#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 3.49 -0.40 3.04 0.00 -1.26 -5.13 121.76 121.51 1uw0 s ALA 2 Ca 0.00 -1.16 0.03 0.00 0.00 0.00 0.00 51.96 50.84 1uw0 s ALA 2 Cb 0.00 0.27 0.16 0.00 0.00 0.00 0.00 23.12 23.55 1uw0 s ALA 2 CO 0.00 -0.13 0.39 -2.00 0.00 0.00 0.00 175.76 174.01 1uw0 s GLU 3 N -3.81 0.76 0.27 0.00 -6.30 -1.26 -5.14 118.70 103.22 1uw0 s GLU 3 Ca 0.19 -1.32 0.11 0.00 -2.50 0.00 0.00 54.97 51.46 1uw0 s GLU 3 Cb 0.04 -0.92 -0.05 0.00 0.00 0.00 0.00 34.13 33.21 1uw0 s GLU 3 CO 0.10 -1.27 -0.15 -0.65 0.02 0.00 0.00 175.26 173.31 1uw0 s GLN 4 N 0.91 1.85 0.03 4.30 -0.21 -1.26 -4.22 119.66 121.05 1uw0 s GLN 4 Ca 0.23 -1.64 0.04 0.00 0.02 0.00 0.00 55.36 54.01 1uw0 s GLN 4 Cb -0.09 -1.90 -0.02 0.00 1.00 0.00 0.00 33.01 32.00 1uw0 s GLN 4 CO -0.07 0.35 -0.11 0.50 -2.12 0.00 0.00 175.29 173.84 1uw0 s ARG 5 N -3.47 0.78 -0.14 2.91 6.06 -0.26 -4.97 118.95 119.86 1uw0 s ARG 5 Ca 0.30 -0.63 -0.12 0.00 -2.50 0.00 0.00 55.73 52.78 1uw0 s ARG 5 Cb -0.06 -0.73 0.04 0.00 0.06 0.00 0.00 34.95 34.26 1uw0 s ARG 5 CO 0.16 0.18 0.37 -0.06 -2.50 0.00 0.00 175.30 173.45 1uw0 s PHE 6 N -0.77 -0.44 0.08 5.12 0.08 -1.26 -0.37 117.98 120.42 1uw0 s PHE 6 Ca -0.00 1.03 -0.17 0.00 0.12 0.00 0.00 56.93 57.91 1uw0 s PHE 6 Cb -0.07 0.16 0.04 0.00 -0.57 0.00 0.00 43.02 42.57 1uw0 s PHE 6 CO 0.01 -0.22 0.40 0.00 -0.10 0.00 0.00 175.22 175.31 1uw0 s VAL 8 N -3.06 5.29 0.09 0.00 -7.23 -1.26 0.17 120.40 114.41 1uw0 s VAL 8 Ca -0.02 0.14 0.02 0.00 -1.81 0.00 0.00 61.98 60.31 1uw0 s VAL 8 Cb 0.00 -3.35 -0.04 0.00 0.56 0.00 0.00 36.38 33.55 1uw0 s VAL 8 CO -0.07 0.53 -0.07 -1.81 -0.31 0.00 0.00 175.10 173.38 1uw0 s ASP 9 N -0.34 1.13 0.17 4.85 1.11 0.31 -3.74 116.67 120.15 1uw0 s ASP 9 Ca 0.11 -0.90 0.06 0.00 0.18 0.00 0.00 52.55 51.99 1uw0 s ASP 9 Cb -0.12 0.07 -0.04 0.00 1.07 0.00 0.00 42.92 43.91 1uw0 s ASP 9 CO 0.01 -0.40 0.10 -0.31 1.18 0.00 0.00 175.17 175.75 1uw0 s TYR 10 N -3.09 3.06 -0.10 4.23 2.02 -1.26 0.12 117.35 122.32 1uw0 s TYR 10 Ca 0.07 -0.05 -0.15 0.00 -0.37 0.00 0.00 57.07 56.57 1uw0 s TYR 10 Cb 0.02 -1.47 -0.05 0.00 -0.40 0.00 0.00 41.96 40.06 1uw0 s TYR 10 CO -0.03 0.52 0.38 0.00 -1.57 0.00 0.00 175.55 174.85 1uw0 s ALA 11 N -1.75 3.59 -0.01 3.71 0.00 -1.06 -4.93 121.76 121.31 1uw0 s ALA 11 Ca 0.30 -0.30 -0.04 0.00 0.00 0.00 0.00 51.96 51.92 1uw0 s ALA 11 Cb -0.10 -2.47 -0.02 0.00 0.00 0.00 0.00 23.12 20.53 1uw0 s ALA 11 CO 0.22 0.18 -0.08 1.63 0.00 0.00 0.00 175.76 177.71 1uw0 n LYS 12 N 3.08 0.13 -3.62 0.00 4.01 -1.26 -4.01 118.16 116.49 1uw0 n LYS 12 Ca -0.11 0.05 -0.28 0.00 -0.51 0.00 0.00 58.31 57.47 1uw0 n LYS 12 Cb 0.52 -0.72 -0.16 0.00 -0.51 0.00 0.00 35.03 34.16 1uw0 n LYS 12 CO 0.00 0.00 0.00 0.50 -1.11 0.00 0.00 177.40 176.79 1uw0 s ARG 13 N -2.16 0.25 0.00 1.97 3.52 -1.26 -4.66 118.95 116.60 1uw0 s ARG 13 Ca -0.08 -0.36 0.00 0.00 -0.13 0.00 0.00 55.73 55.16 1uw0 s ARG 13 Cb 0.02 -1.66 0.00 0.00 -1.56 0.00 0.00 34.95 31.75 1uw0 s ARG 13 CO 0.10 -0.81 0.00 0.41 -0.81 0.00 0.00 175.30 174.20 1uw0 n GLY 14 N 5.20 4.45 3.44 8.12 0.00 -1.26 -5.11 105.19 120.03 1uw0 n GLY 14 Ca -0.07 -1.35 -0.32 0.00 0.00 0.00 0.00 46.02 44.29 1uw0 n GLY 14 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1uw0 s THR 15 N -2.03 2.75 -0.03 2.61 2.01 -1.26 -4.59 115.64 115.11 1uw0 s THR 15 Ca 0.00 -1.00 0.00 0.00 0.31 0.00 0.00 61.69 61.01 1uw0 s THR 15 Cb 0.00 -2.09 0.03 0.00 0.01 0.00 0.00 72.50 70.44 1uw0 s THR 15 CO 0.00 0.48 0.01 0.00 -0.69 0.00 0.00 174.62 174.42 1uw0 s ALA 16 N -0.79 0.27 0.03 7.40 0.00 -0.96 -4.89 121.76 122.82 1uw0 s ALA 16 Ca 0.13 0.19 -0.30 0.00 0.00 0.00 0.00 51.96 51.98 1uw0 s ALA 16 Cb -0.10 -0.31 -0.08 0.00 0.00 0.00 0.00 23.12 22.63 1uw0 s ALA 16 CO 0.02 -0.09 1.76 0.20 0.00 0.00 0.00 175.76 177.65 1uw0 s GLY 17 N 1.04 1.50 0.20 0.00 0.00 -1.26 0.11 107.32 108.90 1uw0 s GLY 17 Ca -0.10 1.18 -0.32 0.00 0.00 0.00 0.00 44.72 45.49 1uw0 s GLY 17 CO -0.02 3.12 1.69 0.00 0.00 0.00 0.00 173.10 177.88 1uw0 s LYS 19 N 1.20 3.08 -1.37 0.00 2.47 -1.17 -2.76 119.74 121.19 1uw0 s LYS 19 Ca 0.74 2.12 -0.02 0.00 -1.56 0.00 0.00 55.97 57.24 1uw0 s LYS 19 Cb -0.48 -2.16 0.02 0.00 -1.46 0.00 0.00 37.83 33.74 1uw0 s LYS 19 CO 0.32 -1.20 0.67 1.63 0.16 0.00 0.00 175.35 176.92 1uw0 n LYS 20 N -1.19 -4.55 -3.50 4.03 5.02 -1.26 -4.89 118.16 111.81 1uw0 n LYS 20 Ca 0.11 0.56 -0.12 0.00 -2.02 0.00 0.00 58.31 56.85 1uw0 n LYS 20 Cb 0.46 -5.06 -0.04 0.00 -0.02 0.00 0.00 35.03 30.38 1uw0 n LYS 20 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1uw0 n LYS 22 N 0.18 2.92 -2.94 0.00 3.00 -1.26 -4.70 118.16 115.35 1uw0 n LYS 22 Ca -0.13 -3.61 -0.08 0.00 -0.00 0.00 0.00 58.31 54.48 1uw0 n LYS 22 Cb 0.61 -2.28 -0.03 0.00 0.00 0.00 0.00 35.03 33.33 1uw0 n LYS 22 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1uw0 n GLU 23 N -0.72 0.25 -4.12 1.64 4.07 -1.26 -5.07 120.64 115.43 1uw0 n GLU 23 Ca 0.55 -1.50 -0.11 0.00 -0.06 0.00 0.00 57.16 56.04 1uw0 n GLU 23 Cb 0.57 1.31 -0.10 0.00 -0.06 0.00 0.00 31.44 33.15 1uw0 n GLU 23 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 1uw0 s LYS 24 N -2.55 0.70 -0.26 5.31 1.02 -1.26 -1.68 119.74 121.03 1uw0 s LYS 24 Ca 0.17 -1.12 -0.13 0.00 0.02 0.00 0.00 55.97 54.91 1uw0 s LYS 24 Cb 0.00 -0.18 -0.04 0.00 -0.52 0.00 0.00 37.83 37.09 1uw0 s LYS 24 CO 0.12 -0.01 0.28 0.42 -0.92 0.00 0.00 175.35 175.25 1uw0 s ILE 25 N -2.90 5.25 0.39 2.17 1.01 0.29 -4.79 121.20 122.63 1uw0 s ILE 25 Ca 0.04 0.40 0.04 0.00 0.00 0.00 0.00 60.65 61.12 1uw0 s ILE 25 Cb 0.00 -3.62 -0.03 0.00 0.01 0.00 0.00 42.46 38.83 1uw0 s ILE 25 CO -0.04 0.23 0.11 0.68 0.00 0.00 0.00 174.94 175.93 1uw0 s VAL 26 N 1.70 0.71 -0.14 2.92 -7.23 -1.26 -2.26 120.40 114.84 1uw0 s VAL 26 Ca 0.12 -2.00 -0.41 0.00 -1.81 0.00 0.00 61.98 57.88 1uw0 s VAL 26 Cb -0.15 -2.42 -0.18 0.00 0.56 0.00 0.00 36.38 34.18 1uw0 s VAL 26 CO 0.09 0.00 1.39 0.29 -0.31 0.00 0.00 175.10 176.56 1uw0 n LYS 27 N -0.87 0.52 0.00 4.82 5.02 -1.26 -1.68 118.16 124.70 1uw0 n LYS 27 Ca -0.06 0.19 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 1uw0 n LYS 27 Cb 0.65 -1.76 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 1uw0 n LYS 27 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1uw0 n GLY 28 N 2.84 0.93 3.21 0.72 0.00 -1.26 -5.07 105.19 106.57 1uw0 n GLY 28 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.96 1uw0 n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uw0 s VAL 29 N -2.00 1.84 -0.08 1.61 1.01 -0.68 -5.04 120.40 117.06 1uw0 s VAL 29 Ca 0.00 -0.94 -0.12 0.00 0.00 0.00 0.00 61.98 60.93 1uw0 s VAL 29 Cb 0.00 -1.57 -0.05 0.00 0.00 0.00 0.00 36.38 34.76 1uw0 s VAL 29 CO 0.00 0.52 0.29 0.00 0.00 0.00 0.00 175.10 175.90 1uw0 s ARG 31 N -0.75 0.56 -0.12 0.00 1.70 0.12 -3.65 118.95 116.80 1uw0 s ARG 31 Ca 0.19 -0.82 -0.04 0.00 -0.47 0.00 0.00 55.73 54.59 1uw0 s ARG 31 Cb -0.14 -0.28 -0.04 0.00 -0.57 0.00 0.00 34.95 33.93 1uw0 s ARG 31 CO 0.08 0.04 0.04 0.42 -1.08 0.00 0.00 175.30 174.80 1uw0 s ILE 32 N -1.62 4.62 -0.19 4.99 1.01 -1.19 0.11 121.20 128.94 1uw0 s ILE 32 Ca -0.08 -0.12 -0.05 0.00 0.00 0.00 0.00 60.65 60.40 1uw0 s ILE 32 Cb -0.08 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 39.36 1uw0 s ILE 32 CO -0.00 0.57 0.01 -0.83 0.00 0.00 0.00 174.94 174.69 1uw0 s GLY 33 N -0.54 1.77 -0.19 6.18 0.00 0.13 -2.09 107.32 112.58 1uw0 s GLY 33 Ca 0.10 -0.89 -0.04 0.00 0.00 0.00 0.00 44.72 43.90 1uw0 s GLY 33 CO 0.02 0.13 -0.04 -1.59 0.00 0.00 0.00 173.10 171.62 1uw0 s LYS 34 N 0.71 3.48 -0.33 2.90 -2.85 -1.19 -1.34 119.74 121.12 1uw0 s LYS 34 Ca 0.01 -0.59 -0.04 0.00 -1.00 0.00 0.00 55.97 54.35 1uw0 s LYS 34 Cb -0.14 -2.96 0.06 0.00 -2.06 0.00 0.00 37.83 32.73 1uw0 s LYS 34 CO 0.02 -0.02 0.07 0.08 0.10 0.00 0.00 175.35 175.60 1uw0 s VAL 35 N 1.04 3.31 -0.23 1.79 1.01 0.50 -3.38 120.40 124.43 1uw0 s VAL 35 Ca 0.01 -1.44 0.02 0.00 0.00 0.00 0.00 61.98 60.57 1uw0 s VAL 35 Cb -0.15 -2.96 0.05 0.00 0.00 0.00 0.00 36.38 33.32 1uw0 s VAL 35 CO 0.00 -0.25 -0.10 -0.69 0.00 0.00 0.00 175.10 174.06 1uw0 s VAL 36 N 1.28 1.88 0.02 2.92 1.01 -1.23 -1.10 120.40 125.18 1uw0 s VAL 36 Ca -0.01 -1.31 -0.30 0.00 0.00 0.00 0.00 61.98 60.35 1uw0 s VAL 36 Cb -0.20 -1.98 -0.05 0.00 0.00 0.00 0.00 36.38 34.14 1uw0 s VAL 36 CO -0.00 0.06 1.29 -2.16 0.00 0.00 0.00 175.10 174.29 1uw0 s PRO 37 N 1.26 4.35 -0.27 2.72 0.04 -1.26 -4.11 135.00 137.73 1uw0 s PRO 37 Ca -0.05 1.85 -0.09 0.00 0.04 0.00 0.00 61.00 62.75 1uw0 s PRO 37 Cb -0.18 -3.46 -0.03 0.00 0.04 0.00 0.00 34.50 30.87 1uw0 s PRO 37 CO -0.07 -0.43 0.12 -0.80 0.04 0.00 0.00 177.00 175.86 1uw0 s ASN 38 N 1.44 5.46 -0.94 6.66 0.01 -1.09 -4.99 114.94 121.49 1uw0 s ASN 38 Ca 0.60 -0.24 -0.21 0.00 -0.71 0.00 0.00 52.86 52.30 1uw0 s ASN 38 Cb -0.30 -1.99 -0.11 0.00 0.41 0.00 0.00 41.25 39.26 1uw0 s ASN 38 CO 0.27 -0.08 1.97 -0.81 -1.51 0.00 0.00 177.10 176.93 1uw0 n PRO 39 N 4.97 1.78 0.16 -0.60 -0.04 -1.26 -4.03 135.00 135.98 1uw0 n PRO 39 Ca -0.15 -2.08 0.00 0.00 -0.04 0.00 0.00 63.50 61.23 1uw0 n PRO 39 Cb 0.51 -3.08 0.00 0.00 -0.04 0.00 0.00 33.50 30.89 1uw0 n PRO 39 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1uw0 n PHE 40 N 8.06 -3.00 -4.16 0.54 -0.00 -1.26 -5.13 117.46 112.51 1uw0 n PHE 40 Ca 0.49 0.73 -0.24 0.00 -0.00 0.00 0.00 57.45 58.44 1uw0 n PHE 40 Cb 0.41 1.53 -0.06 0.00 -0.00 0.00 0.00 39.48 41.36 1uw0 n PHE 40 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1uw0 s SER 41 N -4.12 5.19 -0.19 -2.13 0.15 -1.26 -5.05 113.70 106.29 1uw0 s SER 41 Ca 0.00 -0.32 -0.00 0.00 0.70 0.00 0.00 55.95 56.33 1uw0 s SER 41 Cb 0.00 -1.24 -0.21 0.00 -1.71 0.00 0.00 66.02 62.86 1uw0 s SER 41 CO 0.00 0.03 0.06 -0.62 1.20 0.00 0.00 173.24 173.91 1uw0 n GLU 42 N -0.67 0.70 -0.35 5.44 1.02 -1.26 -4.33 120.64 121.18 1uw0 n GLU 42 Ca -0.08 0.19 0.03 0.00 -0.02 0.00 0.00 57.16 57.28 1uw0 n GLU 42 Cb 0.57 -1.61 0.19 0.00 -0.02 0.00 0.00 31.44 30.57 1uw0 n GLU 42 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 1uw0 h SER 43 N 0.03 1.01 -3.46 1.62 0.02 -2.01 -3.25 113.55 107.52 1uw0 h SER 43 Ca -0.50 0.01 -0.73 0.00 -0.84 0.00 0.00 61.79 59.73 1uw0 h SER 43 Cb 1.98 -0.21 -0.33 0.00 0.14 0.00 0.00 62.40 63.97 1uw0 h SER 43 CO -0.00 0.65 0.01 -0.83 -1.14 0.00 0.00 176.83 175.52 1uw0 s GLY 44 N -3.33 3.06 -0.00 -3.77 0.00 -1.26 -4.92 107.32 97.09 1uw0 s GLY 44 Ca -0.12 -3.79 -0.01 0.00 0.00 0.00 0.00 44.72 40.80 1uw0 s GLY 44 CO 0.81 1.22 0.33 -1.33 0.00 0.00 0.00 173.10 174.13 1uw0 h GLY 45 N 6.28 -0.03 -5.23 0.20 0.00 -1.77 -3.43 103.07 99.09 1uw0 h GLY 45 Ca 0.15 0.01 -0.68 0.00 0.00 0.00 0.00 47.33 46.81 1uw0 h GLY 45 CO 0.88 -0.01 -0.81 0.99 0.00 0.00 0.00 176.54 177.58 1uw0 s ASP 46 N -2.83 3.64 -0.04 0.19 1.11 -1.26 -2.65 116.67 114.82 1uw0 s ASP 46 Ca -0.00 -0.38 0.06 0.00 0.18 0.00 0.00 52.55 52.41 1uw0 s ASP 46 Cb 0.00 -1.19 -0.02 0.00 1.07 0.00 0.00 42.92 42.78 1uw0 s ASP 46 CO 0.01 0.23 -0.21 -0.04 1.18 0.00 0.00 175.17 176.34 1uw0 s MET 47 N -0.05 2.41 -0.15 8.23 -1.94 -1.26 -4.96 119.30 121.58 1uw0 s MET 47 Ca -0.05 -0.83 0.01 0.00 -1.71 0.00 0.00 55.69 53.12 1uw0 s MET 47 Cb -0.14 -2.22 0.00 0.00 2.01 0.00 0.00 34.83 34.48 1uw0 s MET 47 CO 0.04 0.53 -0.17 0.21 -0.01 0.00 0.00 175.02 175.62 1uw0 s LYS 48 N -0.51 3.17 -0.09 2.03 2.20 -1.25 -3.54 119.74 121.75 1uw0 s LYS 48 Ca 0.07 -0.78 0.02 0.00 -0.36 0.00 0.00 55.97 54.92 1uw0 s LYS 48 Cb -0.11 -2.57 -0.02 0.00 -1.51 0.00 0.00 37.83 33.62 1uw0 s LYS 48 CO 0.01 0.03 -0.15 -1.21 -0.36 0.00 0.00 175.35 173.67 1uw0 s GLU 49 N 0.77 2.94 -0.17 4.03 2.02 -1.22 -4.87 118.70 122.19 1uw0 s GLU 49 Ca -0.07 -0.71 -0.17 0.00 0.02 0.00 0.00 54.97 54.04 1uw0 s GLU 49 Cb -0.16 -2.47 -0.04 0.00 0.10 0.00 0.00 34.13 31.56 1uw0 s GLU 49 CO 0.00 0.40 0.44 -1.58 0.02 0.00 0.00 175.26 174.54 1uw0 s TRP 50 N -0.14 3.42 0.48 1.61 0.23 -1.26 -3.15 118.94 120.14 1uw0 s TRP 50 Ca -0.01 0.74 0.06 0.00 -2.03 0.00 0.00 56.10 54.85 1uw0 s TRP 50 Cb -0.14 -2.55 -0.01 0.00 0.03 0.00 0.00 33.47 30.81 1uw0 s TRP 50 CO 0.03 0.05 0.27 0.71 0.96 0.00 0.00 176.95 178.97 1uw0 s TYR 51 N 1.10 2.11 0.18 -1.98 2.02 -0.89 -3.02 117.35 116.87 1uw0 s TYR 51 Ca 0.22 -0.73 0.00 0.00 -0.37 0.00 0.00 57.07 56.19 1uw0 s TYR 51 Cb -0.15 -1.92 0.03 0.00 -0.40 0.00 0.00 41.96 39.53 1uw0 s TYR 51 CO 0.09 -0.12 0.24 0.72 -1.57 0.00 0.00 175.55 174.91 1uw0 n HIS 52 N -1.50 -3.26 0.07 2.71 8.25 -1.26 -3.14 115.22 117.09 1uw0 n HIS 52 Ca -0.03 -0.43 -0.23 0.00 -0.26 0.00 0.00 57.72 56.77 1uw0 n HIS 52 Cb 0.64 -0.18 -0.15 0.00 1.12 0.00 0.00 29.99 31.43 1uw0 n HIS 52 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1uw0 h ILE 53 N -0.42 1.11 0.00 1.59 1.08 -1.99 -3.16 117.51 115.72 1uw0 h ILE 53 Ca -0.08 -2.52 -0.12 0.00 -0.39 0.00 0.00 64.86 61.75 1uw0 h ILE 53 Cb 0.30 2.87 -0.02 0.00 -3.07 0.00 0.00 36.82 36.90 1uw0 h ILE 53 CO 0.09 0.79 -1.22 0.50 -0.69 0.00 0.00 178.15 177.61 1uw0 h LYS 54 N -0.06 0.00 -0.01 2.37 3.64 -1.96 -3.21 116.57 117.35 1uw0 h LYS 54 Ca -0.29 0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 58.86 1uw0 h LYS 54 Cb 1.96 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 33.80 1uw0 h LYS 54 CO 0.16 0.23 -0.89 0.00 -2.27 0.00 0.00 179.45 176.69 1uw0 h MET 56 N 0.23 0.52 0.04 0.00 4.05 -1.71 0.14 114.93 118.21 1uw0 h MET 56 Ca -0.11 -0.39 -0.24 0.00 -0.28 0.00 0.00 59.70 58.68 1uw0 h MET 56 Cb 1.56 0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 32.41 1uw0 h MET 56 CO 0.18 1.02 -1.14 0.74 0.23 0.00 0.00 176.91 177.93 1uw0 h PHE 57 N 0.37 0.16 0.06 1.39 0.04 -1.63 -2.59 116.94 114.74 1uw0 h PHE 57 Ca -0.02 -0.12 -0.24 0.00 2.80 0.00 0.00 57.97 60.39 1uw0 h PHE 57 Cb 1.25 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 39.39 1uw0 h PHE 57 CO 0.05 1.10 -1.08 1.49 -0.60 0.00 0.00 178.31 179.27 1uw0 h GLU 58 N 0.02 0.20 -0.06 1.51 4.81 -0.94 -2.44 114.58 117.68 1uw0 h GLU 58 Ca -0.07 -0.30 -0.16 0.00 -0.13 0.00 0.00 59.36 58.69 1uw0 h GLU 58 Cb 1.86 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 31.33 1uw0 h GLU 58 CO 0.15 1.10 -0.67 -0.22 -0.73 0.00 0.00 179.01 178.64 1uw0 h LYS 59 N 0.08 0.28 -0.04 1.92 3.11 -0.78 -0.22 116.57 120.91 1uw0 h LYS 59 Ca -0.08 -0.22 -0.25 0.00 -2.81 0.00 0.00 60.65 57.29 1uw0 h LYS 59 Cb 1.79 0.04 0.02 0.00 -1.00 0.00 0.00 32.23 33.08 1uw0 h LYS 59 CO 0.17 0.85 -0.96 1.25 -2.81 0.00 0.00 179.45 177.95 1uw0 h LEU 60 N 0.20 0.92 -0.64 5.20 5.85 -1.51 0.86 115.31 126.18 1uw0 h LEU 60 Ca -0.02 -0.71 -0.14 0.00 0.84 0.00 0.00 57.88 57.85 1uw0 h LEU 60 Cb 1.22 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 1uw0 h LEU 60 CO 0.11 1.50 -0.68 -0.08 -0.34 0.00 0.00 178.44 178.95 1uw0 h GLU 61 N 0.42 0.02 0.00 1.25 4.81 -1.44 -3.30 114.58 116.35 1uw0 h GLU 61 Ca -0.11 -0.02 -0.33 0.00 -0.13 0.00 0.00 59.36 58.77 1uw0 h GLU 61 Cb 1.61 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.93 1uw0 h GLU 61 CO 0.19 0.69 -2.03 -2.13 -0.73 0.00 0.00 179.01 175.00 1uw0 n ARG 62 N -3.74 0.66 -4.01 1.92 3.00 -0.10 -4.82 116.66 109.58 1uw0 n ARG 62 Ca -0.01 0.16 -0.31 0.00 -0.00 0.00 0.00 57.85 57.68 1uw0 n ARG 62 Cb 0.67 -1.66 -0.15 0.00 0.00 0.00 0.00 32.46 31.31 1uw0 n ARG 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1uw0 s ALA 63 N -2.55 2.47 -0.32 5.13 0.00 0.30 -5.05 121.76 121.74 1uw0 s ALA 63 Ca -0.08 -1.89 0.04 0.00 0.00 0.00 0.00 51.96 50.02 1uw0 s ALA 63 Cb 0.07 -1.67 0.09 0.00 0.00 0.00 0.00 23.12 21.61 1uw0 s ALA 63 CO 0.82 -1.36 0.01 0.50 0.00 0.00 0.00 175.76 175.73 1uw0 s ARG 64 N 1.14 1.70 -0.07 0.00 3.52 -1.26 -4.27 118.95 119.71 1uw0 s ARG 64 Ca -0.01 -1.73 0.00 0.00 -0.13 0.00 0.00 55.73 53.85 1uw0 s ARG 64 Cb -0.19 -3.13 -0.26 0.00 -1.56 0.00 0.00 34.95 29.81 1uw0 s ARG 64 CO -0.07 -0.84 0.55 0.00 -0.81 0.00 0.00 175.30 174.13 1uw0 h ALA 65 N 7.66 0.52 -3.35 6.12 0.00 -1.95 -3.49 119.26 124.77 1uw0 h ALA 65 Ca -0.08 -1.37 0.00 0.00 0.00 0.00 0.00 54.91 53.46 1uw0 h ALA 65 Cb 1.03 0.56 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1uw0 h ALA 65 CO 0.51 1.37 0.00 0.25 0.00 0.00 0.00 179.25 181.38 1uw0 n THR 66 N -3.33 0.00 -2.80 0.00 -2.24 -1.26 -5.08 114.28 99.56 1uw0 n THR 66 Ca -0.24 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.11 1uw0 n THR 66 Cb 1.05 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 69.24 1uw0 n THR 66 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1uw0 s THR 67 N -1.29 4.25 -0.16 4.28 -4.23 -1.26 -4.96 115.64 112.27 1uw0 s THR 67 Ca 0.00 -0.39 -0.04 0.00 -1.18 0.00 0.00 61.69 60.08 1uw0 s THR 67 Cb 0.00 -4.75 0.07 0.00 1.34 0.00 0.00 72.50 69.16 1uw0 s THR 67 CO 0.00 -1.55 0.19 -0.75 -0.54 0.00 0.00 174.62 171.97 1uw0 s LYS 68 N 4.22 0.12 -0.01 3.99 2.20 -1.26 -5.14 119.74 123.86 1uw0 s LYS 68 Ca 0.26 0.31 -0.00 0.00 -0.36 0.00 0.00 55.97 56.18 1uw0 s LYS 68 Cb -0.13 -0.94 0.01 0.00 -1.51 0.00 0.00 37.83 35.25 1uw0 s LYS 68 CO 0.08 -0.53 0.02 0.21 -0.36 0.00 0.00 175.35 174.77 1uw0 s LYS 69 N 2.29 0.01 -0.28 4.03 2.47 -1.26 -5.03 119.74 121.97 1uw0 s LYS 69 Ca 0.05 0.05 -0.04 0.00 -1.56 0.00 0.00 55.97 54.47 1uw0 s LYS 69 Cb -0.14 -0.03 0.03 0.00 -1.46 0.00 0.00 37.83 36.22 1uw0 s LYS 69 CO -0.09 -0.03 0.01 0.42 0.16 0.00 0.00 175.35 175.81 1uw0 s ILE 70 N 0.19 3.31 0.18 5.43 1.01 -1.26 -5.11 121.20 124.95 1uw0 s ILE 70 Ca -0.02 -0.99 0.07 0.00 0.00 0.00 0.00 60.65 59.72 1uw0 s ILE 70 Cb -0.02 -2.74 -0.04 0.00 0.01 0.00 0.00 42.46 39.67 1uw0 s ILE 70 CO -0.01 0.08 0.01 -1.61 0.00 0.00 0.00 174.94 173.42 1uw0 s GLU 71 N 1.37 2.44 0.63 2.79 2.02 -1.26 -4.87 118.70 121.82 1uw0 s GLU 71 Ca -0.00 -1.10 0.00 0.00 0.02 0.00 0.00 54.97 53.88 1uw0 s GLU 71 Cb -0.18 -2.37 0.00 0.00 0.10 0.00 0.00 34.13 31.68 1uw0 s GLU 71 CO -0.01 0.45 0.00 -0.25 0.02 0.00 0.00 175.26 175.47 1uw0 n ASP 72 N -0.20 -4.05 -1.96 -0.19 9.92 -1.26 -4.53 116.55 114.28 1uw0 n ASP 72 Ca -0.09 0.45 -0.13 0.00 -0.53 0.00 0.00 54.79 54.49 1uw0 n ASP 72 Cb 0.55 -1.37 0.06 0.00 -0.64 0.00 0.00 41.12 39.72 1uw0 n ASP 72 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1uw0 n LEU 73 N 0.00 3.62 -2.68 0.64 7.94 -1.26 -4.77 117.00 120.49 1uw0 n LEU 73 Ca 0.00 -4.08 -0.00 0.00 -1.11 0.00 0.00 56.01 50.82 1uw0 n LEU 73 Cb 0.19 -0.17 0.07 0.00 0.53 0.00 0.00 43.42 44.04 1uw0 n LEU 73 CO 0.00 1.67 0.17 0.35 -1.11 0.00 0.00 177.39 178.48 1uw0 n THR 74 N -0.68 0.84 -0.03 1.96 -2.24 -1.26 -4.84 114.28 108.03 1uw0 n THR 74 Ca 0.30 -2.24 -0.06 0.00 -2.27 0.00 0.00 64.05 59.77 1uw0 n THR 74 Cb 0.90 1.19 -0.02 0.00 -2.10 0.00 0.00 70.33 70.30 1uw0 n THR 74 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1uw0 n GLU 75 N -0.77 0.28 -3.07 -0.78 1.02 -1.26 -4.93 120.64 111.13 1uw0 n GLU 75 Ca -0.00 0.11 -0.17 0.00 -0.02 0.00 0.00 57.16 57.08 1uw0 n GLU 75 Cb 0.84 -0.98 -0.01 0.00 -0.02 0.00 0.00 31.44 31.27 1uw0 n GLU 75 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 1uw0 n LEU 76 N -3.94 -0.18 -3.80 -4.62 -0.00 -1.26 -5.11 117.00 98.08 1uw0 n LEU 76 Ca -0.10 -4.58 -0.12 0.00 -0.00 0.00 0.00 56.01 51.21 1uw0 n LEU 76 Cb 0.33 0.76 -0.12 0.00 -0.00 0.00 0.00 43.42 44.38 1uw0 n LEU 76 CO 0.09 2.19 -0.13 -1.83 -0.00 0.00 0.00 177.39 177.71 1uw0 s GLU 77 N -1.44 0.27 -1.24 1.47 1.03 -1.26 -3.54 118.70 113.99 1uw0 s GLU 77 Ca 0.35 0.23 -0.16 0.00 0.03 0.00 0.00 54.97 55.42 1uw0 s GLU 77 Cb 0.29 0.13 -0.03 0.00 -0.80 0.00 0.00 34.13 33.73 1uw0 s GLU 77 CO -0.09 -0.04 2.17 0.41 -1.33 0.00 0.00 175.26 176.38 1uw0 n GLY 78 N 2.81 3.82 0.11 -3.83 0.00 -1.25 -4.57 105.19 102.27 1uw0 n GLY 78 Ca -0.14 -1.47 0.05 0.00 0.00 0.00 0.00 46.02 44.46 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 6.53 0.00 -0.87 1.61 5.08 -1.88 -3.36 115.95 123.06 1uw0 h TRP 79 Ca 0.54 0.00 0.21 0.00 1.08 0.00 0.00 58.89 60.72 1uw0 h TRP 79 Cb 0.62 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 26.72 1uw0 h TRP 79 CO 1.43 0.35 0.59 1.49 -1.28 0.00 0.00 178.44 181.01 1uw0 h GLU 80 N 0.00 0.29 0.21 0.12 4.81 -1.95 -0.94 114.58 117.12 1uw0 h GLU 80 Ca -0.09 -0.02 -0.32 0.00 -0.13 0.00 0.00 59.36 58.80 1uw0 h GLU 80 Cb 1.35 -0.06 0.03 0.00 0.63 0.00 0.00 28.75 30.69 1uw0 h GLU 80 CO 0.03 0.19 -1.45 0.93 -0.73 0.00 0.00 179.01 177.98 1uw0 h GLU 81 N 0.30 0.45 -6.19 1.92 5.08 -1.97 -3.46 114.58 110.70 1uw0 h GLU 81 Ca 0.44 -0.76 -0.26 0.00 -1.00 0.00 0.00 59.36 57.77 1uw0 h GLU 81 Cb 1.25 0.28 0.15 0.00 0.50 0.00 0.00 28.75 30.93 1uw0 h GLU 81 CO -0.13 1.36 -0.38 1.28 -1.00 0.00 0.00 179.01 180.14 1uw0 n LEU 82 N -3.64 -1.38 -4.90 1.33 4.32 -0.36 -5.00 117.00 107.36 1uw0 n LEU 82 Ca -0.15 -0.40 -0.21 0.00 -0.02 0.00 0.00 56.01 55.23 1uw0 n LEU 82 Cb 1.08 -0.81 -0.03 0.00 -1.62 0.00 0.00 43.42 42.04 1uw0 n LEU 82 CO 0.58 -3.35 -0.09 -1.61 -1.22 0.00 0.00 177.39 171.70 1uw0 s GLU 83 N -3.60 3.18 0.18 3.23 0.41 -1.26 -4.95 118.70 115.90 1uw0 s GLU 83 Ca 0.41 -0.92 -0.12 0.00 -0.41 0.00 0.00 54.97 53.93 1uw0 s GLU 83 Cb -0.07 -2.73 0.10 0.00 -1.78 0.00 0.00 34.13 29.64 1uw0 s GLU 83 CO 0.39 0.39 1.82 -0.44 -0.49 0.00 0.00 175.26 176.93 1uw0 h ASP 84 N 1.30 0.75 0.05 -0.19 3.32 -1.94 0.31 116.42 120.02 1uw0 h ASP 84 Ca -0.50 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 56.48 1uw0 h ASP 84 Cb 1.24 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.60 1uw0 h ASP 84 CO 0.60 0.59 -0.03 -1.13 -1.72 0.00 0.00 179.24 177.56 1uw0 h ASN 85 N 0.84 -0.06 -0.74 6.45 -0.73 -2.00 0.36 115.58 119.70 1uw0 h ASN 85 Ca 0.22 -0.06 -0.04 0.00 1.87 0.00 0.00 56.30 58.30 1uw0 h ASN 85 Cb -0.02 0.02 -0.03 0.00 0.27 0.00 0.00 38.32 38.56 1uw0 h ASN 85 CO -0.04 0.02 0.32 -0.33 -0.37 0.00 0.00 177.43 177.02 1uw0 h GLU 86 N -0.14 1.09 -0.85 6.67 3.07 -1.92 -2.35 114.58 120.15 1uw0 h GLU 86 Ca -0.01 -0.18 0.01 0.00 -0.50 0.00 0.00 59.36 58.68 1uw0 h GLU 86 Cb 0.12 -0.18 -0.04 0.00 -0.84 0.00 0.00 28.75 27.80 1uw0 h GLU 86 CO 0.01 0.88 0.56 -0.22 -1.40 0.00 0.00 179.01 178.84 1uw0 h LYS 87 N 1.05 1.12 -0.64 2.33 3.64 -0.04 -1.98 116.57 122.05 1uw0 h LYS 87 Ca 0.25 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.49 1uw0 h LYS 87 Cb 0.18 -0.25 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 1uw0 h LYS 87 CO -0.02 0.75 0.11 1.49 -2.27 0.00 0.00 179.45 179.51 1uw0 h GLU 88 N 1.15 1.04 -0.56 1.90 4.81 -0.42 -1.73 114.58 120.77 1uw0 h GLU 88 Ca 0.31 -0.26 -0.11 0.00 -0.13 0.00 0.00 59.36 59.17 1uw0 h GLU 88 Cb -0.13 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.11 1uw0 h GLU 88 CO -0.07 0.95 -0.08 0.37 -0.73 0.00 0.00 179.01 179.46 1uw0 h GLN 89 N 0.98 1.04 -0.60 1.92 -0.00 -1.04 -2.73 115.11 114.69 1uw0 h GLN 89 Ca 0.20 -0.37 -0.10 0.00 -0.00 0.00 0.00 58.65 58.38 1uw0 h GLN 89 Cb 0.41 -0.08 -0.02 0.00 0.00 0.00 0.00 27.48 27.79 1uw0 h GLN 89 CO 0.01 1.06 -0.00 0.82 0.00 0.00 0.00 178.83 180.72 1uw0 h ILE 90 N 0.93 1.26 -0.81 2.39 2.04 -1.17 -2.76 117.51 119.40 1uw0 h ILE 90 Ca 0.15 -1.15 0.02 0.00 1.00 0.00 0.00 64.86 64.88 1uw0 h ILE 90 Cb 0.64 0.80 -0.04 0.00 -0.74 0.00 0.00 36.82 37.48 1uw0 h ILE 90 CO 0.04 0.42 0.53 0.71 0.00 0.00 0.00 178.15 179.86 1uw0 h THR 91 N 0.97 1.17 -1.00 -0.27 1.35 -1.14 -1.89 112.91 112.11 1uw0 h THR 91 Ca 0.17 -0.36 0.05 0.00 -0.55 0.00 0.00 66.41 65.72 1uw0 h THR 91 Cb 0.56 0.03 -0.06 0.00 -1.73 0.00 0.00 68.15 66.94 1uw0 h THR 91 CO 0.03 0.19 0.65 -0.61 -0.25 0.00 0.00 175.52 175.53 1uw0 h GLN 92 N 1.05 1.20 0.02 4.72 4.15 -1.19 -2.13 115.11 122.94 1uw0 h GLN 92 Ca 0.31 -0.07 0.01 0.00 0.77 0.00 0.00 58.65 59.66 1uw0 h GLN 92 Cb -0.06 -0.27 -0.01 0.00 0.21 0.00 0.00 27.48 27.35 1uw0 h GLN 92 CO -0.08 0.79 -0.05 0.45 -1.93 0.00 0.00 178.83 178.01 1uw0 h HIS 93 N 1.23 -0.14 -0.87 3.99 3.86 -1.31 -2.05 115.15 119.88 1uw0 h HIS 93 Ca 0.41 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.65 1uw0 h HIS 93 Cb 0.05 0.06 -0.05 0.00 1.06 0.00 0.00 27.41 28.53 1uw0 h HIS 93 CO -0.00 -0.09 0.57 0.82 0.86 0.00 0.00 177.93 180.09 1uw0 h ILE 94 N -0.11 1.15 -0.86 2.45 2.04 -1.39 -1.64 117.51 119.16 1uw0 h ILE 94 Ca 0.02 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.50 1uw0 h ILE 94 Cb 0.12 -0.03 -0.04 0.00 -0.74 0.00 0.00 36.82 36.13 1uw0 h ILE 94 CO -0.04 0.20 0.53 0.00 0.00 0.00 0.00 178.15 178.84 1uw0 h ALA 95 N 1.49 1.31 -0.39 1.87 0.00 -0.87 -2.46 119.26 120.21 1uw0 h ALA 95 Ca 0.34 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.17 1uw0 h ALA 95 Cb 0.01 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1uw0 h ALA 95 CO -0.10 0.60 0.25 0.22 0.00 0.00 0.00 179.25 180.22 1uw0 h ASP 96 N 1.18 0.43 -0.59 0.00 1.82 -0.62 -2.01 116.42 116.64 1uw0 h ASP 96 Ca 0.31 -0.01 0.07 0.00 -0.39 0.00 0.00 57.03 57.02 1uw0 h ASP 96 Cb -0.07 -0.10 -0.04 0.00 0.68 0.00 0.00 39.33 39.80 1uw0 h ASP 96 CO -0.06 0.31 0.39 -0.07 -1.61 0.00 0.00 179.24 178.21 1uw0 h LEU 97 N 0.52 0.44 -5.07 2.28 4.07 -1.25 -2.46 115.31 113.84 1uw0 h LEU 97 Ca 0.15 0.00 -0.72 0.00 0.08 0.00 0.00 57.88 57.39 1uw0 h LEU 97 Cb -0.05 -0.09 -0.25 0.00 1.08 0.00 0.00 40.66 41.35 1uw0 h LEU 97 CO -0.04 0.28 0.98 -1.20 -1.08 0.00 0.00 178.44 177.38 1uw0 n SER 98 N -4.48 7.33 -3.67 -0.43 7.64 -0.76 -4.87 113.62 114.38 1uw0 n SER 98 Ca 0.09 -3.68 -0.18 0.00 1.01 0.00 0.00 58.87 56.11 1uw0 n SER 98 Cb 0.29 -1.12 -0.16 0.00 -1.01 0.00 0.00 64.21 62.20 1uw0 n SER 98 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1uw0 s SER 99 N -0.79 0.85 -0.70 6.43 1.04 -0.93 -4.96 113.70 114.64 1uw0 s SER 99 Ca 0.52 0.25 -0.05 0.00 0.48 0.00 0.00 55.95 57.15 1uw0 s SER 99 Cb 0.39 0.14 0.01 0.00 0.10 0.00 0.00 66.02 66.66 1uw0 s SER 99 CO -0.34 -0.24 0.66 1.17 0.98 0.00 0.00 173.24 175.46 1uw0 n LYS 100 N 5.28 -1.57 0.02 4.02 3.00 -1.26 -4.98 118.16 122.66 1uw0 n LYS 100 Ca -0.05 1.38 -0.02 0.00 -0.00 0.00 0.00 58.31 59.62 1uw0 n LYS 100 Cb 0.50 -4.53 -0.01 0.00 0.00 0.00 0.00 35.03 31.00 1uw0 n LYS 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1uw0 n ALA 101 N -1.69 2.73 -2.55 3.14 0.00 -1.26 -5.08 120.51 115.81 1uw0 n ALA 101 Ca -0.08 -0.12 -0.26 0.00 0.00 0.00 0.00 53.44 52.98 1uw0 n ALA 101 Cb 0.56 0.29 -0.09 0.00 0.00 0.00 0.00 19.45 20.21 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 -2.11 2.89 0.45 0.00 0.00 -1.26 -5.13 121.76 116.61 1uw0 s ALA 102 Ca -0.04 -1.57 -0.15 0.00 0.00 0.00 0.00 51.96 50.19 1uw0 s ALA 102 Cb 0.01 -0.63 -0.08 0.00 0.00 0.00 0.00 23.12 22.42 1uw0 s ALA 102 CO 0.06 0.41 0.90 0.20 0.00 0.00 0.00 175.76 177.32 1uw0 s GLY 103 N -3.01 2.11 -0.40 0.00 0.00 -1.26 -5.04 107.32 99.72 1uw0 s GLY 103 Ca 0.26 0.10 0.04 0.00 0.00 0.00 0.00 44.72 45.12 1uw0 s GLY 103 CO 0.15 0.35 0.12 -0.51 0.00 0.00 0.00 173.10 173.21 1uw0 s THR 104 N -2.42 2.38 -1.05 0.90 -4.23 -1.26 -5.02 115.64 104.95 1uw0 s THR 104 Ca 0.57 -2.69 -0.21 0.00 -1.18 0.00 0.00 61.69 58.18 1uw0 s THR 104 Cb -0.10 -2.72 -0.09 0.00 1.34 0.00 0.00 72.50 70.93 1uw0 s THR 104 CO 0.27 -0.67 1.94 -0.81 -0.54 0.00 0.00 174.62 174.81 1uw0 n PRO 105 N 3.84 1.86 -3.90 3.99 -0.04 -1.26 -4.87 135.00 134.63 1uw0 n PRO 105 Ca 0.04 -2.30 -0.11 0.00 -0.04 0.00 0.00 63.50 61.09 1uw0 n PRO 105 Cb 0.38 -3.31 -0.12 0.00 -0.04 0.00 0.00 33.50 30.42 1uw0 n PRO 105 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1uw0 s LYS 106 N 5.25 0.26 0.09 0.54 1.02 -1.26 -5.08 119.74 120.55 1uw0 s LYS 106 Ca 0.60 -0.27 0.00 0.00 0.02 0.00 0.00 55.97 56.31 1uw0 s LYS 106 Cb 0.08 0.10 0.00 0.00 -0.52 0.00 0.00 37.83 37.49 1uw0 s LYS 106 CO 0.10 -0.05 0.00 1.63 -0.92 0.00 0.00 175.35 176.11 1uw0 n LYS 107 N 2.15 0.00 -2.81 1.68 4.76 -1.26 -4.97 118.16 117.71 1uw0 n LYS 107 Ca -0.19 0.00 -0.01 0.00 -2.87 0.00 0.00 58.31 55.24 1uw0 n LYS 107 Cb 0.57 -0.23 0.06 0.00 -1.84 0.00 0.00 35.03 33.59 1uw0 n LYS 107 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 1uw0 n LYS 108 N -3.11 1.64 -4.40 1.97 3.00 -1.26 -5.08 118.16 110.93 1uw0 n LYS 108 Ca 0.00 -3.27 -0.25 0.00 -0.00 0.00 0.00 58.31 54.80 1uw0 n LYS 108 Cb 0.00 -1.38 -0.17 0.00 0.00 0.00 0.00 35.03 33.48 1uw0 n LYS 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1uw0 s ALA 109 N -3.36 1.22 0.05 3.14 0.00 -1.26 -5.14 121.76 116.40 1uw0 s ALA 109 Ca 0.25 -0.41 0.05 0.00 0.00 0.00 0.00 51.96 51.85 1uw0 s ALA 109 Cb 0.34 -0.63 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 1uw0 s ALA 109 CO -0.04 -0.01 -0.13 0.54 0.00 0.00 0.00 175.76 176.11 1uw0 s VAL 110 N 0.91 1.05 0.01 0.00 0.11 -1.26 -5.05 120.40 116.18 1uw0 s VAL 110 Ca -0.10 -1.11 0.02 0.00 -2.93 0.00 0.00 61.98 57.86 1uw0 s VAL 110 Cb -0.15 -0.99 -0.01 0.00 -1.53 0.00 0.00 36.38 33.70 1uw0 s VAL 110 CO 0.01 -0.12 -0.06 0.68 -3.33 0.00 0.00 175.10 172.28 1uw0 s VAL 111 N -1.05 0.48 -0.22 2.04 -7.23 -1.26 -5.14 120.40 108.03 1uw0 s VAL 111 Ca -0.01 -0.50 0.00 0.00 -1.81 0.00 0.00 61.98 59.66 1uw0 s VAL 111 Cb -0.09 -0.46 0.03 0.00 0.56 0.00 0.00 36.38 36.42 1uw0 s VAL 111 CO 0.02 -0.03 -0.12 -1.10 -0.31 0.00 0.00 175.10 173.56 1uw0 s GLN 112 N -0.58 2.82 -0.11 4.82 -0.21 -1.26 -5.09 119.66 120.05 1uw0 s GLN 112 Ca -0.01 -0.96 -0.01 0.00 0.02 0.00 0.00 55.36 54.39 1uw0 s GLN 112 Cb -0.05 -2.82 0.03 0.00 1.00 0.00 0.00 33.01 31.18 1uw0 s GLN 112 CO 0.00 -0.35 -0.03 0.00 -2.12 0.00 0.00 175.29 172.79 1uw0 s ALA 113 N 1.28 1.09 -0.20 6.09 0.00 -1.26 -5.12 121.76 123.64 1uw0 s ALA 113 Ca 0.01 -0.44 0.01 0.00 0.00 0.00 0.00 51.96 51.54 1uw0 s ALA 113 Cb -0.16 -0.90 0.03 0.00 0.00 0.00 0.00 23.12 22.09 1uw0 s ALA 113 CO -0.08 -0.54 -0.17 0.21 0.00 0.00 0.00 175.76 175.18 1uw0 s LYS 114 N 1.81 2.81 -0.03 0.00 2.20 -1.26 -5.11 119.74 120.16 1uw0 s LYS 114 Ca 0.04 -0.96 0.05 0.00 -0.36 0.00 0.00 55.97 54.74 1uw0 s LYS 114 Cb -0.13 -2.67 -0.01 0.00 -1.51 0.00 0.00 37.83 33.51 1uw0 s LYS 114 CO -0.07 -0.30 -0.18 -0.51 -0.36 0.00 0.00 175.35 173.92 1uw0 s LEU 115 N 1.25 1.99 -0.01 5.43 1.43 -1.26 -5.14 118.68 122.37 1uw0 s LEU 115 Ca 0.01 -0.35 0.07 0.00 -1.03 0.00 0.00 54.13 52.84 1uw0 s LEU 115 Cb -0.15 -0.97 -0.02 0.00 0.03 0.00 0.00 46.19 45.08 1uw0 s LEU 115 CO -0.11 0.20 -0.24 -0.89 0.23 0.00 0.00 176.35 175.55 1uw0 s THR 116 N -0.26 1.87 0.00 5.49 2.01 -1.26 -5.38 115.64 118.12 1uw0 s THR 116 Ca 0.03 -1.06 0.00 0.00 0.31 0.00 0.00 61.69 60.97 1uw0 s THR 116 Cb -0.09 -1.56 0.00 0.00 0.01 0.00 0.00 72.50 70.86 1uw0 s THR 116 CO 0.00 0.48 0.48 0.35 -0.69 0.00 0.00 174.62 175.25