#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 -0.73 -0.21 1.61 0.15 -1.26 -5.17 113.70 108.10 1x6d s SER 2 Ca 0.00 0.90 -0.20 0.00 0.70 0.00 0.00 55.95 57.35 1x6d s SER 2 Cb 0.00 1.79 0.06 0.00 -1.71 0.00 0.00 66.02 66.15 1x6d s SER 2 CO 0.00 -0.14 0.57 -0.94 1.20 0.00 0.00 173.24 173.93 1x6d s SER 3 N 2.61 -0.59 0.00 5.45 1.04 -1.26 -5.17 113.70 115.78 1x6d s SER 3 Ca -0.01 1.14 0.00 0.00 0.48 0.00 0.00 55.95 57.55 1x6d s SER 3 Cb -0.08 1.15 0.00 0.00 0.10 0.00 0.00 66.02 67.19 1x6d s SER 3 CO -0.17 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.46 1x6d n GLY 4 N 2.76 0.92 3.40 7.32 0.00 -1.26 -5.14 105.19 113.19 1x6d n GLY 4 Ca -0.14 -1.77 -0.15 0.00 0.00 0.00 0.00 46.02 43.97 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 -0.46 -1.25 1.61 1.04 -1.26 -5.08 113.70 107.30 1x6d s SER 5 Ca 0.00 0.30 -0.19 0.00 0.48 0.00 0.00 55.95 56.55 1x6d s SER 5 Cb 0.00 0.47 0.07 0.00 0.10 0.00 0.00 66.02 66.67 1x6d s SER 5 CO 0.00 -0.65 1.68 -0.44 0.98 0.00 0.00 173.24 174.82 1x6d s SER 6 N -1.66 6.80 0.00 7.02 0.01 -1.26 -4.77 113.70 119.84 1x6d s SER 6 Ca -0.08 -2.32 0.00 0.00 1.31 0.00 0.00 55.95 54.86 1x6d s SER 6 Cb -0.01 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.65 1x6d s SER 6 CO 0.02 -1.21 0.00 0.61 0.41 0.00 0.00 173.24 173.08 1x6d n GLY 7 N 5.58 1.01 0.13 3.44 0.00 -1.26 -5.00 105.19 109.09 1x6d n GLY 7 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1x6d n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x6d n ALA 8 N -1.78 0.63 -1.40 4.61 0.00 -1.26 -5.13 120.51 116.19 1x6d n ALA 8 Ca 0.00 -0.09 0.06 0.00 0.00 0.00 0.00 53.44 53.40 1x6d n ALA 8 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1x6d n ALA 8 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1x6d n THR 9 N -1.94 -2.04 -0.14 0.00 5.66 -1.26 -4.91 114.28 109.65 1x6d n THR 9 Ca 0.00 1.18 -0.29 0.00 -3.05 0.00 0.00 64.05 61.89 1x6d n THR 9 Cb 0.00 -1.91 -0.10 0.00 -1.55 0.00 0.00 70.33 66.77 1x6d n THR 9 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1x6d n LEU 10 N -3.09 1.95 -4.37 1.09 4.77 -1.26 -5.03 117.00 111.06 1x6d n LEU 10 Ca -0.03 0.35 -0.19 0.00 -0.03 0.00 0.00 56.01 56.11 1x6d n LEU 10 Cb 0.51 -0.83 -0.10 0.00 -2.33 0.00 0.00 43.42 40.66 1x6d n LEU 10 CO 0.01 0.53 -0.37 -0.75 -1.33 0.00 0.00 177.39 175.49 1x6d s LYS 11 N -2.50 1.41 -0.20 3.23 2.47 -1.26 -4.97 119.74 117.92 1x6d s LYS 11 Ca -0.38 -1.69 -0.03 0.00 -1.56 0.00 0.00 55.97 52.30 1x6d s LYS 11 Cb 0.14 -0.92 0.00 0.00 -1.46 0.00 0.00 37.83 35.59 1x6d s LYS 11 CO 0.50 0.01 0.13 0.94 0.16 0.00 0.00 175.35 177.09 1x6d n GLN 12 N -0.47 -1.71 -3.87 4.03 -0.06 -1.26 -5.01 117.38 109.03 1x6d n GLN 12 Ca -0.06 1.63 -0.35 0.00 -2.00 0.00 0.00 57.00 56.22 1x6d n GLN 12 Cb 0.63 -3.59 -0.10 0.00 -4.06 0.00 0.00 30.24 23.12 1x6d n GLN 12 CO 0.00 0.00 0.00 -1.17 -0.20 0.00 0.00 177.06 175.69 1x6d s LEU 13 N -1.29 3.89 0.00 1.69 1.98 -1.26 -4.96 118.68 118.73 1x6d s LEU 13 Ca 0.05 0.07 0.00 0.00 -2.89 0.00 0.00 54.13 51.37 1x6d s LEU 13 Cb -0.02 -2.01 0.00 0.00 0.66 0.00 0.00 46.19 44.83 1x6d s LEU 13 CO 0.43 0.13 0.00 -0.67 -1.89 0.00 0.00 176.35 174.35 1x6d n ASP 14 N 3.86 0.00 -2.21 3.68 -0.08 -1.26 -4.65 116.55 115.89 1x6d n ASP 14 Ca -0.16 0.00 -0.30 0.00 -1.51 0.00 0.00 54.79 52.82 1x6d n ASP 14 Cb 0.52 0.00 0.05 0.00 2.34 0.00 0.00 41.12 44.03 1x6d n ASP 14 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1x6d n GLY 15 N -2.16 6.10 3.70 0.27 0.00 -1.26 -4.98 105.19 106.86 1x6d n GLY 15 Ca 0.00 -2.47 -0.35 0.00 0.00 0.00 0.00 46.02 43.20 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 -4.75 4.60 -0.23 -0.61 -1.09 -1.26 -3.38 121.20 114.48 1x6d s ILE 16 Ca 0.59 -0.13 -0.02 0.00 -2.23 0.00 0.00 60.65 58.85 1x6d s ILE 16 Cb 0.47 -2.98 0.07 0.00 -1.58 0.00 0.00 42.46 38.44 1x6d s ILE 16 CO 0.00 0.58 0.06 -1.38 -1.23 0.00 0.00 174.94 172.97 1x6d s HIS 17 N -0.65 1.18 0.56 3.97 -3.43 -1.14 -5.05 115.29 110.73 1x6d s HIS 17 Ca 0.11 -1.11 -0.17 0.00 -0.80 0.00 0.00 55.06 53.09 1x6d s HIS 17 Cb -0.12 -1.20 -0.05 0.00 -1.43 0.00 0.00 32.58 29.78 1x6d s HIS 17 CO 0.02 -0.70 1.07 0.14 -2.00 0.00 0.00 174.74 173.27 1x6d s VAL 18 N 1.80 3.67 -0.12 -5.38 -7.23 -1.26 -4.14 120.40 107.74 1x6d s VAL 18 Ca 0.02 0.89 -0.00 0.00 -1.81 0.00 0.00 61.98 61.08 1x6d s VAL 18 Cb -0.17 -3.36 0.02 0.00 0.56 0.00 0.00 36.38 33.43 1x6d s VAL 18 CO -0.15 -0.37 -0.09 -0.89 -0.31 0.00 0.00 175.10 173.29 1x6d s THR 19 N -2.22 1.17 -0.46 5.32 2.01 -1.14 -5.01 115.64 115.31 1x6d s THR 19 Ca 0.66 -0.39 -0.18 0.00 0.31 0.00 0.00 61.69 62.09 1x6d s THR 19 Cb -0.17 -1.17 0.04 0.00 0.01 0.00 0.00 72.50 71.21 1x6d s THR 19 CO 0.31 0.38 0.50 -0.63 -0.69 0.00 0.00 174.62 174.49 1x6d s ILE 20 N 1.65 5.04 -0.14 1.82 -1.09 -1.26 -3.43 121.20 123.78 1x6d s ILE 20 Ca 0.05 -0.52 -0.20 0.00 -2.23 0.00 0.00 60.65 57.75 1x6d s ILE 20 Cb -0.13 -4.15 -0.03 0.00 -1.58 0.00 0.00 42.46 36.57 1x6d s ILE 20 CO -0.09 -0.58 0.58 -0.76 -1.23 0.00 0.00 174.94 172.85 1x6d s LEU 21 N 2.22 4.23 -0.42 2.97 1.02 -0.95 -4.95 118.68 122.79 1x6d s LEU 21 Ca 0.12 0.88 -0.13 0.00 0.02 0.00 0.00 54.13 55.01 1x6d s LEU 21 Cb -0.19 -2.84 0.04 0.00 0.02 0.00 0.00 46.19 43.23 1x6d s LEU 21 CO 0.12 -0.13 0.30 -1.00 0.02 0.00 0.00 176.35 175.66 1x6d s HIS 22 N 1.18 3.25 0.16 0.29 3.76 -1.26 -2.70 115.29 119.97 1x6d s HIS 22 Ca 0.29 -0.89 0.03 0.00 -0.15 0.00 0.00 55.06 54.34 1x6d s HIS 22 Cb -0.16 -2.76 -0.01 0.00 1.11 0.00 0.00 32.58 30.76 1x6d s HIS 22 CO 0.12 -0.69 0.16 0.36 -0.85 0.00 0.00 174.74 173.83 1x6d n LYS 23 N 5.10 0.23 -3.57 1.40 2.85 0.19 -5.03 118.16 119.33 1x6d n LYS 23 Ca -0.11 -1.51 -0.22 0.00 -1.05 0.00 0.00 58.31 55.42 1x6d n LYS 23 Cb 0.45 1.29 -0.02 0.00 -0.65 0.00 0.00 35.03 36.10 1x6d n LYS 23 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 1x6d s GLU 24 N -2.58 2.47 -0.48 -1.58 2.02 -1.26 -4.35 118.70 112.95 1x6d s GLU 24 Ca 0.18 -1.63 -0.27 0.00 0.02 0.00 0.00 54.97 53.27 1x6d s GLU 24 Cb 0.01 -2.35 -0.04 0.00 0.10 0.00 0.00 34.13 31.84 1x6d s GLU 24 CO 0.12 -0.33 2.05 -1.21 0.02 0.00 0.00 175.26 175.91 1x6d s GLU 25 N -4.21 2.67 0.00 1.61 2.02 -1.26 -1.27 118.70 118.26 1x6d s GLU 25 Ca 0.47 1.16 0.00 0.00 0.02 0.00 0.00 54.97 56.62 1x6d s GLU 25 Cb -0.03 -4.41 0.00 0.00 0.10 0.00 0.00 34.13 29.79 1x6d s GLU 25 CO 0.28 -2.65 0.00 0.41 0.02 0.00 0.00 175.26 173.31 1x6d n GLY 26 N 5.74 0.93 0.10 -1.39 0.00 0.16 -4.97 105.19 105.76 1x6d n GLY 26 Ca 0.27 -0.58 -0.12 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.91 1.32 0.00 4.61 0.00 -0.40 -5.01 120.51 120.13 1x6d n ALA 27 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.68 1x6d n ALA 27 Cb 0.28 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 1.71 1.16 0.12 0.00 0.00 -1.25 -4.89 105.19 102.04 1x6d n GLY 28 Ca -0.23 -1.87 -0.22 0.00 0.00 0.00 0.00 46.02 43.70 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 -0.36 2.19 0.00 0.99 4.77 -1.26 -4.85 117.00 118.47 1x6d n LEU 29 Ca 0.00 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 1x6d n LEU 29 Cb 0.00 -1.01 0.00 0.00 -2.33 0.00 0.00 43.42 40.08 1x6d n LEU 29 CO 0.00 0.53 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 1x6d n GLY 30 N 1.65 1.17 3.32 -0.72 0.00 -1.26 -1.26 105.19 108.10 1x6d n GLY 30 Ca -0.35 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 -1.78 1.55 0.48 1.61 -0.71 -1.26 -0.34 117.98 117.54 1x6d s PHE 31 Ca 0.00 -1.12 0.02 0.00 -1.04 0.00 0.00 56.93 54.79 1x6d s PHE 31 Cb 0.00 -0.92 -0.02 0.00 -1.21 0.00 0.00 43.02 40.87 1x6d s PHE 31 CO 0.00 -0.26 0.03 -1.54 -1.34 0.00 0.00 175.22 172.11 1x6d s SER 32 N -3.32 3.82 0.25 1.98 1.04 -0.72 -4.99 113.70 111.78 1x6d s SER 32 Ca 0.35 -1.64 0.07 0.00 0.48 0.00 0.00 55.95 55.21 1x6d s SER 32 Cb 0.08 0.45 -0.03 0.00 0.10 0.00 0.00 66.02 66.61 1x6d s SER 32 CO 0.12 -0.84 0.24 -0.76 0.98 0.00 0.00 173.24 172.99 1x6d s LEU 33 N -3.81 3.91 0.02 2.42 1.43 -1.26 -2.60 118.68 118.79 1x6d s LEU 33 Ca 0.12 -0.20 -0.07 0.00 -1.03 0.00 0.00 54.13 52.95 1x6d s LEU 33 Cb 0.02 -2.45 -0.00 0.00 0.03 0.00 0.00 46.19 43.79 1x6d s LEU 33 CO 0.06 -0.07 0.12 0.00 0.23 0.00 0.00 176.35 176.70 1x6d s ALA 34 N -2.11 -0.22 0.00 4.21 0.00 0.49 -4.09 121.76 120.04 1x6d s ALA 34 Ca 0.34 -0.31 0.00 0.00 0.00 0.00 0.00 51.96 51.99 1x6d s ALA 34 Cb -0.08 0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.21 1x6d s ALA 34 CO 0.26 -0.25 0.00 0.41 0.00 0.00 0.00 175.76 176.18 1x6d n GLY 35 N 1.17 -1.37 1.26 0.00 0.00 -1.26 0.51 105.19 105.50 1x6d n GLY 35 Ca -0.21 -1.53 0.01 0.00 0.00 0.00 0.00 46.02 44.29 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 -1.23 0.43 0.13 -0.02 0.00 -0.57 -4.09 105.19 99.84 1x6d n GLY 36 Ca 0.00 -0.89 -0.17 0.00 0.00 0.00 0.00 46.02 44.96 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 0.08 0.00 4.61 0.00 -1.62 -3.14 119.26 121.19 1x6d h ALA 37 Ca -0.06 -0.54 -0.05 0.00 0.00 0.00 0.00 54.91 54.26 1x6d h ALA 37 Cb 0.37 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1x6d h ALA 37 CO 0.10 0.30 -0.25 0.22 0.00 0.00 0.00 179.25 179.61 1x6d h ASP 38 N -0.15 0.00 -3.92 0.00 3.58 -1.86 -3.45 116.42 110.62 1x6d h ASP 38 Ca -0.06 0.00 -0.44 0.00 0.42 0.00 0.00 57.03 56.95 1x6d h ASP 38 Cb 1.22 0.00 0.16 0.00 1.72 0.00 0.00 39.33 42.43 1x6d h ASP 38 CO 0.10 0.25 0.28 -0.76 -2.88 0.00 0.00 179.24 176.24 1x6d s LEU 39 N -6.75 1.80 0.15 2.28 1.02 -1.19 -4.97 118.68 111.01 1x6d s LEU 39 Ca 0.01 0.62 -0.12 0.00 0.02 0.00 0.00 54.13 54.66 1x6d s LEU 39 Cb 0.10 -2.64 -0.01 0.00 0.02 0.00 0.00 46.19 43.66 1x6d s LEU 39 CO 0.65 -3.15 1.54 -0.33 0.02 0.00 0.00 176.35 175.08 1x6d h GLU 40 N -1.92 0.91 -5.71 1.70 4.39 -1.86 -3.40 114.58 108.69 1x6d h GLU 40 Ca -0.47 -0.37 -0.63 0.00 0.34 0.00 0.00 59.36 58.24 1x6d h GLU 40 Cb 1.29 -0.04 -0.13 0.00 -0.10 0.00 0.00 28.75 29.76 1x6d h GLU 40 CO 0.44 1.02 0.40 0.54 -1.16 0.00 0.00 179.01 180.25 1x6d s ASN 41 N -6.57 6.36 0.16 1.42 2.20 -1.26 -4.90 114.94 112.35 1x6d s ASN 41 Ca -0.12 -0.30 -0.14 0.00 -0.94 0.00 0.00 52.86 51.36 1x6d s ASN 41 Cb 0.11 -2.39 0.05 0.00 -2.00 0.00 0.00 41.25 37.02 1x6d s ASN 41 CO 0.85 -1.03 1.76 0.11 -2.94 0.00 0.00 177.10 175.84 1x6d h LYS 42 N 9.11 0.73 -6.20 3.55 1.79 -1.76 -1.52 116.57 122.27 1x6d h LYS 42 Ca -0.26 -0.09 -0.55 0.00 -2.18 0.00 0.00 60.65 57.57 1x6d h LYS 42 Cb 1.08 -0.14 -0.04 0.00 -1.58 0.00 0.00 32.23 31.55 1x6d h LYS 42 CO 1.01 0.58 0.23 0.54 -1.08 0.00 0.00 179.45 180.73 1x6d s VAL 43 N -5.80 4.96 0.63 0.50 0.11 -1.26 -4.23 120.40 115.32 1x6d s VAL 43 Ca -0.13 1.73 -0.16 0.00 -2.93 0.00 0.00 61.98 60.48 1x6d s VAL 43 Cb 0.12 -4.17 -0.02 0.00 -1.53 0.00 0.00 36.38 30.78 1x6d s VAL 43 CO 0.76 0.20 1.11 -0.63 -3.33 0.00 0.00 175.10 173.21 1x6d s ILE 44 N 0.96 3.26 0.25 7.04 1.09 -1.26 -4.66 121.20 127.87 1x6d s ILE 44 Ca 0.44 0.63 0.02 0.00 -1.10 0.00 0.00 60.65 60.63 1x6d s ILE 44 Cb -0.19 -3.16 -0.04 0.00 -1.06 0.00 0.00 42.46 38.01 1x6d s ILE 44 CO 0.22 -0.32 0.16 0.42 -0.10 0.00 0.00 174.94 175.32 1x6d s THR 45 N -2.22 0.10 -0.75 2.92 -4.23 0.18 -1.04 115.64 110.60 1x6d s THR 45 Ca 0.68 -2.00 -0.27 0.00 -1.18 0.00 0.00 61.69 58.93 1x6d s THR 45 Cb -0.21 -2.51 0.02 0.00 1.34 0.00 0.00 72.50 71.14 1x6d s THR 45 CO 0.38 0.00 1.38 -0.69 -0.54 0.00 0.00 174.62 175.15 1x6d s VAL 46 N -3.89 3.68 0.08 2.29 1.01 -1.18 0.19 120.40 122.59 1x6d s VAL 46 Ca 0.39 0.26 -0.31 0.00 0.00 0.00 0.00 61.98 62.32 1x6d s VAL 46 Cb 0.06 -4.79 -0.14 0.00 0.00 0.00 0.00 36.38 31.51 1x6d s VAL 46 CO 0.16 -1.73 1.49 -0.74 0.00 0.00 0.00 175.10 174.29 1x6d h HIS 47 N 10.69 -1.28 -3.76 5.22 2.76 -1.65 -1.96 115.15 125.18 1x6d h HIS 47 Ca -0.23 0.02 -0.09 0.00 -2.20 0.00 0.00 60.37 57.87 1x6d h HIS 47 Cb 1.06 0.51 -0.15 0.00 1.55 0.00 0.00 27.41 30.39 1x6d h HIS 47 CO 1.13 -0.57 -0.38 1.03 -1.30 0.00 0.00 177.93 177.84 1x6d s ARG 48 N -5.47 0.81 -0.36 5.26 3.00 -1.26 -4.67 118.95 116.25 1x6d s ARG 48 Ca -0.15 -0.89 0.01 0.00 0.00 0.00 0.00 55.73 54.70 1x6d s ARG 48 Cb 0.04 0.33 0.11 0.00 0.00 0.00 0.00 34.95 35.43 1x6d s ARG 48 CO 0.53 -0.25 0.13 0.08 0.00 0.00 0.00 175.30 175.78 1x6d s VAL 49 N -3.58 1.42 0.60 3.52 1.01 -1.26 -1.75 120.40 120.36 1x6d s VAL 49 Ca 0.03 -1.99 -0.16 0.00 0.00 0.00 0.00 61.98 59.86 1x6d s VAL 49 Cb 0.04 -2.04 -0.13 0.00 0.00 0.00 0.00 36.38 34.24 1x6d s VAL 49 CO -0.09 -0.71 -0.32 0.49 0.00 0.00 0.00 175.10 174.46 1x6d n PHE 50 N 4.32 -3.29 0.09 5.22 3.72 0.54 -4.86 117.46 123.21 1x6d n PHE 50 Ca 0.02 0.26 -0.07 0.00 -0.05 0.00 0.00 57.45 57.61 1x6d n PHE 50 Cb 0.40 -1.42 0.03 0.00 -0.94 0.00 0.00 39.48 37.54 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 -0.31 0.19 -3.36 -1.08 0.13 -2.00 -3.38 132.00 122.19 1x6d h PRO 51 Ca -0.37 -0.18 -0.66 0.00 -0.87 0.00 0.00 66.00 63.91 1x6d h PRO 51 Cb 1.24 0.05 -0.39 0.00 0.13 0.00 0.00 31.00 32.04 1x6d h PRO 51 CO 0.32 0.89 -0.44 -0.80 -0.23 0.00 0.00 178.00 177.73 1x6d s ASN 52 N -6.91 4.99 0.00 1.44 0.01 -1.26 -4.90 114.94 108.31 1x6d s ASN 52 Ca -0.03 -3.27 0.00 0.00 -0.71 0.00 0.00 52.86 48.85 1x6d s ASN 52 Cb 0.11 -1.75 0.00 0.00 0.41 0.00 0.00 41.25 40.02 1x6d s ASN 52 CO 0.82 -0.23 0.00 0.61 -1.51 0.00 0.00 177.10 176.78 1x6d n GLY 53 N 2.84 2.71 0.12 0.66 0.00 -1.26 -4.96 105.19 105.29 1x6d n GLY 53 Ca 0.12 -0.88 -0.24 0.00 0.00 0.00 0.00 46.02 45.02 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 1.92 -0.06 0.99 4.77 -0.39 -3.04 117.00 121.18 1x6d n LEU 54 Ca 0.00 0.38 0.25 0.00 -0.03 0.00 0.00 56.01 56.61 1x6d n LEU 54 Cb 0.00 -0.86 0.61 0.00 -2.33 0.00 0.00 43.42 40.84 1x6d n LEU 54 CO 0.00 0.35 1.22 0.00 -1.33 0.00 0.00 177.39 177.63 1x6d h ALA 55 N -0.84 2.54 0.06 -1.18 0.00 -1.72 0.69 119.26 118.80 1x6d h ALA 55 Ca -0.49 -0.03 -0.27 0.00 0.00 0.00 0.00 54.91 54.13 1x6d h ALA 55 Cb 1.40 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.23 1x6d h ALA 55 CO -0.30 -1.19 -1.43 1.03 0.00 0.00 0.00 179.25 177.36 1x6d h SER 56 N 0.00 0.20 -0.63 0.00 0.87 -1.80 -3.16 113.55 109.03 1x6d h SER 56 Ca 0.35 -0.73 0.04 0.00 -1.23 0.00 0.00 61.79 60.22 1x6d h SER 56 Cb 1.97 -0.07 -0.05 0.00 -0.44 0.00 0.00 62.40 63.82 1x6d h SER 56 CO -0.00 1.60 0.37 1.56 -0.53 0.00 0.00 176.83 179.82 1x6d h GLN 57 N -0.55 0.69 0.57 2.24 4.20 0.10 -3.07 115.11 119.28 1x6d h GLN 57 Ca -0.34 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.30 1x6d h GLN 57 Cb 1.59 -0.15 0.01 0.00 0.30 0.00 0.00 27.48 29.22 1x6d h GLN 57 CO -0.06 0.45 -0.27 0.93 -0.67 0.00 0.00 178.83 179.21 1x6d h GLU 58 N 0.71 -0.74 0.00 1.46 3.07 -0.09 -3.47 114.58 115.51 1x6d h GLU 58 Ca 0.27 0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.18 1x6d h GLU 58 Cb 0.09 0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.17 1x6d h GLU 58 CO -0.14 -0.49 0.00 0.41 -1.40 0.00 0.00 179.01 177.39 1x6d n GLY 59 N -1.24 0.57 0.08 -3.84 0.00 -1.16 -4.97 105.19 94.62 1x6d n GLY 59 Ca -0.10 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.77 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 1.72 -2.37 2.61 2.02 -1.89 -3.40 112.91 111.59 1x6d h THR 60 Ca 0.00 -2.32 -0.67 0.00 0.77 0.00 0.00 66.41 64.18 1x6d h THR 60 Cb 0.00 3.28 -0.17 0.00 -1.74 0.00 0.00 68.15 69.53 1x6d h THR 60 CO 0.00 0.62 0.82 -0.63 0.37 0.00 0.00 175.52 176.69 1x6d s ILE 61 N -2.38 4.61 -0.18 3.11 1.01 -1.25 -4.99 121.20 121.12 1x6d s ILE 61 Ca -0.18 -1.32 -0.06 0.00 0.00 0.00 0.00 60.65 59.10 1x6d s ILE 61 Cb -0.02 -4.78 -0.04 0.00 0.01 0.00 0.00 42.46 37.64 1x6d s ILE 61 CO 0.72 -1.52 0.03 -1.10 0.00 0.00 0.00 174.94 173.07 1x6d s GLN 62 N 3.06 3.86 -0.39 2.79 -0.21 -1.26 -4.58 119.66 122.92 1x6d s GLN 62 Ca 0.31 -0.41 -0.42 0.00 0.02 0.00 0.00 55.36 54.87 1x6d s GLN 62 Cb -0.07 -3.12 -0.17 0.00 1.00 0.00 0.00 33.01 30.65 1x6d s GLN 62 CO -0.06 0.24 1.87 1.17 -2.12 0.00 0.00 175.29 176.38 1x6d n LYS 63 N 3.61 0.61 0.00 2.91 4.81 -1.26 -0.04 118.16 128.81 1x6d n LYS 63 Ca -0.17 0.21 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 1x6d n LYS 63 Cb 0.52 -1.89 0.00 0.00 0.02 0.00 0.00 35.03 33.69 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 5.23 1.60 3.63 3.14 0.00 -0.73 -5.00 105.19 113.06 1x6d n GLY 64 Ca 0.36 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.98 1.37 -0.25 1.61 0.02 0.95 -4.82 114.94 111.83 1x6d s ASN 65 Ca 0.00 0.71 -0.05 0.00 -1.02 0.00 0.00 52.86 52.50 1x6d s ASN 65 Cb 0.00 -1.03 -0.00 0.00 0.02 0.00 0.00 41.25 40.24 1x6d s ASN 65 CO 0.00 -3.86 0.02 -0.70 0.02 0.00 0.00 177.10 172.58 1x6d s GLU 66 N -5.35 3.29 -0.53 -0.60 2.12 -1.26 -3.07 118.70 113.29 1x6d s GLU 66 Ca 0.70 -0.70 -0.22 0.00 0.36 0.00 0.00 54.97 55.11 1x6d s GLU 66 Cb -0.11 -3.19 0.05 0.00 0.26 0.00 0.00 34.13 31.14 1x6d s GLU 66 CO 0.56 -0.29 0.81 0.08 -0.54 0.00 0.00 175.26 175.87 1x6d s VAL 67 N 1.50 4.60 -0.09 3.70 1.01 -0.21 -4.04 120.40 126.86 1x6d s VAL 67 Ca 0.04 -0.05 -0.26 0.00 0.00 0.00 0.00 61.98 61.72 1x6d s VAL 67 Cb -0.16 -4.44 -0.22 0.00 0.00 0.00 0.00 36.38 31.57 1x6d s VAL 67 CO -0.00 -0.98 0.90 -0.07 0.00 0.00 0.00 175.10 174.95 1x6d h LEU 68 N 10.43 -0.02 -8.05 3.92 3.38 -1.51 -3.36 115.31 120.10 1x6d h LEU 68 Ca -0.27 -0.73 -0.04 0.00 0.09 0.00 0.00 57.88 56.94 1x6d h LEU 68 Cb 1.08 0.01 -0.09 0.00 0.09 0.00 0.00 40.66 41.74 1x6d h LEU 68 CO 1.03 0.75 -0.07 -0.94 0.09 0.00 0.00 178.44 179.30 1x6d s SER 69 N -5.94 -0.14 -0.04 -0.43 1.04 -1.24 -3.19 113.70 103.75 1x6d s SER 69 Ca -0.17 -0.77 -0.02 0.00 0.48 0.00 0.00 55.95 55.48 1x6d s SER 69 Cb -0.01 0.58 0.03 0.00 0.10 0.00 0.00 66.02 66.72 1x6d s SER 69 CO 0.63 -1.11 0.05 -0.63 0.98 0.00 0.00 173.24 173.16 1x6d s ILE 70 N -3.96 -0.02 0.00 -1.02 1.01 -0.89 -2.80 121.20 113.52 1x6d s ILE 70 Ca 0.17 0.37 0.00 0.00 0.00 0.00 0.00 60.65 61.19 1x6d s ILE 70 Cb -0.01 -0.22 0.00 0.00 0.01 0.00 0.00 42.46 42.25 1x6d s ILE 70 CO 0.05 0.19 0.00 0.59 0.00 0.00 0.00 174.94 175.77 1x6d n ASN 71 N 5.24 -2.63 0.00 3.58 4.13 0.50 -1.70 115.26 124.38 1x6d n ASN 71 Ca -0.04 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.22 1x6d n ASN 71 Cb 0.50 -1.30 0.00 0.00 -1.54 0.00 0.00 39.78 37.44 1x6d n ASN 71 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1x6d n GLY 72 N -1.76 0.65 3.47 7.41 0.00 -1.26 -4.90 105.19 108.81 1x6d n GLY 72 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.93 3.18 0.44 1.61 2.20 -0.69 -5.04 119.74 120.51 1x6d s LYS 73 Ca 0.00 -0.71 -0.22 0.00 -0.36 0.00 0.00 55.97 54.68 1x6d s LYS 73 Cb 0.00 -4.06 -0.08 0.00 -1.51 0.00 0.00 37.83 32.17 1x6d s LYS 73 CO 0.00 -1.21 1.06 -1.12 -0.36 0.00 0.00 175.35 173.73 1x6d s SER 74 N 2.56 6.51 -0.58 1.43 0.01 -1.26 -2.09 113.70 120.28 1x6d s SER 74 Ca 0.18 2.04 -0.26 0.00 1.31 0.00 0.00 55.95 59.23 1x6d s SER 74 Cb -0.17 -2.58 0.04 0.00 0.21 0.00 0.00 66.02 63.51 1x6d s SER 74 CO 0.14 -0.66 1.07 -0.76 0.41 0.00 0.00 173.24 173.44 1x6d s LEU 75 N -3.00 3.77 -0.03 2.44 1.43 -1.19 -4.84 118.68 117.25 1x6d s LEU 75 Ca 0.62 -0.18 0.07 0.00 -1.03 0.00 0.00 54.13 53.61 1x6d s LEU 75 Cb -0.21 -2.94 0.26 0.00 0.03 0.00 0.00 46.19 43.33 1x6d s LEU 75 CO 0.26 -1.39 1.12 2.29 0.23 0.00 0.00 176.35 178.87 1x6d n LYS 76 N 8.02 1.90 0.00 1.70 0.00 -1.26 -4.70 118.16 123.82 1x6d n LYS 76 Ca 0.05 -1.05 0.00 0.00 -0.00 0.00 0.00 58.31 57.31 1x6d n LYS 76 Cb 0.48 -1.40 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 0.71 1.92 3.71 2.58 0.00 -1.26 -5.10 105.19 107.75 1x6d n GLY 77 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.30 2.49 -1.67 2.61 -1.04 -1.26 -4.16 114.28 110.96 1x6d n THR 78 Ca 0.00 -0.50 -0.31 0.00 -2.04 0.00 0.00 64.05 61.20 1x6d n THR 78 Cb 0.00 -1.59 0.04 0.00 -1.82 0.00 0.00 70.33 66.96 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 -1.19 4.22 0.28 12.58 -4.23 -1.26 -2.34 115.64 123.71 1x6d s THR 79 Ca 0.60 0.73 -0.01 0.00 -1.18 0.00 0.00 61.69 61.83 1x6d s THR 79 Cb -0.51 -3.54 0.31 0.00 1.34 0.00 0.00 72.50 70.11 1x6d s THR 79 CO 0.59 -0.93 1.63 -0.74 -0.54 0.00 0.00 174.62 174.62 1x6d h HIS 80 N -0.56 0.14 0.59 3.99 2.76 -1.90 1.05 115.15 121.21 1x6d h HIS 80 Ca -0.44 0.06 -0.03 0.00 -2.20 0.00 0.00 60.37 57.76 1x6d h HIS 80 Cb 1.20 0.07 0.01 0.00 1.55 0.00 0.00 27.41 30.24 1x6d h HIS 80 CO 0.63 -0.26 -0.28 1.25 -1.30 0.00 0.00 177.93 177.97 1x6d h HIS 81 N 0.14 -0.73 -0.65 5.26 -0.00 -1.91 0.59 115.15 117.85 1x6d h HIS 81 Ca 0.51 -0.02 0.19 0.00 -0.00 0.00 0.00 60.37 61.05 1x6d h HIS 81 Cb 0.99 0.24 -0.03 0.00 -0.00 0.00 0.00 27.41 28.61 1x6d h HIS 81 CO -0.36 -0.45 0.75 -0.44 -0.00 0.00 0.00 177.93 177.42 1x6d h ASP 82 N -1.14 0.00 0.00 3.26 5.19 -1.58 0.49 116.42 122.64 1x6d h ASP 82 Ca -0.08 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.23 1x6d h ASP 82 Cb 0.60 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.10 1x6d h ASP 82 CO 0.13 0.00 -0.56 0.00 -3.12 0.00 0.00 179.24 175.69 1x6d h ALA 83 N 1.11 0.12 -0.52 3.45 0.00 0.14 -2.78 119.26 120.78 1x6d h ALA 83 Ca 0.31 -0.81 0.10 0.00 0.00 0.00 0.00 54.91 54.51 1x6d h ALA 83 Cb 1.80 0.33 -0.08 0.00 0.00 0.00 0.00 17.79 19.84 1x6d h ALA 83 CO -0.00 0.31 0.04 -0.07 0.00 0.00 0.00 179.25 179.54 1x6d h LEU 84 N -1.00 -0.13 0.69 0.00 3.38 0.46 0.36 115.31 119.07 1x6d h LEU 84 Ca -0.15 0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1x6d h LEU 84 Cb 1.12 0.19 0.01 0.00 0.09 0.00 0.00 40.66 42.06 1x6d h LEU 84 CO -0.09 -0.04 -0.33 0.00 0.09 0.00 0.00 178.44 178.07 1x6d h ALA 85 N 1.45 -0.93 -1.06 1.53 0.00 -0.57 -0.28 119.26 119.40 1x6d h ALA 85 Ca 0.27 -0.20 0.28 0.00 0.00 0.00 0.00 54.91 55.25 1x6d h ALA 85 Cb 0.40 0.36 -0.10 0.00 0.00 0.00 0.00 17.79 18.45 1x6d h ALA 85 CO -0.40 -1.02 0.68 0.82 0.00 0.00 0.00 179.25 179.33 1x6d h ILE 86 N -0.93 0.49 -0.14 0.00 2.04 -1.06 1.64 117.51 119.56 1x6d h ILE 86 Ca -0.09 -0.12 -0.11 0.00 1.00 0.00 0.00 64.86 65.53 1x6d h ILE 86 Cb 0.71 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1x6d h ILE 86 CO 0.16 0.07 -0.40 0.25 0.00 0.00 0.00 178.15 178.22 1x6d h LEU 87 N 0.36 0.32 -0.51 1.44 7.12 0.49 -1.72 115.31 122.80 1x6d h LEU 87 Ca 0.61 -0.13 0.00 0.00 0.13 0.00 0.00 57.88 58.49 1x6d h LEU 87 Cb 1.60 -0.09 0.00 0.00 -0.53 0.00 0.00 40.66 41.64 1x6d h LEU 87 CO -0.30 0.69 0.00 0.54 -0.13 0.00 0.00 178.44 179.24 1x6d n ARG 88 N -4.03 0.21 -0.02 1.25 1.74 0.55 -2.42 116.66 113.93 1x6d n ARG 88 Ca -0.01 0.36 -0.05 0.00 -0.77 0.00 0.00 57.85 57.38 1x6d n ARG 88 Cb 0.48 -1.85 -0.13 0.00 -1.02 0.00 0.00 32.46 29.95 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 -2.23 0.64 0.00 5.56 6.02 -0.45 -3.78 117.38 123.15 1x6d n GLN 89 Ca 0.03 0.19 0.09 0.00 -0.01 0.00 0.00 57.00 57.30 1x6d n GLN 89 Cb 0.28 -1.73 0.48 0.00 1.02 0.00 0.00 30.24 30.29 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 -2.54 2.02 1.01 -1.58 0.00 -0.75 -1.41 120.51 117.26 1x6d n ALA 90 Ca -0.18 -0.09 0.11 0.00 0.00 0.00 0.00 53.44 53.29 1x6d n ALA 90 Cb 0.99 -1.30 0.03 0.00 0.00 0.00 0.00 19.45 19.17 1x6d n ALA 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1x6d n ARG 91 N -1.26 1.46 0.03 0.00 1.74 -1.21 -4.24 116.66 113.19 1x6d n ARG 91 Ca 0.09 -1.20 -0.19 0.00 -0.77 0.00 0.00 57.85 55.78 1x6d n ARG 91 Cb 0.14 -1.48 -0.10 0.00 -1.02 0.00 0.00 32.46 30.00 1x6d n ARG 91 CO 0.00 0.00 0.00 1.05 -1.52 0.00 0.00 177.63 177.16 1x6d h GLU 92 N 2.93 0.64 -7.56 5.56 -0.00 -1.40 0.48 114.58 115.23 1x6d h GLU 92 Ca 0.00 -0.67 -0.44 0.00 -0.00 0.00 0.00 59.36 58.25 1x6d h GLU 92 Cb 0.81 0.19 0.16 0.00 -0.00 0.00 0.00 28.75 29.90 1x6d h GLU 92 CO 0.00 1.26 0.29 -1.25 -0.00 0.00 0.00 179.01 179.31 1x6d s PRO 93 N -3.32 0.30 0.11 1.06 0.04 -1.26 -2.84 135.00 129.09 1x6d s PRO 93 Ca -0.11 -0.02 0.23 0.00 0.04 0.00 0.00 61.00 61.14 1x6d s PRO 93 Cb 0.06 -1.77 0.12 0.00 0.04 0.00 0.00 34.50 32.95 1x6d s PRO 93 CO 0.89 -2.71 1.11 0.54 0.04 0.00 0.00 177.00 176.87 1x6d n ARG 94 N -4.06 0.39 -4.27 4.56 5.12 -1.26 -4.14 116.66 113.00 1x6d n ARG 94 Ca 0.11 0.05 -0.20 0.00 -1.93 0.00 0.00 57.85 55.88 1x6d n ARG 94 Cb 0.59 -1.68 -0.13 0.00 -1.16 0.00 0.00 32.46 30.08 1x6d n ARG 94 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 1x6d s GLN 95 N -3.25 0.94 -0.04 5.56 -0.44 -1.26 0.54 119.66 121.73 1x6d s GLN 95 Ca 0.03 -0.94 0.01 0.00 -2.50 0.00 0.00 55.36 51.96 1x6d s GLN 95 Cb 0.13 -1.01 0.02 0.00 -1.64 0.00 0.00 33.01 30.50 1x6d s GLN 95 CO 0.78 0.24 -0.05 0.00 0.50 0.00 0.00 175.29 176.75 1x6d s ALA 96 N -1.11 0.67 -0.20 1.58 0.00 -1.10 -4.97 121.76 116.64 1x6d s ALA 96 Ca 0.01 -0.12 -0.04 0.00 0.00 0.00 0.00 51.96 51.82 1x6d s ALA 96 Cb -0.09 -0.36 -0.01 0.00 0.00 0.00 0.00 23.12 22.65 1x6d s ALA 96 CO 0.02 0.04 -0.04 0.08 0.00 0.00 0.00 175.76 175.86 1x6d s VAL 97 N 0.64 3.53 -0.12 0.00 1.01 -1.26 -2.25 120.40 121.96 1x6d s VAL 97 Ca -0.09 -0.45 -0.00 0.00 0.00 0.00 0.00 61.98 61.44 1x6d s VAL 97 Cb -0.12 -2.59 0.02 0.00 0.00 0.00 0.00 36.38 33.70 1x6d s VAL 97 CO 0.00 0.44 -0.09 -0.63 0.00 0.00 0.00 175.10 174.82 1x6d s ILE 98 N 1.19 1.10 -0.36 2.22 1.09 -1.22 0.19 121.20 125.41 1x6d s ILE 98 Ca 0.02 -0.34 -0.14 0.00 -1.10 0.00 0.00 60.65 59.09 1x6d s ILE 98 Cb -0.14 -1.10 -0.01 0.00 -1.06 0.00 0.00 42.46 40.15 1x6d s ILE 98 CO -0.01 0.38 0.29 -0.69 -0.10 0.00 0.00 174.94 174.82 1x6d s VAL 99 N 1.63 5.24 0.10 2.92 1.01 -1.12 -2.89 120.40 127.29 1x6d s VAL 99 Ca 0.04 -0.26 0.03 0.00 0.00 0.00 0.00 61.98 61.79 1x6d s VAL 99 Cb -0.13 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 1x6d s VAL 99 CO -0.08 -0.12 -0.09 0.42 0.00 0.00 0.00 175.10 175.23 1x6d s THR 100 N 1.80 0.87 0.26 3.92 -4.23 -1.26 -1.47 115.64 115.53 1x6d s THR 100 Ca 0.07 -1.69 0.06 0.00 -1.18 0.00 0.00 61.69 58.95 1x6d s THR 100 Cb -0.18 -1.40 -0.03 0.00 1.34 0.00 0.00 72.50 72.24 1x6d s THR 100 CO 0.11 -0.63 0.37 -0.13 -0.54 0.00 0.00 174.62 173.80 1x6d s ARG 101 N -2.98 3.32 -0.54 3.99 0.52 -1.26 -2.89 118.95 119.12 1x6d s ARG 101 Ca 0.06 -0.84 -0.28 0.00 -0.52 0.00 0.00 55.73 54.14 1x6d s ARG 101 Cb -0.01 -2.84 0.03 0.00 0.52 0.00 0.00 34.95 32.64 1x6d s ARG 101 CO -0.01 0.35 1.17 0.15 0.02 0.00 0.00 175.30 176.97 1x6d s LYS 102 N -4.01 3.59 0.43 3.54 -0.14 -1.22 -4.67 119.74 117.27 1x6d s LYS 102 Ca 0.36 0.36 0.07 0.00 -1.36 0.00 0.00 55.97 55.40 1x6d s LYS 102 Cb -0.09 -3.97 -0.03 0.00 -1.68 0.00 0.00 37.83 32.06 1x6d s LYS 102 CO 0.29 -1.56 0.27 -0.51 -0.76 0.00 0.00 175.35 173.08 1x6d s LEU 103 N 4.75 3.15 0.86 3.17 1.43 -1.26 -5.09 118.68 125.68 1x6d s LEU 103 Ca 0.45 -1.00 -0.17 0.00 -1.03 0.00 0.00 54.13 52.38 1x6d s LEU 103 Cb -0.07 -1.60 -0.15 0.00 0.03 0.00 0.00 46.19 44.40 1x6d s LEU 103 CO 0.28 -0.65 -0.62 0.35 0.23 0.00 0.00 176.35 175.93 1x6d n THR 104 N -1.40 0.00 -0.52 5.49 -2.24 -1.26 -4.96 114.28 109.39 1x6d n THR 104 Ca 0.00 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 1x6d n THR 104 Cb 0.64 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 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 2.21 -0.04 -5.04 -0.78 -0.04 -1.26 -5.03 135.00 125.03 1x6d n PRO 105 Ca 0.01 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 1x6d n PRO 105 Cb 0.53 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.84 1x6d n PRO 105 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 1x6d s GLU 106 N -2.07 2.55 -0.09 0.54 -1.05 -1.26 -5.11 118.70 112.21 1x6d s GLU 106 Ca 0.00 -0.78 -0.22 0.00 -0.15 0.00 0.00 54.97 53.82 1x6d s GLU 106 Cb 0.00 -2.30 -0.04 0.00 -0.44 0.00 0.00 34.13 31.35 1x6d s GLU 106 CO 0.00 0.51 0.64 0.00 0.95 0.00 0.00 175.26 177.36 1x6d s ALA 107 N -0.45 3.39 -0.39 -0.84 0.00 -1.26 -4.98 121.76 117.23 1x6d s ALA 107 Ca 0.05 0.02 -0.03 0.00 0.00 0.00 0.00 51.96 52.01 1x6d s ALA 107 Cb -0.12 -2.89 0.21 0.00 0.00 0.00 0.00 23.12 20.32 1x6d s ALA 107 CO 0.01 -0.12 0.99 -1.64 0.00 0.00 0.00 175.76 175.00 1x6d s MET 108 N 0.86 0.45 1.07 0.00 1.00 -1.26 -5.17 119.30 116.25 1x6d s MET 108 Ca 0.34 -0.42 -0.18 0.00 0.00 0.00 0.00 55.69 55.43 1x6d s MET 108 Cb -0.17 -0.01 0.26 0.00 0.00 0.00 0.00 34.83 34.90 1x6d s MET 108 CO 0.15 -0.56 1.18 -0.35 0.00 0.00 0.00 175.02 175.44 1x6d n PRO 109 N 2.81 -2.15 -3.18 2.03 -0.04 -1.26 -5.07 135.00 128.14 1x6d n PRO 109 Ca 0.13 -1.85 -0.09 0.00 -0.04 0.00 0.00 63.50 61.65 1x6d n PRO 109 Cb 0.62 -1.45 -0.04 0.00 -0.04 0.00 0.00 33.50 32.59 1x6d n PRO 109 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1x6d s ASP 110 N -5.05 -0.30 1.24 3.54 2.15 -1.26 -5.15 116.67 111.84 1x6d s ASP 110 Ca 0.71 -1.51 -0.20 0.00 0.43 0.00 0.00 52.55 51.98 1x6d s ASP 110 Cb -0.04 1.23 0.30 0.00 -0.30 0.00 0.00 42.92 44.11 1x6d s ASP 110 CO 0.52 -0.17 1.07 -0.76 -0.17 0.00 0.00 175.17 175.66 1x6d s LEU 111 N 1.29 0.36 0.43 -1.34 1.02 -1.26 -4.86 118.68 114.33 1x6d s LEU 111 Ca 0.21 0.70 0.00 0.00 0.02 0.00 0.00 54.13 55.06 1x6d s LEU 111 Cb -0.06 -2.38 0.00 0.00 0.02 0.00 0.00 46.19 43.77 1x6d s LEU 111 CO -0.06 -4.36 0.00 -3.20 0.02 0.00 0.00 176.35 168.75 1x6d n ASN 112 N -4.93 -7.63 -2.68 2.29 2.85 -1.26 -5.05 115.26 98.85 1x6d n ASN 112 Ca 0.13 1.07 -0.04 0.00 -0.11 0.00 0.00 54.58 55.63 1x6d n ASN 112 Cb 0.59 -3.97 0.04 0.00 1.24 0.00 0.00 39.78 37.68 1x6d n ASN 112 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1x6d n SER 113 N -0.69 -1.56 -3.60 1.20 3.41 -1.26 -5.17 113.62 105.96 1x6d n SER 113 Ca 0.00 -1.27 0.03 0.00 -0.26 0.00 0.00 58.87 57.37 1x6d n SER 113 Cb 0.00 0.81 -0.00 0.00 -0.26 0.00 0.00 64.21 64.75 1x6d n SER 113 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1x6d s SER 114 N 0.66 -0.03 0.11 4.04 0.01 -1.26 -5.15 113.70 112.09 1x6d s SER 114 Ca 0.25 -0.07 -0.30 0.00 1.31 0.00 0.00 55.95 57.14 1x6d s SER 114 Cb 0.14 0.08 -0.06 0.00 0.21 0.00 0.00 66.02 66.39 1x6d s SER 114 CO -0.10 -0.14 0.97 -0.83 0.41 0.00 0.00 173.24 173.55 1x6d s GLY 115 N -3.03 2.99 0.96 3.44 0.00 -1.26 -5.05 107.32 105.36 1x6d s GLY 115 Ca 0.15 0.59 -0.16 0.00 0.00 0.00 0.00 44.72 45.31 1x6d s GLY 115 CO -0.05 1.48 1.05 -1.55 0.00 0.00 0.00 173.10 174.03 1x6d n PRO 116 N 2.80 -1.99 -1.55 2.90 -0.04 -1.26 -4.92 135.00 130.95 1x6d n PRO 116 Ca 0.02 -1.65 0.08 0.00 -0.04 0.00 0.00 63.50 61.92 1x6d n PRO 116 Cb 0.49 -1.30 -0.05 0.00 -0.04 0.00 0.00 33.50 32.60 1x6d n PRO 116 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x6d n SER 117 N -4.18 -8.32 -0.06 3.54 2.88 -1.26 -4.95 113.62 101.27 1x6d n SER 117 Ca 0.14 1.72 -0.11 0.00 -1.33 0.00 0.00 58.87 59.29 1x6d n SER 117 Cb 0.51 -5.17 -0.04 0.00 -0.75 0.00 0.00 64.21 58.76 1x6d n SER 117 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1x6d n SER 118 N -3.48 1.57 0.00 -3.46 7.64 -1.26 -5.25 113.62 109.38 1x6d n SER 118 Ca -0.05 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.09 1x6d n SER 118 Cb 0.59 -0.60 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1x6d n SER 118 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64