#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d6o s VAL 2 N 0.00 1.22 -0.18 1.61 0.11 -1.26 -2.09 120.40 119.81 1d6o s VAL 2 Ca 0.00 -0.56 -0.04 0.00 -2.93 0.00 0.00 61.98 58.46 1d6o s VAL 2 Cb 0.00 -1.09 -0.02 0.00 -1.53 0.00 0.00 36.38 33.74 1d6o s VAL 2 CO 0.00 0.37 -0.04 -1.58 -3.33 0.00 0.00 175.10 170.52 1d6o s GLN 3 N 0.44 3.57 -0.26 1.54 0.74 -0.13 -4.95 119.66 120.60 1d6o s GLN 3 Ca -0.11 -0.56 -0.05 0.00 0.05 0.00 0.00 55.36 54.69 1d6o s GLN 3 Cb -0.14 -2.95 -0.00 0.00 1.10 0.00 0.00 33.01 31.02 1d6o s GLN 3 CO 0.03 0.09 0.03 0.08 -0.55 0.00 0.00 175.29 174.97 1d6o s VAL 4 N 0.76 3.74 -0.16 1.34 1.01 -1.26 -0.68 120.40 125.15 1d6o s VAL 4 Ca -0.01 -0.59 0.00 0.00 0.00 0.00 0.00 61.98 61.38 1d6o s VAL 4 Cb -0.14 -2.83 0.00 0.00 0.00 0.00 0.00 36.38 33.40 1d6o s VAL 4 CO 0.02 0.23 -0.16 -1.61 0.00 0.00 0.00 175.10 173.59 1d6o s GLU 5 N 1.49 3.18 0.19 2.72 2.02 0.25 -4.96 118.70 123.59 1d6o s GLU 5 Ca 0.04 -0.76 -0.30 0.00 0.02 0.00 0.00 54.97 53.97 1d6o s GLU 5 Cb -0.16 -2.63 -0.09 0.00 0.10 0.00 0.00 34.13 31.35 1d6o s GLU 5 CO 0.00 -0.04 1.36 0.99 0.02 0.00 0.00 175.26 177.59 1d6o s THR 6 N 0.94 3.11 -0.17 3.63 2.01 -1.26 -0.40 115.64 123.50 1d6o s THR 6 Ca -0.03 0.89 0.03 0.00 0.31 0.00 0.00 61.69 62.89 1d6o s THR 6 Cb -0.15 -3.57 -0.13 0.00 0.01 0.00 0.00 72.50 68.67 1d6o s THR 6 CO -0.02 0.12 -0.12 -0.38 -0.69 0.00 0.00 174.62 173.53 1d6o n ILE 7 N 2.89 1.01 -3.69 1.82 5.41 -0.25 -4.88 119.36 121.67 1d6o n ILE 7 Ca 0.08 -0.43 -0.10 0.00 1.00 0.00 0.00 62.75 63.29 1d6o n ILE 7 Cb 0.42 -1.04 -0.10 0.00 -0.71 0.00 0.00 39.64 38.21 1d6o n ILE 7 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1d6o s SER 8 N -5.54 -0.55 0.56 4.38 0.15 -0.85 -5.00 113.70 106.86 1d6o s SER 8 Ca -0.21 0.95 -0.20 0.00 0.70 0.00 0.00 55.95 57.19 1d6o s SER 8 Cb 0.06 0.83 -0.04 0.00 -1.71 0.00 0.00 66.02 65.15 1d6o s SER 8 CO 0.44 -0.20 1.24 -2.16 1.20 0.00 0.00 173.24 173.77 1d6o s PRO 9 N 1.38 3.11 0.00 5.44 0.04 -1.26 -0.97 135.00 142.74 1d6o s PRO 9 Ca -0.09 1.92 0.00 0.00 0.04 0.00 0.00 61.00 62.87 1d6o s PRO 9 Cb -0.08 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.39 1d6o s PRO 9 CO -0.13 -1.12 0.00 0.41 0.04 0.00 0.00 177.00 176.20 1d6o n GLY 10 N 0.57 1.63 0.08 0.56 0.00 -1.26 -4.21 105.19 102.57 1d6o n GLY 10 Ca 0.12 -1.90 0.15 0.00 0.00 0.00 0.00 46.02 44.39 1d6o n GLY 10 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1d6o n ASP 11 N 0.00 0.32 -0.72 1.61 3.85 -0.16 -4.81 116.55 116.65 1d6o n ASP 11 Ca 0.00 -0.56 -0.09 0.00 -0.71 0.00 0.00 54.79 53.43 1d6o n ASP 11 Cb 0.00 -0.11 -0.04 0.00 -1.35 0.00 0.00 41.12 39.62 1d6o n ASP 11 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1d6o n GLY 12 N 1.24 0.93 0.00 6.12 0.00 -1.26 -4.71 105.19 107.51 1d6o n GLY 12 Ca 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1d6o n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d6o n ARG 13 N -0.83 0.28 -3.11 1.61 1.74 -1.26 -5.01 116.66 110.08 1d6o n ARG 13 Ca -0.09 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.54 1d6o n ARG 13 Cb 0.54 -0.67 -0.05 0.00 -1.02 0.00 0.00 32.46 31.26 1d6o n ARG 13 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1d6o s THR 14 N -1.34 4.81 -0.02 0.55 2.01 -1.26 -5.03 115.64 115.36 1d6o s THR 14 Ca 0.00 -0.82 0.00 0.00 0.31 0.00 0.00 61.69 61.18 1d6o s THR 14 Cb 0.00 -4.44 -0.04 0.00 0.01 0.00 0.00 72.50 68.03 1d6o s THR 14 CO 0.00 -1.05 0.04 -0.36 -0.69 0.00 0.00 174.62 172.56 1d6o s PHE 15 N 2.74 3.18 0.32 4.92 0.08 -1.26 -1.03 117.98 126.92 1d6o s PHE 15 Ca 0.13 0.16 -0.29 0.00 0.12 0.00 0.00 56.93 57.05 1d6o s PHE 15 Cb -0.22 -1.72 -0.11 0.00 -0.57 0.00 0.00 43.02 40.40 1d6o s PHE 15 CO 0.08 0.51 1.42 -2.14 -0.10 0.00 0.00 175.22 174.98 1d6o s PRO 16 N -1.54 4.24 0.20 0.24 0.02 -1.26 -5.03 135.00 131.87 1d6o s PRO 16 Ca 0.20 2.37 0.09 0.00 0.02 0.00 0.00 61.00 63.68 1d6o s PRO 16 Cb -0.12 -3.05 -0.04 0.00 0.02 0.00 0.00 34.50 31.31 1d6o s PRO 16 CO 0.11 -0.38 -0.06 0.15 -0.33 0.00 0.00 177.00 176.48 1d6o s LYS 17 N -1.41 2.17 0.16 5.54 -0.14 -1.26 -4.87 119.74 119.94 1d6o s LYS 17 Ca 0.54 -1.27 -0.34 0.00 -1.36 0.00 0.00 55.97 53.54 1d6o s LYS 17 Cb -0.43 -2.19 -0.14 0.00 -1.68 0.00 0.00 37.83 33.38 1d6o s LYS 17 CO 0.53 0.42 1.48 0.54 -0.76 0.00 0.00 175.35 177.56 1d6o n ARG 18 N -0.19 1.89 0.00 1.68 5.12 -1.26 -1.54 116.66 122.36 1d6o n ARG 18 Ca -0.10 0.68 0.00 0.00 -1.93 0.00 0.00 57.85 56.50 1d6o n ARG 18 Cb 0.56 -2.39 0.00 0.00 -1.16 0.00 0.00 32.46 29.47 1d6o n ARG 18 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1d6o n GLY 19 N 2.91 1.15 3.86 -0.13 0.00 0.34 -5.01 105.19 108.31 1d6o n GLY 19 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 1d6o n GLY 19 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1d6o s GLN 20 N -0.85 3.89 -0.27 1.61 -0.21 -0.59 -4.77 119.66 118.48 1d6o s GLN 20 Ca 0.00 0.63 -0.14 0.00 0.02 0.00 0.00 55.36 55.87 1d6o s GLN 20 Cb 0.00 -2.35 -0.04 0.00 1.00 0.00 0.00 33.01 31.62 1d6o s GLN 20 CO 0.00 -0.02 0.34 0.99 -2.12 0.00 0.00 175.29 174.48 1d6o s THR 21 N -2.29 5.21 -0.13 -0.19 2.01 -1.26 -0.66 115.64 118.33 1d6o s THR 21 Ca 0.54 0.49 -0.15 0.00 0.31 0.00 0.00 61.69 62.88 1d6o s THR 21 Cb -0.10 -3.66 -0.05 0.00 0.01 0.00 0.00 72.50 68.70 1d6o s THR 21 CO 0.26 0.18 0.35 0.00 -0.69 0.00 0.00 174.62 174.73 1d6o s VAL 23 N 0.28 3.55 0.15 0.00 1.01 -0.75 -1.97 120.40 122.67 1d6o s VAL 23 Ca 0.20 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.47 1d6o s VAL 23 Cb -0.14 -2.78 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 1d6o s VAL 23 CO 0.07 0.18 -0.07 0.68 0.00 0.00 0.00 175.10 175.96 1d6o s VAL 24 N 1.45 0.96 -0.06 2.92 -7.23 0.36 -0.87 120.40 117.92 1d6o s VAL 24 Ca 0.02 -2.01 0.05 0.00 -1.81 0.00 0.00 61.98 58.23 1d6o s VAL 24 Cb -0.16 -1.90 -0.02 0.00 0.56 0.00 0.00 36.38 34.86 1d6o s VAL 24 CO -0.01 -0.69 -0.20 -1.00 -0.31 0.00 0.00 175.10 172.89 1d6o s HIS 25 N -3.46 2.57 0.11 2.82 3.76 -0.63 0.20 115.29 120.66 1d6o s HIS 25 Ca 0.18 -0.50 -0.09 0.00 -0.15 0.00 0.00 55.06 54.50 1d6o s HIS 25 Cb 0.04 -1.64 -0.00 0.00 1.11 0.00 0.00 32.58 32.09 1d6o s HIS 25 CO 0.01 -0.07 0.23 1.52 -0.85 0.00 0.00 174.74 175.57 1d6o s TYR 26 N -0.31 0.22 -0.04 1.40 -0.85 -1.26 -0.66 117.35 115.85 1d6o s TYR 26 Ca 0.02 -0.62 -0.00 0.00 -0.52 0.00 0.00 57.07 55.94 1d6o s TYR 26 Cb -0.13 -0.05 0.03 0.00 0.38 0.00 0.00 41.96 42.19 1d6o s TYR 26 CO 0.02 -0.60 0.01 0.99 -1.52 0.00 0.00 175.55 174.45 1d6o s THR 27 N -3.89 0.17 -0.10 -3.49 2.01 -0.28 -1.66 115.64 108.39 1d6o s THR 27 Ca 0.09 0.13 -0.01 0.00 0.31 0.00 0.00 61.69 62.21 1d6o s THR 27 Cb 0.04 -0.29 -0.03 0.00 0.01 0.00 0.00 72.50 72.24 1d6o s THR 27 CO -0.08 0.16 -0.06 -0.83 -0.69 0.00 0.00 174.62 173.13 1d6o s GLY 28 N 1.28 1.70 0.10 4.40 0.00 0.66 -1.22 107.32 114.25 1d6o s GLY 28 Ca -0.06 -0.86 0.03 0.00 0.00 0.00 0.00 44.72 43.83 1d6o s GLY 28 CO -0.02 -0.42 -0.09 1.06 0.00 0.00 0.00 173.10 173.62 1d6o s MET 29 N -0.34 0.86 0.70 2.90 -1.94 0.04 -0.70 119.30 120.82 1d6o s MET 29 Ca 0.05 -1.23 -0.07 0.00 -1.71 0.00 0.00 55.69 52.73 1d6o s MET 29 Cb -0.12 -0.44 0.05 0.00 2.01 0.00 0.00 34.83 36.33 1d6o s MET 29 CO 0.02 0.05 1.01 -0.51 -0.01 0.00 0.00 175.02 175.59 1d6o s LEU 30 N -2.67 2.85 0.55 -0.03 1.43 0.11 -1.85 118.68 119.08 1d6o s LEU 30 Ca 0.08 0.53 0.27 0.00 -1.03 0.00 0.00 54.13 53.99 1d6o s LEU 30 Cb -0.00 -3.20 1.46 0.00 0.03 0.00 0.00 46.19 44.48 1d6o s LEU 30 CO -0.01 -1.54 1.97 -0.08 0.23 0.00 0.00 176.35 176.92 1d6o h GLU 31 N -0.57 0.00 -0.04 1.70 4.81 -1.88 -0.18 114.58 118.41 1d6o h GLU 31 Ca -0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 1d6o h GLU 31 Cb 1.31 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.69 1d6o h GLU 31 CO 0.61 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.49 1d6o n ASP 32 N -4.12 0.80 0.00 1.04 5.68 -1.26 -4.90 116.55 113.79 1d6o n ASP 32 Ca 0.09 -1.39 0.00 0.00 -0.50 0.00 0.00 54.79 53.00 1d6o n ASP 32 Cb 0.62 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.58 1d6o n ASP 32 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1d6o n GLY 33 N 1.03 0.74 3.66 6.12 0.00 -0.08 -5.05 105.19 111.61 1d6o n GLY 33 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 1d6o n GLY 33 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1d6o s LYS 34 N -0.76 4.27 0.11 1.61 2.20 -1.25 -4.79 119.74 121.13 1d6o s LYS 34 Ca 0.00 1.31 -0.30 0.00 -0.36 0.00 0.00 55.97 56.62 1d6o s LYS 34 Cb 0.00 -3.63 -0.07 0.00 -1.51 0.00 0.00 37.83 32.62 1d6o s LYS 34 CO 0.00 -0.58 1.19 0.21 -0.36 0.00 0.00 175.35 175.80 1d6o s LYS 35 N 3.03 4.47 -0.01 4.03 2.20 -1.26 0.10 119.74 132.30 1d6o s LYS 35 Ca 0.43 1.79 0.05 0.00 -0.36 0.00 0.00 55.97 57.88 1d6o s LYS 35 Cb -0.15 -3.31 -0.07 0.00 -1.51 0.00 0.00 37.83 32.79 1d6o s LYS 35 CO 0.07 -0.16 0.11 1.97 -0.36 0.00 0.00 175.35 176.98 1d6o n PHE 36 N 3.33 0.00 -3.51 4.03 -1.74 0.12 -4.94 117.46 114.74 1d6o n PHE 36 Ca 0.07 0.00 -0.16 0.00 -0.56 0.00 0.00 57.45 56.79 1d6o n PHE 36 Cb 0.46 -0.09 -0.05 0.00 1.52 0.00 0.00 39.48 41.31 1d6o n PHE 36 CO 0.00 0.00 0.00 0.34 -0.56 0.00 0.00 176.76 176.54 1d6o s ASP 37 N -2.38 -0.62 -0.30 5.98 2.15 -1.17 -5.01 116.67 115.32 1d6o s ASP 37 Ca -0.01 0.60 -0.15 0.00 0.43 0.00 0.00 52.55 53.41 1d6o s ASP 37 Cb 0.03 0.52 0.15 0.00 -0.30 0.00 0.00 42.92 43.33 1d6o s ASP 37 CO 0.19 -0.63 0.94 -0.55 -0.17 0.00 0.00 175.17 174.95 1d6o s SER 38 N -1.39 -0.61 0.40 -0.34 0.15 -1.26 -0.25 113.70 110.41 1d6o s SER 38 Ca -0.09 0.89 0.21 0.00 0.70 0.00 0.00 55.95 57.67 1d6o s SER 38 Cb -0.00 1.54 0.79 0.00 -1.71 0.00 0.00 66.02 66.64 1d6o s SER 38 CO 0.06 -0.13 1.78 0.77 1.20 0.00 0.00 173.24 176.92 1d6o h SER 39 N 7.01 0.00 -0.07 5.45 4.64 -1.61 -2.98 113.55 126.00 1d6o h SER 39 Ca -0.21 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.05 1d6o h SER 39 Cb 1.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.22 1d6o h SER 39 CO 0.13 0.31 -0.13 0.03 -0.87 0.00 0.00 176.83 176.29 1d6o h ARG 40 N 0.00 0.39 0.00 4.77 3.08 -1.84 -0.49 114.38 120.29 1d6o h ARG 40 Ca -0.00 -0.10 -0.09 0.00 0.07 0.00 0.00 59.98 59.86 1d6o h ARG 40 Cb 0.83 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 1d6o h ARG 40 CO 0.04 0.53 -0.41 -0.44 -1.07 0.00 0.00 179.97 178.62 1d6o h ASP 41 N 0.37 0.00 0.19 7.04 3.32 -1.86 -2.52 116.42 122.95 1d6o h ASP 41 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1d6o h ASP 41 Cb 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1d6o h ASP 41 CO 0.03 0.41 -0.27 0.54 -1.72 0.00 0.00 179.24 178.22 1d6o n ARG 42 N -3.50 0.94 -3.97 3.56 1.74 -0.74 -4.95 116.66 109.73 1d6o n ARG 42 Ca 0.00 -0.60 -0.29 0.00 -0.77 0.00 0.00 57.85 56.20 1d6o n ARG 42 Cb 0.55 -1.49 -0.00 0.00 -1.02 0.00 0.00 32.46 30.50 1d6o n ARG 42 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1d6o n ASN 43 N -0.51 -2.19 -3.59 0.55 5.15 -0.27 -4.98 115.26 109.43 1d6o n ASN 43 Ca 0.12 -0.93 -0.09 0.00 -0.60 0.00 0.00 54.58 53.08 1d6o n ASN 43 Cb 0.37 -3.33 -0.10 0.00 -0.53 0.00 0.00 39.78 36.19 1d6o n ASN 43 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1d6o s LYS 44 N -6.57 0.30 0.71 1.20 2.47 -1.06 -5.05 119.74 111.73 1d6o s LYS 44 Ca 0.33 0.88 -0.16 0.00 -1.56 0.00 0.00 55.97 55.46 1d6o s LYS 44 Cb -0.18 0.09 0.02 0.00 -1.46 0.00 0.00 37.83 36.31 1d6o s LYS 44 CO 0.87 -0.34 1.27 -2.14 0.16 0.00 0.00 175.35 175.17 1d6o s PRO 45 N 2.57 2.21 -0.11 4.03 0.02 -1.26 -4.68 135.00 137.77 1d6o s PRO 45 Ca 0.02 1.97 -0.05 0.00 0.02 0.00 0.00 61.00 62.96 1d6o s PRO 45 Cb -0.13 -1.82 -0.04 0.00 0.02 0.00 0.00 34.50 32.54 1d6o s PRO 45 CO -0.13 -1.84 0.09 0.12 -0.33 0.00 0.00 177.00 174.92 1d6o s PHE 46 N -1.64 3.45 -0.02 6.54 2.19 0.13 -4.89 117.98 123.74 1d6o s PHE 46 Ca 0.80 0.41 0.08 0.00 0.33 0.00 0.00 56.93 58.54 1d6o s PHE 46 Cb -0.35 -1.89 -0.02 0.00 -1.31 0.00 0.00 43.02 39.45 1d6o s PHE 46 CO 0.44 0.64 -0.24 0.15 1.83 0.00 0.00 175.22 178.04 1d6o s LYS 47 N -0.97 2.13 -0.06 10.12 1.02 -1.26 -0.49 119.74 130.22 1d6o s LYS 47 Ca 0.14 -0.92 -0.20 0.00 0.02 0.00 0.00 55.97 55.01 1d6o s LYS 47 Cb -0.12 -2.08 0.04 0.00 -0.52 0.00 0.00 37.83 35.16 1d6o s LYS 47 CO 0.03 0.56 0.46 -0.59 -0.92 0.00 0.00 175.35 174.90 1d6o s PHE 48 N -0.65 -0.40 -0.25 3.18 -0.12 -0.83 -4.98 117.98 113.93 1d6o s PHE 48 Ca 0.10 0.75 -0.19 0.00 -0.05 0.00 0.00 56.93 57.55 1d6o s PHE 48 Cb -0.10 0.21 -0.03 0.00 -0.63 0.00 0.00 43.02 42.47 1d6o s PHE 48 CO -0.00 -0.42 0.55 1.41 -0.05 0.00 0.00 175.22 176.70 1d6o s MET 49 N -0.93 4.09 0.14 1.99 -2.45 -1.26 -0.48 119.30 120.41 1d6o s MET 49 Ca -0.10 0.40 -0.31 0.00 -1.25 0.00 0.00 55.69 54.43 1d6o s MET 49 Cb -0.03 -3.64 -0.10 0.00 1.25 0.00 0.00 34.83 32.31 1d6o s MET 49 CO 0.05 -0.34 1.63 -1.17 1.05 0.00 0.00 175.02 176.24 1d6o s LEU 50 N 2.28 4.37 0.00 4.11 2.96 0.17 -2.68 118.68 129.89 1d6o s LEU 50 Ca 0.23 2.63 0.00 0.00 -0.22 0.00 0.00 54.13 56.77 1d6o s LEU 50 Cb -0.16 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 42.95 1d6o s LEU 50 CO 0.09 -0.88 0.00 0.61 -1.32 0.00 0.00 176.35 174.85 1d6o n GLY 51 N 3.89 0.39 1.14 7.98 0.00 -1.26 -0.50 105.19 116.82 1d6o n GLY 51 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.29 1d6o n GLY 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1d6o n LYS 52 N -2.00 2.49 -3.72 1.61 4.76 -1.09 -4.96 118.16 115.25 1d6o n LYS 52 Ca 0.00 -2.25 -0.28 0.00 -2.87 0.00 0.00 58.31 52.91 1d6o n LYS 52 Cb 0.00 -1.51 0.03 0.00 -1.84 0.00 0.00 35.03 31.71 1d6o n LYS 52 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1d6o n GLN 53 N 1.47 -5.77 0.05 1.97 6.02 -1.26 -4.86 117.38 115.00 1d6o n GLN 53 Ca 0.19 0.66 0.13 0.00 -0.01 0.00 0.00 57.00 57.97 1d6o n GLN 53 Cb 0.61 -5.57 0.39 0.00 1.02 0.00 0.00 30.24 26.69 1d6o n GLN 53 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1d6o n GLU 54 N -4.61 0.15 -4.39 -1.09 1.02 -1.26 -4.88 120.64 105.59 1d6o n GLU 54 Ca 0.02 0.09 -0.19 0.00 -0.02 0.00 0.00 57.16 57.06 1d6o n GLU 54 Cb 0.54 -1.64 -0.10 0.00 -0.02 0.00 0.00 31.44 30.22 1d6o n GLU 54 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1d6o s VAL 55 N -3.07 0.93 0.75 2.62 -7.23 -1.26 -5.10 120.40 108.05 1d6o s VAL 55 Ca 0.11 -2.00 -0.14 0.00 -1.81 0.00 0.00 61.98 58.13 1d6o s VAL 55 Cb 0.15 -2.69 0.05 0.00 0.56 0.00 0.00 36.38 34.46 1d6o s VAL 55 CO 0.62 -0.04 1.19 0.27 -0.31 0.00 0.00 175.10 176.84 1d6o s ILE 56 N -3.48 2.34 0.28 -0.62 -4.36 -1.26 -4.78 121.20 109.31 1d6o s ILE 56 Ca 0.36 0.16 0.01 0.00 -0.26 0.00 0.00 60.65 60.92 1d6o s ILE 56 Cb 0.08 -2.66 0.27 0.00 1.25 0.00 0.00 42.46 41.40 1d6o s ILE 56 CO 0.14 -0.10 1.80 -0.09 0.24 0.00 0.00 174.94 176.93 1d6o h ARG 57 N -0.51 0.82 -0.39 0.37 2.43 -1.83 -1.00 114.38 114.27 1d6o h ARG 57 Ca -0.47 -0.05 0.11 0.00 -0.81 0.00 0.00 59.98 58.76 1d6o h ARG 57 Cb 1.29 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 30.64 1d6o h ARG 57 CO 0.49 0.54 0.28 0.78 -1.51 0.00 0.00 179.97 180.55 1d6o h GLY 58 N 0.84 0.02 0.17 2.80 0.00 -1.57 0.17 103.07 105.51 1d6o h GLY 58 Ca 0.50 -0.01 -0.02 0.00 0.00 0.00 0.00 47.33 47.80 1d6o h GLY 58 CO -0.31 0.00 -0.07 1.49 0.00 0.00 0.00 176.54 177.66 1d6o h TRP 59 N 0.02 0.05 -0.76 5.60 4.06 -1.47 0.84 115.95 124.29 1d6o h TRP 59 Ca 0.18 -0.03 0.14 0.00 2.06 0.00 0.00 58.89 61.24 1d6o h TRP 59 Cb 0.72 -0.00 -0.10 0.00 -1.00 0.00 0.00 29.16 28.78 1d6o h TRP 59 CO -0.00 0.92 0.31 0.93 -3.56 0.00 0.00 178.44 177.04 1d6o h GLU 60 N -0.83 0.43 0.17 0.49 4.39 -1.04 0.67 114.58 118.87 1d6o h GLU 60 Ca -0.01 -0.03 -0.32 0.00 0.34 0.00 0.00 59.36 59.34 1d6o h GLU 60 Cb 0.95 -0.10 0.01 0.00 -0.10 0.00 0.00 28.75 29.51 1d6o h GLU 60 CO 0.01 0.29 -1.55 0.93 -1.16 0.00 0.00 179.01 177.53 1d6o h GLU 61 N 0.45 0.35 -0.04 2.33 5.08 -1.07 -3.29 114.58 118.39 1d6o h GLU 61 Ca 0.42 -0.61 -0.09 0.00 -1.00 0.00 0.00 59.36 58.09 1d6o h GLU 61 Cb 0.64 0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.12 1d6o h GLU 61 CO -0.41 1.25 -0.31 0.78 -1.00 0.00 0.00 179.01 179.32 1d6o h GLY 62 N 1.08 0.31 2.00 -3.84 0.00 -0.60 -3.23 103.07 98.79 1d6o h GLY 62 Ca -0.26 -0.47 -0.04 0.00 0.00 0.00 0.00 47.33 46.56 1d6o h GLY 62 CO 0.20 0.42 -0.19 -2.08 0.00 0.00 0.00 176.54 174.88 1d6o h VAL 63 N -0.27 1.04 0.00 4.60 2.07 -1.06 -1.46 116.25 121.18 1d6o h VAL 63 Ca -0.03 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 66.82 1d6o h VAL 63 Cb 0.99 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 1d6o h VAL 63 CO 0.06 0.19 0.00 0.00 0.02 0.00 0.00 177.57 177.84 1d6o h ALA 64 N 1.81 1.00 -0.33 1.67 0.00 -1.62 -1.77 119.26 120.02 1d6o h ALA 64 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1d6o h ALA 64 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1d6o h ALA 64 CO 0.02 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.31 1d6o n GLN 65 N -2.95 2.29 -3.99 0.00 6.02 -0.55 -4.46 117.38 113.73 1d6o n GLN 65 Ca -0.01 -1.94 -0.29 0.00 -0.01 0.00 0.00 57.00 54.74 1d6o n GLN 65 Cb 0.17 -1.48 -0.05 0.00 1.02 0.00 0.00 30.24 29.90 1d6o n GLN 65 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 1d6o s MET 66 N -1.58 3.17 0.26 -1.09 -1.94 -0.67 -5.10 119.30 112.35 1d6o s MET 66 Ca 0.37 -0.62 0.08 0.00 -1.71 0.00 0.00 55.69 53.81 1d6o s MET 66 Cb 0.21 -2.86 -0.04 0.00 2.01 0.00 0.00 34.83 34.15 1d6o s MET 66 CO 0.30 0.56 0.13 -1.54 -0.01 0.00 0.00 175.02 174.46 1d6o s SER 67 N -2.69 5.18 0.14 3.03 1.04 -1.26 -4.12 113.70 115.01 1d6o s SER 67 Ca 0.32 -0.39 -0.34 0.00 0.48 0.00 0.00 55.95 56.02 1d6o s SER 67 Cb -0.12 -1.21 -0.14 0.00 0.10 0.00 0.00 66.02 64.66 1d6o s SER 67 CO 0.25 -0.03 1.60 0.52 0.98 0.00 0.00 173.24 176.56 1d6o n VAL 68 N -1.08 0.05 0.00 5.02 0.31 -0.20 -1.64 118.33 120.79 1d6o n VAL 68 Ca -0.07 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 1d6o n VAL 68 Cb 0.58 -1.54 0.00 0.00 -0.91 0.00 0.00 33.84 31.97 1d6o n VAL 68 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1d6o n GLY 69 N 3.47 1.62 3.77 2.92 0.00 0.12 -0.99 105.19 116.09 1d6o n GLY 69 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1d6o n GLY 69 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1d6o s GLN 70 N -0.90 4.36 -0.10 1.61 0.74 -0.65 -4.40 119.66 120.32 1d6o s GLN 70 Ca 0.00 1.68 0.03 0.00 0.05 0.00 0.00 55.36 57.12 1d6o s GLN 70 Cb 0.00 -2.85 -0.00 0.00 1.10 0.00 0.00 33.01 31.26 1d6o s GLN 70 CO 0.00 -0.01 -0.22 0.50 -0.55 0.00 0.00 175.29 175.02 1d6o s ARG 71 N -2.00 3.10 0.07 1.67 3.52 -0.14 -1.14 118.95 124.02 1d6o s ARG 71 Ca 0.52 -0.84 -0.07 0.00 -0.13 0.00 0.00 55.73 55.21 1d6o s ARG 71 Cb -0.27 -2.37 -0.01 0.00 -1.56 0.00 0.00 34.95 30.74 1d6o s ARG 71 CO 0.35 0.20 0.14 0.00 -0.81 0.00 0.00 175.30 175.18 1d6o s ALA 72 N 0.32 -0.11 -0.22 6.12 0.00 0.43 -1.10 121.76 127.20 1d6o s ALA 72 Ca -0.17 -0.64 -0.08 0.00 0.00 0.00 0.00 51.96 51.08 1d6o s ALA 72 Cb -0.17 0.38 -0.04 0.00 0.00 0.00 0.00 23.12 23.29 1d6o s ALA 72 CO 0.08 -0.43 0.07 0.21 0.00 0.00 0.00 175.76 175.69 1d6o s LYS 73 N -3.45 3.80 -0.17 0.00 2.20 0.47 -0.67 119.74 121.92 1d6o s LYS 73 Ca 0.02 -0.42 -0.03 0.00 -0.36 0.00 0.00 55.97 55.19 1d6o s LYS 73 Cb 0.03 -3.30 -0.02 0.00 -1.51 0.00 0.00 37.83 33.03 1d6o s LYS 73 CO -0.09 -0.00 -0.06 -0.51 -0.36 0.00 0.00 175.35 174.33 1d6o s LEU 74 N 1.13 3.00 -0.23 5.43 1.43 0.74 -0.59 118.68 129.60 1d6o s LEU 74 Ca 0.05 -0.26 -0.06 0.00 -1.03 0.00 0.00 54.13 52.83 1d6o s LEU 74 Cb -0.14 -1.72 -0.02 0.00 0.03 0.00 0.00 46.19 44.33 1d6o s LEU 74 CO 0.03 0.12 0.02 -0.89 0.23 0.00 0.00 176.35 175.86 1d6o s THR 75 N 0.66 4.02 -0.12 5.49 2.01 0.14 -0.57 115.64 127.27 1d6o s THR 75 Ca -0.04 -0.28 0.02 0.00 0.31 0.00 0.00 61.69 61.71 1d6o s THR 75 Cb -0.15 -2.85 0.01 0.00 0.01 0.00 0.00 72.50 69.53 1d6o s THR 75 CO 0.02 0.39 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.52 1d6o s ILE 76 N 1.35 1.82 0.63 1.82 1.01 0.12 -0.96 121.20 126.99 1d6o s ILE 76 Ca 0.05 -0.84 -0.16 0.00 0.00 0.00 0.00 60.65 59.70 1d6o s ILE 76 Cb -0.15 -1.63 -0.02 0.00 0.01 0.00 0.00 42.46 40.68 1d6o s ILE 76 CO 0.02 0.50 1.10 -0.94 0.00 0.00 0.00 174.94 175.62 1d6o s SER 77 N 0.85 5.35 0.34 3.58 1.04 -0.89 -0.65 113.70 123.32 1d6o s SER 77 Ca -0.08 1.97 0.09 0.00 0.48 0.00 0.00 55.95 58.41 1d6o s SER 77 Cb -0.15 -2.55 0.83 0.00 0.10 0.00 0.00 66.02 64.24 1d6o s SER 77 CO -0.01 -1.47 1.82 1.55 0.98 0.00 0.00 173.24 176.11 1d6o h PRO 78 N 0.26 0.66 0.00 4.02 0.13 -1.84 0.26 132.00 135.48 1d6o h PRO 78 Ca -0.47 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1d6o h PRO 78 Cb 1.24 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1d6o h PRO 78 CO 0.55 0.44 0.00 0.38 -0.23 0.00 0.00 178.00 179.14 1d6o h ASP 79 N 0.68 0.00 -0.34 1.44 2.03 -1.90 0.12 116.42 118.46 1d6o h ASP 79 Ca 0.53 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.83 1d6o h ASP 79 Cb 0.92 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.42 1d6o h ASP 79 CO -0.29 0.00 0.00 -1.22 -1.03 0.00 0.00 179.24 176.70 1d6o n TYR 80 N -2.39 0.44 0.00 4.15 4.02 0.06 -4.85 117.16 118.59 1d6o n TYR 80 Ca -0.00 -0.40 0.00 0.00 -0.01 0.00 0.00 57.90 57.48 1d6o n TYR 80 Cb 0.12 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.42 1d6o n TYR 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1d6o n ALA 81 N 0.71 0.00 -0.46 -0.72 0.00 0.02 -1.35 120.51 118.71 1d6o n ALA 81 Ca 0.13 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.64 1d6o n ALA 81 Cb 0.43 0.00 0.22 0.00 0.00 0.00 0.00 19.45 20.11 1d6o n ALA 81 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1d6o n TYR 82 N 0.00 0.77 -3.99 0.00 4.02 -1.12 -4.77 117.16 112.06 1d6o n TYR 82 Ca 0.00 -0.61 0.00 0.00 -0.01 0.00 0.00 57.90 57.28 1d6o n TYR 82 Cb 0.00 -0.13 0.00 0.00 -0.02 0.00 0.00 39.34 39.19 1d6o n TYR 82 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1d6o n GLY 83 N 0.43 0.94 0.23 2.72 0.00 0.22 -0.88 105.19 108.85 1d6o n GLY 83 Ca 0.17 -0.70 -0.07 0.00 0.00 0.00 0.00 46.02 45.41 1d6o n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d6o h ALA 84 N -0.80 0.84 0.00 4.61 0.00 -1.95 -2.11 119.26 119.85 1d6o h ALA 84 Ca 0.00 -0.45 -0.11 0.00 0.00 0.00 0.00 54.91 54.35 1d6o h ALA 84 Cb 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1d6o h ALA 84 CO 0.00 0.65 -0.54 1.79 0.00 0.00 0.00 179.25 181.14 1d6o h THR 85 N 0.46 0.99 0.00 0.00 1.35 -1.93 -3.31 112.91 110.47 1d6o h THR 85 Ca 0.04 -2.23 0.00 0.00 -0.55 0.00 0.00 66.41 63.66 1d6o h THR 85 Cb 0.92 2.37 0.00 0.00 -1.73 0.00 0.00 68.15 69.72 1d6o h THR 85 CO 0.08 0.53 0.00 0.61 -0.25 0.00 0.00 175.52 176.49 1d6o n GLY 86 N 1.02 2.09 2.49 5.82 0.00 -0.06 -4.21 105.19 112.34 1d6o n GLY 86 Ca 0.01 -0.47 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 1d6o n GLY 86 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1d6o s HIS 87 N 0.00 0.97 -0.14 1.61 5.04 0.41 -4.90 115.29 118.29 1d6o s HIS 87 Ca 0.00 -1.86 -0.40 0.00 -1.54 0.00 0.00 55.06 51.26 1d6o s HIS 87 Cb 0.00 -1.06 -0.19 0.00 0.04 0.00 0.00 32.58 31.37 1d6o s HIS 87 CO 0.00 -0.82 1.16 -2.30 -2.34 0.00 0.00 174.74 170.44 1d6o n PRO 88 N 3.75 0.00 0.00 2.88 -0.02 -1.25 -0.78 135.00 139.58 1d6o n PRO 88 Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 1d6o n PRO 88 Cb 0.38 -1.42 0.00 0.00 -0.02 0.00 0.00 33.50 32.44 1d6o n PRO 88 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1d6o n GLY 89 N 2.11 2.91 1.47 -1.23 0.00 -1.26 -4.77 105.19 104.43 1d6o n GLY 89 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1d6o n GLY 89 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1d6o n ILE 90 N -2.00 0.54 -4.01 -0.61 5.41 -0.05 -5.05 119.36 113.59 1d6o n ILE 90 Ca 0.00 0.18 -0.34 0.00 1.00 0.00 0.00 62.75 63.59 1d6o n ILE 90 Cb 0.00 -1.09 -0.15 0.00 -0.71 0.00 0.00 39.64 37.69 1d6o n ILE 90 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1d6o s ILE 91 N -2.00 2.68 0.85 1.39 1.01 0.04 -4.98 121.20 120.19 1d6o s ILE 91 Ca 0.00 -0.85 -0.10 0.00 0.00 0.00 0.00 60.65 59.69 1d6o s ILE 91 Cb 0.00 -2.24 0.11 0.00 0.01 0.00 0.00 42.46 40.34 1d6o s ILE 91 CO 0.00 0.39 1.12 -2.84 0.00 0.00 0.00 174.94 173.61 1d6o s PRO 92 N 1.35 1.57 0.61 2.79 0.02 -1.26 -0.44 135.00 139.64 1d6o s PRO 92 Ca 0.03 1.37 -0.19 0.00 0.02 0.00 0.00 61.00 62.23 1d6o s PRO 92 Cb -0.15 -1.80 -0.03 0.00 0.02 0.00 0.00 34.50 32.54 1d6o s PRO 92 CO -0.07 -2.19 1.28 -2.14 -0.33 0.00 0.00 177.00 173.55 1d6o s PRO 93 N -4.77 2.80 -1.62 5.54 0.02 -1.26 -3.14 135.00 132.57 1d6o s PRO 93 Ca 0.64 2.03 -0.15 0.00 0.02 0.00 0.00 61.00 63.53 1d6o s PRO 93 Cb -0.20 -1.95 0.12 0.00 0.02 0.00 0.00 34.50 32.49 1d6o s PRO 93 CO 0.57 -1.39 0.82 0.72 -0.33 0.00 0.00 177.00 177.39 1d6o n HIS 94 N -1.63 -1.92 -3.12 6.54 8.25 -0.80 -4.93 115.22 117.62 1d6o n HIS 94 Ca 0.14 0.83 -0.39 0.00 -0.26 0.00 0.00 57.72 58.04 1d6o n HIS 94 Cb 0.48 -3.36 -0.06 0.00 1.12 0.00 0.00 29.99 28.18 1d6o n HIS 94 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1d6o s ALA 95 N -3.35 3.46 -0.12 -1.41 0.00 -1.19 -4.79 121.76 114.37 1d6o s ALA 95 Ca 0.65 0.15 -0.16 0.00 0.00 0.00 0.00 51.96 52.60 1d6o s ALA 95 Cb -0.35 -2.83 -0.04 0.00 0.00 0.00 0.00 23.12 19.90 1d6o s ALA 95 CO 0.89 0.19 0.40 0.99 0.00 0.00 0.00 175.76 178.24 1d6o s THR 96 N -0.42 5.22 0.06 0.00 2.01 -1.26 -3.05 115.64 118.19 1d6o s THR 96 Ca 0.34 0.80 0.06 0.00 0.31 0.00 0.00 61.69 63.19 1d6o s THR 96 Cb -0.20 -3.74 -0.04 0.00 0.01 0.00 0.00 72.50 68.53 1d6o s THR 96 CO 0.20 0.37 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.65 1d6o s LEU 97 N 0.42 3.04 -0.10 4.42 1.43 0.17 -3.16 118.68 124.91 1d6o s LEU 97 Ca 0.22 -0.29 0.03 0.00 -1.03 0.00 0.00 54.13 53.06 1d6o s LEU 97 Cb -0.14 -1.80 0.00 0.00 0.03 0.00 0.00 46.19 44.28 1d6o s LEU 97 CO 0.08 0.23 -0.21 -0.69 0.23 0.00 0.00 176.35 175.99 1d6o s VAL 98 N -1.09 1.87 -0.05 -1.59 1.01 -0.77 0.10 120.40 119.88 1d6o s VAL 98 Ca 0.19 -0.90 0.05 0.00 0.00 0.00 0.00 61.98 61.32 1d6o s VAL 98 Cb -0.11 -1.63 -0.01 0.00 0.00 0.00 0.00 36.38 34.63 1d6o s VAL 98 CO 0.10 0.52 -0.21 -0.36 0.00 0.00 0.00 175.10 175.15 1d6o s PHE 99 N 0.46 2.07 -0.37 5.22 0.40 0.26 -0.78 117.98 125.25 1d6o s PHE 99 Ca -0.17 -0.59 -0.12 0.00 -0.60 0.00 0.00 56.93 55.45 1d6o s PHE 99 Cb -0.17 -1.37 0.01 0.00 0.51 0.00 0.00 43.02 42.00 1d6o s PHE 99 CO 0.07 -0.18 0.24 0.34 0.70 0.00 0.00 175.22 176.39 1d6o s ASP 100 N -0.11 5.90 -0.06 1.36 -1.08 -0.36 -0.19 116.67 122.13 1d6o s ASP 100 Ca -0.03 -0.78 0.04 0.00 -0.52 0.00 0.00 52.55 51.26 1d6o s ASP 100 Cb -0.12 -2.09 0.00 0.00 -1.46 0.00 0.00 42.92 39.25 1d6o s ASP 100 CO 0.03 -0.35 -0.18 -0.69 0.52 0.00 0.00 175.17 174.50 1d6o s VAL 101 N 1.64 1.54 -0.16 1.11 1.01 0.15 -1.13 120.40 124.56 1d6o s VAL 101 Ca 0.04 -0.74 0.02 0.00 0.00 0.00 0.00 61.98 61.29 1d6o s VAL 101 Cb -0.18 -1.34 0.01 0.00 0.00 0.00 0.00 36.38 34.87 1d6o s VAL 101 CO 0.08 0.44 -0.20 -0.70 0.00 0.00 0.00 175.10 174.72 1d6o s GLU 102 N 0.28 3.02 -0.52 2.72 2.12 0.17 -0.43 118.70 126.06 1d6o s GLU 102 Ca -0.11 -0.83 -0.22 0.00 0.36 0.00 0.00 54.97 54.17 1d6o s GLU 102 Cb -0.14 -2.51 0.04 0.00 0.26 0.00 0.00 34.13 31.78 1d6o s GLU 102 CO 0.04 -0.10 0.81 -1.17 -0.54 0.00 0.00 175.26 174.31 1d6o s LEU 103 N 1.03 4.40 -0.05 2.70 2.96 -0.30 -1.60 118.68 127.82 1d6o s LEU 103 Ca -0.02 -0.48 -0.24 0.00 -0.22 0.00 0.00 54.13 53.17 1d6o s LEU 103 Cb -0.14 -2.73 -0.26 0.00 0.50 0.00 0.00 46.19 43.56 1d6o s LEU 103 CO -0.06 -1.06 0.97 -0.07 -1.32 0.00 0.00 176.35 174.81 1d6o h LEU 104 N 10.41 0.30 -7.68 -0.68 3.38 -1.32 0.33 115.31 120.05 1d6o h LEU 104 Ca -0.26 -0.85 0.19 0.00 0.09 0.00 0.00 57.88 57.05 1d6o h LEU 104 Cb 1.08 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.67 1d6o h LEU 104 CO 1.02 1.11 0.55 -1.59 0.09 0.00 0.00 178.44 179.63 1d6o s LYS 105 N -2.84 1.13 -0.03 1.13 -2.85 -1.21 -4.48 119.74 110.60 1d6o s LYS 105 Ca -0.15 -0.65 0.06 0.00 -1.00 0.00 0.00 55.97 54.23 1d6o s LYS 105 Cb 0.01 0.37 -0.01 0.00 -2.06 0.00 0.00 37.83 36.13 1d6o s LYS 105 CO 0.77 -0.52 -0.22 -0.51 0.10 0.00 0.00 175.35 174.96 1d6o s LEU 106 N -3.05 2.03 0.00 2.77 1.43 -1.26 -1.80 118.68 118.79 1d6o s LEU 106 Ca 0.15 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 52.83 1d6o s LEU 106 Cb -0.01 -1.18 0.00 0.00 0.03 0.00 0.00 46.19 45.03 1d6o s LEU 106 CO 0.02 0.26 0.29 -0.62 0.23 0.00 0.00 176.35 176.53