#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uw0 n ALA 2 N 0.00 2.49 -2.39 -5.12 0.00 -1.26 -4.91 120.51 109.32 1uw0 n ALA 2 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 1uw0 n ALA 2 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 1uw0 n ALA 2 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1uw0 s GLU 3 N -2.00 1.47 -0.11 0.00 2.02 -1.26 -5.08 118.70 113.74 1uw0 s GLU 3 Ca 0.00 -1.76 0.03 0.00 0.02 0.00 0.00 54.97 53.26 1uw0 s GLU 3 Cb 0.00 -0.86 -0.00 0.00 0.10 0.00 0.00 34.13 33.36 1uw0 s GLU 3 CO 0.00 -0.06 -0.21 -1.14 0.02 0.00 0.00 175.26 173.86 1uw0 s GLN 4 N -3.82 3.11 -0.05 1.61 2.00 -1.26 -4.55 119.66 116.71 1uw0 s GLN 4 Ca 0.30 -0.83 -0.02 0.00 -2.00 0.00 0.00 55.36 52.81 1uw0 s GLN 4 Cb 0.06 -2.37 0.04 0.00 0.80 0.00 0.00 33.01 31.53 1uw0 s GLN 4 CO 0.11 0.20 0.09 1.03 -0.50 0.00 0.00 175.29 176.22 1uw0 s ARG 5 N 0.32 -0.01 -0.01 1.67 0.52 -1.23 -5.02 118.95 115.19 1uw0 s ARG 5 Ca -0.16 0.35 0.06 0.00 -0.52 0.00 0.00 55.73 55.46 1uw0 s ARG 5 Cb -0.17 -0.31 -0.03 0.00 0.52 0.00 0.00 34.95 34.96 1uw0 s ARG 5 CO 0.08 -0.24 -0.20 -0.06 0.02 0.00 0.00 175.30 174.90 1uw0 s PHE 6 N 1.62 2.51 0.15 -0.53 0.08 -1.26 -0.47 117.98 120.10 1uw0 s PHE 6 Ca -0.03 -0.30 0.07 0.00 0.12 0.00 0.00 56.93 56.79 1uw0 s PHE 6 Cb -0.12 -1.53 -0.04 0.00 -0.57 0.00 0.00 43.02 40.76 1uw0 s PHE 6 CO -0.04 0.12 -0.15 0.00 -0.10 0.00 0.00 175.22 175.05 1uw0 s VAL 8 N -2.39 3.49 0.06 0.00 1.01 0.42 0.72 120.40 123.71 1uw0 s VAL 8 Ca 0.14 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1uw0 s VAL 8 Cb -0.04 -2.59 -0.03 0.00 0.00 0.00 0.00 36.38 33.72 1uw0 s VAL 8 CO 0.05 0.42 -0.05 -0.62 0.00 0.00 0.00 175.10 174.89 1uw0 s ASP 9 N 1.43 0.72 0.14 3.32 -1.08 0.07 -4.14 116.67 117.12 1uw0 s ASP 9 Ca 0.05 -0.83 0.03 0.00 -0.52 0.00 0.00 52.55 51.27 1uw0 s ASP 9 Cb -0.14 0.12 -0.04 0.00 -1.46 0.00 0.00 42.92 41.40 1uw0 s ASP 9 CO -0.02 -0.43 0.23 -0.31 0.52 0.00 0.00 175.17 175.16 1uw0 s TYR 10 N -2.94 3.41 0.07 -5.34 2.02 -1.26 -0.94 117.35 112.37 1uw0 s TYR 10 Ca 0.01 0.10 -0.18 0.00 -0.37 0.00 0.00 57.07 56.64 1uw0 s TYR 10 Cb 0.01 -1.64 -0.07 0.00 -0.40 0.00 0.00 41.96 39.86 1uw0 s TYR 10 CO -0.05 0.53 0.53 0.00 -1.57 0.00 0.00 175.55 174.99 1uw0 s ALA 11 N -1.70 3.61 0.21 3.71 0.00 -1.07 -4.89 121.76 121.63 1uw0 s ALA 11 Ca 0.34 -0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.25 1uw0 s ALA 11 Cb -0.11 -2.57 0.00 0.00 0.00 0.00 0.00 23.12 20.44 1uw0 s ALA 11 CO 0.27 0.43 0.00 1.17 0.00 0.00 0.00 175.76 177.63 1uw0 n LYS 12 N 1.60 0.00 -3.67 0.00 4.81 -1.26 -3.36 118.16 116.27 1uw0 n LYS 12 Ca -0.10 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.04 1uw0 n LYS 12 Cb 0.51 -0.10 -0.15 0.00 0.02 0.00 0.00 35.03 35.31 1uw0 n LYS 12 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1uw0 s ARG 13 N -2.00 0.59 0.00 1.64 1.81 -1.26 -4.65 118.95 115.07 1uw0 s ARG 13 Ca 0.00 -0.98 0.00 0.00 -1.72 0.00 0.00 55.73 53.03 1uw0 s ARG 13 Cb 0.00 -1.75 0.00 0.00 -0.45 0.00 0.00 34.95 32.75 1uw0 s ARG 13 CO 0.00 -1.01 0.00 0.41 -0.68 0.00 0.00 175.30 174.02 1uw0 n GLY 14 N 4.87 4.67 3.27 -3.53 0.00 -1.26 -5.09 105.19 108.11 1uw0 n GLY 14 Ca -0.02 -0.74 -0.25 0.00 0.00 0.00 0.00 46.02 45.00 1uw0 n GLY 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uw0 s THR 15 N -0.86 1.70 -0.02 2.61 -4.23 -1.26 -4.39 115.64 109.18 1uw0 s THR 15 Ca 0.00 -1.31 -0.29 0.00 -1.18 0.00 0.00 61.69 58.91 1uw0 s THR 15 Cb 0.00 -1.50 0.09 0.00 1.34 0.00 0.00 72.50 72.43 1uw0 s THR 15 CO 0.00 0.14 0.77 0.00 -0.54 0.00 0.00 174.62 174.99 1uw0 s ALA 16 N -0.90 -1.78 -0.10 3.99 0.00 -1.11 -4.92 121.76 116.93 1uw0 s ALA 16 Ca 0.07 1.15 -0.29 0.00 0.00 0.00 0.00 51.96 52.89 1uw0 s ALA 16 Cb -0.09 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.09 1uw0 s ALA 16 CO 0.03 -0.50 1.47 0.20 0.00 0.00 0.00 175.76 176.96 1uw0 s GLY 17 N -1.73 1.59 0.38 0.00 0.00 -1.26 0.19 107.32 106.49 1uw0 s GLY 17 Ca -0.03 0.72 -0.28 0.00 0.00 0.00 0.00 44.72 45.13 1uw0 s GLY 17 CO -0.00 2.78 1.44 0.00 0.00 0.00 0.00 173.10 177.32 1uw0 s LYS 19 N -2.09 3.66 -1.38 0.00 2.47 -0.96 -3.54 119.74 117.88 1uw0 s LYS 19 Ca 0.54 -0.01 -0.02 0.00 -1.56 0.00 0.00 55.97 54.92 1uw0 s LYS 19 Cb -0.49 -2.78 0.02 0.00 -1.46 0.00 0.00 37.83 33.12 1uw0 s LYS 19 CO 0.63 0.40 0.64 1.63 0.16 0.00 0.00 175.35 178.81 1uw0 n LYS 20 N -0.11 -4.35 0.00 4.03 4.01 -1.26 -4.70 118.16 115.77 1uw0 n LYS 20 Ca -0.02 0.53 0.00 0.00 -0.51 0.00 0.00 58.31 58.31 1uw0 n LYS 20 Cb 0.52 -4.99 0.00 0.00 -0.51 0.00 0.00 35.03 30.06 1uw0 n LYS 20 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1uw0 n LYS 22 N -1.74 -0.17 -2.44 0.00 4.81 -1.23 -4.83 118.16 112.57 1uw0 n LYS 22 Ca 0.00 0.62 0.01 0.00 -0.87 0.00 0.00 58.31 58.07 1uw0 n LYS 22 Cb 0.00 -1.90 0.00 0.00 0.02 0.00 0.00 35.03 33.15 1uw0 n LYS 22 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1uw0 n GLU 23 N -0.82 0.06 -4.73 1.64 2.13 -1.26 -5.00 120.64 112.66 1uw0 n GLU 23 Ca 0.00 -0.24 -0.29 0.00 0.66 0.00 0.00 57.16 57.29 1uw0 n GLU 23 Cb 0.31 0.39 -0.14 0.00 0.27 0.00 0.00 31.44 32.27 1uw0 n GLU 23 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1uw0 s LYS 24 N -2.01 1.65 -0.05 5.31 1.02 -1.26 -1.35 119.74 123.05 1uw0 s LYS 24 Ca 0.09 -1.18 -0.01 0.00 0.02 0.00 0.00 55.97 54.89 1uw0 s LYS 24 Cb -0.00 -1.92 -0.03 0.00 -0.52 0.00 0.00 37.83 35.35 1uw0 s LYS 24 CO -0.00 0.48 0.01 0.42 -0.92 0.00 0.00 175.35 175.34 1uw0 s ILE 25 N -0.89 4.28 0.05 2.17 1.01 0.13 -4.78 121.20 123.16 1uw0 s ILE 25 Ca 0.12 -0.37 -0.02 0.00 0.00 0.00 0.00 60.65 60.38 1uw0 s ILE 25 Cb -0.10 -2.84 -0.03 0.00 0.01 0.00 0.00 42.46 39.50 1uw0 s ILE 25 CO 0.03 0.52 0.01 -0.69 0.00 0.00 0.00 174.94 174.81 1uw0 s VAL 26 N -0.97 0.19 0.21 2.92 1.01 -1.26 -2.73 120.40 119.77 1uw0 s VAL 26 Ca 0.16 -1.54 -0.31 0.00 0.00 0.00 0.00 61.98 60.28 1uw0 s VAL 26 Cb -0.11 -1.26 -0.15 0.00 0.00 0.00 0.00 36.38 34.86 1uw0 s VAL 26 CO 0.05 -0.85 1.15 1.17 0.00 0.00 0.00 175.10 176.62 1uw0 n LYS 27 N 0.37 1.31 0.00 2.72 0.00 -1.26 -3.04 118.16 118.26 1uw0 n LYS 27 Ca -0.16 0.46 0.00 0.00 0.00 0.00 0.00 58.31 58.61 1uw0 n LYS 27 Cb 0.60 -1.94 0.00 0.00 0.00 0.00 0.00 35.03 33.69 1uw0 n LYS 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1uw0 n GLY 28 N 1.83 1.03 3.08 3.14 0.00 -1.21 -4.99 105.19 108.06 1uw0 n GLY 28 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.90 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 1.27 0.36 1.61 0.11 -1.17 -4.99 120.40 115.59 1uw0 s VAL 29 Ca 0.00 -0.60 -0.26 0.00 -2.93 0.00 0.00 61.98 58.19 1uw0 s VAL 29 Cb 0.00 -1.13 -0.09 0.00 -1.53 0.00 0.00 36.38 33.63 1uw0 s VAL 29 CO 0.00 0.38 1.11 0.00 -3.33 0.00 0.00 175.10 173.26 1uw0 s ARG 31 N -2.08 0.66 -0.01 0.00 1.70 -0.11 -4.33 118.95 114.79 1uw0 s ARG 31 Ca 0.53 -0.72 -0.00 0.00 -0.47 0.00 0.00 55.73 55.07 1uw0 s ARG 31 Cb -0.28 0.27 -0.04 0.00 -0.57 0.00 0.00 34.95 34.33 1uw0 s ARG 31 CO 0.36 -0.18 0.06 0.42 -1.08 0.00 0.00 175.30 174.88 1uw0 s ILE 32 N -2.72 4.61 -0.11 4.99 1.01 -1.11 -0.75 121.20 127.12 1uw0 s ILE 32 Ca -0.04 -0.44 -0.03 0.00 0.00 0.00 0.00 60.65 60.14 1uw0 s ILE 32 Cb -0.00 -3.09 -0.03 0.00 0.01 0.00 0.00 42.46 39.34 1uw0 s ILE 32 CO -0.05 0.36 0.02 -0.83 0.00 0.00 0.00 174.94 174.45 1uw0 s GLY 33 N -1.67 1.89 -0.16 6.18 0.00 0.22 -0.53 107.32 113.25 1uw0 s GLY 33 Ca 0.22 -0.78 0.01 0.00 0.00 0.00 0.00 44.72 44.17 1uw0 s GLY 33 CO 0.13 -0.41 -0.18 1.25 0.00 0.00 0.00 173.10 173.89 1uw0 s LYS 34 N -0.62 3.12 -0.38 2.90 2.20 -0.77 0.11 119.74 126.31 1uw0 s LYS 34 Ca 0.10 -0.79 -0.16 0.00 -0.36 0.00 0.00 55.97 54.76 1uw0 s LYS 34 Cb -0.12 -2.58 0.00 0.00 -1.51 0.00 0.00 37.83 33.62 1uw0 s LYS 34 CO 0.02 -0.06 0.42 0.08 -0.36 0.00 0.00 175.35 175.45 1uw0 s VAL 35 N 0.96 5.11 -0.18 4.02 1.01 0.39 -3.02 120.40 128.69 1uw0 s VAL 35 Ca -0.03 -0.07 0.01 0.00 0.00 0.00 0.00 61.98 61.89 1uw0 s VAL 35 Cb -0.15 -3.93 0.02 0.00 0.00 0.00 0.00 36.38 32.32 1uw0 s VAL 35 CO -0.04 -0.25 -0.19 -0.69 0.00 0.00 0.00 175.10 173.94 1uw0 s VAL 36 N 2.13 2.02 0.41 2.92 1.01 -0.60 -3.56 120.40 124.71 1uw0 s VAL 36 Ca 0.13 -0.97 -0.24 0.00 0.00 0.00 0.00 61.98 60.90 1uw0 s VAL 36 Cb -0.17 -1.85 -0.09 0.00 0.00 0.00 0.00 36.38 34.27 1uw0 s VAL 36 CO 0.13 0.48 1.09 -2.16 0.00 0.00 0.00 175.10 174.64 1uw0 s PRO 37 N 1.30 4.07 0.02 2.72 0.04 -1.26 -1.65 135.00 140.24 1uw0 s PRO 37 Ca 0.04 1.62 -0.00 0.00 0.04 0.00 0.00 61.00 62.70 1uw0 s PRO 37 Cb -0.14 -2.55 -0.04 0.00 0.04 0.00 0.00 34.50 31.82 1uw0 s PRO 37 CO -0.12 -0.25 0.12 1.21 0.04 0.00 0.00 177.00 178.01 1uw0 s ASN 38 N -1.44 5.92 -1.00 6.66 2.47 -1.07 0.66 114.94 127.13 1uw0 s ASN 38 Ca 0.59 0.19 -0.19 0.00 0.42 0.00 0.00 52.86 53.86 1uw0 s ASN 38 Cb -0.25 -1.74 -0.09 0.00 -1.45 0.00 0.00 41.25 37.72 1uw0 s ASN 38 CO 0.31 0.24 2.02 -0.81 -3.72 0.00 0.00 177.10 175.14 1uw0 n PRO 39 N 0.89 1.95 0.19 0.43 -0.04 -1.26 -3.96 135.00 133.20 1uw0 n PRO 39 Ca -0.11 -2.11 0.00 0.00 -0.04 0.00 0.00 63.50 61.25 1uw0 n PRO 39 Cb 0.52 -3.05 0.00 0.00 -0.04 0.00 0.00 33.50 30.93 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 7.15 -3.89 -4.83 0.54 -0.00 -1.26 -5.06 117.46 110.12 1uw0 n PHE 40 Ca 0.50 1.17 -0.29 0.00 -0.00 0.00 0.00 57.45 58.83 1uw0 n PHE 40 Cb 0.40 2.78 -0.14 0.00 -0.00 0.00 0.00 39.48 42.52 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 -2.97 2.98 -0.05 -2.13 0.15 -1.25 -5.04 113.70 105.38 1uw0 s SER 41 Ca 0.00 -0.58 0.21 0.00 0.70 0.00 0.00 55.95 56.29 1uw0 s SER 41 Cb 0.00 -0.26 -0.30 0.00 -1.71 0.00 0.00 66.02 63.74 1uw0 s SER 41 CO 0.00 0.23 0.43 -1.84 1.20 0.00 0.00 173.24 173.26 1uw0 n GLU 42 N 1.78 0.66 0.02 5.44 0.00 -1.26 -3.77 120.64 123.51 1uw0 n GLU 42 Ca -0.17 -0.14 -0.22 0.00 0.00 0.00 0.00 57.16 56.63 1uw0 n GLU 42 Cb 0.52 -1.54 -0.14 0.00 0.00 0.00 0.00 31.44 30.28 1uw0 n GLU 42 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.13 177.90 1uw0 h SER 43 N 0.00 0.45 -2.11 -1.84 0.02 -2.00 -3.41 113.55 104.65 1uw0 h SER 43 Ca -0.12 -0.93 -0.57 0.00 -0.84 0.00 0.00 61.79 59.34 1uw0 h SER 43 Cb 1.27 -0.15 -0.41 0.00 0.14 0.00 0.00 62.40 63.25 1uw0 h SER 43 CO 0.01 1.82 -0.87 0.61 -1.14 0.00 0.00 176.83 177.25 1uw0 n GLY 44 N 1.93 4.09 2.37 -3.77 0.00 -1.26 -4.97 105.19 103.58 1uw0 n GLY 44 Ca -0.30 -2.20 -0.26 0.00 0.00 0.00 0.00 46.02 43.27 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 0.77 2.72 3.00 -0.02 0.00 -1.25 -4.82 105.19 105.60 1uw0 n GLY 45 Ca 0.26 -1.60 -0.13 0.00 0.00 0.00 0.00 46.02 44.55 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 -0.66 -0.15 0.01 1.61 1.01 -1.26 -2.61 116.67 114.61 1uw0 s ASP 46 Ca 0.33 0.32 0.07 0.00 0.71 0.00 0.00 52.55 53.98 1uw0 s ASP 46 Cb 0.08 0.29 -0.03 0.00 1.01 0.00 0.00 42.92 44.27 1uw0 s ASP 46 CO -0.15 -0.09 -0.20 -0.32 0.21 0.00 0.00 175.17 174.62 1uw0 s MET 47 N 0.46 2.13 -0.14 8.23 1.75 -0.66 -4.92 119.30 126.15 1uw0 s MET 47 Ca -0.03 -0.93 0.00 0.00 -1.25 0.00 0.00 55.69 53.48 1uw0 s MET 47 Cb -0.05 -2.17 0.02 0.00 2.84 0.00 0.00 34.83 35.48 1uw0 s MET 47 CO -0.02 0.56 -0.13 0.21 -0.65 0.00 0.00 175.02 174.98 1uw0 s LYS 48 N -1.10 2.19 0.11 4.11 2.20 -1.25 -1.56 119.74 124.43 1uw0 s LYS 48 Ca 0.13 -0.52 0.10 0.00 -0.36 0.00 0.00 55.97 55.31 1uw0 s LYS 48 Cb -0.10 -2.01 -0.04 0.00 -1.51 0.00 0.00 37.83 34.17 1uw0 s LYS 48 CO 0.03 -0.22 -0.22 -1.21 -0.36 0.00 0.00 175.35 173.37 1uw0 s GLU 49 N 1.45 1.64 0.46 4.03 0.41 -1.17 -4.87 118.70 120.65 1uw0 s GLU 49 Ca 0.03 -1.24 -0.01 0.00 -0.41 0.00 0.00 54.97 53.35 1uw0 s GLU 49 Cb -0.13 -2.02 -0.01 0.00 -1.78 0.00 0.00 34.13 30.19 1uw0 s GLU 49 CO -0.09 0.47 0.70 -1.58 -0.49 0.00 0.00 175.26 174.27 1uw0 s TRP 50 N -1.08 3.32 0.26 1.61 0.23 -1.26 -1.85 118.94 120.16 1uw0 s TRP 50 Ca 0.16 0.39 0.02 0.00 -2.03 0.00 0.00 56.10 54.64 1uw0 s TRP 50 Cb -0.10 -2.31 -0.03 0.00 0.03 0.00 0.00 33.47 31.06 1uw0 s TRP 50 CO 0.08 -0.34 0.20 0.71 0.96 0.00 0.00 176.95 178.56 1uw0 s TYR 51 N -2.61 1.39 0.39 -1.98 1.51 0.31 -2.28 117.35 114.09 1uw0 s TYR 51 Ca 0.48 -1.48 0.04 0.00 -1.01 0.00 0.00 57.07 55.09 1uw0 s TYR 51 Cb -0.10 -0.60 0.04 0.00 -0.11 0.00 0.00 41.96 41.19 1uw0 s TYR 51 CO 0.40 -0.75 0.32 0.72 -1.11 0.00 0.00 175.55 175.13 1uw0 n HIS 52 N -0.42 -1.03 -0.08 2.71 8.25 -1.26 -2.74 115.22 120.65 1uw0 n HIS 52 Ca 0.04 -1.64 -0.08 0.00 -0.26 0.00 0.00 57.72 55.78 1uw0 n HIS 52 Cb 0.64 -0.33 -0.03 0.00 1.12 0.00 0.00 29.99 31.40 1uw0 n HIS 52 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1uw0 n ILE 53 N -1.47 1.41 0.08 1.59 2.08 -1.26 -3.77 119.36 118.02 1uw0 n ILE 53 Ca -0.00 0.18 -0.22 0.00 0.56 0.00 0.00 62.75 63.27 1uw0 n ILE 53 Cb 0.44 -2.32 -0.15 0.00 -0.75 0.00 0.00 39.64 36.86 1uw0 n ILE 53 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 1uw0 h LYS 54 N -0.96 0.38 0.00 0.38 3.11 -1.97 -1.11 116.57 116.40 1uw0 h LYS 54 Ca 0.00 -0.64 -0.03 0.00 -2.81 0.00 0.00 60.65 57.17 1uw0 h LYS 54 Cb 0.83 0.24 -0.00 0.00 -1.00 0.00 0.00 32.23 32.30 1uw0 h LYS 54 CO 0.00 1.31 -0.12 0.00 -2.81 0.00 0.00 179.45 177.82 1uw0 h MET 56 N 0.00 0.00 -0.03 0.00 1.85 -1.65 -3.31 114.93 111.80 1uw0 h MET 56 Ca -0.00 0.00 0.01 0.00 -0.61 0.00 0.00 59.70 59.10 1uw0 h MET 56 Cb 0.25 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 32.28 1uw0 h MET 56 CO 0.02 0.57 0.02 0.74 -0.40 0.00 0.00 176.91 177.86 1uw0 h PHE 57 N -1.00 0.00 -0.87 1.39 -1.00 -1.10 -1.23 116.94 113.13 1uw0 h PHE 57 Ca -0.06 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.71 1uw0 h PHE 57 Cb 0.69 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.21 1uw0 h PHE 57 CO 0.10 0.00 0.53 1.49 -1.61 0.00 0.00 178.31 178.81 1uw0 h GLU 58 N 0.00 1.17 -0.47 1.51 4.57 0.06 -0.82 114.58 120.60 1uw0 h GLU 58 Ca 0.01 -0.10 -0.12 0.00 -1.18 0.00 0.00 59.36 57.97 1uw0 h GLU 58 Cb 0.06 -0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 28.39 1uw0 h GLU 58 CO -0.00 0.81 -0.18 -0.22 -1.18 0.00 0.00 179.01 178.24 1uw0 h LYS 59 N 1.19 0.95 -0.79 1.92 3.64 -1.31 -2.90 116.57 119.28 1uw0 h LYS 59 Ca 0.31 -0.39 -0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1uw0 h LYS 59 Cb -0.06 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.68 1uw0 h LYS 59 CO -0.06 1.06 0.49 -0.07 -2.27 0.00 0.00 179.45 178.60 1uw0 h LEU 60 N 0.80 0.95 -1.66 5.20 4.07 -1.27 -1.04 115.31 122.36 1uw0 h LEU 60 Ca 0.11 -0.06 0.10 0.00 0.08 0.00 0.00 57.88 58.12 1uw0 h LEU 60 Cb 0.75 -0.24 -0.04 0.00 1.08 0.00 0.00 40.66 42.21 1uw0 h LEU 60 CO 0.06 0.73 0.40 -0.08 -1.08 0.00 0.00 178.44 178.47 1uw0 h GLU 61 N 1.08 0.37 -0.81 1.13 4.81 -0.98 -0.34 114.58 119.85 1uw0 h GLU 61 Ca 0.29 -0.02 -0.42 0.00 -0.13 0.00 0.00 59.36 59.07 1uw0 h GLU 61 Cb -0.05 -0.08 -0.25 0.00 0.63 0.00 0.00 28.75 28.99 1uw0 h GLU 61 CO -0.05 0.24 0.44 0.54 -0.73 0.00 0.00 179.01 179.45 1uw0 n ARG 62 N -4.47 2.16 -4.11 1.92 1.74 -0.46 -4.98 116.66 108.46 1uw0 n ARG 62 Ca 0.10 -3.07 -0.24 0.00 -0.77 0.00 0.00 57.85 53.87 1uw0 n ARG 62 Cb 0.39 -2.08 -0.07 0.00 -1.02 0.00 0.00 32.46 29.69 1uw0 n ARG 62 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1uw0 s ALA 63 N -3.28 3.56 0.74 7.54 0.00 -0.14 -5.03 121.76 125.15 1uw0 s ALA 63 Ca 0.53 -2.02 -0.15 0.00 0.00 0.00 0.00 51.96 50.33 1uw0 s ALA 63 Cb 0.46 -0.49 0.04 0.00 0.00 0.00 0.00 23.12 23.13 1uw0 s ALA 63 CO 0.08 -0.11 1.19 1.03 0.00 0.00 0.00 175.76 177.95 1uw0 s ARG 64 N -3.89 2.12 -0.02 0.00 0.52 -1.26 -4.96 118.95 111.46 1uw0 s ARG 64 Ca 0.40 1.70 0.03 0.00 -0.52 0.00 0.00 55.73 57.33 1uw0 s ARG 64 Cb 0.02 -1.84 -0.25 0.00 0.52 0.00 0.00 34.95 33.40 1uw0 s ARG 64 CO 0.23 -1.83 0.75 0.00 0.02 0.00 0.00 175.30 174.46 1uw0 h ALA 65 N -0.40 0.49 -1.04 2.13 0.00 -1.99 -3.35 119.26 115.10 1uw0 h ALA 65 Ca -0.47 -1.27 0.28 0.00 0.00 0.00 0.00 54.91 53.46 1uw0 h ALA 65 Cb 1.29 0.39 -0.06 0.00 0.00 0.00 0.00 17.79 19.40 1uw0 h ALA 65 CO 0.50 1.34 0.71 1.79 0.00 0.00 0.00 179.25 183.59 1uw0 h THR 66 N 0.04 0.51 -3.73 0.00 1.35 -2.04 -3.36 112.91 105.68 1uw0 h THR 66 Ca -0.27 -0.06 -0.65 0.00 -0.55 0.00 0.00 66.41 64.88 1uw0 h THR 66 Cb 1.99 0.31 -0.21 0.00 -1.73 0.00 0.00 68.15 68.51 1uw0 h THR 66 CO 0.12 0.03 -0.59 -0.89 -0.25 0.00 0.00 175.52 173.94 1uw0 s THR 67 N -5.20 4.65 0.03 6.82 2.01 -1.26 -5.09 115.64 117.60 1uw0 s THR 67 Ca -0.07 -0.06 0.07 0.00 0.31 0.00 0.00 61.69 61.95 1uw0 s THR 67 Cb 0.23 -3.19 -0.03 0.00 0.01 0.00 0.00 72.50 69.52 1uw0 s THR 67 CO 0.79 0.31 -0.20 -0.54 -0.69 0.00 0.00 174.62 174.30 1uw0 s LYS 68 N 1.66 2.06 0.05 4.92 -0.14 -1.26 -4.85 119.74 122.18 1uw0 s LYS 68 Ca 0.07 -0.98 0.01 0.00 -1.36 0.00 0.00 55.97 53.70 1uw0 s LYS 68 Cb -0.15 -2.16 -0.03 0.00 -1.68 0.00 0.00 37.83 33.81 1uw0 s LYS 68 CO 0.06 0.54 -0.05 0.15 -0.76 0.00 0.00 175.35 175.30 1uw0 s LYS 69 N -1.31 0.53 -0.16 1.68 1.02 -1.26 -5.02 119.74 115.23 1uw0 s LYS 69 Ca 0.14 -0.93 -0.07 0.00 0.02 0.00 0.00 55.97 55.13 1uw0 s LYS 69 Cb -0.10 -0.01 0.03 0.00 -0.52 0.00 0.00 37.83 37.22 1uw0 s LYS 69 CO 0.04 -0.04 0.14 -0.89 -0.92 0.00 0.00 175.35 173.69 1uw0 n ILE 70 N 0.90 -9.56 -4.90 2.17 5.41 -1.26 -5.00 119.36 107.12 1uw0 n ILE 70 Ca -0.19 1.91 -0.33 0.00 1.00 0.00 0.00 62.75 65.14 1uw0 n ILE 70 Cb 0.57 -5.53 -0.14 0.00 -0.71 0.00 0.00 39.64 33.84 1uw0 n ILE 70 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1uw0 s GLU 71 N -0.71 2.80 0.40 0.38 0.41 -1.26 -5.04 118.70 115.68 1uw0 s GLU 71 Ca -0.16 -0.72 0.00 0.00 -0.41 0.00 0.00 54.97 53.68 1uw0 s GLU 71 Cb 0.01 -2.44 0.00 0.00 -1.78 0.00 0.00 34.13 29.93 1uw0 s GLU 71 CO 0.58 0.46 0.00 -3.47 -0.49 0.00 0.00 175.26 172.34 1uw0 n ASP 72 N 2.78 -5.22 -4.03 -0.19 -0.08 -1.26 -4.48 116.55 104.08 1uw0 n ASP 72 Ca -0.17 0.82 -0.33 0.00 -1.51 0.00 0.00 54.79 53.60 1uw0 n ASP 72 Cb 0.52 -2.46 -0.09 0.00 2.34 0.00 0.00 41.12 41.43 1uw0 n ASP 72 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 1uw0 s LEU 73 N 0.00 5.23 0.03 -2.67 2.96 -1.26 -4.73 118.68 118.25 1uw0 s LEU 73 Ca 0.00 -3.70 0.00 0.00 -0.22 0.00 0.00 54.13 50.21 1uw0 s LEU 73 Cb 0.00 -1.80 0.00 0.00 0.50 0.00 0.00 46.19 44.89 1uw0 s LEU 73 CO 0.00 -0.16 0.00 0.35 -1.32 0.00 0.00 176.35 175.22 1uw0 n THR 74 N 2.29 0.00 -0.29 3.68 -2.24 -1.26 -4.96 114.28 111.50 1uw0 n THR 74 Ca 0.19 0.00 0.18 0.00 -2.27 0.00 0.00 64.05 62.15 1uw0 n THR 74 Cb 0.36 0.00 0.45 0.00 -2.10 0.00 0.00 70.33 69.04 1uw0 n THR 74 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1uw0 h GLU 75 N 0.00 0.50 -7.14 -0.78 5.08 -1.85 -3.41 114.58 106.98 1uw0 h GLU 75 Ca 0.00 -0.03 -0.53 0.00 -1.00 0.00 0.00 59.36 57.80 1uw0 h GLU 75 Cb 0.00 -0.11 0.14 0.00 0.50 0.00 0.00 28.75 29.28 1uw0 h GLU 75 CO 0.00 0.33 0.43 -0.51 -1.00 0.00 0.00 179.01 178.27 1uw0 s LEU 76 N -9.73 3.46 -0.32 1.33 1.02 -1.26 -4.97 118.68 108.21 1uw0 s LEU 76 Ca -0.09 2.38 -0.11 0.00 0.02 0.00 0.00 54.13 56.33 1uw0 s LEU 76 Cb 0.24 -4.59 -0.02 0.00 0.02 0.00 0.00 46.19 41.84 1uw0 s LEU 76 CO 0.79 -1.98 0.19 -0.70 0.02 0.00 0.00 176.35 174.67 1uw0 s GLU 77 N -3.67 3.49 0.00 1.70 2.12 -0.97 -4.47 118.70 116.90 1uw0 s GLU 77 Ca 0.76 -0.63 0.00 0.00 0.36 0.00 0.00 54.97 55.46 1uw0 s GLU 77 Cb -0.30 -3.66 0.00 0.00 0.26 0.00 0.00 34.13 30.42 1uw0 s GLU 77 CO 0.40 -0.39 0.00 0.41 -0.54 0.00 0.00 175.26 175.15 1uw0 n GLY 78 N 5.04 3.42 0.43 -1.50 0.00 -1.26 -0.44 105.19 110.88 1uw0 n GLY 78 Ca -0.13 -0.46 0.24 0.00 0.00 0.00 0.00 46.02 45.66 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 0.24 -1.00 1.61 5.08 -1.78 -0.24 115.95 119.86 1uw0 h TRP 79 Ca 0.00 0.01 0.08 0.00 1.08 0.00 0.00 58.89 60.06 1uw0 h TRP 79 Cb 0.00 -0.07 -0.07 0.00 -3.00 0.00 0.00 29.16 26.02 1uw0 h TRP 79 CO 0.00 0.06 0.64 1.49 -1.28 0.00 0.00 178.44 179.35 1uw0 h GLU 80 N 0.18 1.10 -0.58 0.12 4.22 -1.93 -1.81 114.58 115.88 1uw0 h GLU 80 Ca 0.44 -0.07 -0.08 0.00 0.08 0.00 0.00 59.36 59.74 1uw0 h GLU 80 Cb 1.45 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 1uw0 h GLU 80 CO -0.09 0.73 0.06 1.49 -2.18 0.00 0.00 179.01 179.02 1uw0 h GLU 81 N 1.13 0.98 -6.45 1.92 4.57 -1.40 -3.45 114.58 111.88 1uw0 h GLU 81 Ca 0.45 -0.28 -0.50 0.00 -1.18 0.00 0.00 59.36 57.84 1uw0 h GLU 81 Cb 0.24 -0.10 0.24 0.00 -0.16 0.00 0.00 28.75 28.96 1uw0 h GLU 81 CO -0.19 0.95 -1.42 1.28 -1.18 0.00 0.00 179.01 178.45 1uw0 n LEU 82 N -4.28 -2.54 -4.92 1.64 4.32 -0.68 -4.97 117.00 105.58 1uw0 n LEU 82 Ca 0.03 0.07 -0.26 0.00 -0.02 0.00 0.00 56.01 55.82 1uw0 n LEU 82 Cb 0.30 -0.90 0.01 0.00 -1.62 0.00 0.00 43.42 41.21 1uw0 n LEU 82 CO 0.43 -3.62 0.41 -1.61 -1.22 0.00 0.00 177.39 171.78 1uw0 s GLU 83 N -2.96 3.37 0.32 3.23 2.02 -1.26 -4.79 118.70 118.63 1uw0 s GLU 83 Ca 0.49 0.03 0.03 0.00 0.02 0.00 0.00 54.97 55.55 1uw0 s GLU 83 Cb -0.11 -2.41 0.62 0.00 0.10 0.00 0.00 34.13 32.33 1uw0 s GLU 83 CO 0.69 -0.27 1.90 0.22 0.02 0.00 0.00 175.26 177.82 1uw0 h ASP 84 N 0.22 0.83 -0.24 -0.19 3.58 -1.95 0.88 116.42 119.55 1uw0 h ASP 84 Ca -0.47 0.02 -0.19 0.00 0.42 0.00 0.00 57.03 56.81 1uw0 h ASP 84 Cb 1.22 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 42.12 1uw0 h ASP 84 CO 0.61 0.50 -0.59 0.78 -2.88 0.00 0.00 179.24 177.66 1uw0 h ASN 85 N 0.93 0.94 0.16 2.28 2.35 -1.99 -0.24 115.58 120.00 1uw0 h ASN 85 Ca 0.41 -0.56 -0.19 0.00 -0.55 0.00 0.00 56.30 55.41 1uw0 h ASN 85 Cb 0.36 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.45 1uw0 h ASN 85 CO -0.17 1.33 -0.74 -0.33 -1.65 0.00 0.00 177.43 175.87 1uw0 h GLU 86 N 0.59 0.50 -0.31 0.81 4.39 -1.73 -2.69 114.58 116.14 1uw0 h GLU 86 Ca -0.00 -0.40 -0.14 0.00 0.34 0.00 0.00 59.36 59.15 1uw0 h GLU 86 Cb 1.20 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.93 1uw0 h GLU 86 CO 0.13 1.03 -0.39 -0.22 -1.16 0.00 0.00 179.01 178.40 1uw0 h LYS 87 N 0.34 0.73 -0.68 2.33 3.64 0.79 -3.02 116.57 120.70 1uw0 h LYS 87 Ca -0.03 -0.38 -0.07 0.00 -1.27 0.00 0.00 60.65 58.90 1uw0 h LYS 87 Cb 1.32 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 33.12 1uw0 h LYS 87 CO 0.13 0.99 0.16 1.49 -2.27 0.00 0.00 179.45 179.96 1uw0 h GLU 88 N 0.60 1.09 -0.42 1.90 4.81 -1.00 -2.58 114.58 118.99 1uw0 h GLU 88 Ca 0.05 -0.26 0.01 0.00 -0.13 0.00 0.00 59.36 59.03 1uw0 h GLU 88 Cb 0.93 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 30.15 1uw0 h GLU 88 CO 0.09 0.97 0.28 0.37 -0.73 0.00 0.00 179.01 179.98 1uw0 h GLN 89 N 1.04 0.53 -0.69 1.92 4.15 -1.36 -2.09 115.11 118.61 1uw0 h GLN 89 Ca 0.21 -0.03 -0.08 0.00 0.77 0.00 0.00 58.65 59.53 1uw0 h GLN 89 Cb 0.37 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.92 1uw0 h GLN 89 CO 0.00 0.35 0.13 0.82 -1.93 0.00 0.00 178.83 178.20 1uw0 h ILE 90 N 0.55 1.26 -0.29 2.39 2.04 -1.37 -0.88 117.51 121.21 1uw0 h ILE 90 Ca 0.16 -1.03 -0.01 0.00 1.00 0.00 0.00 64.86 64.98 1uw0 h ILE 90 Cb -0.04 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 1uw0 h ILE 90 CO -0.03 0.39 0.15 0.71 0.00 0.00 0.00 178.15 179.37 1uw0 h THR 91 N 1.06 1.13 -0.81 -0.27 1.35 -1.33 -1.70 112.91 112.34 1uw0 h THR 91 Ca 0.21 -0.36 -0.02 0.00 -0.55 0.00 0.00 66.41 65.69 1uw0 h THR 91 Cb 0.43 0.85 -0.04 0.00 -1.73 0.00 0.00 68.15 67.65 1uw0 h THR 91 CO 0.01 0.14 0.43 1.56 -0.25 0.00 0.00 175.52 177.41 1uw0 h GLN 92 N 0.35 1.13 -0.24 4.72 4.20 -1.32 0.15 115.11 124.10 1uw0 h GLN 92 Ca 0.10 -0.14 0.03 0.00 0.06 0.00 0.00 58.65 58.71 1uw0 h GLN 92 Cb 0.08 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 27.61 1uw0 h GLN 92 CO -0.02 0.84 0.05 1.25 -0.67 0.00 0.00 178.83 180.28 1uw0 h HIS 93 N 1.14 0.08 -0.41 2.96 2.76 -0.56 0.75 115.15 121.86 1uw0 h HIS 93 Ca 0.28 0.01 -0.16 0.00 -2.20 0.00 0.00 60.37 58.31 1uw0 h HIS 93 Cb 0.05 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.00 1uw0 h HIS 93 CO 0.01 0.02 -0.36 0.82 -1.30 0.00 0.00 177.93 177.12 1uw0 h ILE 94 N 0.14 1.27 -0.50 6.26 2.04 -0.96 -2.69 117.51 123.07 1uw0 h ILE 94 Ca 0.11 -1.53 -0.03 0.00 1.00 0.00 0.00 64.86 64.41 1uw0 h ILE 94 Cb 0.11 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 1uw0 h ILE 94 CO -0.15 0.52 0.17 0.00 0.00 0.00 0.00 178.15 178.69 1uw0 h ALA 95 N 0.79 1.36 -0.46 1.87 0.00 -0.13 -0.72 119.26 121.98 1uw0 h ALA 95 Ca 0.07 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1uw0 h ALA 95 Cb 0.95 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1uw0 h ALA 95 CO 0.09 0.47 -0.08 -0.44 0.00 0.00 0.00 179.25 179.29 1uw0 h ASP 96 N 0.72 0.81 -0.06 0.00 3.32 0.72 -2.12 116.42 119.81 1uw0 h ASP 96 Ca 0.17 -0.24 -0.24 0.00 0.02 0.00 0.00 57.03 56.74 1uw0 h ASP 96 Cb 0.19 -0.22 0.02 0.00 0.22 0.00 0.00 39.33 39.54 1uw0 h ASP 96 CO -0.01 0.92 -0.89 0.25 -1.72 0.00 0.00 179.24 177.79 1uw0 h LEU 97 N 0.75 0.89 -0.57 1.55 5.85 -1.12 -3.25 115.31 119.41 1uw0 h LEU 97 Ca 0.13 -0.70 -0.00 0.00 0.84 0.00 0.00 57.88 58.15 1uw0 h LEU 97 Cb 0.57 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 1uw0 h LEU 97 CO 0.04 1.46 0.34 -1.28 -0.34 0.00 0.00 178.44 178.65 1uw0 h SER 98 N 0.40 0.69 -2.90 1.25 0.87 -1.06 -3.42 113.55 109.38 1uw0 h SER 98 Ca -0.10 -0.06 -0.30 0.00 -1.23 0.00 0.00 61.79 60.10 1uw0 h SER 98 Cb 1.54 -0.17 -0.36 0.00 -0.44 0.00 0.00 62.40 62.97 1uw0 h SER 98 CO 0.18 0.55 -0.63 -0.55 -0.53 0.00 0.00 176.83 175.85 1uw0 s SER 99 N -5.81 0.98 0.03 6.23 0.15 -0.80 -5.04 113.70 109.43 1uw0 s SER 99 Ca -0.13 0.15 -0.03 0.00 0.70 0.00 0.00 55.95 56.64 1uw0 s SER 99 Cb 0.13 0.33 -0.01 0.00 -1.71 0.00 0.00 66.02 64.75 1uw0 s SER 99 CO 0.76 -0.27 -0.06 1.17 1.20 0.00 0.00 173.24 176.04 1uw0 n LYS 100 N 5.32 0.09 -4.20 5.44 4.81 -1.23 -4.46 118.16 123.94 1uw0 n LYS 100 Ca -0.05 0.04 -0.25 0.00 -0.87 0.00 0.00 58.31 57.17 1uw0 n LYS 100 Cb 0.50 -0.65 -0.06 0.00 0.02 0.00 0.00 35.03 34.83 1uw0 n LYS 100 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1uw0 n ALA 101 N -3.54 0.44 -2.79 3.14 0.00 -1.26 -5.09 120.51 111.40 1uw0 n ALA 101 Ca -0.04 -1.88 -0.15 0.00 0.00 0.00 0.00 53.44 51.37 1uw0 n ALA 101 Cb 0.21 1.15 0.01 0.00 0.00 0.00 0.00 19.45 20.81 1uw0 n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uw0 n ALA 102 N -1.46 3.35 -1.00 0.00 0.00 -1.26 -5.11 120.51 115.04 1uw0 n ALA 102 Ca -0.16 -3.46 0.00 0.00 0.00 0.00 0.00 53.44 49.82 1uw0 n ALA 102 Cb 0.54 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 19.12 1uw0 n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uw0 n GLY 103 N -0.04 -1.81 2.76 0.00 0.00 -1.26 -5.06 105.19 99.77 1uw0 n GLY 103 Ca 0.19 -1.51 -0.24 0.00 0.00 0.00 0.00 46.02 44.46 1uw0 n GLY 103 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1uw0 s THR 104 N -0.52 0.40 0.65 2.61 2.01 -1.26 -5.14 115.64 114.40 1uw0 s THR 104 Ca 0.00 -0.08 -0.14 0.00 0.31 0.00 0.00 61.69 61.78 1uw0 s THR 104 Cb 0.00 -0.68 -0.01 0.00 0.01 0.00 0.00 72.50 71.83 1uw0 s THR 104 CO 0.00 0.11 1.08 -2.16 -0.69 0.00 0.00 174.62 172.96 1uw0 s PRO 105 N 1.95 2.96 0.05 4.92 0.04 -1.26 -5.01 135.00 138.64 1uw0 s PRO 105 Ca 0.03 1.24 -0.02 0.00 0.04 0.00 0.00 61.00 62.30 1uw0 s PRO 105 Cb -0.14 -1.98 -0.01 0.00 0.04 0.00 0.00 34.50 32.42 1uw0 s PRO 105 CO -0.06 -1.11 -0.03 1.63 0.04 0.00 0.00 177.00 177.47 1uw0 n LYS 106 N -2.48 0.05 -4.95 4.56 5.02 -1.26 -5.04 118.16 114.06 1uw0 n LYS 106 Ca 0.09 0.02 -0.32 0.00 -2.02 0.00 0.00 58.31 56.08 1uw0 n LYS 106 Cb 0.53 -0.59 -0.16 0.00 -0.02 0.00 0.00 35.03 34.79 1uw0 n LYS 106 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1uw0 s LYS 107 N -2.07 3.20 0.03 1.97 -0.14 -1.26 -5.01 119.74 116.45 1uw0 s LYS 107 Ca -0.03 -0.79 -0.02 0.00 -1.36 0.00 0.00 55.97 53.77 1uw0 s LYS 107 Cb 0.01 -2.47 -0.01 0.00 -1.68 0.00 0.00 37.83 33.68 1uw0 s LYS 107 CO 0.04 0.17 -0.05 1.63 -0.76 0.00 0.00 175.35 176.38 1uw0 n LYS 108 N 3.60 0.07 -4.38 1.68 5.02 -1.26 -5.09 118.16 117.81 1uw0 n LYS 108 Ca -0.19 0.03 -0.25 0.00 -2.02 0.00 0.00 58.31 55.88 1uw0 n LYS 108 Cb 0.53 -0.63 -0.09 0.00 -0.02 0.00 0.00 35.03 34.82 1uw0 n LYS 108 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1uw0 s ALA 109 N -2.11 3.17 0.06 7.82 0.00 -1.26 -5.15 121.76 124.29 1uw0 s ALA 109 Ca -0.04 -2.00 0.05 0.00 0.00 0.00 0.00 51.96 49.96 1uw0 s ALA 109 Cb 0.01 -0.29 -0.03 0.00 0.00 0.00 0.00 23.12 22.81 1uw0 s ALA 109 CO 0.06 0.06 -0.14 0.54 0.00 0.00 0.00 175.76 176.28 1uw0 s VAL 110 N -2.54 1.10 0.01 0.00 0.11 -1.26 -5.15 120.40 112.67 1uw0 s VAL 110 Ca 0.35 -1.16 0.06 0.00 -2.93 0.00 0.00 61.98 58.30 1uw0 s VAL 110 Cb 0.01 -1.03 -0.03 0.00 -1.53 0.00 0.00 36.38 33.80 1uw0 s VAL 110 CO 0.19 -0.12 -0.19 -0.69 -3.33 0.00 0.00 175.10 170.96 1uw0 s VAL 111 N -1.07 2.72 -0.13 2.04 1.01 -1.26 -5.12 120.40 118.59 1uw0 s VAL 111 Ca -0.00 -1.07 0.02 0.00 0.00 0.00 0.00 61.98 60.92 1uw0 s VAL 111 Cb -0.09 -2.09 -0.00 0.00 0.00 0.00 0.00 36.38 34.19 1uw0 s VAL 111 CO 0.02 0.44 -0.18 -1.10 0.00 0.00 0.00 175.10 174.27 1uw0 s GLN 112 N -1.13 3.19 0.00 2.72 -0.21 -1.26 -5.12 119.66 117.85 1uw0 s GLN 112 Ca 0.13 -0.78 0.02 0.00 0.02 0.00 0.00 55.36 54.75 1uw0 s GLN 112 Cb -0.10 -2.50 -0.01 0.00 1.00 0.00 0.00 33.01 31.40 1uw0 s GLN 112 CO 0.03 0.12 -0.07 0.00 -2.12 0.00 0.00 175.29 173.26 1uw0 s ALA 113 N 0.52 0.54 -0.39 6.09 0.00 -1.26 -5.12 121.76 122.14 1uw0 s ALA 113 Ca -0.12 -0.34 0.01 0.00 0.00 0.00 0.00 51.96 51.51 1uw0 s ALA 113 Cb -0.16 -0.11 0.11 0.00 0.00 0.00 0.00 23.12 22.95 1uw0 s ALA 113 CO 0.04 0.11 0.15 0.15 0.00 0.00 0.00 175.76 176.22 1uw0 s LYS 114 N -0.34 1.78 -0.15 0.00 3.01 -1.26 -5.08 119.74 117.70 1uw0 s LYS 114 Ca 0.01 -1.93 0.00 0.00 -1.01 0.00 0.00 55.97 53.04 1uw0 s LYS 114 Cb -0.03 -3.40 -0.00 0.00 -1.01 0.00 0.00 37.83 33.38 1uw0 s LYS 114 CO -0.00 -1.02 -0.16 -0.51 0.51 0.00 0.00 175.35 174.17 1uw0 s LEU 115 N 0.88 2.46 0.11 3.17 1.43 -1.26 -5.12 118.68 120.35 1uw0 s LEU 115 Ca 0.11 -0.47 0.10 0.00 -1.03 0.00 0.00 54.13 52.83 1uw0 s LEU 115 Cb -0.21 -1.56 -0.04 0.00 0.03 0.00 0.00 46.19 44.41 1uw0 s LEU 115 CO -0.06 0.09 -0.23 0.42 0.23 0.00 0.00 176.35 176.80 1uw0 s THR 116 N 0.80 2.49 -0.19 5.49 -4.23 -1.26 -5.36 115.64 113.37 1uw0 s THR 116 Ca -0.06 -1.61 0.02 0.00 -1.18 0.00 0.00 61.69 58.86 1uw0 s THR 116 Cb -0.15 -2.11 0.01 0.00 1.34 0.00 0.00 72.50 71.59 1uw0 s THR 116 CO 0.00 0.13 0.55 0.35 -0.54 0.00 0.00 174.62 175.11