#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dtt s LYS 2 N 0.00 2.56 -0.04 2.12 -0.14 -1.26 -5.12 119.74 117.86 2dtt s LYS 2 Ca 0.00 -0.71 0.04 0.00 -1.36 0.00 0.00 55.97 53.95 2dtt s LYS 2 Cb 0.00 -2.50 -0.00 0.00 -1.68 0.00 0.00 37.83 33.65 2dtt s LYS 2 CO 0.00 0.61 -0.17 -1.54 -0.76 0.00 0.00 175.35 173.49 2dtt s SER 3 N -1.31 2.07 0.04 2.83 1.04 -1.26 -5.09 113.70 112.02 2dtt s SER 3 Ca 0.16 -0.33 -0.00 0.00 0.48 0.00 0.00 55.95 56.25 2dtt s SER 3 Cb -0.11 -0.51 -0.03 0.00 0.10 0.00 0.00 66.02 65.47 2dtt s SER 3 CO 0.06 0.16 -0.04 -0.13 0.98 0.00 0.00 173.24 174.28 2dtt s ARG 4 N -0.04 0.53 -0.04 4.02 0.52 -1.26 -2.19 118.95 120.49 2dtt s ARG 4 Ca -0.02 -1.01 0.03 0.00 -0.52 0.00 0.00 55.73 54.21 2dtt s ARG 4 Cb -0.10 0.11 -0.03 0.00 0.52 0.00 0.00 34.95 35.45 2dtt s ARG 4 CO 0.01 -0.07 -0.11 0.96 0.02 0.00 0.00 175.30 176.11 2dtt s ILE 5 N -2.97 3.37 -0.07 1.52 -4.36 -0.36 -4.94 121.20 113.40 2dtt s ILE 5 Ca -0.01 -0.67 0.05 0.00 -0.26 0.00 0.00 60.65 59.77 2dtt s ILE 5 Cb 0.01 -2.37 -0.01 0.00 1.25 0.00 0.00 42.46 41.34 2dtt s ILE 5 CO -0.06 0.55 -0.23 -0.63 0.24 0.00 0.00 174.94 174.81 2dtt s ILE 6 N -0.81 2.22 -0.07 8.37 1.01 -1.26 -1.53 121.20 129.13 2dtt s ILE 6 Ca 0.13 -1.00 0.03 0.00 0.00 0.00 0.00 60.65 59.81 2dtt s ILE 6 Cb -0.11 -1.82 0.01 0.00 0.01 0.00 0.00 42.46 40.54 2dtt s ILE 6 CO 0.02 0.57 -0.17 0.54 0.00 0.00 0.00 174.94 175.89 2dtt s VAL 7 N -0.14 1.52 -0.06 2.92 0.11 -0.48 -4.98 120.40 119.28 2dtt s VAL 7 Ca -0.04 -0.72 0.03 0.00 -2.93 0.00 0.00 61.98 58.32 2dtt s VAL 7 Cb -0.14 -1.34 -0.02 0.00 -1.53 0.00 0.00 36.38 33.35 2dtt s VAL 7 CO 0.04 0.44 -0.14 -0.13 -3.33 0.00 0.00 175.10 171.97 2dtt s ARG 8 N 0.42 2.66 0.33 1.54 0.52 -1.26 -1.45 118.95 121.70 2dtt s ARG 8 Ca -0.14 -0.70 -0.06 0.00 -0.52 0.00 0.00 55.73 54.31 2dtt s ARG 8 Cb -0.16 -2.42 0.01 0.00 0.52 0.00 0.00 34.95 32.90 2dtt s ARG 8 CO 0.05 0.54 0.51 -0.08 0.02 0.00 0.00 175.30 176.34 2dtt s THR 9 N -0.51 0.00 0.07 0.02 -1.32 -0.53 -5.02 115.64 108.35 2dtt s THR 9 Ca 0.07 -1.49 -0.12 0.00 -1.21 0.00 0.00 61.69 58.94 2dtt s THR 9 Cb -0.12 -2.58 0.02 0.00 -1.51 0.00 0.00 72.50 68.31 2dtt s THR 9 CO 0.02 0.00 0.28 -0.94 -2.21 0.00 0.00 174.62 171.77 2dtt s SER 10 N -3.17 -0.06 0.08 8.08 1.04 -1.26 -0.39 113.70 118.02 2dtt s SER 10 Ca 0.27 -0.36 -0.18 0.00 0.48 0.00 0.00 55.95 56.15 2dtt s SER 10 Cb -0.01 0.37 0.04 0.00 0.10 0.00 0.00 66.02 66.52 2dtt s SER 10 CO 0.16 -0.70 0.43 0.72 0.98 0.00 0.00 173.24 174.84 2dtt s PHE 11 N -3.20 -0.27 0.06 5.02 -0.12 -0.51 -4.97 117.98 113.97 2dtt s PHE 11 Ca -0.00 0.12 0.08 0.00 -0.05 0.00 0.00 56.93 57.07 2dtt s PHE 11 Cb 0.01 0.27 -0.03 0.00 -0.63 0.00 0.00 43.02 42.64 2dtt s PHE 11 CO -0.07 -0.65 -0.21 0.16 -0.05 0.00 0.00 175.22 174.39 2dtt s ASP 12 N -2.38 3.57 0.01 1.98 1.47 -1.26 0.18 116.67 120.24 2dtt s ASP 12 Ca -0.01 -0.52 -0.23 0.00 1.18 0.00 0.00 52.55 52.97 2dtt s ASP 12 Cb 0.00 -0.47 0.05 0.00 -0.34 0.00 0.00 42.92 42.16 2dtt s ASP 12 CO -0.07 0.24 0.51 0.00 0.68 0.00 0.00 175.17 176.54 2dtt s ALA 13 N -0.92 -1.31 0.15 2.11 0.00 -0.92 0.66 121.76 121.54 2dtt s ALA 13 Ca 0.14 0.69 0.05 0.00 0.00 0.00 0.00 51.96 52.84 2dtt s ALA 13 Cb -0.10 0.24 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 2dtt s ALA 13 CO 0.05 -0.43 0.15 0.00 0.00 0.00 0.00 175.76 175.53 2dtt s ALA 14 N -1.97 3.62 -0.02 0.00 0.00 -0.82 -1.64 121.76 120.93 2dtt s ALA 14 Ca -0.08 -1.17 -0.30 0.00 0.00 0.00 0.00 51.96 50.41 2dtt s ALA 14 Cb -0.01 -1.42 0.12 0.00 0.00 0.00 0.00 23.12 21.81 2dtt s ALA 14 CO 0.02 0.53 1.29 -3.38 0.00 0.00 0.00 175.76 174.22 2dtt s HIS 15 N -1.71 -0.03 -0.09 0.00 -3.43 -0.16 -0.56 115.29 109.30 2dtt s HIS 15 Ca 0.31 -0.07 -0.05 0.00 -0.80 0.00 0.00 55.06 54.45 2dtt s HIS 15 Cb -0.10 0.55 0.04 0.00 -1.43 0.00 0.00 32.58 31.64 2dtt s HIS 15 CO 0.24 -0.27 0.22 0.00 -2.00 0.00 0.00 174.74 172.92 2dtt s ALA 16 N -2.34 -0.48 0.18 -1.38 0.00 -1.26 -2.23 121.76 114.25 2dtt s ALA 16 Ca 0.16 0.87 -0.03 0.00 0.00 0.00 0.00 51.96 52.97 2dtt s ALA 16 Cb 0.04 -0.56 -0.05 0.00 0.00 0.00 0.00 23.12 22.55 2dtt s ALA 16 CO -0.03 -0.18 0.40 0.08 0.00 0.00 0.00 175.76 176.03 2dtt s VAL 17 N 1.12 5.17 0.07 0.00 1.01 -1.26 -4.73 120.40 121.78 2dtt s VAL 17 Ca -0.08 -0.11 -0.31 0.00 0.00 0.00 0.00 61.98 61.48 2dtt s VAL 17 Cb -0.10 -3.67 -0.07 0.00 0.00 0.00 0.00 36.38 32.54 2dtt s VAL 17 CO -0.07 -0.08 1.42 -0.54 0.00 0.00 0.00 175.10 175.84 2dtt s LYS 18 N -2.99 4.29 -0.69 2.72 1.02 -1.26 -2.17 119.74 120.66 2dtt s LYS 18 Ca 0.40 2.06 0.04 0.00 0.02 0.00 0.00 55.97 58.49 2dtt s LYS 18 Cb -0.12 -3.40 0.33 0.00 -0.52 0.00 0.00 37.83 34.12 2dtt s LYS 18 CO 0.27 -0.51 1.11 1.33 -0.92 0.00 0.00 175.35 176.62 2dtt n VAL 19 N 4.27 3.66 0.00 3.17 0.24 0.01 -4.92 118.33 124.76 2dtt n VAL 19 Ca 0.12 -5.64 0.00 0.00 -2.04 0.00 0.00 64.34 56.79 2dtt n VAL 19 Cb 0.43 -1.52 0.00 0.00 -1.47 0.00 0.00 33.84 31.27 2dtt n VAL 19 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dtt n GLY 20 N -0.05 0.53 0.01 7.63 0.00 -1.26 -4.26 105.19 107.78 2dtt n GLY 20 Ca 0.34 -1.19 0.11 0.00 0.00 0.00 0.00 46.02 45.27 2dtt n GLY 20 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2dtt n ASP 21 N 0.00 0.60 -4.78 1.61 2.03 -1.26 -4.98 116.55 109.76 2dtt n ASP 21 Ca 0.00 -0.49 -0.30 0.00 0.52 0.00 0.00 54.79 54.52 2dtt n ASP 21 Cb 0.00 1.24 -0.06 0.00 -0.72 0.00 0.00 41.12 41.58 2dtt n ASP 21 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2dtt s HIS 22 N -3.21 1.96 0.18 -0.67 3.76 -1.26 -5.13 115.29 110.93 2dtt s HIS 22 Ca 0.02 -0.85 0.07 0.00 -0.15 0.00 0.00 55.06 54.16 2dtt s HIS 22 Cb 0.15 -1.76 -0.04 0.00 1.11 0.00 0.00 32.58 32.04 2dtt s HIS 22 CO 0.86 0.06 0.01 -1.58 -0.85 0.00 0.00 174.74 173.24 2dtt s TRP 23 N -2.80 2.86 1.01 1.40 0.52 -1.26 -0.81 118.94 119.87 2dtt s TRP 23 Ca 0.21 -0.13 -0.14 0.00 0.02 0.00 0.00 56.10 56.06 2dtt s TRP 23 Cb 0.02 -1.38 0.19 0.00 -1.15 0.00 0.00 33.47 31.15 2dtt s TRP 23 CO 0.12 0.52 1.12 -2.00 0.02 0.00 0.00 176.95 176.74 2dtt s GLU 24 N -3.02 0.35 0.18 4.98 2.12 -0.92 -4.82 118.70 117.56 2dtt s GLU 24 Ca 0.28 0.27 -0.30 0.00 0.36 0.00 0.00 54.97 55.58 2dtt s GLU 24 Cb -0.09 -1.75 -0.08 0.00 0.26 0.00 0.00 34.13 32.47 2dtt s GLU 24 CO 0.19 -2.73 1.05 -0.51 -0.54 0.00 0.00 175.26 172.72 2dtt s ASP 25 N -3.81 7.36 0.33 -1.70 1.01 -1.26 -4.76 116.67 113.84 2dtt s ASP 25 Ca 0.66 2.02 -0.29 0.00 0.71 0.00 0.00 52.55 55.66 2dtt s ASP 25 Cb -0.15 -2.60 -0.11 0.00 1.01 0.00 0.00 42.92 41.07 2dtt s ASP 25 CO 0.56 -0.14 1.52 -0.69 0.21 0.00 0.00 175.17 176.63 2dtt s VAL 26 N -0.37 2.12 0.15 -1.27 1.01 -1.26 -4.74 120.40 116.04 2dtt s VAL 26 Ca 0.47 0.11 -0.18 0.00 0.00 0.00 0.00 61.98 62.39 2dtt s VAL 26 Cb -0.28 -3.07 0.04 0.00 0.00 0.00 0.00 36.38 33.07 2dtt s VAL 26 CO 0.34 0.02 0.48 -1.38 0.00 0.00 0.00 175.10 174.56 2dtt s HIS 27 N -0.58 -0.28 0.22 5.22 -3.43 -0.95 -4.95 115.29 110.55 2dtt s HIS 27 Ca 0.57 -0.01 0.09 0.00 -0.80 0.00 0.00 55.06 54.91 2dtt s HIS 27 Cb -0.46 0.36 -0.04 0.00 -1.43 0.00 0.00 32.58 31.01 2dtt s HIS 27 CO 0.55 -0.78 -0.04 0.20 -2.00 0.00 0.00 174.74 172.67 2dtt s GLY 28 N -2.80 1.69 0.07 -1.38 0.00 -1.26 -0.99 107.32 102.66 2dtt s GLY 28 Ca 0.03 -1.55 0.02 0.00 0.00 0.00 0.00 44.72 43.22 2dtt s GLY 28 CO -0.11 -1.60 -0.07 0.30 0.00 0.00 0.00 173.10 171.63 2dtt s HIS 29 N -2.03 0.79 -0.29 1.90 3.76 -0.65 -4.98 115.29 113.79 2dtt s HIS 29 Ca 0.29 -0.76 -0.19 0.00 -0.15 0.00 0.00 55.06 54.25 2dtt s HIS 29 Cb -0.08 -0.47 -0.02 0.00 1.11 0.00 0.00 32.58 33.13 2dtt s HIS 29 CO 0.18 -0.13 0.54 0.99 -0.85 0.00 0.00 174.74 175.47 2dtt s THR 30 N -2.76 5.02 0.06 1.30 2.01 -1.26 -2.16 115.64 117.86 2dtt s THR 30 Ca 0.03 0.77 -0.22 0.00 0.31 0.00 0.00 61.69 62.59 2dtt s THR 30 Cb -0.01 -3.90 -0.06 0.00 0.01 0.00 0.00 72.50 68.54 2dtt s THR 30 CO -0.03 -0.03 0.65 -0.36 -0.69 0.00 0.00 174.62 174.16 2dtt s PHE 31 N 2.41 3.77 -0.22 4.92 0.40 0.48 -2.49 117.98 127.25 2dtt s PHE 31 Ca 0.22 1.35 -0.04 0.00 -0.60 0.00 0.00 56.93 57.86 2dtt s PHE 31 Cb -0.15 -2.64 -0.01 0.00 0.51 0.00 0.00 43.02 40.73 2dtt s PHE 31 CO 0.11 0.44 -0.03 -0.06 0.70 0.00 0.00 175.22 176.38 2dtt s PHE 32 N -0.63 2.97 -0.13 0.36 0.08 -0.61 -1.43 117.98 118.59 2dtt s PHE 32 Ca 0.32 -0.82 -0.01 0.00 0.12 0.00 0.00 56.93 56.55 2dtt s PHE 32 Cb -0.20 -2.11 -0.02 0.00 -0.57 0.00 0.00 43.02 40.12 2dtt s PHE 32 CO 0.20 -0.48 -0.08 -1.17 -0.10 0.00 0.00 175.22 173.59 2dtt s LEU 33 N 1.40 3.00 -0.14 -0.37 2.96 0.47 -0.34 118.68 125.66 2dtt s LEU 33 Ca 0.05 -0.19 0.02 0.00 -0.22 0.00 0.00 54.13 53.78 2dtt s LEU 33 Cb -0.14 -1.69 0.02 0.00 0.50 0.00 0.00 46.19 44.87 2dtt s LEU 33 CO -0.02 0.21 -0.18 -0.70 -1.32 0.00 0.00 176.35 174.34 2dtt s GLU 34 N 0.12 2.66 -0.13 1.98 2.12 0.18 -1.46 118.70 124.17 2dtt s GLU 34 Ca -0.04 -0.71 0.02 0.00 0.36 0.00 0.00 54.97 54.60 2dtt s GLU 34 Cb -0.14 -2.25 -0.00 0.00 0.26 0.00 0.00 34.13 31.99 2dtt s GLU 34 CO 0.04 -0.11 -0.18 0.08 -0.54 0.00 0.00 175.26 174.55 2dtt s VAL 35 N 1.09 2.51 -0.18 3.70 1.01 -0.53 -0.70 120.40 127.30 2dtt s VAL 35 Ca -0.02 -0.84 -0.00 0.00 0.00 0.00 0.00 61.98 61.11 2dtt s VAL 35 Cb -0.14 -2.02 0.01 0.00 0.00 0.00 0.00 36.38 34.22 2dtt s VAL 35 CO -0.06 0.54 -0.15 0.00 0.00 0.00 0.00 175.10 175.43 2dtt s ALA 36 N 0.52 2.49 -0.15 5.51 0.00 0.51 -1.38 121.76 129.26 2dtt s ALA 36 Ca -0.12 -1.15 0.00 0.00 0.00 0.00 0.00 51.96 50.69 2dtt s ALA 36 Cb -0.16 -1.31 -0.00 0.00 0.00 0.00 0.00 23.12 21.64 2dtt s ALA 36 CO 0.04 -0.27 -0.15 0.42 0.00 0.00 0.00 175.76 175.81 2dtt s ILE 37 N 1.19 2.73 -0.10 0.00 1.09 -0.58 -0.79 121.20 124.74 2dtt s ILE 37 Ca 0.02 -0.75 -0.06 0.00 -1.10 0.00 0.00 60.65 58.76 2dtt s ILE 37 Cb -0.14 -2.15 -0.04 0.00 -1.06 0.00 0.00 42.46 39.07 2dtt s ILE 37 CO -0.07 0.51 0.12 -0.70 -0.10 0.00 0.00 174.94 174.70 2dtt s GLU 38 N 0.79 3.35 0.07 2.79 2.12 -0.43 -1.22 118.70 126.17 2dtt s GLU 38 Ca -0.05 -0.21 -0.16 0.00 0.36 0.00 0.00 54.97 54.91 2dtt s GLU 38 Cb -0.15 -3.10 0.05 0.00 0.26 0.00 0.00 34.13 31.19 2dtt s GLU 38 CO 0.00 0.75 0.75 0.41 -0.54 0.00 0.00 175.26 176.64 2dtt n GLY 39 N 1.89 0.65 3.82 -1.50 0.00 -0.93 -1.42 105.19 107.70 2dtt n GLY 39 Ca -0.19 -1.04 -0.37 0.00 0.00 0.00 0.00 46.02 44.42 2dtt n GLY 39 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dtt s GLU 40 N -2.02 4.11 -0.64 1.61 0.41 -1.26 -4.21 118.70 116.70 2dtt s GLU 40 Ca 0.17 0.64 -0.28 0.00 -0.41 0.00 0.00 54.97 55.10 2dtt s GLU 40 Cb -0.01 -3.10 0.02 0.00 -1.78 0.00 0.00 34.13 29.25 2dtt s GLU 40 CO 0.02 0.57 1.33 0.42 -0.49 0.00 0.00 175.26 177.11 2dtt s ILE 41 N -1.26 3.80 -0.16 -1.63 1.01 -1.26 -4.22 121.20 117.47 2dtt s ILE 41 Ca 0.33 0.60 -0.02 0.00 0.00 0.00 0.00 60.65 61.56 2dtt s ILE 41 Cb -0.18 -4.68 -0.01 0.00 0.01 0.00 0.00 42.46 37.60 2dtt s ILE 41 CO 0.19 -1.48 -0.09 -0.75 0.00 0.00 0.00 174.94 172.81 2dtt s LYS 42 N 5.55 3.41 -1.66 2.79 2.20 0.19 -4.49 119.74 127.73 2dtt s LYS 42 Ca 0.44 -0.65 -0.00 0.00 -0.36 0.00 0.00 55.97 55.39 2dtt s LYS 42 Cb -0.09 -2.78 0.00 0.00 -1.51 0.00 0.00 37.83 33.45 2dtt s LYS 42 CO 0.21 0.08 0.04 0.09 -0.36 0.00 0.00 175.35 175.41 2dtt n ASN 43 N 3.94 -5.62 0.00 1.43 3.02 -1.26 -1.22 115.26 115.55 2dtt n ASN 43 Ca -0.18 -0.01 0.00 0.00 -0.03 0.00 0.00 54.58 54.36 2dtt n ASN 43 Cb 0.52 -4.68 0.00 0.00 -0.61 0.00 0.00 39.78 35.01 2dtt n ASN 43 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dtt n GLY 44 N -1.02 0.61 3.06 7.41 0.00 -1.26 -5.04 105.19 108.95 2dtt n GLY 44 Ca -0.22 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.66 2dtt n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dtt s TYR 45 N -2.27 0.70 -0.23 1.61 2.02 -0.36 -5.04 117.35 113.79 2dtt s TYR 45 Ca 0.00 -0.42 -0.16 0.00 -0.37 0.00 0.00 57.07 56.12 2dtt s TYR 45 Cb 0.00 -0.42 -0.10 0.00 -0.40 0.00 0.00 41.96 41.03 2dtt s TYR 45 CO 0.00 -0.06 -0.26 0.28 -1.57 0.00 0.00 175.55 173.95 2dtt n VAL 46 N 1.72 1.51 -3.54 0.71 0.31 -1.26 0.54 118.33 118.32 2dtt n VAL 46 Ca -0.21 -0.12 -0.17 0.00 -0.01 0.00 0.00 64.34 63.82 2dtt n VAL 46 Cb 0.55 -2.09 -0.06 0.00 -0.91 0.00 0.00 33.84 31.33 2dtt n VAL 46 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 2dtt s MET 47 N -2.58 1.03 0.10 5.55 -2.45 -1.26 -4.79 119.30 114.89 2dtt s MET 47 Ca -0.32 0.36 -0.31 0.00 -1.25 0.00 0.00 55.69 54.16 2dtt s MET 47 Cb 0.09 0.49 -0.08 0.00 1.25 0.00 0.00 34.83 36.58 2dtt s MET 47 CO 0.46 -0.30 1.47 0.34 1.05 0.00 0.00 175.02 178.04 2dtt s ASP 48 N -0.98 6.75 0.12 1.11 2.15 -1.26 -4.94 116.67 119.62 2dtt s ASP 48 Ca -0.09 2.36 -0.31 0.00 0.43 0.00 0.00 52.55 54.94 2dtt s ASP 48 Cb -0.01 -2.58 -0.10 0.00 -0.30 0.00 0.00 42.92 39.94 2dtt s ASP 48 CO 0.09 -0.73 1.58 -0.26 -0.17 0.00 0.00 175.17 175.67 2dtt h PHE 49 N 7.24 -1.27 -0.76 -5.34 0.04 -2.00 -2.24 116.94 112.61 2dtt h PHE 49 Ca -0.41 0.04 0.09 0.00 2.80 0.00 0.00 57.97 60.48 2dtt h PHE 49 Cb 1.20 0.55 -0.05 0.00 2.20 0.00 0.00 35.95 39.85 2dtt h PHE 49 CO 0.69 -0.52 0.50 1.25 -0.60 0.00 0.00 178.31 179.63 2dtt h LEU 50 N -0.63 0.63 -0.81 1.54 5.85 -1.99 0.30 115.31 120.21 2dtt h LEU 50 Ca 0.03 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.71 2dtt h LEU 50 Cb 0.68 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.56 2dtt h LEU 50 CO -0.30 0.38 0.22 -0.08 -0.34 0.00 0.00 178.44 178.33 2dtt h GLU 51 N 0.70 1.11 -0.15 1.25 4.81 -1.83 -1.68 114.58 118.80 2dtt h GLU 51 Ca 0.35 -0.23 -0.09 0.00 -0.13 0.00 0.00 59.36 59.25 2dtt h GLU 51 Cb 0.42 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.64 2dtt h GLU 51 CO -0.13 0.95 -0.27 1.25 -0.73 0.00 0.00 179.01 180.08 2dtt h LEU 52 N 1.07 0.50 -0.99 1.64 5.85 -0.65 -3.08 115.31 119.64 2dtt h LEU 52 Ca 0.23 -0.54 0.06 0.00 0.84 0.00 0.00 57.88 58.47 2dtt h LEU 52 Cb 0.30 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.12 2dtt h LEU 52 CO -0.01 0.95 0.64 -0.09 -0.34 0.00 0.00 178.44 179.59 2dtt h ARG 53 N 0.07 1.15 -0.74 1.25 2.43 -0.81 -1.68 114.38 116.05 2dtt h ARG 53 Ca 0.01 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.05 2dtt h ARG 53 Cb 0.86 -0.26 -0.03 0.00 -0.42 0.00 0.00 29.97 30.12 2dtt h ARG 53 CO 0.06 0.76 0.21 0.87 -1.51 0.00 0.00 179.97 180.37 2dtt h LYS 54 N 1.18 1.16 -0.34 0.20 1.57 -1.34 0.11 116.57 119.12 2dtt h LYS 54 Ca 0.42 -0.26 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 2dtt h LYS 54 Cb 0.13 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 2dtt h LYS 54 CO -0.16 1.00 0.15 0.82 -0.57 0.00 0.00 179.45 180.69 2dtt h ILE 55 N 1.11 1.17 -0.34 1.86 2.04 -1.31 -2.09 117.51 119.95 2dtt h ILE 55 Ca 0.24 -0.49 -0.07 0.00 1.00 0.00 0.00 64.86 65.54 2dtt h ILE 55 Cb 0.33 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 2dtt h ILE 55 CO -0.00 0.18 -0.08 0.58 0.00 0.00 0.00 178.15 178.83 2dtt h VAL 56 N 0.40 1.28 0.00 1.67 2.07 -1.06 -3.12 116.25 117.49 2dtt h VAL 56 Ca 0.11 -1.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.50 2dtt h VAL 56 Cb 0.14 1.32 -0.00 0.00 -1.52 0.00 0.00 31.29 31.23 2dtt h VAL 56 CO -0.01 0.37 -0.04 -0.33 0.02 0.00 0.00 177.57 177.58 2dtt h GLU 57 N 0.43 0.00 -0.12 1.57 5.08 -0.77 -0.56 114.58 120.21 2dtt h GLU 57 Ca 0.09 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.31 2dtt h GLU 57 Cb 0.57 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 2dtt h GLU 57 CO 0.03 0.04 -0.53 0.93 -1.00 0.00 0.00 179.01 178.47 2dtt h GLU 58 N 0.00 0.34 -0.00 2.33 5.08 -1.33 -1.22 114.58 119.78 2dtt h GLU 58 Ca -0.00 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.15 2dtt h GLU 58 Cb 0.68 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.95 2dtt h GLU 58 CO 0.00 0.79 -0.00 0.82 -1.00 0.00 0.00 179.01 179.62 2dtt h ILE 59 N 0.27 1.62 0.00 3.13 2.04 -1.35 -3.25 117.51 119.97 2dtt h ILE 59 Ca 0.01 -1.84 -0.02 0.00 1.00 0.00 0.00 64.86 64.01 2dtt h ILE 59 Cb 1.03 2.87 -0.00 0.00 -0.74 0.00 0.00 36.82 39.98 2dtt h ILE 59 CO 0.09 0.48 -0.10 0.71 0.00 0.00 0.00 178.15 179.32 2dtt h THR 60 N -0.78 0.53 -0.80 -0.27 1.35 -1.15 -2.45 112.91 109.35 2dtt h THR 60 Ca -0.00 -0.47 0.08 0.00 -0.55 0.00 0.00 66.41 65.47 2dtt h THR 60 Cb 0.79 1.31 -0.05 0.00 -1.73 0.00 0.00 68.15 68.46 2dtt h THR 60 CO 0.00 0.10 0.52 0.50 -0.25 0.00 0.00 175.52 176.39 2dtt h LYS 61 N 0.00 0.77 0.00 4.72 3.64 -1.25 0.12 116.57 124.58 2dtt h LYS 61 Ca -0.00 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 2dtt h LYS 61 Cb 0.30 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 31.94 2dtt h LYS 61 CO 0.01 0.51 -0.16 0.93 -2.27 0.00 0.00 179.45 178.47 2dtt h GLU 62 N 0.80 0.00 0.00 1.90 5.08 -1.54 -3.07 114.58 117.75 2dtt h GLU 62 Ca 0.36 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.41 2dtt h GLU 62 Cb 0.35 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.54 2dtt h GLU 62 CO -0.13 0.16 -1.96 1.28 -1.00 0.00 0.00 179.01 177.35 2dtt n LEU 63 N -3.52 0.52 -4.68 1.33 4.77 -0.17 -4.84 117.00 110.42 2dtt n LEU 63 Ca -0.01 0.25 -0.49 0.00 -0.03 0.00 0.00 56.01 55.72 2dtt n LEU 63 Cb 0.31 0.29 -0.05 0.00 -2.33 0.00 0.00 43.42 41.65 2dtt n LEU 63 CO 0.31 0.41 1.34 -0.67 -1.33 0.00 0.00 177.39 177.46 2dtt n ASP 64 N -2.91 3.05 0.00 -1.43 2.03 0.25 -1.51 116.55 116.03 2dtt n ASP 64 Ca -0.23 1.03 0.00 0.00 0.52 0.00 0.00 54.79 56.11 2dtt n ASP 64 Cb 1.08 -1.33 0.00 0.00 -0.72 0.00 0.00 41.12 40.14 2dtt n ASP 64 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 2dtt n HIS 65 N 5.31 0.00 -4.11 -0.67 8.25 0.21 -4.96 115.22 119.25 2dtt n HIS 65 Ca 0.21 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.43 2dtt n HIS 65 Cb 0.26 -0.50 -0.05 0.00 1.12 0.00 0.00 29.99 30.82 2dtt n HIS 65 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2dtt s ARG 66 N -0.50 2.85 -0.46 -0.41 0.52 -0.57 -4.92 118.95 115.47 2dtt s ARG 66 Ca 0.00 -0.96 -0.29 0.00 -0.52 0.00 0.00 55.73 53.96 2dtt s ARG 66 Cb 0.00 -2.59 0.03 0.00 0.52 0.00 0.00 34.95 32.91 2dtt s ARG 66 CO 0.00 0.45 1.18 1.21 0.02 0.00 0.00 175.30 178.16 2dtt s ASN 67 N -3.33 6.60 0.62 0.23 3.84 -1.26 -1.95 114.94 119.69 2dtt s ASN 67 Ca 0.31 0.56 0.40 0.00 0.21 0.00 0.00 52.86 54.34 2dtt s ASN 67 Cb -0.09 -2.55 1.96 0.00 -0.55 0.00 0.00 41.25 40.02 2dtt s ASN 67 CO 0.23 -1.26 2.20 -0.07 -2.79 0.00 0.00 177.10 175.42 2dtt h LEU 68 N 11.31 0.00 0.00 3.21 3.38 -1.19 -1.43 115.31 130.59 2dtt h LEU 68 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2dtt h LEU 68 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 2dtt h LEU 68 CO 1.12 0.00 0.00 0.59 0.09 0.00 0.00 178.44 180.24 2dtt n ASN 69 N -3.09 0.00 0.07 -0.43 4.13 -1.26 -0.37 115.26 114.31 2dtt n ASN 69 Ca -0.01 0.40 0.12 0.00 1.68 0.00 0.00 54.58 56.76 2dtt n ASN 69 Cb 0.18 -0.45 0.03 0.00 -1.54 0.00 0.00 39.78 37.99 2dtt n ASN 69 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2dtt n ASN 70 N -1.45 0.71 -0.09 6.41 3.02 -0.54 -4.38 115.26 118.94 2dtt n ASN 70 Ca 0.05 0.14 -0.11 0.00 -0.03 0.00 0.00 54.58 54.64 2dtt n ASN 70 Cb 0.20 0.56 -0.10 0.00 -0.61 0.00 0.00 39.78 39.83 2dtt n ASN 70 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2dtt n ILE 71 N -2.37 1.08 -4.73 2.41 5.41 -0.62 -5.00 119.36 115.55 2dtt n ILE 71 Ca 0.01 -0.51 -0.31 0.00 1.00 0.00 0.00 62.75 62.93 2dtt n ILE 71 Cb 0.50 -0.95 -0.13 0.00 -0.71 0.00 0.00 39.64 38.35 2dtt n ILE 71 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 2dtt s PHE 72 N -2.38 2.58 0.22 1.39 0.08 0.50 -5.01 117.98 115.36 2dtt s PHE 72 Ca -0.19 -0.24 -0.02 0.00 0.12 0.00 0.00 56.93 56.61 2dtt s PHE 72 Cb 0.06 -1.50 0.21 0.00 -0.57 0.00 0.00 43.02 41.22 2dtt s PHE 72 CO 0.52 0.23 1.58 1.49 -0.10 0.00 0.00 175.22 178.94 2dtt h GLU 73 N 4.73 0.56 -2.53 0.44 4.57 -1.85 -3.38 114.58 117.12 2dtt h GLU 73 Ca -0.47 -0.29 -0.55 0.00 -1.18 0.00 0.00 59.36 56.87 2dtt h GLU 73 Cb 1.15 0.01 -0.38 0.00 -0.16 0.00 0.00 28.75 29.37 2dtt h GLU 73 CO 0.48 0.88 -0.82 1.21 -1.18 0.00 0.00 179.01 179.57 2dtt s ASN 74 N -6.86 2.81 0.00 1.04 2.47 -1.26 -4.99 114.94 108.15 2dtt s ASN 74 Ca -0.07 -2.03 -0.02 0.00 0.42 0.00 0.00 52.86 51.16 2dtt s ASN 74 Cb 0.12 -0.28 -0.09 0.00 -1.45 0.00 0.00 41.25 39.56 2dtt s ASN 74 CO 0.82 -0.32 1.68 -0.81 -3.72 0.00 0.00 177.10 174.76 2dtt n PRO 75 N 4.18 0.81 -1.27 0.43 -0.04 -1.26 -4.74 135.00 133.12 2dtt n PRO 75 Ca 0.10 -0.33 -0.31 0.00 -0.04 0.00 0.00 63.50 62.92 2dtt n PRO 75 Cb 0.38 -1.59 0.09 0.00 -0.04 0.00 0.00 33.50 32.35 2dtt n PRO 75 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2dtt s THR 76 N 1.71 3.33 0.49 0.52 -4.23 -1.26 -4.84 115.64 111.35 2dtt s THR 76 Ca 0.22 0.44 0.19 0.00 -1.18 0.00 0.00 61.69 61.35 2dtt s THR 76 Cb 0.10 -2.92 0.25 0.00 1.34 0.00 0.00 72.50 71.27 2dtt s THR 76 CO 0.00 -0.56 2.10 0.74 -0.54 0.00 0.00 174.62 176.36 2dtt h THR 77 N -1.10 0.93 -0.15 3.99 2.02 -1.98 -2.07 112.91 114.55 2dtt h THR 77 Ca -0.44 -0.31 -0.18 0.00 0.77 0.00 0.00 66.41 66.26 2dtt h THR 77 Cb 1.23 1.17 0.01 0.00 -1.74 0.00 0.00 68.15 68.82 2dtt h THR 77 CO 0.51 0.08 -0.61 -0.33 0.37 0.00 0.00 175.52 175.54 2dtt h GLU 78 N 0.00 0.69 -0.11 6.66 3.07 -1.96 -1.90 114.58 121.03 2dtt h GLU 78 Ca -0.00 -0.53 -0.10 0.00 -0.50 0.00 0.00 59.36 58.23 2dtt h GLU 78 Cb 0.16 0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.16 2dtt h GLU 78 CO 0.01 1.15 -0.38 -0.91 -1.40 0.00 0.00 179.01 177.48 2dtt h ASN 79 N 0.37 0.23 -0.12 1.42 2.35 -1.72 -0.31 115.58 117.81 2dtt h ASN 79 Ca -0.03 -0.09 -0.08 0.00 -0.55 0.00 0.00 56.30 55.55 2dtt h ASN 79 Cb 1.24 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.55 2dtt h ASN 79 CO 0.13 0.60 -0.23 0.40 -1.65 0.00 0.00 177.43 176.68 2dtt h ILE 80 N 0.19 1.38 -0.23 2.81 2.04 -1.41 -2.04 117.51 120.25 2dtt h ILE 80 Ca 0.02 -1.50 0.00 0.00 1.00 0.00 0.00 64.86 64.38 2dtt h ILE 80 Cb 0.76 2.06 -0.01 0.00 -0.74 0.00 0.00 36.82 38.89 2dtt h ILE 80 CO 0.06 0.44 0.14 0.00 0.00 0.00 0.00 178.15 178.79 2dtt h ALA 81 N 0.53 0.28 -0.47 1.87 0.00 -1.17 -0.32 119.26 119.99 2dtt h ALA 81 Ca 0.00 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.96 2dtt h ALA 81 Cb 0.82 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.48 2dtt h ALA 81 CO 0.05 -0.25 0.20 -0.07 0.00 0.00 0.00 179.25 179.18 2dtt h LEU 82 N 0.29 0.25 -0.98 0.00 3.38 -1.08 0.23 115.31 117.40 2dtt h LEU 82 Ca 0.09 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2dtt h LEU 82 Cb -0.02 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 2dtt h LEU 82 CO -0.03 0.18 0.49 -0.25 0.09 0.00 0.00 178.44 178.92 2dtt h TRP 83 N 0.39 1.17 -0.25 1.13 7.01 -0.92 -1.44 115.95 123.05 2dtt h TRP 83 Ca 0.22 -0.02 -0.11 0.00 2.11 0.00 0.00 58.89 61.09 2dtt h TRP 83 Cb 0.18 -0.38 -0.00 0.00 -2.10 0.00 0.00 29.16 26.86 2dtt h TRP 83 CO -0.13 0.80 -0.26 0.82 -2.79 0.00 0.00 178.44 176.88 2dtt h ILE 84 N 1.21 1.31 -0.27 2.65 2.04 -0.19 -2.27 117.51 121.99 2dtt h ILE 84 Ca 0.31 -1.44 0.04 0.00 1.00 0.00 0.00 64.86 64.78 2dtt h ILE 84 Cb 0.00 1.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.72 2dtt h ILE 84 CO -0.05 0.45 0.01 1.23 0.00 0.00 0.00 178.15 179.78 2dtt h GLY 85 N 0.32 0.26 0.98 5.37 0.00 -0.21 -0.55 103.07 109.25 2dtt h GLY 85 Ca 0.04 0.02 0.01 0.00 0.00 0.00 0.00 47.33 47.40 2dtt h GLY 85 CO 0.06 -0.05 0.26 0.83 0.00 0.00 0.00 176.54 177.65 2dtt h GLU 86 N 0.09 0.52 -0.77 4.80 5.08 -1.27 -0.76 114.58 122.27 2dtt h GLU 86 Ca 0.13 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 2dtt h GLU 86 Cb 0.16 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.26 2dtt h GLU 86 CO -0.21 0.35 0.41 0.00 -1.00 0.00 0.00 179.01 178.56 2dtt h ARG 87 N 0.54 1.09 0.24 2.33 2.47 -1.03 -2.22 114.38 117.80 2dtt h ARG 87 Ca 0.15 -0.13 -0.01 0.00 -1.26 0.00 0.00 59.98 58.73 2dtt h ARG 87 Cb -0.05 -0.21 0.00 0.00 -1.65 0.00 0.00 29.97 28.06 2dtt h ARG 87 CO -0.04 0.81 -0.11 0.82 0.56 0.00 0.00 179.97 182.01 2dtt h ILE 88 N 1.08 0.83 -0.88 2.04 2.04 -0.80 -3.04 117.51 118.76 2dtt h ILE 88 Ca 0.27 -0.54 0.22 0.00 1.00 0.00 0.00 64.86 65.81 2dtt h ILE 88 Cb 0.05 1.13 -0.13 0.00 -0.74 0.00 0.00 36.82 37.14 2dtt h ILE 88 CO -0.04 0.12 0.37 -0.09 0.00 0.00 0.00 178.15 178.50 2dtt h ARG 89 N -0.61 0.36 0.00 2.37 2.43 -1.07 0.27 114.38 118.14 2dtt h ARG 89 Ca -0.03 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.09 2dtt h ARG 89 Cb 0.44 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 2dtt h ARG 89 CO 0.05 0.24 -0.10 0.22 -1.51 0.00 0.00 179.97 178.87 2dtt h ASP 90 N 0.37 0.00 0.00 -3.80 3.58 -1.31 -3.01 116.42 112.26 2dtt h ASP 90 Ca 0.55 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.00 2dtt h ASP 90 Cb 1.05 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.10 2dtt h ASP 90 CO -0.54 0.10 -0.98 0.29 -2.88 0.00 0.00 179.24 175.24 2dtt n LYS 91 N -3.70 0.60 -2.16 0.28 4.76 0.87 -5.00 118.16 113.80 2dtt n LYS 91 Ca -0.02 -0.01 -0.40 0.00 -2.87 0.00 0.00 58.31 55.01 2dtt n LYS 91 Cb 0.22 -1.42 -0.02 0.00 -1.84 0.00 0.00 35.03 31.97 2dtt n LYS 91 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2dtt s LEU 92 N -3.01 4.39 0.86 -0.35 1.43 -0.59 -4.99 118.68 116.41 2dtt s LEU 92 Ca 0.06 2.61 -0.12 0.00 -1.03 0.00 0.00 54.13 55.66 2dtt s LEU 92 Cb 0.15 -3.72 0.11 0.00 0.03 0.00 0.00 46.19 42.76 2dtt s LEU 92 CO 0.80 -0.55 1.18 -2.16 0.23 0.00 0.00 176.35 175.85 2dtt s PRO 93 N -1.86 1.35 0.00 1.29 0.04 -1.26 -4.88 135.00 129.67 2dtt s PRO 93 Ca 0.50 1.67 0.10 0.00 0.04 0.00 0.00 61.00 63.31 2dtt s PRO 93 Cb -0.38 -1.75 0.62 0.00 0.04 0.00 0.00 34.50 33.03 2dtt s PRO 93 CO 0.50 -2.41 1.05 -0.35 0.04 0.00 0.00 177.00 175.82 2dtt n PRO 94 N -3.73 0.39 -0.04 0.56 -0.04 -1.26 -3.08 135.00 127.80 2dtt n PRO 94 Ca 0.13 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.68 2dtt n PRO 94 Cb 0.51 -1.42 0.10 0.00 -0.04 0.00 0.00 33.50 32.65 2dtt n PRO 94 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2dtt n TYR 95 N -0.92 0.09 -4.37 0.54 4.11 -1.26 -4.99 117.16 110.36 2dtt n TYR 95 Ca 0.08 -0.06 -0.18 0.00 -0.00 0.00 0.00 57.90 57.73 2dtt n TYR 95 Cb 0.04 -0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.27 2dtt n TYR 95 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.86 177.00 2dtt s VAL 96 N -1.46 0.88 0.03 -3.48 -7.23 -1.18 -4.59 120.40 103.38 2dtt s VAL 96 Ca 0.23 -2.01 0.03 0.00 -1.81 0.00 0.00 61.98 58.42 2dtt s VAL 96 Cb 0.16 -2.63 -0.02 0.00 0.56 0.00 0.00 36.38 34.45 2dtt s VAL 96 CO 0.23 -0.07 -0.08 -1.59 -0.31 0.00 0.00 175.10 173.28 2dtt s LYS 97 N -3.95 0.57 -0.10 4.82 -2.85 -0.51 -4.85 119.74 112.88 2dtt s LYS 97 Ca 0.35 -0.58 -0.30 0.00 -1.00 0.00 0.00 55.97 54.44 2dtt s LYS 97 Cb 0.08 -0.45 -0.04 0.00 -2.06 0.00 0.00 37.83 35.36 2dtt s LYS 97 CO 0.13 0.10 1.44 -1.17 0.10 0.00 0.00 175.35 175.96 2dtt s LEU 98 N -1.06 4.26 -0.24 2.77 2.96 -1.26 -1.32 118.68 124.79 2dtt s LEU 98 Ca -0.04 1.97 -0.02 0.00 -0.22 0.00 0.00 54.13 55.82 2dtt s LEU 98 Cb -0.07 -3.54 -0.14 0.00 0.50 0.00 0.00 46.19 42.93 2dtt s LEU 98 CO 0.00 -0.82 -0.24 1.17 -1.32 0.00 0.00 176.35 175.14 2dtt n LYS 99 N 6.63 0.58 -3.70 1.98 3.00 0.03 -4.58 118.16 122.10 2dtt n LYS 99 Ca 0.15 0.16 -0.14 0.00 -0.00 0.00 0.00 58.31 58.48 2dtt n LYS 99 Cb 0.44 -1.46 -0.09 0.00 0.00 0.00 0.00 35.03 33.92 2dtt n LYS 99 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 2dtt s ARG 100 N -2.47 0.65 -0.08 1.64 3.52 -0.92 -1.34 118.95 119.95 2dtt s ARG 100 Ca -0.33 0.33 -0.01 0.00 -0.13 0.00 0.00 55.73 55.59 2dtt s ARG 100 Cb 0.10 0.31 0.03 0.00 -1.56 0.00 0.00 34.95 33.82 2dtt s ARG 100 CO 0.52 -0.14 -0.02 0.08 -0.81 0.00 0.00 175.30 174.94 2dtt s VAL 101 N -0.45 0.53 -0.21 7.11 1.01 -0.39 -0.36 120.40 127.64 2dtt s VAL 101 Ca -0.06 0.02 0.02 0.00 0.00 0.00 0.00 61.98 61.96 2dtt s VAL 101 Cb -0.03 -0.65 0.04 0.00 0.00 0.00 0.00 36.38 35.73 2dtt s VAL 101 CO 0.03 0.28 -0.15 -0.69 0.00 0.00 0.00 175.10 174.57 2dtt s VAL 102 N 1.89 2.00 -0.23 2.92 1.01 0.12 -0.55 120.40 127.56 2dtt s VAL 102 Ca 0.05 -1.16 -0.03 0.00 0.00 0.00 0.00 61.98 60.83 2dtt s VAL 102 Cb -0.12 -1.95 0.00 0.00 0.00 0.00 0.00 36.38 34.31 2dtt s VAL 102 CO -0.06 0.29 -0.06 -0.22 0.00 0.00 0.00 175.10 175.06 2dtt s LEU 103 N 1.26 2.94 -0.15 3.92 2.96 0.26 -0.65 118.68 129.22 2dtt s LEU 103 Ca -0.01 -0.56 -0.07 0.00 -0.22 0.00 0.00 54.13 53.28 2dtt s LEU 103 Cb -0.16 -1.70 -0.04 0.00 0.50 0.00 0.00 46.19 44.79 2dtt s LEU 103 CO -0.09 -0.06 0.08 0.26 -1.32 0.00 0.00 176.35 175.22 2dtt s TRP 104 N 1.42 3.33 -0.79 5.38 0.52 0.54 -0.25 118.94 129.08 2dtt s TRP 104 Ca 0.04 0.23 -0.13 0.00 0.02 0.00 0.00 56.10 56.26 2dtt s TRP 104 Cb -0.15 -2.00 0.21 0.00 -1.15 0.00 0.00 33.47 30.38 2dtt s TRP 104 CO -0.04 0.36 0.72 -2.00 0.02 0.00 0.00 176.95 176.01 2dtt s GLU 105 N -0.18 3.48 1.47 4.98 2.12 1.00 -1.58 118.70 129.99 2dtt s GLU 105 Ca 0.08 -2.43 0.00 0.00 0.36 0.00 0.00 54.97 52.99 2dtt s GLU 105 Cb -0.12 -4.36 0.00 0.00 0.26 0.00 0.00 34.13 29.91 2dtt s GLU 105 CO 0.01 -1.28 0.00 0.41 -0.54 0.00 0.00 175.26 173.86 2dtt n GLY 106 N 4.00 -1.46 0.00 -1.50 0.00 -1.04 -3.94 105.19 101.26 2dtt n GLY 106 Ca 0.12 -1.50 0.08 0.00 0.00 0.00 0.00 46.02 44.71 2dtt n GLY 106 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dtt n LYS 107 N 0.00 1.57 0.00 1.61 5.02 -1.26 -4.61 118.16 120.48 2dtt n LYS 107 Ca 0.00 -0.02 -0.06 0.00 -2.02 0.00 0.00 58.31 56.20 2dtt n LYS 107 Cb 0.00 -1.27 -0.12 0.00 -0.02 0.00 0.00 35.03 33.62 2dtt n LYS 107 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 2dtt h ASP 108 N 0.00 0.00 -3.72 4.39 3.32 -1.99 -3.47 116.42 114.95 2dtt h ASP 108 Ca 0.00 0.00 -0.43 0.00 0.02 0.00 0.00 57.03 56.62 2dtt h ASP 108 Cb 0.43 0.00 -0.32 0.00 0.22 0.00 0.00 39.33 39.67 2dtt h ASP 108 CO 0.00 0.89 -0.79 0.20 -1.72 0.00 0.00 179.24 177.82 2dtt s ASN 109 N -6.07 1.22 0.26 6.45 0.01 -1.25 -5.06 114.94 110.50 2dtt s ASN 109 Ca -0.04 -0.19 -0.09 0.00 -0.71 0.00 0.00 52.86 51.83 2dtt s ASN 109 Cb 0.08 -0.39 -0.01 0.00 0.41 0.00 0.00 41.25 41.34 2dtt s ASN 109 CO 0.82 0.04 0.43 -0.83 -1.51 0.00 0.00 177.10 176.05 2dtt s GLY 110 N 0.34 0.85 -0.04 0.66 0.00 -1.26 -0.00 107.32 107.86 2dtt s GLY 110 Ca -0.06 -1.12 0.06 0.00 0.00 0.00 0.00 44.72 43.60 2dtt s GLY 110 CO 0.01 -0.81 -0.22 0.14 0.00 0.00 0.00 173.10 172.22 2dtt s VAL 111 N -3.83 1.80 -0.16 1.40 1.01 0.65 -4.96 120.40 116.30 2dtt s VAL 111 Ca 0.26 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.32 2dtt s VAL 111 Cb 0.01 -1.53 0.02 0.00 0.00 0.00 0.00 36.38 34.87 2dtt s VAL 111 CO 0.12 0.51 -0.21 -0.70 0.00 0.00 0.00 175.10 174.82 2dtt s GLU 112 N -0.18 3.01 -0.13 2.72 2.12 -1.26 -0.58 118.70 124.40 2dtt s GLU 112 Ca -0.01 -0.84 -0.00 0.00 0.36 0.00 0.00 54.97 54.48 2dtt s GLU 112 Cb -0.12 -2.52 -0.01 0.00 0.26 0.00 0.00 34.13 31.74 2dtt s GLU 112 CO 0.02 -0.13 -0.13 -0.51 -0.54 0.00 0.00 175.26 173.97 2dtt s LEU 113 N 1.10 2.69 -0.01 2.70 1.43 0.28 -5.00 118.68 121.87 2dtt s LEU 113 Ca 0.00 -0.34 0.03 0.00 -1.03 0.00 0.00 54.13 52.79 2dtt s LEU 113 Cb -0.14 -1.61 -0.01 0.00 0.03 0.00 0.00 46.19 44.47 2dtt s LEU 113 CO -0.08 0.15 -0.11 -0.70 0.23 0.00 0.00 176.35 175.84 2dtt s GLU 114 N 0.41 0.96 0.00 1.70 2.12 -1.26 -1.26 118.70 121.36 2dtt s GLU 114 Ca -0.10 -0.40 0.03 0.00 0.36 0.00 0.00 54.97 54.86 2dtt s GLU 114 Cb -0.16 -0.92 0.02 0.00 0.26 0.00 0.00 34.13 33.34 2dtt s GLU 114 CO 0.05 0.22 0.60 0.91 -0.54 0.00 0.00 175.26 176.50