#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 3.58 0.16 -5.12 0.00 -1.26 -5.10 121.76 114.02 1uw0 s ALA 2 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.23 1uw0 s ALA 2 Cb 0.00 0.38 0.00 0.00 0.00 0.00 0.00 23.12 23.50 1uw0 s ALA 2 CO 0.00 -0.17 0.00 0.39 0.00 0.00 0.00 175.76 175.98 1uw0 n GLU 3 N -1.11 0.00 -4.17 0.00 1.02 -1.26 -5.06 120.64 110.06 1uw0 n GLU 3 Ca -0.13 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 56.85 1uw0 n GLU 3 Cb 0.66 -0.34 -0.13 0.00 -0.02 0.00 0.00 31.44 31.61 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 -2.00 0.55 0.15 3.49 -0.21 -1.26 -4.34 119.66 116.04 1uw0 s GLN 4 Ca 0.00 -0.45 0.09 0.00 0.02 0.00 0.00 55.36 55.02 1uw0 s GLN 4 Cb 0.00 -0.46 -0.04 0.00 1.00 0.00 0.00 33.01 33.51 1uw0 s GLN 4 CO 0.00 0.11 -0.15 1.03 -2.12 0.00 0.00 175.29 174.16 1uw0 s ARG 5 N -0.72 1.87 -0.07 2.91 0.52 -0.43 -4.96 118.95 118.06 1uw0 s ARG 5 Ca -0.02 -1.27 -0.05 0.00 -0.52 0.00 0.00 55.73 53.87 1uw0 s ARG 5 Cb -0.05 -2.10 0.03 0.00 0.52 0.00 0.00 34.95 33.35 1uw0 s ARG 5 CO 0.00 0.45 0.18 -0.06 0.02 0.00 0.00 175.30 175.90 1uw0 s PHE 6 N -1.46 -0.22 0.20 -0.53 0.08 -1.26 -0.71 117.98 114.08 1uw0 s PHE 6 Ca 0.21 0.54 -0.15 0.00 0.12 0.00 0.00 56.93 57.66 1uw0 s PHE 6 Cb -0.09 0.03 0.01 0.00 -0.57 0.00 0.00 43.02 42.40 1uw0 s PHE 6 CO 0.12 -0.14 0.46 0.00 -0.10 0.00 0.00 175.22 175.56 1uw0 s VAL 8 N -3.92 5.19 -0.40 0.00 -7.23 -1.26 -1.21 120.40 111.57 1uw0 s VAL 8 Ca 0.13 0.13 -0.01 0.00 -1.81 0.00 0.00 61.98 60.42 1uw0 s VAL 8 Cb 0.00 -3.47 0.11 0.00 0.56 0.00 0.00 36.38 33.58 1uw0 s VAL 8 CO -0.01 0.27 0.17 -1.81 -0.31 0.00 0.00 175.10 173.42 1uw0 s ASP 9 N 1.70 5.10 0.81 4.85 1.11 0.20 -4.29 116.67 126.15 1uw0 s ASP 9 Ca 0.07 -2.13 -0.15 0.00 0.18 0.00 0.00 52.55 50.52 1uw0 s ASP 9 Cb -0.16 -1.77 0.00 0.00 1.07 0.00 0.00 42.92 42.06 1uw0 s ASP 9 CO 0.10 -0.48 0.56 -1.22 1.18 0.00 0.00 175.17 175.30 1uw0 n TYR 10 N 4.41 -0.80 -3.20 4.23 4.01 -1.26 -3.68 117.16 120.87 1uw0 n TYR 10 Ca 0.00 0.31 -0.42 0.00 -0.16 0.00 0.00 57.90 57.63 1uw0 n TYR 10 Cb 0.41 -1.89 -0.07 0.00 -0.31 0.00 0.00 39.34 37.47 1uw0 n TYR 10 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1uw0 s ALA 11 N -2.10 3.43 -0.26 -0.72 0.00 -1.02 -4.88 121.76 116.20 1uw0 s ALA 11 Ca 0.63 -1.13 0.19 0.00 0.00 0.00 0.00 51.96 51.65 1uw0 s ALA 11 Cb -0.29 -3.13 0.45 0.00 0.00 0.00 0.00 23.12 20.15 1uw0 s ALA 11 CO 0.60 -1.46 1.27 1.63 0.00 0.00 0.00 175.76 177.80 1uw0 n LYS 12 N 5.91 1.42 -2.65 0.00 5.02 -1.26 -3.67 118.16 122.94 1uw0 n LYS 12 Ca -0.04 -2.48 -0.01 0.00 -2.02 0.00 0.00 58.31 53.76 1uw0 n LYS 12 Cb 0.48 -0.68 0.09 0.00 -0.02 0.00 0.00 35.03 34.90 1uw0 n LYS 12 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1uw0 n ARG 13 N -0.86 1.43 0.00 1.97 0.63 -1.26 -5.10 116.66 113.47 1uw0 n ARG 13 Ca -0.04 -2.14 0.00 0.00 -0.92 0.00 0.00 57.85 54.75 1uw0 n ARG 13 Cb 0.85 -0.39 0.00 0.00 0.45 0.00 0.00 32.46 33.36 1uw0 n ARG 13 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1uw0 n GLY 14 N -1.07 -0.78 3.40 5.14 0.00 -1.26 -5.03 105.19 105.58 1uw0 n GLY 14 Ca -0.08 -2.20 -0.31 0.00 0.00 0.00 0.00 46.02 43.43 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 -0.14 2.52 -0.09 2.61 2.01 -1.26 -4.43 115.64 116.85 1uw0 s THR 15 Ca 0.00 -1.13 -0.09 0.00 0.31 0.00 0.00 61.69 60.78 1uw0 s THR 15 Cb 0.00 -1.99 0.02 0.00 0.01 0.00 0.00 72.50 70.55 1uw0 s THR 15 CO 0.00 0.45 0.25 0.00 -0.69 0.00 0.00 174.62 174.63 1uw0 s ALA 16 N -0.79 -0.62 0.37 7.40 0.00 -1.11 -4.91 121.76 122.10 1uw0 s ALA 16 Ca 0.12 0.71 -0.27 0.00 0.00 0.00 0.00 51.96 52.52 1uw0 s ALA 16 Cb -0.10 -0.41 -0.11 0.00 0.00 0.00 0.00 23.12 22.49 1uw0 s ALA 16 CO 0.02 -0.12 1.35 0.41 0.00 0.00 0.00 175.76 177.42 1uw0 n GLY 17 N 2.94 0.77 3.69 0.00 0.00 -1.26 0.34 105.19 111.66 1uw0 n GLY 17 Ca -0.13 0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 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 2.00 2.99 -0.99 0.00 3.01 0.19 -3.23 119.74 123.71 1uw0 s LYS 19 Ca 0.47 1.15 0.00 0.00 -1.01 0.00 0.00 55.97 56.58 1uw0 s LYS 19 Cb -0.18 -1.99 0.00 0.00 -1.01 0.00 0.00 37.83 34.65 1uw0 s LYS 19 CO 0.17 -1.07 0.00 1.17 0.51 0.00 0.00 175.35 176.13 1uw0 n LYS 20 N -2.61 -1.21 -3.62 1.68 0.00 -1.26 -4.05 118.16 107.10 1uw0 n LYS 20 Ca 0.09 0.78 -0.04 0.00 0.00 0.00 0.00 58.31 59.13 1uw0 n LYS 20 Cb 0.53 -4.90 -0.04 0.00 0.00 0.00 0.00 35.03 30.63 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 -1.34 3.53 0.08 0.00 2.47 -1.26 -4.41 119.74 118.81 1uw0 s LYS 22 Ca 0.07 -1.60 -0.10 0.00 -1.56 0.00 0.00 55.97 52.78 1uw0 s LYS 22 Cb -0.01 -4.84 0.03 0.00 -1.46 0.00 0.00 37.83 31.55 1uw0 s LYS 22 CO -0.05 -1.80 0.46 -1.91 0.16 0.00 0.00 175.35 172.21 1uw0 n GLU 23 N 6.81 0.30 -4.24 4.03 2.13 -1.26 -5.01 120.64 123.40 1uw0 n GLU 23 Ca 0.20 -0.67 -0.19 0.00 0.66 0.00 0.00 57.16 57.16 1uw0 n GLU 23 Cb 0.49 0.91 -0.12 0.00 0.27 0.00 0.00 31.44 32.99 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 -2.02 1.02 -0.49 5.31 1.02 -1.26 -0.11 119.74 123.20 1uw0 s LYS 24 Ca 0.10 -1.17 -0.08 0.00 0.02 0.00 0.00 55.97 54.84 1uw0 s LYS 24 Cb -0.01 -1.01 0.13 0.00 -0.52 0.00 0.00 37.83 36.41 1uw0 s LYS 24 CO 0.03 0.21 0.35 0.42 -0.92 0.00 0.00 175.35 175.44 1uw0 s ILE 25 N -1.75 4.12 0.26 2.17 1.01 0.15 -4.75 121.20 122.42 1uw0 s ILE 25 Ca 0.06 -1.94 0.07 0.00 0.00 0.00 0.00 60.65 58.84 1uw0 s ILE 25 Cb -0.07 -3.71 -0.03 0.00 0.01 0.00 0.00 42.46 38.65 1uw0 s ILE 25 CO 0.03 -0.79 0.23 -0.69 0.00 0.00 0.00 174.94 173.73 1uw0 s VAL 26 N 1.17 4.45 0.17 2.92 1.01 -1.26 -2.74 120.40 126.12 1uw0 s VAL 26 Ca 0.07 -1.35 -0.33 0.00 0.00 0.00 0.00 61.98 60.38 1uw0 s VAL 26 Cb -0.25 -3.44 -0.16 0.00 0.00 0.00 0.00 36.38 32.54 1uw0 s VAL 26 CO -0.02 -0.33 1.17 0.29 0.00 0.00 0.00 175.10 176.21 1uw0 n LYS 27 N -1.23 1.14 0.00 2.72 5.02 -1.26 -2.74 118.16 121.81 1uw0 n LYS 27 Ca -0.07 0.41 0.00 0.00 -2.02 0.00 0.00 58.31 56.62 1uw0 n LYS 27 Cb 0.58 -1.91 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 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 2.03 0.91 3.16 0.72 0.00 -1.24 -5.06 105.19 105.72 1uw0 n GLY 28 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 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 1.47 -0.03 1.61 0.11 -1.11 -5.03 120.40 115.42 1uw0 s VAL 29 Ca 0.00 -0.77 -0.17 0.00 -2.93 0.00 0.00 61.98 58.12 1uw0 s VAL 29 Cb 0.00 -1.25 -0.05 0.00 -1.53 0.00 0.00 36.38 33.55 1uw0 s VAL 29 CO 0.00 0.42 0.46 0.00 -3.33 0.00 0.00 175.10 172.65 1uw0 s ARG 31 N -0.47 0.56 -0.18 0.00 1.70 -1.24 -3.93 118.95 115.39 1uw0 s ARG 31 Ca 0.25 -0.74 -0.04 0.00 -0.47 0.00 0.00 55.73 54.74 1uw0 s ARG 31 Cb -0.17 -0.38 -0.02 0.00 -0.57 0.00 0.00 34.95 33.82 1uw0 s ARG 31 CO 0.13 0.07 -0.04 0.42 -1.08 0.00 0.00 175.30 174.80 1uw0 s ILE 32 N -1.26 3.69 -0.00 4.99 1.01 -0.84 0.61 121.20 129.39 1uw0 s ILE 32 Ca -0.08 -0.42 0.00 0.00 0.00 0.00 0.00 60.65 60.16 1uw0 s ILE 32 Cb -0.09 -2.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.71 1uw0 s ILE 32 CO 0.01 0.47 0.05 -0.83 0.00 0.00 0.00 174.94 174.63 1uw0 s GLY 33 N 0.74 1.96 -0.18 6.18 0.00 -0.35 -3.54 107.32 112.14 1uw0 s GLY 33 Ca -0.02 -0.90 -0.03 0.00 0.00 0.00 0.00 44.72 43.77 1uw0 s GLY 33 CO 0.02 -0.78 -0.07 1.25 0.00 0.00 0.00 173.10 173.53 1uw0 s LYS 34 N -1.67 3.44 -0.41 2.90 2.20 -1.25 -1.90 119.74 123.05 1uw0 s LYS 34 Ca 0.22 -0.62 -0.15 0.00 -0.36 0.00 0.00 55.97 55.06 1uw0 s LYS 34 Cb -0.12 -2.88 0.03 0.00 -1.51 0.00 0.00 37.83 33.35 1uw0 s LYS 34 CO 0.12 0.02 0.30 0.08 -0.36 0.00 0.00 175.35 175.52 1uw0 s VAL 35 N 0.91 5.22 -0.06 4.02 1.01 0.11 -3.97 120.40 127.64 1uw0 s VAL 35 Ca -0.01 -0.71 0.05 0.00 0.00 0.00 0.00 61.98 61.31 1uw0 s VAL 35 Cb -0.15 -3.93 -0.01 0.00 0.00 0.00 0.00 36.38 32.30 1uw0 s VAL 35 CO 0.01 -0.33 -0.23 -0.69 0.00 0.00 0.00 175.10 173.86 1uw0 s VAL 36 N 1.67 1.89 0.01 2.92 1.01 -0.91 -1.31 120.40 125.68 1uw0 s VAL 36 Ca 0.05 -0.97 -0.30 0.00 0.00 0.00 0.00 61.98 60.75 1uw0 s VAL 36 Cb -0.19 -1.61 -0.05 0.00 0.00 0.00 0.00 36.38 34.53 1uw0 s VAL 36 CO 0.10 0.53 1.22 -2.16 0.00 0.00 0.00 175.10 174.78 1uw0 s PRO 37 N -0.07 4.39 -0.30 2.72 0.04 -1.26 -2.36 135.00 138.15 1uw0 s PRO 37 Ca -0.05 1.76 -0.09 0.00 0.04 0.00 0.00 61.00 62.65 1uw0 s PRO 37 Cb -0.13 -3.45 -0.02 0.00 0.04 0.00 0.00 34.50 30.94 1uw0 s PRO 37 CO 0.04 -0.36 0.15 1.21 0.04 0.00 0.00 177.00 178.07 1uw0 s ASN 38 N 1.30 5.54 -1.22 6.66 2.47 -1.25 -5.00 114.94 123.44 1uw0 s ASN 38 Ca 0.58 -0.42 -0.21 0.00 0.42 0.00 0.00 52.86 53.24 1uw0 s ASN 38 Cb -0.28 -2.01 -0.01 0.00 -1.45 0.00 0.00 41.25 37.51 1uw0 s ASN 38 CO 0.26 -0.15 1.82 -2.16 -3.72 0.00 0.00 177.10 173.15 1uw0 s PRO 39 N 1.63 3.23 0.32 0.43 0.04 -1.26 -4.27 135.00 135.12 1uw0 s PRO 39 Ca 0.05 -1.52 0.00 0.00 0.04 0.00 0.00 61.00 59.57 1uw0 s PRO 39 Cb -0.17 -5.38 0.00 0.00 0.04 0.00 0.00 34.50 28.99 1uw0 s PRO 39 CO 0.06 -3.10 0.00 0.34 0.04 0.00 0.00 177.00 174.35 1uw0 n PHE 40 N 11.38 -3.00 -4.21 0.56 -0.00 -1.26 -5.13 117.46 115.80 1uw0 n PHE 40 Ca 0.46 0.73 -0.25 0.00 -0.00 0.00 0.00 57.45 58.40 1uw0 n PHE 40 Cb 0.46 1.51 -0.07 0.00 -0.00 0.00 0.00 39.48 41.38 1uw0 n PHE 40 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.76 175.64 1uw0 s SER 41 N -4.15 4.89 -0.20 -2.13 0.01 -1.26 -5.05 113.70 105.81 1uw0 s SER 41 Ca 0.00 -0.43 -0.01 0.00 1.31 0.00 0.00 55.95 56.83 1uw0 s SER 41 Cb 0.00 -1.06 -0.21 0.00 0.21 0.00 0.00 66.02 64.96 1uw0 s SER 41 CO 0.00 0.04 0.02 -0.62 0.41 0.00 0.00 173.24 173.08 1uw0 n GLU 42 N -0.57 0.69 -0.36 12.44 -0.58 -1.26 -4.35 120.64 126.65 1uw0 n GLU 42 Ca -0.08 0.19 0.04 0.00 -0.42 0.00 0.00 57.16 56.88 1uw0 n GLU 42 Cb 0.57 -1.60 0.20 0.00 -0.57 0.00 0.00 31.44 30.04 1uw0 n GLU 42 CO 0.00 0.00 0.00 0.77 -0.48 0.00 0.00 177.13 177.42 1uw0 h SER 43 N 0.03 1.00 -3.52 1.62 0.02 -2.02 -3.42 113.55 107.25 1uw0 h SER 43 Ca -0.52 0.01 -0.38 0.00 -0.84 0.00 0.00 61.79 60.07 1uw0 h SER 43 Cb 1.96 -0.20 0.16 0.00 0.14 0.00 0.00 62.40 64.47 1uw0 h SER 43 CO -0.02 0.63 0.31 0.61 -1.14 0.00 0.00 176.83 177.22 1uw0 n GLY 44 N -1.37 -1.77 0.00 -3.77 0.00 -1.26 -5.07 105.19 91.96 1uw0 n GLY 44 Ca 0.16 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.52 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 -3.02 0.28 3.49 -0.02 0.00 -1.26 -4.98 105.19 99.68 1uw0 n GLY 45 Ca 0.14 0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 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 1.02 3.86 0.06 1.61 1.01 -1.26 -3.82 116.67 119.15 1uw0 s ASP 46 Ca 0.00 -0.59 0.05 0.00 0.71 0.00 0.00 52.55 52.73 1uw0 s ASP 46 Cb 0.00 -0.53 -0.04 0.00 1.01 0.00 0.00 42.92 43.37 1uw0 s ASP 46 CO 0.00 0.17 -0.08 -0.04 0.21 0.00 0.00 175.17 175.43 1uw0 s MET 47 N -2.21 2.33 -0.05 8.23 -1.94 -1.00 -4.92 119.30 119.74 1uw0 s MET 47 Ca 0.18 -0.89 -0.03 0.00 -1.71 0.00 0.00 55.69 53.24 1uw0 s MET 47 Cb -0.10 -2.39 0.03 0.00 2.01 0.00 0.00 34.83 34.37 1uw0 s MET 47 CO 0.10 0.55 0.13 -1.59 -0.01 0.00 0.00 175.02 174.20 1uw0 s LYS 48 N -1.86 0.11 0.26 2.03 -2.85 -1.26 -2.15 119.74 114.02 1uw0 s LYS 48 Ca 0.20 0.27 0.09 0.00 -1.00 0.00 0.00 55.97 55.53 1uw0 s LYS 48 Cb -0.11 -0.07 -0.04 0.00 -2.06 0.00 0.00 37.83 35.55 1uw0 s LYS 48 CO 0.11 -0.10 0.02 -1.21 0.10 0.00 0.00 175.35 174.27 1uw0 s GLU 49 N 0.66 2.36 -0.29 1.78 2.02 -1.25 -4.91 118.70 119.06 1uw0 s GLU 49 Ca -0.05 -1.36 -0.05 0.00 0.02 0.00 0.00 54.97 53.53 1uw0 s GLU 49 Cb -0.07 -2.22 0.02 0.00 0.10 0.00 0.00 34.13 31.97 1uw0 s GLU 49 CO -0.03 0.38 0.04 -1.58 0.02 0.00 0.00 175.26 174.09 1uw0 s TRP 50 N -2.26 3.15 0.35 1.61 0.23 -1.26 -3.80 118.94 116.96 1uw0 s TRP 50 Ca 0.31 -1.26 0.05 0.00 -2.03 0.00 0.00 56.10 53.17 1uw0 s TRP 50 Cb -0.07 -2.20 -0.07 0.00 0.03 0.00 0.00 33.47 31.17 1uw0 s TRP 50 CO 0.20 -0.66 0.05 1.52 0.96 0.00 0.00 176.95 179.02 1uw0 s TYR 51 N 1.42 2.10 0.47 -1.98 1.13 -1.23 0.55 117.35 119.81 1uw0 s TYR 51 Ca 0.01 -0.89 -0.04 0.00 -1.41 0.00 0.00 57.07 54.74 1uw0 s TYR 51 Cb -0.18 -1.41 -0.02 0.00 -1.10 0.00 0.00 41.96 39.25 1uw0 s TYR 51 CO 0.01 0.11 0.74 -1.01 -2.51 0.00 0.00 175.55 172.89 1uw0 s HIS 52 N -3.15 3.46 0.07 -3.49 3.76 -1.26 -1.98 115.29 112.70 1uw0 s HIS 52 Ca 0.36 0.63 -0.20 0.00 -0.15 0.00 0.00 55.06 55.69 1uw0 s HIS 52 Cb 0.09 -2.29 -0.10 0.00 1.11 0.00 0.00 32.58 31.38 1uw0 s HIS 52 CO 0.16 -0.30 1.53 0.82 -0.85 0.00 0.00 174.74 176.10 1uw0 h ILE 53 N 0.28 1.23 -0.85 0.60 2.04 -1.94 0.21 117.51 119.08 1uw0 h ILE 53 Ca -0.47 -0.77 -0.01 0.00 1.00 0.00 0.00 64.86 64.60 1uw0 h ILE 53 Cb 1.22 1.38 -0.04 0.00 -0.74 0.00 0.00 36.82 38.64 1uw0 h ILE 53 CO 0.61 0.24 0.48 0.50 0.00 0.00 0.00 178.15 179.97 1uw0 h LYS 54 N 0.10 1.18 -0.48 2.37 3.64 -1.94 1.08 116.57 122.52 1uw0 h LYS 54 Ca 0.06 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 59.27 1uw0 h LYS 54 Cb 0.34 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1uw0 h LYS 54 CO 0.01 0.86 0.16 0.00 -2.27 0.00 0.00 179.45 178.20 1uw0 h MET 56 N 0.64 0.36 0.00 0.00 1.85 -0.04 -3.00 114.93 114.74 1uw0 h MET 56 Ca 0.16 -0.29 -0.05 0.00 -0.61 0.00 0.00 59.70 58.91 1uw0 h MET 56 Cb 0.26 0.06 -0.01 0.00 0.43 0.00 0.00 31.60 32.34 1uw0 h MET 56 CO -0.01 0.93 -0.24 0.74 -0.40 0.00 0.00 176.91 177.93 1uw0 h PHE 57 N -0.13 0.00 -0.58 1.39 0.04 0.13 -0.56 116.94 117.23 1uw0 h PHE 57 Ca -0.02 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.69 1uw0 h PHE 57 Cb 0.99 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.12 1uw0 h PHE 57 CO 0.13 0.24 0.15 1.49 -0.60 0.00 0.00 178.31 179.72 1uw0 h GLU 58 N 0.00 0.93 -0.18 1.51 4.57 -0.06 0.51 114.58 121.86 1uw0 h GLU 58 Ca -0.00 -0.22 -0.18 0.00 -1.18 0.00 0.00 59.36 57.78 1uw0 h GLU 58 Cb 0.46 -0.12 0.01 0.00 -0.16 0.00 0.00 28.75 28.93 1uw0 h GLU 58 CO 0.03 0.85 -0.59 -0.22 -1.18 0.00 0.00 179.01 177.91 1uw0 h LYS 59 N 0.83 0.72 -0.87 1.92 1.63 -1.32 -3.01 116.57 116.47 1uw0 h LYS 59 Ca 0.18 -0.53 -0.03 0.00 -0.85 0.00 0.00 60.65 59.43 1uw0 h LYS 59 Cb 0.34 0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 32.02 1uw0 h LYS 59 CO 0.00 1.15 0.44 1.25 -3.45 0.00 0.00 179.45 178.85 1uw0 h LEU 60 N 0.43 1.12 -1.77 5.20 5.85 -0.88 -1.27 115.31 123.99 1uw0 h LEU 60 Ca -0.02 -0.12 0.08 0.00 0.84 0.00 0.00 57.88 58.66 1uw0 h LEU 60 Cb 1.21 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 41.93 1uw0 h LEU 60 CO 0.12 0.93 0.31 -0.08 -0.34 0.00 0.00 178.44 179.38 1uw0 h GLU 61 N 1.24 0.26 -0.84 1.25 4.81 0.10 -0.59 114.58 120.82 1uw0 h GLU 61 Ca 0.30 -0.02 -0.40 0.00 -0.13 0.00 0.00 59.36 59.11 1uw0 h GLU 61 Cb 0.08 -0.06 -0.24 0.00 0.63 0.00 0.00 28.75 29.16 1uw0 h GLU 61 CO -0.04 0.17 0.46 0.54 -0.73 0.00 0.00 179.01 179.41 1uw0 n ARG 62 N -4.46 2.45 -3.97 1.92 5.12 -0.52 -4.98 116.66 112.22 1uw0 n ARG 62 Ca 0.07 -3.05 -0.23 0.00 -1.93 0.00 0.00 57.85 52.71 1uw0 n ARG 62 Cb 0.34 -2.12 -0.06 0.00 -1.16 0.00 0.00 32.46 29.46 1uw0 n ARG 62 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1uw0 s ALA 63 N -3.23 3.67 0.77 7.54 0.00 -0.23 -5.04 121.76 125.23 1uw0 s ALA 63 Ca 0.54 -1.90 -0.12 0.00 0.00 0.00 0.00 51.96 50.49 1uw0 s ALA 63 Cb 0.46 -0.74 0.06 0.00 0.00 0.00 0.00 23.12 22.90 1uw0 s ALA 63 CO 0.10 -0.07 1.13 1.03 0.00 0.00 0.00 175.76 177.94 1uw0 s ARG 64 N -3.93 2.12 0.08 0.00 0.52 -1.26 -4.96 118.95 111.51 1uw0 s ARG 64 Ca 0.41 1.40 -0.03 0.00 -0.52 0.00 0.00 55.73 56.99 1uw0 s ARG 64 Cb -0.01 -1.87 -0.27 0.00 0.52 0.00 0.00 34.95 33.32 1uw0 s ARG 64 CO 0.24 -1.78 1.15 0.00 0.02 0.00 0.00 175.30 174.93 1uw0 h ALA 65 N -0.85 0.13 -0.93 2.13 0.00 -1.99 -3.30 119.26 114.45 1uw0 h ALA 65 Ca -0.45 -0.90 0.23 0.00 0.00 0.00 0.00 54.91 53.79 1uw0 h ALA 65 Cb 1.25 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.98 1uw0 h ALA 65 CO 0.50 1.02 0.62 1.15 0.00 0.00 0.00 179.25 182.54 1uw0 h THR 66 N 0.06 0.63 -3.45 0.00 2.02 -2.05 -3.32 112.91 106.81 1uw0 h THR 66 Ca -0.12 -0.12 -0.71 0.00 0.77 0.00 0.00 66.41 66.23 1uw0 h THR 66 Cb 1.95 0.26 -0.31 0.00 -1.74 0.00 0.00 68.15 68.31 1uw0 h THR 66 CO 0.19 0.06 -0.50 -0.89 0.37 0.00 0.00 175.52 174.76 1uw0 s THR 67 N -5.37 3.79 0.04 3.16 2.01 -1.24 -5.08 115.64 112.95 1uw0 s THR 67 Ca -0.08 -1.73 0.07 0.00 0.31 0.00 0.00 61.69 60.26 1uw0 s THR 67 Cb 0.23 -3.45 -0.03 0.00 0.01 0.00 0.00 72.50 69.26 1uw0 s THR 67 CO 0.78 -0.61 -0.17 -0.75 -0.69 0.00 0.00 174.62 173.18 1uw0 s LYS 68 N 1.29 2.11 0.09 4.92 2.20 -1.25 -4.72 119.74 124.38 1uw0 s LYS 68 Ca 0.05 -0.96 0.08 0.00 -0.36 0.00 0.00 55.97 54.78 1uw0 s LYS 68 Cb -0.23 -2.21 -0.03 0.00 -1.51 0.00 0.00 37.83 33.85 1uw0 s LYS 68 CO -0.01 0.55 -0.20 0.15 -0.36 0.00 0.00 175.35 175.47 1uw0 s LYS 69 N -1.40 1.12 -0.11 4.03 1.02 -1.26 -4.98 119.74 118.16 1uw0 s LYS 69 Ca 0.15 -1.11 -0.08 0.00 0.02 0.00 0.00 55.97 54.95 1uw0 s LYS 69 Cb -0.11 -1.34 0.03 0.00 -0.52 0.00 0.00 37.83 35.90 1uw0 s LYS 69 CO 0.05 0.31 0.15 -0.89 -0.92 0.00 0.00 175.35 174.05 1uw0 n ILE 70 N 1.20 -9.71 -4.39 2.17 5.41 -1.26 -5.01 119.36 107.77 1uw0 n ILE 70 Ca -0.19 2.10 -0.31 0.00 1.00 0.00 0.00 62.75 65.34 1uw0 n ILE 70 Cb 0.54 -5.33 -0.10 0.00 -0.71 0.00 0.00 39.64 34.03 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 -0.47 2.34 1.95 0.38 2.02 -1.26 -5.03 118.70 118.63 1uw0 s GLU 71 Ca -0.17 -0.87 0.00 0.00 0.02 0.00 0.00 54.97 53.95 1uw0 s GLU 71 Cb 0.01 -2.39 0.00 0.00 0.10 0.00 0.00 34.13 31.85 1uw0 s GLU 71 CO 0.47 0.56 0.00 -3.47 0.02 0.00 0.00 175.26 172.83 1uw0 n ASP 72 N 1.20 -2.42 -0.00 -0.19 -0.08 -1.26 -4.59 116.55 109.20 1uw0 n ASP 72 Ca -0.14 0.00 -0.03 0.00 -1.51 0.00 0.00 54.79 53.10 1uw0 n ASP 72 Cb 0.52 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.97 1uw0 n ASP 72 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 1uw0 n LEU 73 N 0.00 1.43 -3.96 -2.67 7.94 -1.26 -4.79 117.00 113.68 1uw0 n LEU 73 Ca 0.00 0.21 -0.40 0.00 -1.11 0.00 0.00 56.01 54.72 1uw0 n LEU 73 Cb 0.00 -0.49 -0.04 0.00 0.53 0.00 0.00 43.42 43.42 1uw0 n LEU 73 CO 0.00 -0.58 2.05 0.35 -1.11 0.00 0.00 177.39 178.10 1uw0 n THR 74 N -3.86 2.30 0.08 1.96 -2.24 -1.26 -4.27 114.28 107.00 1uw0 n THR 74 Ca -0.05 -2.15 0.00 0.00 -2.27 0.00 0.00 64.05 59.58 1uw0 n THR 74 Cb 0.19 -2.33 0.00 0.00 -2.10 0.00 0.00 70.33 66.09 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 7.30 0.00 -3.01 -0.78 1.02 -1.26 -5.01 120.64 118.90 1uw0 n GLU 75 Ca 0.49 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 57.47 1uw0 n GLU 75 Cb 0.42 -0.27 0.00 0.00 -0.02 0.00 0.00 31.44 31.57 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 -3.38 -0.66 -3.82 -4.62 -0.00 -1.26 -5.11 117.00 98.15 1uw0 n LEU 76 Ca 0.00 -4.36 -0.12 0.00 -0.00 0.00 0.00 56.01 51.52 1uw0 n LEU 76 Cb 0.04 0.77 -0.12 0.00 -0.00 0.00 0.00 43.42 44.11 1uw0 n LEU 76 CO 0.00 2.14 -0.19 -1.83 -0.00 0.00 0.00 177.39 177.52 1uw0 s GLU 77 N -1.01 0.19 -0.93 1.47 -1.05 -1.26 -3.57 118.70 112.54 1uw0 s GLU 77 Ca 0.33 0.21 -0.19 0.00 -0.15 0.00 0.00 54.97 55.17 1uw0 s GLU 77 Cb 0.28 0.09 -0.11 0.00 -0.44 0.00 0.00 34.13 33.95 1uw0 s GLU 77 CO -0.11 -0.02 2.02 0.41 0.95 0.00 0.00 175.26 178.51 1uw0 n GLY 78 N 2.96 3.01 0.12 -3.83 0.00 -1.26 -4.50 105.19 101.69 1uw0 n GLY 78 Ca -0.13 -1.31 -0.16 0.00 0.00 0.00 0.00 46.02 44.43 1uw0 n GLY 78 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1uw0 n TRP 79 N 6.87 0.90 -0.03 1.61 4.27 -1.26 -3.50 117.44 126.30 1uw0 n TRP 79 Ca 0.50 0.23 0.23 0.00 -3.89 0.00 0.00 57.50 54.57 1uw0 n TRP 79 Cb 0.38 -1.13 0.72 0.00 -1.36 0.00 0.00 31.31 29.91 1uw0 n TRP 79 CO 0.00 0.00 0.00 1.49 -2.29 0.00 0.00 177.69 176.89 1uw0 h GLU 80 N 0.04 0.00 0.02 -2.67 4.81 -1.93 -2.51 114.58 112.34 1uw0 h GLU 80 Ca -0.42 0.00 -0.36 0.00 -0.13 0.00 0.00 59.36 58.45 1uw0 h GLU 80 Cb 2.03 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 31.35 1uw0 h GLU 80 CO 0.06 0.00 -2.22 -1.91 -0.73 0.00 0.00 179.01 174.21 1uw0 n GLU 81 N -4.18 0.68 -0.56 1.92 2.13 -1.26 -4.97 120.64 114.40 1uw0 n GLU 81 Ca 0.12 0.15 -0.11 0.00 0.66 0.00 0.00 57.16 57.97 1uw0 n GLU 81 Cb 0.72 -1.61 0.09 0.00 0.27 0.00 0.00 31.44 30.91 1uw0 n GLU 81 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1uw0 n LEU 82 N -3.09 0.00 -4.73 4.31 4.77 -0.95 -4.98 117.00 112.33 1uw0 n LEU 82 Ca -0.34 -0.51 -0.35 0.00 -0.03 0.00 0.00 56.01 54.79 1uw0 n LEU 82 Cb 1.07 -0.39 0.08 0.00 -2.33 0.00 0.00 43.42 41.85 1uw0 n LEU 82 CO 0.38 -1.17 0.83 -1.61 -1.33 0.00 0.00 177.39 174.48 1uw0 s GLU 83 N -4.04 2.34 -0.11 3.23 2.02 -1.26 -4.96 118.70 115.92 1uw0 s GLU 83 Ca 0.28 1.84 -0.06 0.00 0.02 0.00 0.00 54.97 57.05 1uw0 s GLU 83 Cb -0.02 -1.85 -0.26 0.00 0.10 0.00 0.00 34.13 32.10 1uw0 s GLU 83 CO 0.21 -1.70 0.42 -0.44 0.02 0.00 0.00 175.26 173.77 1uw0 h ASP 84 N 0.04 0.40 -0.62 -0.19 5.19 -1.94 -3.31 116.42 115.99 1uw0 h ASP 84 Ca -0.49 -0.88 0.04 0.00 -0.62 0.00 0.00 57.03 55.08 1uw0 h ASP 84 Cb 1.31 -0.13 -0.05 0.00 0.18 0.00 0.00 39.33 40.64 1uw0 h ASP 84 CO 0.51 1.79 0.37 -1.13 -3.12 0.00 0.00 179.24 177.66 1uw0 h ASN 85 N 0.07 0.57 -0.96 6.45 -1.24 -1.99 -1.67 115.58 116.81 1uw0 h ASN 85 Ca -0.41 0.01 0.00 0.00 0.71 0.00 0.00 56.30 56.62 1uw0 h ASN 85 Cb 2.04 -0.10 -0.05 0.00 0.73 0.00 0.00 38.32 40.94 1uw0 h ASN 85 CO 0.10 0.39 0.60 -0.33 -1.29 0.00 0.00 177.43 176.90 1uw0 h GLU 86 N 0.70 1.28 -0.90 6.67 5.08 -1.98 -1.92 114.58 123.52 1uw0 h GLU 86 Ca 0.26 -0.10 0.10 0.00 -1.00 0.00 0.00 59.36 58.62 1uw0 h GLU 86 Cb 0.09 -0.28 -0.07 0.00 0.50 0.00 0.00 28.75 28.99 1uw0 h GLU 86 CO -0.13 0.88 0.58 -0.22 -1.00 0.00 0.00 179.01 179.12 1uw0 h LYS 87 N 1.31 0.86 -0.85 2.33 3.11 -1.40 -1.37 116.57 120.57 1uw0 h LYS 87 Ca 0.35 -0.05 0.02 0.00 -2.81 0.00 0.00 60.65 58.15 1uw0 h LYS 87 Cb -0.10 -0.19 -0.05 0.00 -1.00 0.00 0.00 32.23 30.89 1uw0 h LYS 87 CO -0.07 0.57 0.55 1.49 -2.81 0.00 0.00 179.45 179.18 1uw0 h GLU 88 N 0.89 1.08 -0.25 1.90 4.22 -1.05 -1.86 114.58 119.50 1uw0 h GLU 88 Ca 0.42 -0.06 -0.02 0.00 0.08 0.00 0.00 59.36 59.78 1uw0 h GLU 88 Cb 0.43 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1uw0 h GLU 88 CO -0.19 0.71 0.09 1.96 -2.18 0.00 0.00 179.01 179.40 1uw0 h GLN 89 N 1.11 0.34 -0.62 1.92 1.08 -1.23 -2.36 115.11 115.36 1uw0 h GLN 89 Ca 0.32 -0.04 -0.08 0.00 -1.45 0.00 0.00 58.65 57.41 1uw0 h GLN 89 Cb -0.07 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.26 1uw0 h GLN 89 CO -0.09 0.30 0.08 0.82 -0.95 0.00 0.00 178.83 178.99 1uw0 h ILE 90 N 0.35 1.26 -0.93 2.54 2.04 -1.20 -2.72 117.51 118.84 1uw0 h ILE 90 Ca 0.09 -1.02 0.03 0.00 1.00 0.00 0.00 64.86 64.95 1uw0 h ILE 90 Cb 0.10 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 36.82 1uw0 h ILE 90 CO -0.01 0.38 0.61 0.74 0.00 0.00 0.00 178.15 179.87 1uw0 h THR 91 N 0.95 1.18 -0.83 -0.27 2.02 -1.31 -1.59 112.91 113.06 1uw0 h THR 91 Ca 0.19 -0.41 0.09 0.00 0.77 0.00 0.00 66.41 67.05 1uw0 h THR 91 Cb 0.44 -0.11 -0.06 0.00 -1.74 0.00 0.00 68.15 66.68 1uw0 h THR 91 CO 0.01 0.22 0.54 -0.61 0.37 0.00 0.00 175.52 176.05 1uw0 h GLN 92 N 1.18 0.79 0.05 6.66 5.75 -1.45 -1.31 115.11 126.79 1uw0 h GLN 92 Ca 0.36 -0.05 0.01 0.00 -0.15 0.00 0.00 58.65 58.83 1uw0 h GLN 92 Cb -0.02 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.33 1uw0 h GLN 92 CO -0.10 0.52 -0.12 0.45 -2.65 0.00 0.00 178.83 176.92 1uw0 h HIS 93 N 0.81 -0.32 -0.64 3.99 3.86 -1.29 0.76 115.15 122.33 1uw0 h HIS 93 Ca 0.38 0.01 -0.06 0.00 -1.16 0.00 0.00 60.37 59.54 1uw0 h HIS 93 Cb 0.40 0.14 -0.03 0.00 1.06 0.00 0.00 27.41 28.98 1uw0 h HIS 93 CO -0.00 -0.19 0.15 0.82 0.86 0.00 0.00 177.93 179.57 1uw0 h ILE 94 N -0.23 1.25 -0.38 2.45 5.03 -1.44 -1.49 117.51 122.70 1uw0 h ILE 94 Ca 0.03 -0.91 -0.12 0.00 -0.12 0.00 0.00 64.86 63.74 1uw0 h ILE 94 Cb 0.26 0.59 -0.01 0.00 -3.03 0.00 0.00 36.82 34.63 1uw0 h ILE 94 CO -0.09 0.35 -0.25 0.00 -0.68 0.00 0.00 178.15 177.48 1uw0 h ALA 95 N 1.20 0.84 -0.57 1.87 0.00 -0.72 -0.48 119.26 121.41 1uw0 h ALA 95 Ca 0.20 -0.39 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1uw0 h ALA 95 Cb 0.34 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1uw0 h ALA 95 CO 0.00 0.64 -0.05 -0.44 0.00 0.00 0.00 179.25 179.40 1uw0 h ASP 96 N 0.67 1.01 0.33 0.00 3.32 0.91 -3.02 116.42 119.64 1uw0 h ASP 96 Ca 0.09 -0.31 -0.19 0.00 0.02 0.00 0.00 57.03 56.64 1uw0 h ASP 96 Cb 0.77 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.04 1uw0 h ASP 96 CO 0.06 1.09 -0.79 0.25 -1.72 0.00 0.00 179.24 178.13 1uw0 h LEU 97 N 0.93 0.45 -5.80 1.55 5.85 -1.14 -3.30 115.31 113.83 1uw0 h LEU 97 Ca 0.16 -0.32 -0.76 0.00 0.84 0.00 0.00 57.88 57.80 1uw0 h LEU 97 Cb 0.61 -0.13 -0.22 0.00 0.37 0.00 0.00 40.66 41.28 1uw0 h LEU 97 CO 0.04 1.07 1.39 -1.20 -0.34 0.00 0.00 178.44 179.41 1uw0 n SER 98 N -3.79 7.53 -2.66 1.25 7.64 -0.20 -4.55 113.62 118.84 1uw0 n SER 98 Ca -0.05 -3.52 -0.04 0.00 1.01 0.00 0.00 58.87 56.28 1uw0 n SER 98 Cb 0.74 -1.22 0.04 0.00 -1.01 0.00 0.00 64.21 62.77 1uw0 n SER 98 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1uw0 n SER 99 N 0.46 2.16 -3.53 6.43 3.41 -1.22 -4.88 113.62 116.45 1uw0 n SER 99 Ca 0.52 -2.34 -0.28 0.00 -0.26 0.00 0.00 58.87 56.51 1uw0 n SER 99 Cb 0.27 -0.45 -0.15 0.00 -0.26 0.00 0.00 64.21 63.62 1uw0 n SER 99 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1uw0 s LYS 100 N -3.70 0.20 -0.41 4.33 2.20 -1.26 -4.98 119.74 116.12 1uw0 s LYS 100 Ca 0.31 -0.51 -0.22 0.00 -0.36 0.00 0.00 55.97 55.20 1uw0 s LYS 100 Cb 0.34 -1.13 0.03 0.00 -1.51 0.00 0.00 37.83 35.56 1uw0 s LYS 100 CO -0.03 -1.02 0.55 0.00 -0.36 0.00 0.00 175.35 174.49 1uw0 n ALA 101 N 5.24 -2.77 -4.13 3.13 0.00 -1.26 -5.04 120.51 115.69 1uw0 n ALA 101 Ca -0.06 0.81 -0.07 0.00 0.00 0.00 0.00 53.44 54.12 1uw0 n ALA 101 Cb 0.42 -2.94 -0.01 0.00 0.00 0.00 0.00 19.45 16.91 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 -0.11 0.11 -2.76 0.00 0.00 -1.26 -5.15 120.51 111.33 1uw0 n ALA 102 Ca 0.04 -0.52 -0.25 0.00 0.00 0.00 0.00 53.44 52.71 1uw0 n ALA 102 Cb 0.50 0.28 -0.06 0.00 0.00 0.00 0.00 19.45 20.17 1uw0 n ALA 102 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1uw0 s GLY 103 N -1.68 1.64 -0.32 0.00 0.00 -1.26 -5.10 107.32 100.59 1uw0 s GLY 103 Ca 0.01 -1.34 -0.01 0.00 0.00 0.00 0.00 44.72 43.37 1uw0 s GLY 103 CO 0.00 -1.36 0.19 -0.51 0.00 0.00 0.00 173.10 171.42 1uw0 s THR 104 N -1.89 -0.02 -1.12 0.90 -4.23 -1.26 -5.05 115.64 102.96 1uw0 s THR 104 Ca 0.31 -1.18 -0.21 0.00 -1.18 0.00 0.00 61.69 59.43 1uw0 s THR 104 Cb -0.09 -1.02 -0.07 0.00 1.34 0.00 0.00 72.50 72.67 1uw0 s THR 104 CO 0.22 -0.82 1.92 -0.81 -0.54 0.00 0.00 174.62 174.60 1uw0 n PRO 105 N 4.65 1.99 -3.48 3.99 -0.04 -1.26 -4.80 135.00 136.05 1uw0 n PRO 105 Ca 0.03 -2.47 -0.28 0.00 -0.04 0.00 0.00 63.50 60.75 1uw0 n PRO 105 Cb 0.40 -3.43 -0.13 0.00 -0.04 0.00 0.00 33.50 30.31 1uw0 n PRO 105 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1uw0 s LYS 106 N 5.35 0.43 0.05 0.54 2.20 -1.26 -5.13 119.74 121.91 1uw0 s LYS 106 Ca 0.61 -1.01 0.09 0.00 -0.36 0.00 0.00 55.97 55.30 1uw0 s LYS 106 Cb 0.06 -1.20 -0.03 0.00 -1.51 0.00 0.00 37.83 35.14 1uw0 s LYS 106 CO 0.10 -1.14 -0.25 0.15 -0.36 0.00 0.00 175.35 173.85 1uw0 s LYS 107 N 1.46 1.85 -0.13 4.03 1.02 -1.26 -5.13 119.74 121.58 1uw0 s LYS 107 Ca 0.15 -1.09 0.02 0.00 0.02 0.00 0.00 55.97 55.07 1uw0 s LYS 107 Cb -0.20 -2.02 0.00 0.00 -0.52 0.00 0.00 37.83 35.08 1uw0 s LYS 107 CO -0.12 0.52 -0.19 0.15 -0.92 0.00 0.00 175.35 174.78 1uw0 s LYS 108 N -1.31 3.14 0.36 1.68 -0.14 -1.26 -5.13 119.74 117.09 1uw0 s LYS 108 Ca 0.12 -0.80 0.08 0.00 -1.36 0.00 0.00 55.97 54.01 1uw0 s LYS 108 Cb -0.10 -2.49 -0.07 0.00 -1.68 0.00 0.00 37.83 33.49 1uw0 s LYS 108 CO 0.03 0.08 -0.05 0.00 -0.76 0.00 0.00 175.35 174.65 1uw0 s ALA 109 N 0.63 2.97 -0.14 5.17 0.00 -1.26 -5.14 121.76 123.99 1uw0 s ALA 109 Ca -0.10 -2.16 0.00 0.00 0.00 0.00 0.00 51.96 49.70 1uw0 s ALA 109 Cb -0.16 0.08 -0.01 0.00 0.00 0.00 0.00 23.12 23.03 1uw0 s ALA 109 CO 0.03 -0.02 -0.15 0.08 0.00 0.00 0.00 175.76 175.70 1uw0 s VAL 110 N -2.70 2.77 -0.19 0.00 1.01 -1.26 -5.11 120.40 114.91 1uw0 s VAL 110 Ca 0.33 -0.75 -0.01 0.00 0.00 0.00 0.00 61.98 61.56 1uw0 s VAL 110 Cb 0.06 -2.16 0.00 0.00 0.00 0.00 0.00 36.38 34.28 1uw0 s VAL 110 CO 0.17 0.52 -0.12 -0.69 0.00 0.00 0.00 175.10 174.97 1uw0 s VAL 111 N 0.64 2.72 -0.13 2.92 1.01 -1.26 -5.11 120.40 121.20 1uw0 s VAL 111 Ca -0.08 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.20 1uw0 s VAL 111 Cb -0.16 -2.19 -0.00 0.00 0.00 0.00 0.00 36.38 34.02 1uw0 s VAL 111 CO 0.03 0.48 -0.18 -1.10 0.00 0.00 0.00 175.10 174.33 1uw0 s GLN 112 N 1.31 3.20 -0.06 2.72 -1.52 -1.26 -5.12 119.66 118.94 1uw0 s GLN 112 Ca 0.04 -0.78 0.05 0.00 -1.95 0.00 0.00 55.36 52.72 1uw0 s GLN 112 Cb -0.14 -2.51 -0.02 0.00 -0.22 0.00 0.00 33.01 30.12 1uw0 s GLN 112 CO -0.07 0.13 -0.20 0.00 -0.25 0.00 0.00 175.29 174.89 1uw0 s ALA 113 N 0.52 2.37 -0.11 6.09 0.00 -1.26 -5.12 121.76 124.25 1uw0 s ALA 113 Ca -0.12 -1.02 0.03 0.00 0.00 0.00 0.00 51.96 50.86 1uw0 s ALA 113 Cb -0.16 -0.82 0.01 0.00 0.00 0.00 0.00 23.12 22.14 1uw0 s ALA 113 CO 0.04 0.44 -0.21 0.15 0.00 0.00 0.00 175.76 176.19 1uw0 s LYS 114 N -0.30 2.81 0.16 0.00 1.02 -1.26 -5.13 119.74 117.05 1uw0 s LYS 114 Ca 0.01 -0.79 0.09 0.00 0.02 0.00 0.00 55.97 55.30 1uw0 s LYS 114 Cb -0.13 -2.19 -0.04 0.00 -0.52 0.00 0.00 37.83 34.95 1uw0 s LYS 114 CO 0.03 0.09 -0.15 -1.17 -0.92 0.00 0.00 175.35 173.23 1uw0 s LEU 115 N 0.55 2.80 -0.10 3.17 2.96 -1.26 -5.13 118.68 121.67 1uw0 s LEU 115 Ca -0.14 -0.62 0.03 0.00 -0.22 0.00 0.00 54.13 53.18 1uw0 s LEU 115 Cb -0.17 -1.55 -0.01 0.00 0.50 0.00 0.00 46.19 44.97 1uw0 s LEU 115 CO 0.05 0.13 -0.19 -0.89 -1.32 0.00 0.00 176.35 174.12 1uw0 s THR 116 N -1.51 2.50 -0.05 3.68 2.01 -1.26 -5.38 115.64 115.62 1uw0 s THR 116 Ca 0.22 -0.88 0.00 0.00 0.31 0.00 0.00 61.69 61.35 1uw0 s THR 116 Cb -0.09 -1.99 0.00 0.00 0.01 0.00 0.00 72.50 70.43 1uw0 s THR 116 CO 0.13 0.55 0.51 0.41 -0.69 0.00 0.00 174.62 175.53