#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uw0 s ALA 2 N 0.00 0.82 -0.28 3.04 0.00 -1.26 -5.08 121.76 119.00 1uw0 s ALA 2 Ca 0.00 -1.45 0.16 0.00 0.00 0.00 0.00 51.96 50.68 1uw0 s ALA 2 Cb 0.00 0.98 0.49 0.00 0.00 0.00 0.00 23.12 24.59 1uw0 s ALA 2 CO 0.00 -0.53 1.14 0.39 0.00 0.00 0.00 175.76 176.75 1uw0 n GLU 3 N -0.15 2.47 -4.17 0.00 1.02 -1.26 -5.08 120.64 113.48 1uw0 n GLU 3 Ca -0.04 -3.77 -0.16 0.00 -0.02 0.00 0.00 57.16 53.17 1uw0 n GLU 3 Cb 0.64 -1.87 -0.11 0.00 -0.02 0.00 0.00 31.44 30.08 1uw0 n GLU 3 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1uw0 s GLN 4 N -3.71 0.82 -0.01 3.49 -0.21 -1.26 -4.27 119.66 114.51 1uw0 s GLN 4 Ca 0.37 -1.05 -0.03 0.00 0.02 0.00 0.00 55.36 54.67 1uw0 s GLN 4 Cb 0.36 -0.64 -0.00 0.00 1.00 0.00 0.00 33.01 33.72 1uw0 s GLN 4 CO -0.01 0.12 0.07 0.50 -2.12 0.00 0.00 175.29 173.85 1uw0 s ARG 5 N -2.26 0.27 0.07 2.91 3.52 -1.05 -5.01 118.95 117.41 1uw0 s ARG 5 Ca 0.01 -0.24 0.08 0.00 -0.13 0.00 0.00 55.73 55.45 1uw0 s ARG 5 Cb -0.06 0.11 -0.04 0.00 -1.56 0.00 0.00 34.95 33.40 1uw0 s ARG 5 CO 0.01 -0.05 -0.19 -0.06 -0.81 0.00 0.00 175.30 174.20 1uw0 s PHE 6 N -0.81 2.52 0.07 5.12 0.40 -1.26 0.27 117.98 124.29 1uw0 s PHE 6 Ca -0.09 -0.28 0.06 0.00 -0.60 0.00 0.00 56.93 56.03 1uw0 s PHE 6 Cb -0.05 -1.40 -0.03 0.00 0.51 0.00 0.00 43.02 42.04 1uw0 s PHE 6 CO 0.00 0.29 -0.17 0.00 0.70 0.00 0.00 175.22 176.05 1uw0 s VAL 8 N -1.07 1.18 0.26 0.00 -7.23 -1.02 0.20 120.40 112.71 1uw0 s VAL 8 Ca 0.03 -1.02 0.09 0.00 -1.81 0.00 0.00 61.98 59.27 1uw0 s VAL 8 Cb -0.09 -1.55 -0.05 0.00 0.56 0.00 0.00 36.38 35.25 1uw0 s VAL 8 CO 0.03 -0.17 -0.14 -0.62 -0.31 0.00 0.00 175.10 173.89 1uw0 s ASP 9 N 1.55 3.08 0.17 4.85 -1.08 -0.24 -4.10 116.67 120.90 1uw0 s ASP 9 Ca -0.03 -1.08 0.04 0.00 -0.52 0.00 0.00 52.55 50.96 1uw0 s ASP 9 Cb -0.18 -0.22 -0.04 0.00 -1.46 0.00 0.00 42.92 41.02 1uw0 s ASP 9 CO -0.08 -0.14 0.23 -0.31 0.52 0.00 0.00 175.17 175.40 1uw0 s TYR 10 N -2.79 3.34 -0.02 -5.34 2.02 -1.26 0.14 117.35 113.44 1uw0 s TYR 10 Ca 0.27 0.04 -0.14 0.00 -0.37 0.00 0.00 57.07 56.88 1uw0 s TYR 10 Cb -0.01 -1.59 -0.05 0.00 -0.40 0.00 0.00 41.96 39.91 1uw0 s TYR 10 CO 0.12 0.51 0.37 0.00 -1.57 0.00 0.00 175.55 174.97 1uw0 s ALA 11 N -1.79 3.73 0.02 3.71 0.00 -1.04 -4.91 121.76 121.47 1uw0 s ALA 11 Ca 0.33 -0.28 -0.04 0.00 0.00 0.00 0.00 51.96 51.97 1uw0 s ALA 11 Cb -0.10 -2.32 -0.01 0.00 0.00 0.00 0.00 23.12 20.68 1uw0 s ALA 11 CO 0.26 0.50 -0.07 1.63 0.00 0.00 0.00 175.76 178.09 1uw0 n LYS 12 N 1.84 0.10 -2.76 0.00 5.02 -1.26 -3.20 118.16 117.90 1uw0 n LYS 12 Ca -0.15 0.04 -0.01 0.00 -2.02 0.00 0.00 58.31 56.18 1uw0 n LYS 12 Cb 0.53 -0.59 0.05 0.00 -0.02 0.00 0.00 35.03 34.99 1uw0 n LYS 12 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 1uw0 n ARG 13 N -3.45 1.72 -3.71 1.97 1.85 -1.26 -4.42 116.66 109.36 1uw0 n ARG 13 Ca -0.03 -3.47 -0.17 0.00 -1.00 0.00 0.00 57.85 53.18 1uw0 n ARG 13 Cb 0.10 -1.57 -0.16 0.00 -1.05 0.00 0.00 32.46 29.78 1uw0 n ARG 13 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1uw0 s GLY 14 N -3.74 0.11 0.04 2.89 0.00 -1.26 -5.05 107.32 100.32 1uw0 s GLY 14 Ca 0.28 0.38 0.06 0.00 0.00 0.00 0.00 44.72 45.44 1uw0 s GLY 14 CO -0.04 1.17 -0.13 -0.51 0.00 0.00 0.00 173.10 173.59 1uw0 s THR 15 N 1.70 3.20 -0.09 0.90 -4.23 -1.26 -4.66 115.64 111.20 1uw0 s THR 15 Ca -0.02 -1.08 -0.27 0.00 -1.18 0.00 0.00 61.69 59.14 1uw0 s THR 15 Cb -0.12 -2.40 0.06 0.00 1.34 0.00 0.00 72.50 71.38 1uw0 s THR 15 CO -0.04 0.30 0.62 0.00 -0.54 0.00 0.00 174.62 174.96 1uw0 s ALA 16 N -1.02 -1.60 -0.09 3.99 0.00 -1.21 -4.90 121.76 116.93 1uw0 s ALA 16 Ca 0.17 1.29 -0.35 0.00 0.00 0.00 0.00 51.96 53.07 1uw0 s ALA 16 Cb -0.11 -0.22 -0.13 0.00 0.00 0.00 0.00 23.12 22.67 1uw0 s ALA 16 CO 0.08 -0.34 1.82 0.41 0.00 0.00 0.00 175.76 177.73 1uw0 n GLY 17 N 1.35 1.31 3.68 0.00 0.00 -1.26 -2.20 105.19 108.07 1uw0 n GLY 17 Ca -0.18 0.85 -0.42 0.00 0.00 0.00 0.00 46.02 46.26 1uw0 n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uw0 s LYS 19 N 3.20 2.89 -0.97 0.00 1.02 0.29 -3.17 119.74 123.00 1uw0 s LYS 19 Ca 0.77 1.26 0.00 0.00 0.02 0.00 0.00 55.97 58.02 1uw0 s LYS 19 Cb -0.40 -1.97 0.00 0.00 -0.52 0.00 0.00 37.83 34.94 1uw0 s LYS 19 CO 0.34 -1.16 0.00 1.17 -0.92 0.00 0.00 175.35 174.78 1uw0 n LYS 20 N -2.52 -1.21 -3.61 1.68 3.00 -1.26 -4.01 118.16 110.23 1uw0 n LYS 20 Ca 0.09 0.77 -0.05 0.00 -0.00 0.00 0.00 58.31 59.12 1uw0 n LYS 20 Cb 0.52 -4.89 -0.04 0.00 0.00 0.00 0.00 35.03 30.62 1uw0 n LYS 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1uw0 s LYS 22 N -1.12 3.49 0.10 0.00 -0.14 -1.26 -4.43 119.74 116.38 1uw0 s LYS 22 Ca 0.05 -1.51 -0.10 0.00 -1.36 0.00 0.00 55.97 53.05 1uw0 s LYS 22 Cb -0.01 -4.80 0.04 0.00 -1.68 0.00 0.00 37.83 31.38 1uw0 s LYS 22 CO -0.04 -1.81 0.48 -1.91 -0.76 0.00 0.00 175.35 171.30 1uw0 n GLU 23 N 6.98 0.33 -4.18 1.68 2.13 -1.26 -5.02 120.64 121.30 1uw0 n GLU 23 Ca 0.18 -0.74 -0.16 0.00 0.66 0.00 0.00 57.16 57.10 1uw0 n GLU 23 Cb 0.48 0.99 -0.11 0.00 0.27 0.00 0.00 31.44 33.07 1uw0 n GLU 23 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 1uw0 s LYS 24 N -2.03 0.86 -0.09 5.31 -2.85 -1.26 -1.28 119.74 118.41 1uw0 s LYS 24 Ca 0.11 -1.09 -0.01 0.00 -1.00 0.00 0.00 55.97 53.97 1uw0 s LYS 24 Cb -0.01 -0.69 -0.03 0.00 -2.06 0.00 0.00 37.83 35.03 1uw0 s LYS 24 CO 0.03 0.13 -0.02 0.42 0.10 0.00 0.00 175.35 176.01 1uw0 s ILE 25 N -1.96 4.14 0.10 3.79 1.01 -0.93 -4.81 121.20 122.53 1uw0 s ILE 25 Ca 0.03 -0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.38 1uw0 s ILE 25 Cb -0.06 -2.73 -0.04 0.00 0.01 0.00 0.00 42.46 39.64 1uw0 s ILE 25 CO 0.01 0.60 -0.03 -0.69 0.00 0.00 0.00 174.94 174.83 1uw0 s VAL 26 N -0.78 0.46 0.08 2.92 1.01 -1.26 -3.35 120.40 119.48 1uw0 s VAL 26 Ca 0.12 -1.90 -0.37 0.00 0.00 0.00 0.00 61.98 59.83 1uw0 s VAL 26 Cb -0.11 -1.75 -0.17 0.00 0.00 0.00 0.00 36.38 34.34 1uw0 s VAL 26 CO 0.02 -0.79 1.31 1.17 0.00 0.00 0.00 175.10 176.81 1uw0 n LYS 27 N -0.03 1.03 0.00 2.72 4.81 -1.26 -2.78 118.16 122.64 1uw0 n LYS 27 Ca -0.11 0.37 0.00 0.00 -0.87 0.00 0.00 58.31 57.70 1uw0 n LYS 27 Cb 0.62 -2.00 0.00 0.00 0.02 0.00 0.00 35.03 33.67 1uw0 n LYS 27 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1uw0 n GLY 28 N 2.41 1.08 3.18 3.14 0.00 -1.20 -5.02 105.19 108.79 1uw0 n GLY 28 Ca 0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 1uw0 n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uw0 s VAL 29 N -2.00 1.60 0.21 1.61 0.11 -1.12 -5.00 120.40 115.81 1uw0 s VAL 29 Ca 0.00 -0.82 -0.24 0.00 -2.93 0.00 0.00 61.98 57.99 1uw0 s VAL 29 Cb 0.00 -1.36 -0.08 0.00 -1.53 0.00 0.00 36.38 33.41 1uw0 s VAL 29 CO 0.00 0.45 0.80 0.00 -3.33 0.00 0.00 175.10 173.02 1uw0 s ARG 31 N -1.50 1.69 -0.24 0.00 0.52 0.12 -4.42 118.95 115.11 1uw0 s ARG 31 Ca 0.40 -1.18 0.02 0.00 -0.52 0.00 0.00 55.73 54.45 1uw0 s ARG 31 Cb -0.21 -1.98 0.06 0.00 0.52 0.00 0.00 34.95 33.34 1uw0 s ARG 31 CO 0.25 0.49 -0.11 0.42 0.02 0.00 0.00 175.30 176.37 1uw0 s ILE 32 N -0.92 2.02 -0.12 1.52 1.01 -1.16 -1.07 121.20 122.47 1uw0 s ILE 32 Ca 0.13 -1.46 -0.06 0.00 0.00 0.00 0.00 60.65 59.26 1uw0 s ILE 32 Cb -0.10 -2.12 -0.04 0.00 0.01 0.00 0.00 42.46 40.21 1uw0 s ILE 32 CO 0.04 0.03 0.08 -0.83 0.00 0.00 0.00 174.94 174.26 1uw0 s GLY 33 N 1.19 2.02 -0.20 6.18 0.00 0.13 -3.74 107.32 112.89 1uw0 s GLY 33 Ca -0.07 -0.71 -0.05 0.00 0.00 0.00 0.00 44.72 43.89 1uw0 s GLY 33 CO -0.06 -0.35 0.01 1.25 0.00 0.00 0.00 173.10 173.95 1uw0 s LYS 34 N -0.70 3.66 -0.34 2.90 2.20 -1.25 0.12 119.74 126.32 1uw0 s LYS 34 Ca 0.12 -0.50 -0.12 0.00 -0.36 0.00 0.00 55.97 55.11 1uw0 s LYS 34 Cb -0.12 -3.09 -0.01 0.00 -1.51 0.00 0.00 37.83 33.10 1uw0 s LYS 34 CO 0.03 0.04 0.22 0.08 -0.36 0.00 0.00 175.35 175.36 1uw0 s VAL 35 N 0.92 5.10 -0.25 4.02 1.01 0.14 -3.94 120.40 127.40 1uw0 s VAL 35 Ca 0.01 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.70 1uw0 s VAL 35 Cb -0.14 -3.63 0.04 0.00 0.00 0.00 0.00 36.38 32.65 1uw0 s VAL 35 CO 0.02 -0.00 -0.09 -0.69 0.00 0.00 0.00 175.10 174.34 1uw0 s VAL 36 N 1.69 2.57 0.49 2.92 1.01 -1.12 -2.52 120.40 125.44 1uw0 s VAL 36 Ca 0.06 -1.25 -0.21 0.00 0.00 0.00 0.00 61.98 60.58 1uw0 s VAL 36 Cb -0.17 -2.36 -0.07 0.00 0.00 0.00 0.00 36.38 33.77 1uw0 s VAL 36 CO 0.09 0.13 1.11 -2.16 0.00 0.00 0.00 175.10 174.27 1uw0 s PRO 37 N 1.24 3.65 0.34 2.72 0.04 -1.26 -3.59 135.00 138.14 1uw0 s PRO 37 Ca -0.03 1.58 0.07 0.00 0.04 0.00 0.00 61.00 62.66 1uw0 s PRO 37 Cb -0.18 -2.19 -0.02 0.00 0.04 0.00 0.00 34.50 32.16 1uw0 s PRO 37 CO -0.05 -0.60 0.39 -0.80 0.04 0.00 0.00 177.00 175.98 1uw0 s ASN 38 N -1.70 5.62 0.17 6.66 -0.87 -0.36 -4.98 114.94 119.48 1uw0 s ASN 38 Ca 0.67 -0.35 -0.08 0.00 -1.57 0.00 0.00 52.86 51.54 1uw0 s ASN 38 Cb -0.23 -1.08 0.05 0.00 -0.02 0.00 0.00 41.25 39.96 1uw0 s ASN 38 CO 0.27 -0.41 1.53 1.55 -2.57 0.00 0.00 177.10 177.47 1uw0 h PRO 39 N 1.06 0.85 -6.31 -0.60 0.13 -1.97 -3.44 132.00 121.72 1uw0 h PRO 39 Ca -0.45 -0.42 -0.60 0.00 -0.87 0.00 0.00 66.00 63.65 1uw0 h PRO 39 Cb 1.26 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.28 1uw0 h PRO 39 CO 0.55 1.06 -0.64 0.12 -0.23 0.00 0.00 178.00 178.87 1uw0 s PHE 40 N -4.42 2.93 -0.35 1.56 2.19 -1.26 -5.10 117.98 113.53 1uw0 s PHE 40 Ca -0.10 -0.10 -0.01 0.00 0.33 0.00 0.00 56.93 57.06 1uw0 s PHE 40 Cb 0.12 -1.43 0.09 0.00 -1.31 0.00 0.00 43.02 40.49 1uw0 s PHE 40 CO 0.86 0.51 0.09 -1.54 1.83 0.00 0.00 175.22 176.98 1uw0 s SER 41 N -2.89 4.99 -0.04 6.13 1.04 -1.26 -4.79 113.70 116.88 1uw0 s SER 41 Ca 0.28 -1.81 -0.05 0.00 0.48 0.00 0.00 55.95 54.85 1uw0 s SER 41 Cb -0.10 -1.73 -0.02 0.00 0.10 0.00 0.00 66.02 64.27 1uw0 s SER 41 CO 0.20 -0.40 -0.09 -0.62 0.98 0.00 0.00 173.24 173.30 1uw0 n GLU 42 N 4.51 0.14 -0.03 4.02 4.71 -1.26 -4.85 120.64 127.87 1uw0 n GLU 42 Ca -0.05 0.05 -0.22 0.00 -0.01 0.00 0.00 57.16 56.94 1uw0 n GLU 42 Cb 0.42 -0.69 -0.13 0.00 -1.01 0.00 0.00 31.44 30.03 1uw0 n GLU 42 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65 1uw0 n SER 43 N -3.06 2.03 0.00 1.62 7.64 -1.26 -4.98 113.62 115.61 1uw0 n SER 43 Ca -0.04 0.28 0.00 0.00 1.01 0.00 0.00 58.87 60.13 1uw0 n SER 43 Cb 0.14 -0.90 0.00 0.00 -1.01 0.00 0.00 64.21 62.43 1uw0 n SER 43 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uw0 n GLY 44 N 1.79 -0.60 0.00 0.23 0.00 -1.26 -5.09 105.19 100.26 1uw0 n GLY 44 Ca -0.32 0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1uw0 n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uw0 n GLY 45 N 0.57 4.18 3.31 -0.02 0.00 -1.26 -4.85 105.19 107.12 1uw0 n GLY 45 Ca 0.00 -0.67 -0.33 0.00 0.00 0.00 0.00 46.02 45.02 1uw0 n GLY 45 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1uw0 s ASP 46 N 0.00 3.84 0.08 1.61 1.11 -1.26 -1.23 116.67 120.83 1uw0 s ASP 46 Ca 0.00 -0.40 0.09 0.00 0.18 0.00 0.00 52.55 52.41 1uw0 s ASP 46 Cb 0.00 -1.59 -0.04 0.00 1.07 0.00 0.00 42.92 42.36 1uw0 s ASP 46 CO 0.00 0.12 -0.21 -0.32 1.18 0.00 0.00 175.17 175.94 1uw0 s MET 47 N 0.64 1.81 0.02 8.23 1.75 -1.24 -4.92 119.30 125.60 1uw0 s MET 47 Ca -0.07 -1.13 0.04 0.00 -1.25 0.00 0.00 55.69 53.27 1uw0 s MET 47 Cb -0.16 -2.08 -0.02 0.00 2.84 0.00 0.00 34.83 35.42 1uw0 s MET 47 CO 0.03 0.50 -0.12 -1.59 -0.65 0.00 0.00 175.02 173.18 1uw0 s LYS 48 N -1.77 0.87 -0.05 4.11 -2.85 -1.26 -2.78 119.74 116.01 1uw0 s LYS 48 Ca 0.15 -0.60 0.06 0.00 -1.00 0.00 0.00 55.97 54.58 1uw0 s LYS 48 Cb -0.10 -0.84 -0.01 0.00 -2.06 0.00 0.00 37.83 34.81 1uw0 s LYS 48 CO 0.07 0.22 -0.25 -1.21 0.10 0.00 0.00 175.35 174.27 1uw0 s GLU 49 N -0.81 2.41 -0.39 1.78 2.02 -1.25 -4.91 118.70 117.54 1uw0 s GLU 49 Ca 0.02 -0.89 -0.20 0.00 0.02 0.00 0.00 54.97 53.92 1uw0 s GLU 49 Cb -0.06 -2.09 0.01 0.00 0.10 0.00 0.00 34.13 32.08 1uw0 s GLU 49 CO 0.01 0.41 0.61 -1.58 0.02 0.00 0.00 175.26 174.72 1uw0 s TRP 50 N -0.24 3.13 0.37 1.61 0.23 -1.26 -3.96 118.94 118.82 1uw0 s TRP 50 Ca -0.01 0.15 0.04 0.00 -2.03 0.00 0.00 56.10 54.25 1uw0 s TRP 50 Cb -0.13 -3.17 -0.06 0.00 0.03 0.00 0.00 33.47 30.15 1uw0 s TRP 50 CO 0.03 -0.70 0.05 1.52 0.96 0.00 0.00 176.95 178.81 1uw0 s TYR 51 N 2.67 2.04 0.67 -1.98 -0.85 -1.25 0.11 117.35 118.77 1uw0 s TYR 51 Ca 0.22 -0.95 -0.03 0.00 -0.52 0.00 0.00 57.07 55.80 1uw0 s TYR 51 Cb -0.15 -1.40 0.08 0.00 0.38 0.00 0.00 41.96 40.87 1uw0 s TYR 51 CO 0.16 0.08 0.94 -1.01 -1.52 0.00 0.00 175.55 174.20 1uw0 s HIS 52 N -3.12 2.45 -0.05 -3.49 3.76 -1.26 -2.98 115.29 110.59 1uw0 s HIS 52 Ca 0.31 0.08 -0.22 0.00 -0.15 0.00 0.00 55.06 55.08 1uw0 s HIS 52 Cb 0.07 -3.04 -0.17 0.00 1.11 0.00 0.00 32.58 30.55 1uw0 s HIS 52 CO 0.15 -1.38 0.92 0.82 -0.85 0.00 0.00 174.74 174.40 1uw0 h ILE 53 N -0.41 0.98 -0.95 0.60 2.04 -1.99 -1.40 117.51 116.39 1uw0 h ILE 53 Ca -0.41 -1.20 0.04 0.00 1.00 0.00 0.00 64.86 64.28 1uw0 h ILE 53 Cb 1.29 1.65 -0.06 0.00 -0.74 0.00 0.00 36.82 38.96 1uw0 h ILE 53 CO 0.51 0.25 0.62 0.50 0.00 0.00 0.00 178.15 180.03 1uw0 h LYS 54 N -0.81 1.16 -0.28 2.37 3.64 -1.96 0.95 116.57 121.64 1uw0 h LYS 54 Ca -0.02 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 1uw0 h LYS 54 Cb 0.55 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 1uw0 h LYS 54 CO 0.03 0.77 0.13 0.00 -2.27 0.00 0.00 179.45 178.10 1uw0 h MET 56 N 0.31 0.56 0.00 0.00 1.85 -0.64 -2.66 114.93 114.35 1uw0 h MET 56 Ca 0.10 -0.50 -0.06 0.00 -0.61 0.00 0.00 59.70 58.62 1uw0 h MET 56 Cb 0.14 0.12 -0.01 0.00 0.43 0.00 0.00 31.60 32.28 1uw0 h MET 56 CO -0.01 1.13 -0.30 0.74 -0.40 0.00 0.00 176.91 178.07 1uw0 h PHE 57 N 0.17 0.00 -0.12 1.39 0.04 0.98 -2.79 116.94 116.60 1uw0 h PHE 57 Ca -0.06 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.49 1uw0 h PHE 57 Cb 1.29 0.00 0.01 0.00 2.20 0.00 0.00 35.95 39.45 1uw0 h PHE 57 CO 0.12 0.30 -0.80 1.49 -0.60 0.00 0.00 178.31 178.82 1uw0 h GLU 58 N 0.00 0.69 -0.63 1.51 4.81 0.78 -2.88 114.58 118.86 1uw0 h GLU 58 Ca -0.00 -0.59 -0.05 0.00 -0.13 0.00 0.00 59.36 58.60 1uw0 h GLU 58 Cb 0.74 0.13 -0.03 0.00 0.63 0.00 0.00 28.75 30.22 1uw0 h GLU 58 CO 0.04 1.20 0.22 -0.22 -0.73 0.00 0.00 179.01 179.52 1uw0 h LYS 59 N 0.46 0.97 -0.90 1.92 3.64 -1.31 -2.14 116.57 119.21 1uw0 h LYS 59 Ca -0.06 -0.20 0.01 0.00 -1.27 0.00 0.00 60.65 59.14 1uw0 h LYS 59 Cb 1.42 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 33.05 1uw0 h LYS 59 CO 0.16 0.84 0.60 -0.07 -2.27 0.00 0.00 179.45 178.71 1uw0 h LEU 60 N 0.90 1.03 -0.97 5.20 4.07 -1.50 0.21 115.31 124.26 1uw0 h LEU 60 Ca 0.21 -0.03 -0.08 0.00 0.08 0.00 0.00 57.88 58.06 1uw0 h LEU 60 Cb 0.26 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 41.73 1uw0 h LEU 60 CO -0.01 0.75 -0.16 -0.08 -1.08 0.00 0.00 178.44 177.86 1uw0 h GLU 61 N 1.22 0.56 0.17 1.13 4.81 -1.25 -3.10 114.58 118.12 1uw0 h GLU 61 Ca 0.33 -0.18 -0.29 0.00 -0.13 0.00 0.00 59.36 59.08 1uw0 h GLU 61 Cb -0.14 -0.05 0.02 0.00 0.63 0.00 0.00 28.75 29.21 1uw0 h GLU 61 CO -0.07 0.70 -1.31 -0.09 -0.73 0.00 0.00 179.01 177.51 1uw0 h ARG 62 N 0.51 0.38 -5.29 1.92 2.43 -0.76 -3.44 114.38 110.13 1uw0 h ARG 62 Ca 0.09 -0.63 -0.65 0.00 -0.81 0.00 0.00 59.98 57.98 1uw0 h ARG 62 Cb 0.57 0.23 -0.26 0.00 -0.42 0.00 0.00 29.97 30.09 1uw0 h ARG 62 CO 0.04 1.30 -0.74 0.00 -1.51 0.00 0.00 179.97 179.05 1uw0 s ALA 63 N -2.67 2.72 -0.38 2.80 0.00 0.70 -5.09 121.76 119.84 1uw0 s ALA 63 Ca -0.06 -0.90 -0.02 0.00 0.00 0.00 0.00 51.96 50.99 1uw0 s ALA 63 Cb 0.06 -1.33 0.10 0.00 0.00 0.00 0.00 23.12 21.95 1uw0 s ALA 63 CO 0.91 0.18 0.14 0.50 0.00 0.00 0.00 175.76 177.49 1uw0 s ARG 64 N 0.45 2.01 0.00 0.00 6.06 -1.26 -4.48 118.95 121.73 1uw0 s ARG 64 Ca -0.08 -1.72 0.23 0.00 -2.50 0.00 0.00 55.73 51.66 1uw0 s ARG 64 Cb -0.15 -3.45 0.84 0.00 0.06 0.00 0.00 34.95 32.24 1uw0 s ARG 64 CO 0.04 -0.96 1.60 0.00 -2.50 0.00 0.00 175.30 173.48 1uw0 n ALA 65 N 4.55 2.54 -3.47 6.12 0.00 -1.26 -4.93 120.51 124.05 1uw0 n ALA 65 Ca -0.03 -0.50 -0.25 0.00 0.00 0.00 0.00 53.44 52.65 1uw0 n ALA 65 Cb 0.42 -1.11 0.03 0.00 0.00 0.00 0.00 19.45 18.79 1uw0 n ALA 65 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1uw0 n THR 66 N 0.27 -1.98 -4.39 0.00 -1.04 -1.26 -4.98 114.28 100.89 1uw0 n THR 66 Ca 0.17 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.94 1uw0 n THR 66 Cb 0.33 -3.04 -0.09 0.00 -1.82 0.00 0.00 70.33 65.72 1uw0 n THR 66 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1uw0 s THR 67 N -3.19 2.84 -0.65 12.58 -4.23 -1.26 -5.09 115.64 116.64 1uw0 s THR 67 Ca 0.49 -2.16 -0.14 0.00 -1.18 0.00 0.00 61.69 58.71 1uw0 s THR 67 Cb -0.24 -2.59 0.17 0.00 1.34 0.00 0.00 72.50 71.19 1uw0 s THR 67 CO 0.60 -0.35 0.59 -0.54 -0.54 0.00 0.00 174.62 174.38 1uw0 s LYS 68 N -3.60 3.16 0.01 3.99 -0.14 -1.26 -5.04 119.74 116.85 1uw0 s LYS 68 Ca 0.31 -2.06 0.07 0.00 -1.36 0.00 0.00 55.97 52.93 1uw0 s LYS 68 Cb -0.04 -4.28 -0.02 0.00 -1.68 0.00 0.00 37.83 31.80 1uw0 s LYS 68 CO 0.17 -1.29 -0.20 0.15 -0.76 0.00 0.00 175.35 173.43 1uw0 s LYS 69 N 0.91 1.47 -0.19 1.68 1.02 -1.26 -4.94 119.74 118.44 1uw0 s LYS 69 Ca 0.10 -0.81 -0.02 0.00 0.02 0.00 0.00 55.97 55.26 1uw0 s LYS 69 Cb -0.21 -1.49 0.01 0.00 -0.52 0.00 0.00 37.83 35.61 1uw0 s LYS 69 CO -0.02 0.40 0.04 -0.89 -0.92 0.00 0.00 175.35 173.95 1uw0 n ILE 70 N 2.24 -8.74 -4.60 2.17 5.41 -1.26 -4.99 119.36 109.59 1uw0 n ILE 70 Ca -0.16 1.51 -0.34 0.00 1.00 0.00 0.00 62.75 64.76 1uw0 n ILE 70 Cb 0.53 -5.52 -0.12 0.00 -0.71 0.00 0.00 39.64 33.83 1uw0 n ILE 70 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 1uw0 s GLU 71 N -1.19 3.01 1.53 0.38 2.12 -1.26 -5.03 118.70 118.26 1uw0 s GLU 71 Ca -0.05 -0.56 0.00 0.00 0.36 0.00 0.00 54.97 54.73 1uw0 s GLU 71 Cb 0.00 -2.66 0.00 0.00 0.26 0.00 0.00 34.13 31.73 1uw0 s GLU 71 CO 0.52 0.52 0.00 -3.47 -0.54 0.00 0.00 175.26 172.30 1uw0 n ASP 72 N 2.65 -3.42 -1.89 -1.70 2.03 -1.26 -4.20 116.55 108.76 1uw0 n ASP 72 Ca -0.18 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 54.91 1uw0 n ASP 72 Cb 0.53 0.00 0.05 0.00 -0.72 0.00 0.00 41.12 40.98 1uw0 n ASP 72 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1uw0 n LEU 73 N 0.00 5.05 -2.34 -2.67 7.94 -1.26 -4.68 117.00 119.04 1uw0 n LEU 73 Ca 0.00 -4.56 -0.01 0.00 -1.11 0.00 0.00 56.01 50.33 1uw0 n LEU 73 Cb 0.00 -0.46 0.05 0.00 0.53 0.00 0.00 43.42 43.55 1uw0 n LEU 73 CO 0.00 1.92 0.23 0.35 -1.11 0.00 0.00 177.39 178.78 1uw0 n THR 74 N -0.80 0.53 -2.40 1.96 -2.24 -1.26 -4.91 114.28 105.16 1uw0 n THR 74 Ca 0.44 -1.68 -0.06 0.00 -2.27 0.00 0.00 64.05 60.47 1uw0 n THR 74 Cb 0.91 1.07 0.05 0.00 -2.10 0.00 0.00 70.33 70.27 1uw0 n THR 74 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1uw0 n GLU 75 N -0.62 2.02 -4.00 -0.78 2.13 -1.26 -5.07 120.64 113.06 1uw0 n GLU 75 Ca -0.05 -3.45 -0.09 0.00 0.66 0.00 0.00 57.16 54.23 1uw0 n GLU 75 Cb 0.87 -1.56 -0.11 0.00 0.27 0.00 0.00 31.44 30.91 1uw0 n GLU 75 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1uw0 s LEU 76 N -3.09 2.25 -0.73 4.31 1.43 -1.26 -4.90 118.68 116.70 1uw0 s LEU 76 Ca 0.37 -0.62 -0.24 0.00 -1.03 0.00 0.00 54.13 52.60 1uw0 s LEU 76 Cb 0.36 0.18 0.06 0.00 0.03 0.00 0.00 46.19 46.82 1uw0 s LEU 76 CO -0.04 -0.40 1.12 -0.70 0.23 0.00 0.00 176.35 176.56 1uw0 s GLU 77 N -2.18 3.20 0.00 1.70 2.12 -1.19 -3.96 118.70 118.39 1uw0 s GLU 77 Ca -0.09 -0.68 0.00 0.00 0.36 0.00 0.00 54.97 54.56 1uw0 s GLU 77 Cb -0.05 -4.32 0.00 0.00 0.26 0.00 0.00 34.13 30.03 1uw0 s GLU 77 CO -0.04 -1.96 0.00 0.41 -0.54 0.00 0.00 175.26 173.13 1uw0 n GLY 78 N 5.45 2.16 0.31 -1.50 0.00 -1.26 -2.43 105.19 107.91 1uw0 n GLY 78 Ca 0.02 -0.23 0.13 0.00 0.00 0.00 0.00 46.02 45.94 1uw0 n GLY 78 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1uw0 h TRP 79 N 0.00 0.00 -0.93 1.61 5.08 -1.71 -2.01 115.95 117.99 1uw0 h TRP 79 Ca 0.00 0.00 0.18 0.00 1.08 0.00 0.00 58.89 60.15 1uw0 h TRP 79 Cb 0.00 0.00 -0.08 0.00 -3.00 0.00 0.00 29.16 26.08 1uw0 h TRP 79 CO 0.00 0.00 0.60 1.49 -1.28 0.00 0.00 178.44 179.25 1uw0 h GLU 80 N 0.00 0.55 0.07 0.12 4.81 -1.94 -0.54 114.58 117.66 1uw0 h GLU 80 Ca 0.10 -0.03 -0.24 0.00 -0.13 0.00 0.00 59.36 59.05 1uw0 h GLU 80 Cb 0.39 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 1uw0 h GLU 80 CO -0.00 0.37 -1.12 1.49 -0.73 0.00 0.00 179.01 179.01 1uw0 h GLU 81 N 0.57 0.17 -6.43 1.92 4.57 -1.75 -3.46 114.58 110.17 1uw0 h GLU 81 Ca 0.49 -0.28 -0.46 0.00 -1.18 0.00 0.00 59.36 57.93 1uw0 h GLU 81 Cb 0.98 0.10 0.24 0.00 -0.16 0.00 0.00 28.75 29.91 1uw0 h GLU 81 CO -0.23 1.12 -1.61 1.28 -1.18 0.00 0.00 179.01 178.39 1uw0 n LEU 82 N -3.48 -2.54 -4.79 1.64 4.32 -0.21 -5.00 117.00 106.93 1uw0 n LEU 82 Ca -0.05 -0.10 -0.22 0.00 -0.02 0.00 0.00 56.01 55.62 1uw0 n LEU 82 Cb 0.97 -0.80 -0.05 0.00 -1.62 0.00 0.00 43.42 41.93 1uw0 n LEU 82 CO 0.51 -2.88 -0.18 -0.70 -1.22 0.00 0.00 177.39 172.92 1uw0 s GLU 83 N -2.97 2.74 0.21 3.23 2.12 -1.26 -4.94 118.70 117.84 1uw0 s GLU 83 Ca 0.49 -1.19 -0.09 0.00 0.36 0.00 0.00 54.97 54.53 1uw0 s GLU 83 Cb -0.04 -2.45 0.20 0.00 0.26 0.00 0.00 34.13 32.10 1uw0 s GLU 83 CO 0.65 0.33 1.86 0.22 -0.54 0.00 0.00 175.26 177.78 1uw0 h ASP 84 N 1.53 0.80 0.18 -1.70 3.58 -1.97 0.63 116.42 119.46 1uw0 h ASP 84 Ca -0.47 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 56.97 1uw0 h ASP 84 Cb 1.24 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 42.12 1uw0 h ASP 84 CO 0.60 0.56 -0.09 0.78 -2.88 0.00 0.00 179.24 178.21 1uw0 h ASN 85 N 0.94 -0.20 -0.77 2.28 2.35 -2.00 0.57 115.58 118.75 1uw0 h ASN 85 Ca 0.30 -0.07 -0.06 0.00 -0.55 0.00 0.00 56.30 55.93 1uw0 h ASN 85 Cb -0.01 0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.38 1uw0 h ASN 85 CO -0.10 -0.07 0.27 -0.33 -1.65 0.00 0.00 177.43 175.55 1uw0 h GLU 86 N -0.33 1.18 -0.85 0.81 5.08 -1.90 -2.38 114.58 116.19 1uw0 h GLU 86 Ca -0.02 -0.24 0.02 0.00 -1.00 0.00 0.00 59.36 58.12 1uw0 h GLU 86 Cb 0.26 -0.18 -0.05 0.00 0.50 0.00 0.00 28.75 29.28 1uw0 h GLU 86 CO 0.04 0.99 0.56 -0.22 -1.00 0.00 0.00 179.01 179.38 1uw0 h LYS 87 N 1.14 1.08 -0.53 2.33 3.64 0.56 -1.77 116.57 123.02 1uw0 h LYS 87 Ca 0.25 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.53 1uw0 h LYS 87 Cb 0.28 -0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 1uw0 h LYS 87 CO -0.01 0.71 0.16 0.93 -2.27 0.00 0.00 179.45 178.97 1uw0 h GLU 88 N 1.11 0.80 -0.37 1.90 5.08 -0.37 -1.58 114.58 121.15 1uw0 h GLU 88 Ca 0.32 -0.14 -0.14 0.00 -1.00 0.00 0.00 59.36 58.40 1uw0 h GLU 88 Cb -0.06 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 1uw0 h GLU 88 CO -0.08 0.70 -0.32 0.37 -1.00 0.00 0.00 179.01 178.67 1uw0 h GLN 89 N 0.78 0.81 -0.37 2.33 4.15 -1.13 -2.84 115.11 118.84 1uw0 h GLN 89 Ca 0.18 -0.38 -0.13 0.00 0.77 0.00 0.00 58.65 59.08 1uw0 h GLN 89 Cb 0.24 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.91 1uw0 h GLN 89 CO -0.01 1.02 -0.30 0.82 -1.93 0.00 0.00 178.83 178.43 1uw0 h ILE 90 N 0.68 1.28 -0.80 2.39 2.04 -1.11 -2.86 117.51 119.14 1uw0 h ILE 90 Ca 0.07 -1.45 0.03 0.00 1.00 0.00 0.00 64.86 64.51 1uw0 h ILE 90 Cb 0.87 1.32 -0.04 0.00 -0.74 0.00 0.00 36.82 38.22 1uw0 h ILE 90 CO 0.08 0.48 0.53 0.71 0.00 0.00 0.00 178.15 179.95 1uw0 h THR 91 N 0.68 1.14 -0.87 -0.27 1.35 -1.18 -1.37 112.91 112.40 1uw0 h THR 91 Ca 0.08 -0.34 0.09 0.00 -0.55 0.00 0.00 66.41 65.68 1uw0 h THR 91 Cb 0.85 0.05 -0.06 0.00 -1.73 0.00 0.00 68.15 67.25 1uw0 h THR 91 CO 0.07 0.18 0.56 -0.61 -0.25 0.00 0.00 175.52 175.48 1uw0 h GLN 92 N 1.00 0.85 0.34 4.72 4.15 -1.26 0.17 115.11 125.08 1uw0 h GLN 92 Ca 0.31 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.67 1uw0 h GLN 92 Cb 0.01 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.50 1uw0 h GLN 92 CO -0.09 0.56 -0.23 0.45 -1.93 0.00 0.00 178.83 177.60 1uw0 h HIS 93 N 0.88 -0.59 -0.66 3.99 3.86 -1.27 0.60 115.15 121.96 1uw0 h HIS 93 Ca 0.39 -0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.53 1uw0 h HIS 93 Cb 0.36 0.21 -0.03 0.00 1.06 0.00 0.00 27.41 29.02 1uw0 h HIS 93 CO -0.00 -0.35 0.13 0.82 0.86 0.00 0.00 177.93 179.39 1uw0 h ILE 94 N -0.55 1.26 -0.64 2.45 2.04 -1.42 -2.38 117.51 118.27 1uw0 h ILE 94 Ca -0.03 -0.99 -0.03 0.00 1.00 0.00 0.00 64.86 64.80 1uw0 h ILE 94 Cb 0.47 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 1uw0 h ILE 94 CO 0.02 0.37 0.26 0.00 0.00 0.00 0.00 178.15 178.81 1uw0 h ALA 95 N 1.12 1.25 -0.07 1.87 0.00 -0.30 -1.62 119.26 121.51 1uw0 h ALA 95 Ca 0.20 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1uw0 h ALA 95 Cb 0.40 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1uw0 h ALA 95 CO 0.01 0.55 0.04 0.22 0.00 0.00 0.00 179.25 180.07 1uw0 h ASP 96 N 0.92 0.09 -0.61 0.00 3.58 0.70 -2.51 116.42 118.59 1uw0 h ASP 96 Ca 0.22 -0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.58 1uw0 h ASP 96 Cb 0.17 -0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.17 1uw0 h ASP 96 CO -0.02 0.14 0.38 -0.07 -2.88 0.00 0.00 179.24 176.79 1uw0 h LEU 97 N 0.02 0.74 -6.75 2.28 4.07 -1.18 -3.18 115.31 111.31 1uw0 h LEU 97 Ca 0.02 -0.04 -0.77 0.00 0.08 0.00 0.00 57.88 57.17 1uw0 h LEU 97 Cb 0.08 -0.19 -0.30 0.00 1.08 0.00 0.00 40.66 41.33 1uw0 h LEU 97 CO -0.00 0.57 0.56 -0.24 -1.08 0.00 0.00 178.44 178.25 1uw0 n SER 98 N -4.41 6.03 -2.64 -0.43 2.88 -0.64 -5.01 113.62 109.40 1uw0 n SER 98 Ca 0.06 -3.44 -0.08 0.00 -1.33 0.00 0.00 58.87 54.09 1uw0 n SER 98 Cb 0.07 -1.16 -0.01 0.00 -0.75 0.00 0.00 64.21 62.35 1uw0 n SER 98 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1uw0 n SER 99 N 1.16 2.27 -3.39 -3.46 3.41 -1.18 -4.83 113.62 107.60 1uw0 n SER 99 Ca 0.27 -1.53 -0.21 0.00 -0.26 0.00 0.00 58.87 57.15 1uw0 n SER 99 Cb 0.34 0.08 -0.07 0.00 -0.26 0.00 0.00 64.21 64.30 1uw0 n SER 99 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1uw0 n LYS 100 N -0.34 0.48 -2.25 4.33 5.02 -1.26 -5.08 118.16 119.06 1uw0 n LYS 100 Ca -0.05 -3.19 -0.18 0.00 -2.02 0.00 0.00 58.31 52.88 1uw0 n LYS 100 Cb 0.15 2.20 0.03 0.00 -0.02 0.00 0.00 35.03 37.39 1uw0 n LYS 100 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1uw0 n ALA 101 N -1.00 4.36 -3.81 7.82 0.00 -1.26 -5.00 120.51 121.62 1uw0 n ALA 101 Ca -0.13 -3.52 -0.28 0.00 0.00 0.00 0.00 53.44 49.52 1uw0 n ALA 101 Cb 0.57 -0.48 -0.16 0.00 0.00 0.00 0.00 19.45 19.38 1uw0 n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uw0 s ALA 102 N -3.65 1.24 0.00 0.00 0.00 -1.26 -5.12 121.76 112.97 1uw0 s ALA 102 Ca 0.44 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.61 1uw0 s ALA 102 Cb 0.39 -1.18 0.00 0.00 0.00 0.00 0.00 23.12 22.33 1uw0 s ALA 102 CO 0.01 -1.04 0.00 0.41 0.00 0.00 0.00 175.76 175.15 1uw0 n GLY 103 N 4.96 -1.53 2.72 0.00 0.00 -1.26 -4.95 105.19 105.13 1uw0 n GLY 103 Ca -0.10 -0.25 -0.30 0.00 0.00 0.00 0.00 46.02 45.37 1uw0 n GLY 103 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uw0 s THR 104 N 0.00 1.31 0.89 2.61 -4.23 -1.26 -5.12 115.64 109.84 1uw0 s THR 104 Ca 0.00 -2.35 -0.12 0.00 -1.18 0.00 0.00 61.69 58.04 1uw0 s THR 104 Cb 0.00 -1.93 0.13 0.00 1.34 0.00 0.00 72.50 72.04 1uw0 s THR 104 CO 0.00 -0.86 1.11 -2.16 -0.54 0.00 0.00 174.62 172.17 1uw0 s PRO 105 N 0.58 1.30 -0.27 3.99 0.04 -1.26 -5.06 135.00 134.31 1uw0 s PRO 105 Ca 0.16 0.56 -0.03 0.00 0.04 0.00 0.00 61.00 61.73 1uw0 s PRO 105 Cb -0.23 -1.83 0.09 0.00 0.04 0.00 0.00 34.50 32.56 1uw0 s PRO 105 CO -0.03 -2.15 0.10 0.21 0.04 0.00 0.00 177.00 175.17 1uw0 s LYS 106 N -5.10 0.48 0.41 4.56 2.20 -1.26 -5.13 119.74 115.90 1uw0 s LYS 106 Ca 0.63 -0.71 0.03 0.00 -0.36 0.00 0.00 55.97 55.57 1uw0 s LYS 106 Cb -0.16 -1.71 -0.03 0.00 -1.51 0.00 0.00 37.83 34.42 1uw0 s LYS 106 CO 0.55 -0.92 0.09 0.15 -0.36 0.00 0.00 175.35 174.86 1uw0 s LYS 107 N 1.86 1.92 -0.70 4.03 1.02 -1.26 -5.11 119.74 121.51 1uw0 s LYS 107 Ca 0.07 -2.16 0.04 0.00 0.02 0.00 0.00 55.97 53.94 1uw0 s LYS 107 Cb -0.17 -0.87 0.17 0.00 -0.52 0.00 0.00 37.83 36.44 1uw0 s LYS 107 CO -0.25 -0.38 0.49 0.21 -0.92 0.00 0.00 175.35 174.50 1uw0 s LYS 108 N -3.78 2.50 0.26 1.68 2.20 -1.26 -5.08 119.74 116.27 1uw0 s LYS 108 Ca 0.24 -3.20 0.10 0.00 -0.36 0.00 0.00 55.97 52.74 1uw0 s LYS 108 Cb 0.04 -3.49 -0.05 0.00 -1.51 0.00 0.00 37.83 32.81 1uw0 s LYS 108 CO 0.13 -1.25 -0.15 0.00 -0.36 0.00 0.00 175.35 173.71 1uw0 s ALA 109 N -1.21 2.48 -0.17 3.13 0.00 -1.26 -5.14 121.76 119.59 1uw0 s ALA 109 Ca 0.24 -1.83 0.00 0.00 0.00 0.00 0.00 51.96 50.37 1uw0 s ALA 109 Cb -0.09 -0.12 0.03 0.00 0.00 0.00 0.00 23.12 22.95 1uw0 s ALA 109 CO -0.13 0.14 -0.10 0.08 0.00 0.00 0.00 175.76 175.75 1uw0 s VAL 110 N -2.74 1.48 -0.09 0.00 1.01 -1.26 -5.12 120.40 113.68 1uw0 s VAL 110 Ca 0.28 -0.76 0.03 0.00 0.00 0.00 0.00 61.98 61.53 1uw0 s VAL 110 Cb -0.02 -1.51 -0.01 0.00 0.00 0.00 0.00 36.38 34.84 1uw0 s VAL 110 CO 0.12 0.27 -0.20 -0.69 0.00 0.00 0.00 175.10 174.61 1uw0 s VAL 111 N 1.49 2.51 -0.24 2.92 1.01 -1.26 -5.11 120.40 121.72 1uw0 s VAL 111 Ca 0.02 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.13 1uw0 s VAL 111 Cb -0.15 -1.98 0.06 0.00 0.00 0.00 0.00 36.38 34.31 1uw0 s VAL 111 CO -0.09 0.56 -0.09 -1.58 0.00 0.00 0.00 175.10 173.90 1uw0 s GLN 112 N 0.07 1.98 -0.21 2.72 0.74 -1.26 -5.10 119.66 118.60 1uw0 s GLN 112 Ca -0.08 -1.13 0.02 0.00 0.05 0.00 0.00 55.36 54.22 1uw0 s GLN 112 Cb -0.15 -2.70 0.03 0.00 1.10 0.00 0.00 33.01 31.29 1uw0 s GLN 112 CO 0.05 -0.55 -0.16 0.00 -0.55 0.00 0.00 175.29 174.08 1uw0 s ALA 113 N 1.26 2.44 0.01 1.58 0.00 -1.26 -5.11 121.76 120.67 1uw0 s ALA 113 Ca -0.06 -1.43 0.07 0.00 0.00 0.00 0.00 51.96 50.54 1uw0 s ALA 113 Cb -0.19 -1.35 -0.02 0.00 0.00 0.00 0.00 23.12 21.56 1uw0 s ALA 113 CO -0.06 -0.67 -0.23 0.21 0.00 0.00 0.00 175.76 175.01 1uw0 s LYS 114 N 1.23 1.72 0.09 0.00 2.20 -1.26 -5.14 119.74 118.57 1uw0 s LYS 114 Ca -0.00 -0.89 0.08 0.00 -0.36 0.00 0.00 55.97 54.79 1uw0 s LYS 114 Cb -0.16 -1.74 -0.03 0.00 -1.51 0.00 0.00 37.83 34.39 1uw0 s LYS 114 CO -0.10 0.47 -0.20 -0.51 -0.36 0.00 0.00 175.35 174.65 1uw0 s LEU 115 N -0.81 2.29 -0.07 5.43 1.43 -1.26 -5.14 118.68 120.55 1uw0 s LEU 115 Ca 0.09 -0.66 0.06 0.00 -1.03 0.00 0.00 54.13 52.58 1uw0 s LEU 115 Cb -0.09 -0.83 -0.01 0.00 0.03 0.00 0.00 46.19 45.30 1uw0 s LEU 115 CO 0.00 0.04 -0.25 -0.89 0.23 0.00 0.00 176.35 175.49 1uw0 s THR 116 N -1.16 2.08 -0.39 5.49 2.01 -1.26 -5.38 115.64 117.04 1uw0 s THR 116 Ca 0.05 -1.05 0.03 0.00 0.31 0.00 0.00 61.69 61.03 1uw0 s THR 116 Cb -0.10 -1.76 0.02 0.00 0.01 0.00 0.00 72.50 70.68 1uw0 s THR 116 CO 0.04 0.57 0.60 0.41 -0.69 0.00 0.00 174.62 175.54