x6d n GLN 12 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1x6d n LEU 13 N 0.00 -5.98 -3.10 1.08 -0.00 -1.26 -4.81 117.00 102.93 1x6d n LEU 13 Ca 0.00 3.04 -0.18 0.00 -0.00 0.00 0.00 56.01 58.87 1x6d n LEU 13 Cb 0.00 -2.92 0.02 0.00 -0.00 0.00 0.00 43.42 40.51 1x6d n LEU 13 CO 0.00 -1.09 -0.04 0.47 -0.00 0.00 0.00 177.39 176.73 1x6d n ASP 14 N 1.08 -7.09 -4.15 1.96 8.00 -1.26 -4.94 116.55 110.14 1x6d n ASP 14 Ca 0.00 0.24 -0.39 0.00 0.71 0.00 0.00 54.79 55.36 1x6d n ASP 14 Cb 0.00 -4.11 -0.09 0.00 -0.02 0.00 0.00 41.12 36.90 1x6d n ASP 14 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1x6d s GLY 15 N -2.28 2.36 0.04 0.44 0.00 -1.26 -5.01 107.32 101.61 1x6d s GLY 15 Ca 0.27 -3.03 0.04 0.00 0.00 0.00 0.00 44.72 42.01 1x6d s GLY 15 CO 0.81 1.11 -0.05 -0.42 0.00 0.00 0.00 173.10 174.55 1x6d s ILE 16 N 0.42 3.76 -0.06 0.90 1.09 -1.26 -1.58 121.20 124.47 1x6d s ILE 16 Ca 0.14 -0.90 -0.02 0.00 -1.10 0.00 0.00 60.65 58.77 1x6d s ILE 16 Cb -0.20 -2.70 0.04 0.00 -1.06 0.00 0.00 42.46 38.53 1x6d s ILE 16 CO -0.04 0.27 0.11 -1.38 -0.10 0.00 0.00 174.94 173.81 1x6d s HIS 17 N -1.13 -0.10 0.18 3.97 -3.43 -1.21 -5.03 115.29 108.54 1x6d s HIS 17 Ca 0.20 0.41 -0.30 0.00 -0.80 0.00 0.00 55.06 54.57 1x6d s HIS 17 Cb -0.11 -0.22 -0.08 0.00 -1.43 0.00 0.00 32.58 30.74 1x6d s HIS 17 CO 0.12 -0.18 1.31 0.08 -2.00 0.00 0.00 174.74 174.07 1x6d s VAL 18 N 1.59 3.27 -0.22 -5.38 1.01 -1.26 -4.42 120.40 114.99 1x6d s VAL 18 Ca -0.04 1.02 -0.02 0.00 0.00 0.00 0.00 61.98 62.94 1x6d s VAL 18 Cb -0.12 -3.65 0.01 0.00 0.00 0.00 0.00 36.38 32.62 1x6d s VAL 18 CO -0.05 0.14 -0.08 -0.89 0.00 0.00 0.00 175.10 174.22 1x6d s THR 19 N 0.31 2.94 -0.38 3.92 2.01 -1.16 -5.05 115.64 118.23 1x6d s THR 19 Ca 0.58 -0.74 -0.08 0.00 0.31 0.00 0.00 61.69 61.76 1x6d s THR 19 Cb -0.36 -2.36 0.05 0.00 0.01 0.00 0.00 72.50 69.84 1x6d s THR 19 CO 0.36 0.39 0.19 -0.63 -0.69 0.00 0.00 174.62 174.24 1x6d s ILE 20 N 1.39 4.10 -0.23 1.82 -1.09 -1.26 -3.36 121.20 122.58 1x6d s ILE 20 Ca 0.04 -1.21 -0.13 0.00 -2.23 0.00 0.00 60.65 57.12 1x6d s ILE 20 Cb -0.15 -3.40 -0.05 0.00 -1.58 0.00 0.00 42.46 37.28 1x6d s ILE 20 CO -0.06 -0.33 0.26 -0.76 -1.23 0.00 0.00 174.94 172.82 1x6d s LEU 21 N 1.43 4.13 -0.52 2.97 2.01 -1.08 -4.96 118.68 122.66 1x6d s LEU 21 Ca 0.01 0.27 -0.18 0.00 0.01 0.00 0.00 54.13 54.25 1x6d s LEU 21 Cb -0.21 -2.28 0.08 0.00 0.01 0.00 0.00 46.19 43.79 1x6d s LEU 21 CO 0.03 -0.00 0.57 -1.00 1.01 0.00 0.00 176.35 176.96 1x6d s HIS 22 N 1.21 3.11 0.47 0.29 3.76 -1.26 -1.99 115.29 120.87 1x6d s HIS 22 Ca 0.12 -0.83 0.02 0.00 -0.15 0.00 0.00 55.06 54.23 1x6d s HIS 22 Cb -0.14 -3.60 -0.01 0.00 1.11 0.00 0.00 32.58 29.94 1x6d s HIS 22 CO 0.06 -1.04 0.08 -1.59 -0.85 0.00 0.00 174.74 171.40 1x6d s LYS 23 N 2.27 2.09 0.45 1.40 -2.85 0.53 -5.01 119.74 118.62 1x6d s LYS 23 Ca 0.10 -2.31 0.06 0.00 -1.00 0.00 0.00 55.97 52.82 1x6d s LYS 23 Cb -0.23 -1.00 0.02 0.00 -2.06 0.00 0.00 37.83 34.55 1x6d s LYS 23 CO 0.08 -0.46 0.62 -1.21 0.10 0.00 0.00 175.35 174.48 1x6d s GLU 24 N -3.77 2.77 -0.42 1.78 2.02 -1.26 -4.26 118.70 115.56 1x6d s GLU 24 Ca 0.14 -1.10 -0.27 0.00 0.02 0.00 0.00 54.97 53.76 1x6d s GLU 24 Cb 0.01 -2.69 -0.06 0.00 0.10 0.00 0.00 34.13 31.49 1x6d s GLU 24 CO 0.09 -0.37 2.37 -1.21 0.02 0.00 0.00 175.26 176.15 1x6d s GLU 25 N -4.45 2.36 0.00 1.61 2.02 -1.25 -0.78 118.70 118.21 1x6d s GLU 25 Ca 0.55 1.58 0.00 0.00 0.02 0.00 0.00 54.97 57.12 1x6d s GLU 25 Cb -0.10 -4.53 0.00 0.00 0.10 0.00 0.00 34.13 29.60 1x6d s GLU 25 CO 0.34 -2.98 0.00 0.41 0.02 0.00 0.00 175.26 173.05 1x6d n GLY 26 N 5.95 0.75 0.10 -1.39 0.00 -0.23 -4.97 105.19 105.40 1x6d n GLY 26 Ca 0.35 -0.74 -0.13 0.00 0.00 0.00 0.00 46.02 45.50 1x6d n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x6d n ALA 27 N -1.88 1.34 0.00 4.61 0.00 0.04 -5.04 120.51 119.59 1x6d n ALA 27 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 53.44 52.61 1x6d n ALA 27 Cb 0.49 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.28 1x6d n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x6d n GLY 28 N 1.74 1.81 0.12 0.00 0.00 -1.26 -4.90 105.19 102.70 1x6d n GLY 28 Ca -0.25 -1.96 -0.22 0.00 0.00 0.00 0.00 46.02 43.59 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 0.00 2.09 0.00 0.99 4.77 -1.26 -4.84 117.00 118.74 1x6d n LEU 29 Ca 0.00 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.33 1x6d n LEU 29 Cb 0.00 -1.00 0.00 0.00 -2.33 0.00 0.00 43.42 40.09 1x6d n LEU 29 CO 0.00 0.46 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1x6d n GLY 30 N 1.58 0.59 3.28 -0.72 0.00 -1.26 -1.17 105.19 107.48 1x6d n GLY 30 Ca -0.34 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.47 1.53 0.36 1.61 -0.71 -1.26 0.78 117.98 118.82 1x6d s PHE 31 Ca 0.00 -1.55 0.04 0.00 -1.04 0.00 0.00 56.93 54.38 1x6d s PHE 31 Cb 0.00 -0.61 -0.05 0.00 -1.21 0.00 0.00 43.02 41.15 1x6d s PHE 31 CO 0.00 -0.84 0.08 0.45 -1.34 0.00 0.00 175.22 173.57 1x6d s SER 32 N -3.30 2.54 0.20 1.98 0.15 -0.52 -4.96 113.70 109.80 1x6d s SER 32 Ca 0.39 -1.48 0.04 0.00 0.70 0.00 0.00 55.95 55.61 1x6d s SER 32 Cb 0.03 0.12 -0.03 0.00 -1.71 0.00 0.00 66.02 64.43 1x6d s SER 32 CO 0.23 -0.71 0.33 -0.76 1.20 0.00 0.00 173.24 173.52 1x6d s LEU 33 N -3.53 4.33 0.02 3.45 1.43 -1.26 -2.17 118.68 120.94 1x6d s LEU 33 Ca 0.32 0.11 -0.03 0.00 -1.03 0.00 0.00 54.13 53.50 1x6d s LEU 33 Cb 0.07 -2.88 -0.01 0.00 0.03 0.00 0.00 46.19 43.39 1x6d s LEU 33 CO 0.15 -0.02 0.03 0.00 0.23 0.00 0.00 176.35 176.74 1x6d s ALA 34 N -1.88 -0.03 0.00 4.21 0.00 0.52 -4.20 121.76 120.38 1x6d s ALA 34 Ca 0.34 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 51.84 1x6d s ALA 34 Cb -0.10 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.17 1x6d s ALA 34 CO 0.29 -0.19 0.00 0.41 0.00 0.00 0.00 175.76 176.26 1x6d n GLY 35 N 1.44 -1.50 3.94 0.00 0.00 -1.26 0.11 105.19 107.93 1x6d n GLY 35 Ca -0.23 -1.54 -0.01 0.00 0.00 0.00 0.00 46.02 44.24 1x6d n GLY 35 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1x6d s GLY 36 N -3.36 0.04 0.04 -0.02 0.00 0.03 -4.35 107.32 99.69 1x6d s GLY 36 Ca 0.00 -0.23 -0.16 0.00 0.00 0.00 0.00 44.72 44.32 1x6d s GLY 36 CO 0.00 4.03 1.09 0.00 0.00 0.00 0.00 173.10 178.23 1x6d h ALA 37 N 2.00 0.01 0.00 3.20 0.00 -1.58 -3.01 119.26 119.88 1x6d h ALA 37 Ca -0.25 -0.72 -0.05 0.00 0.00 0.00 0.00 54.91 53.89 1x6d h ALA 37 Cb 1.20 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1x6d h ALA 37 CO 0.35 0.60 -0.23 0.22 0.00 0.00 0.00 179.25 180.19 1x6d h ASP 38 N 0.17 0.00 -2.37 0.00 3.58 -1.86 -3.45 116.42 112.49 1x6d h ASP 38 Ca -0.16 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.25 1x6d h ASP 38 Cb 1.76 0.00 0.02 0.00 1.72 0.00 0.00 39.33 42.83 1x6d h ASP 38 CO 0.21 0.23 0.04 0.18 -2.88 0.00 0.00 179.24 177.01 1x6d n LEU 39 N -3.35 0.00 0.05 2.28 4.32 -1.19 -4.99 117.00 114.12 1x6d n LEU 39 Ca 0.01 -0.16 -0.08 0.00 -0.02 0.00 0.00 56.01 55.75 1x6d n LEU 39 Cb 0.46 -0.10 -0.13 0.00 -1.62 0.00 0.00 43.42 42.03 1x6d n LEU 39 CO 0.34 -0.59 0.02 -0.33 -1.22 0.00 0.00 177.39 175.60 1x6d h GLU 40 N 0.00 0.03 -5.20 3.23 5.08 -1.86 -3.40 114.58 112.46 1x6d h GLU 40 Ca -0.04 -0.05 -0.68 0.00 -1.00 0.00 0.00 59.36 57.58 1x6d h GLU 40 Cb 0.12 0.02 -0.16 0.00 0.50 0.00 0.00 28.75 29.23 1x6d h GLU 40 CO 0.03 0.95 1.08 -0.80 -1.00 0.00 0.00 179.01 179.27 1x6d s ASN 41 N -6.67 6.68 0.24 1.42 0.01 -1.26 -4.84 114.94 110.53 1x6d s ASN 41 Ca -0.00 -2.10 -0.04 0.00 -0.71 0.00 0.00 52.86 50.00 1x6d s ASN 41 Cb 0.09 -2.43 0.45 0.00 0.41 0.00 0.00 41.25 39.76 1x6d s ASN 41 CO 0.83 -1.09 1.75 0.11 -1.51 0.00 0.00 177.10 177.19 1x6d h LYS 42 N 8.70 0.53 -5.42 -0.60 1.79 -1.75 0.12 116.57 119.93 1x6d h LYS 42 Ca 0.20 -0.03 -0.61 0.00 -2.18 0.00 0.00 60.65 58.03 1x6d h LYS 42 Cb 0.99 -0.12 -0.12 0.00 -1.58 0.00 0.00 32.23 31.40 1x6d h LYS 42 CO 1.20 0.35 -0.00 0.54 -1.08 0.00 0.00 179.45 180.45 1x6d s VAL 43 N -6.02 5.07 0.54 0.50 0.11 -1.26 -4.18 120.40 115.16 1x6d s VAL 43 Ca -0.12 0.93 -0.21 0.00 -2.93 0.00 0.00 61.98 59.64 1x6d s VAL 43 Cb 0.20 -3.84 -0.05 0.00 -1.53 0.00 0.00 36.38 31.16 1x6d s VAL 43 CO 0.77 0.10 1.28 -0.63 -3.33 0.00 0.00 175.10 173.29 1x6d s ILE 44 N 2.15 2.44 0.29 7.04 1.09 -1.26 -4.73 121.20 128.23 1x6d s ILE 44 Ca 0.22 0.32 0.02 0.00 -1.10 0.00 0.00 60.65 60.12 1x6d s ILE 44 Cb -0.16 -3.15 -0.05 0.00 -1.06 0.00 0.00 42.46 38.04 1x6d s ILE 44 CO 0.09 -0.02 0.11 0.42 -0.10 0.00 0.00 174.94 175.45 1x6d s THR 45 N -1.42 0.58 -0.63 2.92 -4.23 0.30 -1.93 115.64 111.22 1x6d s THR 45 Ca 0.71 -2.00 -0.27 0.00 -1.18 0.00 0.00 61.69 58.95 1x6d s THR 45 Cb -0.35 -2.60 0.01 0.00 1.34 0.00 0.00 72.50 70.89 1x6d s THR 45 CO 0.41 0.00 1.53 -0.69 -0.54 0.00 0.00 174.62 175.33 1x6d s VAL 46 N -3.61 3.62 0.06 2.29 1.01 -1.25 0.19 120.40 122.71 1x6d s VAL 46 Ca 0.36 0.43 -0.32 0.00 0.00 0.00 0.00 61.98 62.44 1x6d s VAL 46 Cb 0.07 -4.41 -0.17 0.00 0.00 0.00 0.00 36.38 31.87 1x6d s VAL 46 CO 0.15 -1.29 1.49 -0.74 0.00 0.00 0.00 175.10 174.71 1x6d h HIS 47 N 12.05 -1.18 -3.47 5.22 2.76 -1.60 -2.70 115.15 126.23 1x6d h HIS 47 Ca -0.27 -0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 57.79 1x6d h HIS 47 Cb 1.10 0.43 -0.17 0.00 1.55 0.00 0.00 27.41 30.33 1x6d h HIS 47 CO 1.07 -0.64 -0.32 1.03 -1.30 0.00 0.00 177.93 177.77 1x6d s ARG 48 N -5.54 0.77 -0.39 5.26 3.00 -1.26 -4.74 118.95 116.04 1x6d s ARG 48 Ca -0.16 -0.61 0.03 0.00 0.00 0.00 0.00 55.73 54.98 1x6d s ARG 48 Cb 0.03 0.33 0.11 0.00 0.00 0.00 0.00 34.95 35.42 1x6d s ARG 48 CO 0.52 -0.24 0.13 0.08 0.00 0.00 0.00 175.30 175.80 1x6d s VAL 49 N -2.73 2.05 0.64 3.52 1.01 -1.26 -1.43 120.40 122.20 1x6d s VAL 49 Ca -0.04 -2.49 -0.16 0.00 0.00 0.00 0.00 61.98 59.30 1x6d s VAL 49 Cb -0.00 -2.48 -0.14 0.00 0.00 0.00 0.00 36.38 33.76 1x6d s VAL 49 CO -0.05 -0.70 -0.37 0.49 0.00 0.00 0.00 175.10 174.48 1x6d n PHE 50 N 3.96 -3.50 0.14 5.22 3.72 0.23 -4.85 117.46 122.38 1x6d n PHE 50 Ca 0.04 0.23 0.01 0.00 -0.05 0.00 0.00 57.45 57.68 1x6d n PHE 50 Cb 0.38 -1.44 0.15 0.00 -0.94 0.00 0.00 39.48 37.64 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 -0.37 0.00 -3.34 -1.08 0.13 -1.99 -3.38 132.00 121.96 1x6d h PRO 51 Ca -0.38 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.09 1x6d h PRO 51 Cb 1.26 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 32.00 1x6d h PRO 51 CO 0.31 0.59 -0.49 0.54 -0.23 0.00 0.00 178.00 178.72 1x6d s ASN 52 N -6.62 4.85 0.00 1.44 2.20 -1.26 -4.94 114.94 110.61 1x6d s ASN 52 Ca 0.00 -3.28 0.00 0.00 -0.94 0.00 0.00 52.86 48.65 1x6d s ASN 52 Cb 0.11 -1.72 0.00 0.00 -2.00 0.00 0.00 41.25 37.64 1x6d s ASN 52 CO 0.74 -0.22 0.00 0.61 -2.94 0.00 0.00 177.10 175.30 1x6d n GLY 53 N 2.81 2.40 0.12 0.45 0.00 -1.26 -4.88 105.19 104.83 1x6d n GLY 53 Ca 0.11 -0.98 -0.24 0.00 0.00 0.00 0.00 46.02 44.92 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 1.99 -0.34 0.99 4.77 -0.32 -3.33 117.00 120.75 1x6d n LEU 54 Ca 0.00 0.37 0.22 0.00 -0.03 0.00 0.00 56.01 56.57 1x6d n LEU 54 Cb 0.00 -0.94 0.48 0.00 -2.33 0.00 0.00 43.42 40.62 1x6d n LEU 54 CO 0.00 0.42 1.19 0.00 -1.33 0.00 0.00 177.39 177.68 1x6d h ALA 55 N -0.56 2.10 -0.07 -1.18 0.00 -1.87 1.22 119.26 118.90 1x6d h ALA 55 Ca -0.45 0.10 -0.18 0.00 0.00 0.00 0.00 54.91 54.37 1x6d h ALA 55 Cb 1.47 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.30 1x6d h ALA 55 CO -0.24 -0.56 -0.74 1.03 0.00 0.00 0.00 179.25 178.74 1x6d h SER 56 N 0.43 0.46 -0.14 0.00 0.87 -1.80 -0.27 113.55 113.09 1x6d h SER 56 Ca 0.64 -0.30 -0.05 0.00 -1.23 0.00 0.00 61.79 60.85 1x6d h SER 56 Cb 1.50 -0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 63.33 1x6d h SER 56 CO -0.39 1.04 -0.09 1.56 -0.53 0.00 0.00 176.83 178.43 1x6d h GLN 57 N 0.26 0.31 0.13 2.24 4.20 0.11 -3.27 115.11 119.09 1x6d h GLN 57 Ca -0.03 -0.15 -0.01 0.00 0.06 0.00 0.00 58.65 58.53 1x6d h GLN 57 Cb 1.32 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.09 1x6d h GLN 57 CO 0.13 0.66 -0.06 0.93 -0.67 0.00 0.00 178.83 179.81 1x6d h GLU 58 N -0.04 -0.17 0.00 1.46 4.39 0.29 -3.47 114.58 117.04 1x6d h GLU 58 Ca 0.03 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.74 1x6d h GLU 58 Cb 0.58 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.27 1x6d h GLU 58 CO 0.03 0.14 0.00 0.41 -1.16 0.00 0.00 179.01 178.42 1x6d n GLY 59 N -0.34 0.75 0.06 -3.84 0.00 -0.11 -4.92 105.19 96.79 1x6d n GLY 59 Ca -0.09 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.81 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 1.32 -2.22 2.61 2.02 -1.92 -3.37 112.91 111.35 1x6d h THR 60 Ca 0.00 -0.97 -0.64 0.00 0.77 0.00 0.00 66.41 65.57 1x6d h THR 60 Cb 0.00 1.93 -0.14 0.00 -1.74 0.00 0.00 68.15 68.20 1x6d h THR 60 CO 0.00 0.26 0.90 -0.63 0.37 0.00 0.00 175.52 176.41 1x6d s ILE 61 N -4.59 4.35 -0.19 3.11 1.01 -1.26 -4.97 121.20 118.66 1x6d s ILE 61 Ca -0.15 -0.86 -0.04 0.00 0.00 0.00 0.00 60.65 59.61 1x6d s ILE 61 Cb 0.03 -4.82 -0.02 0.00 0.01 0.00 0.00 42.46 37.66 1x6d s ILE 61 CO 0.68 -1.61 -0.04 -1.10 0.00 0.00 0.00 174.94 172.87 1x6d s GLN 62 N 3.85 3.47 -0.50 2.79 -0.21 -1.26 -4.59 119.66 123.21 1x6d s GLN 62 Ca 0.32 -0.60 -0.44 0.00 0.02 0.00 0.00 55.36 54.66 1x6d s GLN 62 Cb -0.08 -2.96 -0.19 0.00 1.00 0.00 0.00 33.01 30.78 1x6d s GLN 62 CO -0.01 -0.03 2.05 1.17 -2.12 0.00 0.00 175.29 176.35 1x6d n LYS 63 N 4.31 0.02 0.00 2.91 4.81 -1.26 0.14 118.16 129.08 1x6d n LYS 63 Ca -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.27 1x6d n LYS 63 Cb 0.52 -1.51 0.00 0.00 0.02 0.00 0.00 35.03 34.05 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 6.88 1.60 0.00 3.14 0.00 -1.02 -5.00 105.19 110.78 1x6d n GLY 64 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.53 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 -1.03 -4.17 1.61 5.03 0.12 -4.87 115.26 111.95 1x6d n ASN 65 Ca 0.00 -0.46 -0.33 0.00 0.87 0.00 0.00 54.58 54.66 1x6d n ASN 65 Cb 0.00 0.00 -0.16 0.00 -1.02 0.00 0.00 39.78 38.60 1x6d n ASN 65 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1x6d s GLU 66 N -2.93 3.09 -0.86 3.52 2.12 -1.26 -3.89 118.70 118.49 1x6d s GLU 66 Ca 0.00 -0.79 -0.18 0.00 0.36 0.00 0.00 54.97 54.36 1x6d s GLU 66 Cb 0.00 -2.64 0.13 0.00 0.26 0.00 0.00 34.13 31.89 1x6d s GLU 66 CO 0.00 -0.16 1.02 0.08 -0.54 0.00 0.00 175.26 175.66 1x6d s VAL 67 N 1.21 4.82 0.05 3.70 1.01 -0.81 -3.81 120.40 126.56 1x6d s VAL 67 Ca 0.03 -1.52 -0.22 0.00 0.00 0.00 0.00 61.98 60.27 1x6d s VAL 67 Cb -0.14 -4.70 -0.14 0.00 0.00 0.00 0.00 36.38 31.41 1x6d s VAL 67 CO -0.09 -1.40 1.46 -0.07 0.00 0.00 0.00 175.10 175.01 1x6d h LEU 68 N 10.10 0.22 -8.42 3.92 3.38 -1.31 -3.40 115.31 119.80 1x6d h LEU 68 Ca 0.06 -0.33 -0.16 0.00 0.09 0.00 0.00 57.88 57.55 1x6d h LEU 68 Cb 1.04 -0.06 -0.12 0.00 0.09 0.00 0.00 40.66 41.61 1x6d h LEU 68 CO 1.07 0.50 -0.34 -0.94 0.09 0.00 0.00 178.44 178.81 1x6d s SER 69 N -5.76 0.12 -0.05 -0.43 1.04 -1.24 -3.17 113.70 104.21 1x6d s SER 69 Ca -0.14 -1.18 -0.02 0.00 0.48 0.00 0.00 55.95 55.09 1x6d s SER 69 Cb 0.05 0.51 0.04 0.00 0.10 0.00 0.00 66.02 66.71 1x6d s SER 69 CO 0.71 -1.03 0.09 -0.63 0.98 0.00 0.00 173.24 173.36 1x6d s ILE 70 N -3.99 -0.14 0.00 -1.02 -1.09 0.74 -3.47 121.20 112.22 1x6d s ILE 70 Ca 0.30 0.37 0.00 0.00 -2.23 0.00 0.00 60.65 59.09 1x6d s ILE 70 Cb 0.03 -0.19 0.00 0.00 -1.58 0.00 0.00 42.46 40.72 1x6d s ILE 70 CO 0.11 0.15 0.00 -3.20 -1.23 0.00 0.00 174.94 170.78 1x6d n ASN 71 N 5.11 -4.36 0.00 3.58 4.05 0.49 -1.02 115.26 123.12 1x6d n ASN 71 Ca -0.08 0.00 0.00 0.00 0.45 0.00 0.00 54.58 54.95 1x6d n ASN 71 Cb 0.50 -2.18 0.00 0.00 1.23 0.00 0.00 39.78 39.33 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 -0.78 0.92 3.47 8.20 0.00 -1.17 -4.72 105.19 111.10 1x6d n GLY 72 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.98 3.69 0.44 1.61 2.20 -0.18 -5.06 119.74 121.46 1x6d s LYS 73 Ca 0.00 -0.46 -0.19 0.00 -0.36 0.00 0.00 55.97 54.96 1x6d s LYS 73 Cb 0.00 -3.34 -0.10 0.00 -1.51 0.00 0.00 37.83 32.88 1x6d s LYS 73 CO 0.00 -0.16 0.94 -1.12 -0.36 0.00 0.00 175.35 174.65 1x6d s SER 74 N 1.56 6.85 -0.54 1.43 0.01 -1.26 -0.19 113.70 121.56 1x6d s SER 74 Ca 0.06 1.63 -0.23 0.00 1.31 0.00 0.00 55.95 58.72 1x6d s SER 74 Cb -0.15 -2.52 0.04 0.00 0.21 0.00 0.00 66.02 63.60 1x6d s SER 74 CO 0.04 -0.41 0.89 -0.76 0.41 0.00 0.00 173.24 173.41 1x6d s LEU 75 N -3.39 4.23 -0.03 2.44 1.43 -1.19 -4.86 118.68 117.31 1x6d s LEU 75 Ca 0.61 -0.41 0.08 0.00 -1.03 0.00 0.00 54.13 53.38 1x6d s LEU 75 Cb -0.09 -2.79 0.30 0.00 0.03 0.00 0.00 46.19 43.64 1x6d s LEU 75 CO 0.18 -1.16 1.16 2.29 0.23 0.00 0.00 176.35 179.05 1x6d n LYS 76 N 7.23 2.03 0.00 1.70 0.00 -1.26 -4.70 118.16 123.16 1x6d n LYS 76 Ca 0.01 -1.19 0.00 0.00 -0.00 0.00 0.00 58.31 57.13 1x6d n LYS 76 Cb 0.47 -1.44 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 0.75 1.95 3.69 2.58 0.00 -1.26 -5.10 105.19 107.79 1x6d n GLY 77 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.20 2.95 -1.47 2.61 -1.04 -1.26 -4.36 114.28 111.50 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 -1.48 0.13 0.00 -1.82 0.00 0.00 70.33 67.16 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 -1.27 2.39 0.58 12.58 -4.23 -1.26 -2.08 115.64 122.35 1x6d s THR 79 Ca 0.65 0.13 0.28 0.00 -1.18 0.00 0.00 61.69 61.57 1x6d s THR 79 Cb -0.48 -2.82 0.36 0.00 1.34 0.00 0.00 72.50 70.89 1x6d s THR 79 CO 0.55 -0.16 2.11 -0.74 -0.54 0.00 0.00 174.62 175.84 1x6d h HIS 80 N -1.43 0.00 0.00 3.99 2.76 -1.89 0.21 115.15 118.79 1x6d h HIS 80 Ca -0.50 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.67 1x6d h HIS 80 Cb 1.31 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.27 1x6d h HIS 80 CO 0.36 0.00 -0.32 1.25 -1.30 0.00 0.00 177.93 177.91 1x6d h HIS 81 N 0.00 0.00 -0.78 5.26 -0.00 -1.90 -2.74 115.15 114.99 1x6d h HIS 81 Ca 0.08 0.00 0.23 0.00 -0.00 0.00 0.00 60.37 60.68 1x6d h HIS 81 Cb 0.44 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.81 1x6d h HIS 81 CO 0.00 0.00 0.84 -0.44 -0.00 0.00 0.00 177.93 178.33 1x6d h ASP 82 N -0.85 0.00 0.00 3.26 3.32 -1.86 0.47 116.42 120.76 1x6d h ASP 82 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1x6d h ASP 82 Cb 0.32 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.87 1x6d h ASP 82 CO 0.00 0.00 -0.00 0.00 -1.72 0.00 0.00 179.24 177.52 1x6d h ALA 83 N 1.05 0.00 -0.50 3.45 0.00 -0.71 -2.58 119.26 119.97 1x6d h ALA 83 Ca 0.37 -0.33 0.09 0.00 0.00 0.00 0.00 54.91 55.04 1x6d h ALA 83 Cb 2.05 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 19.74 1x6d h ALA 83 CO -0.00 0.00 -0.35 -0.07 0.00 0.00 0.00 179.25 178.83 1x6d h LEU 84 N -1.00 -1.19 -0.02 0.00 4.07 0.18 0.23 115.31 117.58 1x6d h LEU 84 Ca -0.00 0.21 0.03 0.00 0.08 0.00 0.00 57.88 58.20 1x6d h LEU 84 Cb 0.66 0.57 -0.04 0.00 1.08 0.00 0.00 40.66 42.92 1x6d h LEU 84 CO -0.00 -0.32 -0.18 0.00 -1.08 0.00 0.00 178.44 176.86 1x6d h ALA 85 N 0.81 -0.20 -1.02 1.53 0.00 -1.20 0.18 119.26 119.35 1x6d h ALA 85 Ca 0.19 0.01 0.29 0.00 0.00 0.00 0.00 54.91 55.40 1x6d h ALA 85 Cb 0.55 0.32 -0.13 0.00 0.00 0.00 0.00 17.79 18.53 1x6d h ALA 85 CO -0.62 -0.67 0.60 0.82 0.00 0.00 0.00 179.25 179.39 1x6d h ILE 86 N -0.28 0.42 -0.22 0.00 2.04 -0.58 1.60 117.51 120.49 1x6d h ILE 86 Ca 0.06 -0.15 -0.13 0.00 1.00 0.00 0.00 64.86 65.64 1x6d h ILE 86 Cb 0.36 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.37 1x6d h ILE 86 CO -0.18 0.08 -0.39 0.25 0.00 0.00 0.00 178.15 177.91 1x6d h LEU 87 N 0.45 0.54 -0.20 1.44 7.12 0.11 -1.84 115.31 122.92 1x6d h LEU 87 Ca 0.69 -0.23 0.00 0.00 0.13 0.00 0.00 57.88 58.46 1x6d h LEU 87 Cb 1.48 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 41.46 1x6d h LEU 87 CO -0.52 0.87 0.00 0.54 -0.13 0.00 0.00 178.44 179.21 1x6d n ARG 88 N -4.04 0.08 -0.03 1.25 1.74 0.52 -2.32 116.66 113.86 1x6d n ARG 88 Ca -0.01 0.26 -0.07 0.00 -0.77 0.00 0.00 57.85 57.26 1x6d n ARG 88 Cb 0.50 -1.63 -0.14 0.00 -1.02 0.00 0.00 32.46 30.17 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 -1.77 0.65 0.00 5.56 6.02 0.32 -3.82 117.38 124.33 1x6d n GLN 89 Ca 0.04 0.18 0.10 0.00 -0.01 0.00 0.00 57.00 57.31 1x6d n GLN 89 Cb 0.23 -1.71 0.47 0.00 1.02 0.00 0.00 30.24 30.25 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 -2.58 1.99 1.04 -1.58 0.00 -0.84 -1.68 120.51 116.87 1x6d n ALA 90 Ca -0.20 -0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.27 1x6d n ALA 90 Cb 1.03 -1.32 0.05 0.00 0.00 0.00 0.00 19.45 19.21 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 -1.38 0.72 -0.14 0.00 1.85 -1.19 -4.21 116.66 112.31 1x6d n ARG 91 Ca 0.07 -0.56 -0.11 0.00 -1.00 0.00 0.00 57.85 56.25 1x6d n ARG 91 Cb 0.19 -1.49 -0.02 0.00 -1.05 0.00 0.00 32.46 30.10 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 1.38 0.71 0.00 2.89 5.08 -1.46 -0.58 114.58 122.59 1x6d h GLU 92 Ca 0.00 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1x6d h GLU 92 Cb 0.63 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1x6d h GLU 92 CO 0.00 0.82 0.00 -0.35 -1.00 0.00 0.00 179.01 178.48 1x6d n PRO 93 N -4.42 0.61 0.00 2.33 -0.04 -1.26 -3.32 135.00 128.90 1x6d n PRO 93 Ca -0.01 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.49 1x6d n PRO 93 Cb 0.31 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.73 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 -0.32 3.60 -4.45 0.54 3.00 -1.26 -3.65 116.66 114.12 1x6d n ARG 94 Ca 0.00 -0.15 -0.21 0.00 -0.01 0.00 0.00 57.85 57.47 1x6d n ARG 94 Cb 0.00 -0.95 -0.14 0.00 0.00 0.00 0.00 32.46 31.37 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 -1.67 1.04 -0.09 5.56 0.74 -1.26 0.20 119.66 124.18 1x6d s GLN 95 Ca 0.04 -0.75 0.04 0.00 0.05 0.00 0.00 55.36 54.74 1x6d s GLN 95 Cb 0.07 -1.06 0.00 0.00 1.10 0.00 0.00 33.01 33.12 1x6d s GLN 95 CO 0.32 0.27 -0.20 0.00 -0.55 0.00 0.00 175.29 175.13 1x6d s ALA 96 N -0.76 1.87 -0.30 1.58 0.00 -0.84 -4.91 121.76 118.40 1x6d s ALA 96 Ca 0.03 -0.80 -0.03 0.00 0.00 0.00 0.00 51.96 51.16 1x6d s ALA 96 Cb -0.08 -0.72 0.04 0.00 0.00 0.00 0.00 23.12 22.36 1x6d s ALA 96 CO 0.01 0.24 0.03 0.08 0.00 0.00 0.00 175.76 176.12 1x6d s VAL 97 N 0.40 3.28 -0.07 0.00 1.01 -1.26 -2.64 120.40 121.12 1x6d s VAL 97 Ca -0.17 -1.21 0.04 0.00 0.00 0.00 0.00 61.98 60.64 1x6d s VAL 97 Cb -0.17 -2.83 -0.00 0.00 0.00 0.00 0.00 36.38 33.38 1x6d s VAL 97 CO 0.07 -0.07 -0.20 -0.63 0.00 0.00 0.00 175.10 174.27 1x6d s ILE 98 N 1.32 1.68 -0.27 2.22 1.09 -1.21 0.19 121.20 126.21 1x6d s ILE 98 Ca -0.03 -0.83 -0.02 0.00 -1.10 0.00 0.00 60.65 58.67 1x6d s ILE 98 Cb -0.19 -1.45 0.03 0.00 -1.06 0.00 0.00 42.46 39.79 1x6d s ILE 98 CO -0.00 0.47 -0.03 -0.69 -0.10 0.00 0.00 174.94 174.60 1x6d s VAL 99 N 0.20 3.01 0.01 2.92 1.01 -1.23 -2.99 120.40 123.33 1x6d s VAL 99 Ca -0.10 -1.11 0.03 0.00 0.00 0.00 0.00 61.98 60.79 1x6d s VAL 99 Cb -0.15 -2.60 -0.01 0.00 0.00 0.00 0.00 36.38 33.62 1x6d s VAL 99 CO 0.05 0.08 -0.08 0.42 0.00 0.00 0.00 175.10 175.57 1x6d s THR 100 N 1.32 0.62 0.09 3.92 -4.23 -1.25 -0.96 115.64 115.15 1x6d s THR 100 Ca -0.01 -0.53 0.07 0.00 -1.18 0.00 0.00 61.69 60.03 1x6d s THR 100 Cb -0.18 -0.56 -0.04 0.00 1.34 0.00 0.00 72.50 73.06 1x6d s THR 100 CO -0.03 0.04 -0.14 0.00 -0.54 0.00 0.00 174.62 173.95 1x6d s ARG 101 N -0.55 2.04 0.17 3.99 1.70 -1.25 -3.34 118.95 121.71 1x6d s ARG 101 Ca 0.00 -1.04 -0.33 0.00 -0.47 0.00 0.00 55.73 53.89 1x6d s ARG 101 Cb -0.05 -2.23 -0.13 0.00 -0.57 0.00 0.00 34.95 31.97 1x6d s ARG 101 CO 0.00 0.51 1.67 1.63 -1.08 0.00 0.00 175.30 178.04 1x6d n LYS 102 N 0.99 2.49 -3.66 3.89 4.76 -0.61 -4.16 118.16 121.86 1x6d n LYS 102 Ca -0.15 0.90 -0.22 0.00 -2.87 0.00 0.00 58.31 55.97 1x6d n LYS 102 Cb 0.52 -2.71 -0.03 0.00 -1.84 0.00 0.00 35.03 30.97 1x6d n LYS 102 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1x6d s LEU 103 N 1.28 3.24 1.00 -0.35 1.43 -1.26 -4.71 118.68 119.30 1x6d s LEU 103 Ca 0.78 -0.87 -0.17 0.00 -1.03 0.00 0.00 54.13 52.84 1x6d s LEU 103 Cb -0.59 -1.83 -0.14 0.00 0.03 0.00 0.00 46.19 43.66 1x6d s LEU 103 CO 0.36 -0.74 -0.77 0.35 0.23 0.00 0.00 176.35 175.78 1x6d n THR 104 N -1.57 0.00 0.01 5.49 -2.24 -1.26 -4.94 114.28 109.77 1x6d n THR 104 Ca 0.03 -0.46 -0.01 0.00 -2.27 0.00 0.00 64.05 61.34 1x6d n THR 104 Cb 0.62 -0.04 -0.00 0.00 -2.10 0.00 0.00 70.33 68.81 1x6d n THR 104 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1x6d h PRO 105 N -1.04 -0.04 -2.55 -0.78 0.13 -2.03 -3.50 132.00 122.19 1x6d h PRO 105 Ca -0.44 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 64.85 1x6d h PRO 105 Cb 1.30 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.41 1x6d h PRO 105 CO 0.24 -0.03 0.56 -1.83 -0.23 0.00 0.00 178.00 176.71 1x6d s GLU 106 N -1.64 1.35 0.31 0.86 -1.05 -1.26 -5.19 118.70 112.09 1x6d s GLU 106 Ca -0.01 -0.86 0.03 0.00 -0.15 0.00 0.00 54.97 53.98 1x6d s GLU 106 Cb 0.00 0.38 -0.04 0.00 -0.44 0.00 0.00 34.13 34.03 1x6d s GLU 106 CO 0.02 -0.63 0.12 0.00 0.95 0.00 0.00 175.26 175.71 1x6d s ALA 107 N -2.24 2.11 -0.84 -0.84 0.00 -1.26 -5.03 121.76 113.66 1x6d s ALA 107 Ca 0.21 -1.76 -0.22 0.00 0.00 0.00 0.00 51.96 50.20 1x6d s ALA 107 Cb -0.03 0.98 -0.21 0.00 0.00 0.00 0.00 23.12 23.86 1x6d s ALA 107 CO 0.05 -0.43 2.16 -0.12 0.00 0.00 0.00 175.76 177.42 1x6d n MET 108 N -0.62 0.00 -1.01 0.00 1.56 -1.26 -4.85 117.12 110.94 1x6d n MET 108 Ca -0.01 0.00 -0.20 0.00 -0.27 0.00 0.00 57.70 57.22 1x6d n MET 108 Cb 0.66 -1.16 0.16 0.00 2.15 0.00 0.00 33.22 35.02 1x6d n MET 108 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 1x6d n PRO 109 N 6.55 -1.67 -3.73 2.12 -0.04 -1.26 -5.03 135.00 131.94 1x6d n PRO 109 Ca 0.56 -1.30 -0.38 0.00 -0.04 0.00 0.00 63.50 62.34 1x6d n PRO 109 Cb 0.05 -1.03 -0.12 0.00 -0.04 0.00 0.00 33.50 32.36 1x6d n PRO 109 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1x6d s ASP 110 N -3.93 5.24 1.33 3.54 1.01 -1.26 -5.09 116.67 117.50 1x6d s ASP 110 Ca 0.50 -0.58 -0.22 0.00 0.71 0.00 0.00 52.55 52.96 1x6d s ASP 110 Cb -0.03 -1.92 0.33 0.00 1.01 0.00 0.00 42.92 42.31 1x6d s ASP 110 CO 0.37 -0.17 1.04 -0.76 0.21 0.00 0.00 175.17 175.86 1x6d s LEU 111 N 1.55 -0.18 0.56 1.23 1.02 -1.26 -4.86 118.68 116.73 1x6d s LEU 111 Ca 0.04 0.60 0.00 0.00 0.02 0.00 0.00 54.13 54.78 1x6d s LEU 111 Cb -0.17 -2.12 0.00 0.00 0.02 0.00 0.00 46.19 43.92 1x6d s LEU 111 CO 0.04 -4.79 0.00 -3.20 0.02 0.00 0.00 176.35 168.42 1x6d n ASN 112 N -5.21 -7.78 -3.15 2.29 5.15 -1.26 -5.01 115.26 100.29 1x6d n ASN 112 Ca 0.15 1.69 0.04 0.00 -0.60 0.00 0.00 54.58 55.86 1x6d n ASN 112 Cb 0.60 -4.65 -0.00 0.00 -0.53 0.00 0.00 39.78 35.20 1x6d n ASN 112 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1x6d s SER 113 N -5.52 -1.44 -0.34 1.20 0.15 -1.26 -5.11 113.70 101.38 1x6d s SER 113 Ca 0.00 0.19 -0.36 0.00 0.70 0.00 0.00 55.95 56.49 1x6d s SER 113 Cb 0.00 1.92 -0.12 0.00 -1.71 0.00 0.00 66.02 66.11 1x6d s SER 113 CO 0.00 -0.26 2.16 -0.24 1.20 0.00 0.00 173.24 176.10 1x6d n SER 114 N 5.37 2.15 -2.67 5.45 2.88 -1.26 -3.55 113.62 122.00 1x6d n SER 114 Ca 0.05 0.47 -0.05 0.00 -1.33 0.00 0.00 58.87 58.01 1x6d n SER 114 Cb 0.54 -1.25 -0.04 0.00 -0.75 0.00 0.00 64.21 62.71 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 6.40 -4.59 0.11 0.46 0.00 -1.26 -4.96 105.19 101.35 1x6d n GLY 115 Ca 0.40 1.50 -0.10 0.00 0.00 0.00 0.00 46.02 47.83 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 4.13 -0.16 -5.96 1.61 0.13 -2.02 -3.49 132.00 126.23 1x6d h PRO 116 Ca -0.46 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1x6d h PRO 116 Cb 1.05 0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.20 1x6d h PRO 116 CO 0.02 0.29 -0.77 0.43 -0.23 0.00 0.00 178.00 177.74 1x6d n SER 117 N -4.86 -6.44 -4.60 1.44 7.64 -1.26 -4.75 113.62 100.79 1x6d n SER 117 Ca -0.07 0.84 -0.43 0.00 1.01 0.00 0.00 58.87 60.22 1x6d n SER 117 Cb 0.26 -2.57 -0.02 0.00 -1.01 0.00 0.00 64.21 60.87 1x6d n SER 117 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1x6d s SER 118 N -0.76 6.17 0.00 6.43 1.04 -1.26 -5.27 113.70 120.04 1x6d s SER 118 Ca -0.03 1.09 0.00 0.00 0.48 0.00 0.00 55.95 57.48 1x6d s SER 118 Cb 0.00 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.59 1x6d s SER 118 CO 0.21 -1.52 0.05 0.61 0.98 0.00 0.00 173.24 173.57