#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wew s SER 2 N 0.00 -0.26 0.03 1.61 0.01 -1.26 -5.18 113.70 108.66 1wew s SER 2 Ca 0.00 -0.21 0.08 0.00 1.31 0.00 0.00 55.95 57.12 1wew s SER 2 Cb 0.00 0.43 -0.02 0.00 0.21 0.00 0.00 66.02 66.64 1wew s SER 2 CO 0.00 -0.76 -0.23 -0.94 0.41 0.00 0.00 173.24 171.72 1wew s SER 3 N -2.74 2.72 -0.30 2.44 1.04 -1.26 -5.11 113.70 110.50 1wew s SER 3 Ca 0.09 -0.52 -0.18 0.00 0.48 0.00 0.00 55.95 55.81 1wew s SER 3 Cb -0.01 -0.25 0.17 0.00 0.10 0.00 0.00 66.02 66.04 1wew s SER 3 CO -0.03 0.21 1.24 -0.83 0.98 0.00 0.00 173.24 174.81 1wew s GLY 4 N -1.09 -0.41 -0.55 7.32 0.00 -1.26 -5.12 107.32 106.21 1wew s GLY 4 Ca 0.09 2.85 -0.27 0.00 0.00 0.00 0.00 44.72 47.39 1wew s GLY 4 CO 0.01 4.13 1.11 -1.35 0.00 0.00 0.00 173.10 177.01 1wew s SER 5 N 3.00 6.45 0.24 1.64 1.04 -1.26 -5.01 113.70 119.80 1wew s SER 5 Ca 0.11 0.05 0.08 0.00 0.48 0.00 0.00 55.95 56.66 1wew s SER 5 Cb -0.04 -2.52 -0.04 0.00 0.10 0.00 0.00 66.02 63.52 1wew s SER 5 CO -0.14 -1.37 0.08 -0.44 0.98 0.00 0.00 173.24 172.35 1wew s SER 6 N 2.83 5.00 0.00 7.02 0.01 -1.26 -5.05 113.70 122.25 1wew s SER 6 Ca 0.40 -0.43 0.00 0.00 1.31 0.00 0.00 55.95 57.23 1wew s SER 6 Cb -0.09 -1.12 0.00 0.00 0.21 0.00 0.00 66.02 65.03 1wew s SER 6 CO 0.25 0.00 0.00 0.61 0.41 0.00 0.00 173.24 174.51 1wew n GLY 7 N -0.88 -0.52 3.42 3.44 0.00 -1.26 -5.01 105.19 104.38 1wew n GLY 7 Ca -0.07 0.11 -0.45 0.00 0.00 0.00 0.00 46.02 45.61 1wew n GLY 7 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1wew s GLU 8 N -0.47 4.00 0.24 1.61 2.12 -1.26 -5.02 118.70 119.93 1wew s GLU 8 Ca 0.00 -2.62 -0.24 0.00 0.36 0.00 0.00 54.97 52.47 1wew s GLU 8 Cb 0.00 -4.84 -0.09 0.00 0.26 0.00 0.00 34.13 29.46 1wew s GLU 8 CO 0.00 -1.58 0.82 -0.51 -0.54 0.00 0.00 175.26 173.45 1wew s ASP 9 N 2.47 7.26 0.00 -1.70 1.01 -1.26 -4.93 116.67 119.52 1wew s ASP 9 Ca 0.36 1.64 0.10 0.00 0.71 0.00 0.00 52.55 55.36 1wew s ASP 9 Cb -0.06 -2.50 0.62 0.00 1.01 0.00 0.00 42.92 41.99 1wew s ASP 9 CO -0.04 0.05 1.06 -0.81 0.21 0.00 0.00 175.17 175.63 1wew n PRO 10 N 0.93 0.49 -2.22 8.23 -0.04 -1.26 -2.88 135.00 138.25 1wew n PRO 10 Ca -0.02 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.21 1wew n PRO 10 Cb 0.50 -1.33 0.01 0.00 -0.04 0.00 0.00 33.50 32.65 1wew n PRO 10 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1wew n PHE 11 N -0.83 2.87 -4.01 0.54 3.72 -1.26 -5.05 117.46 113.43 1wew n PHE 11 Ca 0.08 -2.52 -0.28 0.00 -0.05 0.00 0.00 57.45 54.68 1wew n PHE 11 Cb 0.04 -0.25 -0.05 0.00 -0.94 0.00 0.00 39.48 38.28 1wew n PHE 11 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 176.76 177.85 1wew s GLN 12 N -3.58 3.12 0.76 -1.08 -2.07 -1.14 -5.11 119.66 110.57 1wew s GLN 12 Ca 0.48 -0.70 -0.11 0.00 -1.82 0.00 0.00 55.36 53.22 1wew s GLN 12 Cb 0.40 -2.81 0.05 0.00 -1.09 0.00 0.00 33.01 29.57 1wew s GLN 12 CO -0.04 0.53 1.09 -1.25 -1.32 0.00 0.00 175.29 174.31 1wew s PRO 13 N -2.91 2.32 -1.30 9.60 0.04 -1.26 -4.93 135.00 136.56 1wew s PRO 13 Ca 0.32 1.20 -0.15 0.00 0.04 0.00 0.00 61.00 62.41 1wew s PRO 13 Cb -0.11 -1.90 0.11 0.00 0.04 0.00 0.00 34.50 32.64 1wew s PRO 13 CO 0.25 -1.60 1.75 0.39 0.04 0.00 0.00 177.00 177.84 1wew n GLU 14 N -3.38 3.25 -3.74 4.56 4.71 -1.26 -4.97 120.64 119.82 1wew n GLU 14 Ca 0.09 -3.37 -0.35 0.00 -0.01 0.00 0.00 57.16 53.52 1wew n GLU 14 Cb 0.53 -3.24 -0.05 0.00 -1.01 0.00 0.00 31.44 27.67 1wew n GLU 14 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 1wew s ILE 15 N 2.67 5.28 0.05 -3.67 -1.09 -1.26 -4.96 121.20 118.22 1wew s ILE 15 Ca 0.47 0.20 0.00 0.00 -2.23 0.00 0.00 60.65 59.09 1wew s ILE 15 Cb 0.05 -3.57 0.00 0.00 -1.58 0.00 0.00 42.46 37.35 1wew s ILE 15 CO 0.02 0.36 0.00 1.17 -1.23 0.00 0.00 174.94 175.26 1wew n LYS 16 N 1.10 0.00 -2.61 2.79 3.00 -1.26 -5.05 118.16 116.13 1wew n LYS 16 Ca -0.11 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.12 1wew n LYS 16 Cb 0.53 -0.38 0.04 0.00 0.00 0.00 0.00 35.03 35.22 1wew n LYS 16 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1wew n VAL 17 N -3.10 -3.89 -0.37 3.15 0.31 -1.24 -4.77 118.33 108.42 1wew n VAL 17 Ca 0.00 -0.42 -0.06 0.00 -0.01 0.00 0.00 64.34 63.85 1wew n VAL 17 Cb 0.25 -4.17 0.02 0.00 -0.91 0.00 0.00 33.84 29.02 1wew n VAL 17 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1wew n ARG 18 N -2.53 1.29 -1.49 5.55 5.12 -0.98 -4.45 116.66 119.17 1wew n ARG 18 Ca -0.11 -0.59 -0.31 0.00 -1.93 0.00 0.00 57.85 54.91 1wew n ARG 18 Cb 0.58 -1.23 0.06 0.00 -1.16 0.00 0.00 32.46 30.71 1wew n ARG 18 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1wew h VAL 20 N -0.75 0.06 0.00 0.00 -1.51 -1.96 -0.85 116.25 111.25 1wew h VAL 20 Ca -0.44 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 1wew h VAL 20 Cb 1.22 1.00 0.00 0.00 -2.13 0.00 0.00 31.29 31.38 1wew h VAL 20 CO 0.54 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.88 1wew n GLY 22 N -0.91 -0.41 3.50 0.00 0.00 -0.32 -5.01 105.19 102.03 1wew n GLY 22 Ca -0.01 0.14 -0.23 0.00 0.00 0.00 0.00 46.02 45.91 1wew n GLY 22 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1wew s ASN 23 N -3.13 2.85 -0.28 1.61 2.47 -1.26 -5.07 114.94 112.13 1wew s ASN 23 Ca 0.46 -1.35 0.09 0.00 0.42 0.00 0.00 52.86 52.47 1wew s ASN 23 Cb -0.20 -0.18 0.46 0.00 -1.45 0.00 0.00 41.25 39.88 1wew s ASN 23 CO 0.57 -0.53 1.18 -1.54 -3.72 0.00 0.00 177.10 173.06 1wew n SER 24 N -0.75 4.43 -4.67 -4.21 3.41 -1.26 -4.65 113.62 105.92 1wew n SER 24 Ca -0.03 -3.59 -0.24 0.00 -0.26 0.00 0.00 58.87 54.74 1wew n SER 24 Cb 0.66 -0.36 -0.07 0.00 -0.26 0.00 0.00 64.21 64.18 1wew n SER 24 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 1wew s LEU 25 N -3.58 3.31 -0.06 1.04 0.05 -1.26 -5.00 118.68 113.18 1wew s LEU 25 Ca 0.48 -0.49 0.03 0.00 0.05 0.00 0.00 54.13 54.20 1wew s LEU 25 Cb 0.40 -1.89 -0.03 0.00 -2.05 0.00 0.00 46.19 42.62 1wew s LEU 25 CO 0.03 0.04 -0.14 -1.61 -0.55 0.00 0.00 176.35 174.12 1wew s GLU 26 N -3.35 2.58 0.48 1.48 2.02 -1.26 -4.92 118.70 115.72 1wew s GLU 26 Ca 0.30 -0.68 0.08 0.00 0.02 0.00 0.00 54.97 54.68 1wew s GLU 26 Cb -0.08 -2.41 0.02 0.00 0.10 0.00 0.00 34.13 31.77 1wew s GLU 26 CO 0.20 0.60 0.53 0.95 0.02 0.00 0.00 175.26 177.55 1wew s THR 27 N -0.66 2.41 0.29 3.63 -4.23 -1.26 -5.00 115.64 110.82 1wew s THR 27 Ca 0.10 -1.21 0.01 0.00 -1.18 0.00 0.00 61.69 59.41 1wew s THR 27 Cb -0.11 -2.62 0.35 0.00 1.34 0.00 0.00 72.50 71.45 1wew s THR 27 CO 0.01 0.00 1.61 0.44 -0.54 0.00 0.00 174.62 176.14 1wew h ASP 28 N 0.68 -0.23 -4.44 3.99 3.32 -2.05 -3.40 116.42 114.28 1wew h ASP 28 Ca -0.37 0.23 -0.43 0.00 0.02 0.00 0.00 57.03 56.48 1wew h ASP 28 Cb 1.28 0.37 -0.22 0.00 0.22 0.00 0.00 39.33 40.98 1wew h ASP 28 CO 0.51 -0.25 -0.79 -0.44 -1.72 0.00 0.00 179.24 176.55 1wew s SER 29 N -5.05 1.78 -0.06 6.45 0.01 -1.26 -5.15 113.70 110.42 1wew s SER 29 Ca -0.12 -0.62 -0.24 0.00 1.31 0.00 0.00 55.95 56.27 1wew s SER 29 Cb 0.27 -0.06 0.05 0.00 0.21 0.00 0.00 66.02 66.49 1wew s SER 29 CO 0.77 -0.06 0.54 -0.04 0.41 0.00 0.00 173.24 174.87 1wew s MET 30 N -1.76 0.89 -0.08 12.44 -1.94 -1.26 -3.91 119.30 123.68 1wew s MET 30 Ca -0.01 0.17 0.02 0.00 -1.71 0.00 0.00 55.69 54.16 1wew s MET 30 Cb -0.10 0.41 -0.02 0.00 2.01 0.00 0.00 34.83 37.13 1wew s MET 30 CO 0.02 -0.25 -0.14 0.96 -0.01 0.00 0.00 175.02 175.60 1wew s ILE 31 N -1.07 3.07 -0.13 2.53 -4.36 -0.93 -4.93 121.20 115.37 1wew s ILE 31 Ca -0.11 -0.70 -0.07 0.00 -0.26 0.00 0.00 60.65 59.52 1wew s ILE 31 Cb -0.02 -2.23 -0.04 0.00 1.25 0.00 0.00 42.46 41.41 1wew s ILE 31 CO 0.07 0.57 0.13 -1.58 0.24 0.00 0.00 174.94 174.37 1wew s GLN 32 N -0.31 3.49 0.35 0.37 0.74 -1.26 -0.93 119.66 122.12 1wew s GLN 32 Ca 0.03 -0.15 -0.29 0.00 0.05 0.00 0.00 55.36 55.00 1wew s GLN 32 Cb -0.13 -3.19 -0.11 0.00 1.10 0.00 0.00 33.01 30.68 1wew s GLN 32 CO 0.03 0.73 1.50 0.00 -0.55 0.00 0.00 175.29 176.99 1wew h GLU 34 N 3.49 -0.19 -4.76 0.00 4.39 -1.90 -3.35 114.58 112.27 1wew h GLU 34 Ca -0.50 0.01 -0.53 0.00 0.34 0.00 0.00 59.36 58.68 1wew h GLU 34 Cb 1.23 0.04 0.09 0.00 -0.10 0.00 0.00 28.75 30.01 1wew h GLU 34 CO 0.68 -0.13 -0.41 -3.47 -1.16 0.00 0.00 179.01 174.52 1wew n ASP 35 N -5.18 -0.97 -0.02 1.42 -0.08 -1.26 -4.77 116.55 105.68 1wew n ASP 35 Ca -0.08 0.90 -0.13 0.00 -1.51 0.00 0.00 54.79 53.96 1wew n ASP 35 Cb 0.11 -0.75 -0.10 0.00 2.34 0.00 0.00 41.12 42.72 1wew n ASP 35 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1wew h PRO 36 N 0.82 0.04 0.03 -0.67 0.13 -2.01 -2.23 132.00 128.11 1wew h PRO 36 Ca -0.23 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1wew h PRO 36 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1wew h PRO 36 CO 0.45 0.52 -0.01 0.00 -0.23 0.00 0.00 178.00 178.73 1wew h ARG 37 N -0.44 -0.04 0.00 0.86 3.08 -1.96 -3.33 114.38 112.55 1wew h ARG 37 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1wew h ARG 37 Cb 0.51 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.57 1wew h ARG 37 CO 0.00 0.26 0.00 0.00 -1.07 0.00 0.00 179.97 179.16 1wew n HIS 39 N -2.17 -1.18 -4.05 0.00 8.25 -0.84 -4.91 115.22 110.31 1wew n HIS 39 Ca 0.00 0.51 -0.32 0.00 -0.26 0.00 0.00 57.72 57.65 1wew n HIS 39 Cb 0.00 -2.60 -0.06 0.00 1.12 0.00 0.00 29.99 28.44 1wew n HIS 39 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1wew s VAL 40 N -4.23 4.80 -0.01 1.59 -7.23 -1.26 -4.77 120.40 109.29 1wew s VAL 40 Ca 0.05 -0.49 -0.18 0.00 -1.81 0.00 0.00 61.98 59.55 1wew s VAL 40 Cb -0.03 -3.25 -0.06 0.00 0.56 0.00 0.00 36.38 33.61 1wew s VAL 40 CO 0.93 0.26 0.51 0.26 -0.31 0.00 0.00 175.10 176.76 1wew s TRP 41 N -1.29 3.69 -0.04 2.82 0.52 -1.26 -1.05 118.94 122.33 1wew s TRP 41 Ca 0.26 1.10 0.00 0.00 0.02 0.00 0.00 56.10 57.48 1wew s TRP 41 Cb -0.12 -2.48 0.03 0.00 -1.15 0.00 0.00 33.47 29.74 1wew s TRP 41 CO 0.18 0.46 -0.01 -0.65 0.02 0.00 0.00 176.95 176.95 1wew s GLN 42 N -0.50 0.48 0.13 4.98 -1.52 -0.10 -2.32 119.66 120.80 1wew s GLN 42 Ca 0.27 0.04 -0.35 0.00 -1.95 0.00 0.00 55.36 53.38 1wew s GLN 42 Cb -0.17 -0.65 -0.17 0.00 -0.22 0.00 0.00 33.01 31.80 1wew s GLN 42 CO 0.15 -0.15 1.17 0.72 -0.25 0.00 0.00 175.29 176.94 1wew n HIS 43 N 4.30 1.20 -0.12 0.91 8.25 -1.26 -2.20 115.22 126.30 1wew n HIS 43 Ca -0.22 0.72 -0.10 0.00 -0.26 0.00 0.00 57.72 57.86 1wew n HIS 43 Cb 0.50 -2.26 -0.02 0.00 1.12 0.00 0.00 29.99 29.34 1wew n HIS 43 CO 0.00 0.00 0.00 -0.39 0.64 0.00 0.00 176.34 176.59 1wew h VAL 44 N 2.82 1.22 -0.10 1.59 -1.51 -1.92 -2.70 116.25 115.65 1wew h VAL 44 Ca -0.45 -0.76 -0.05 0.00 -1.23 0.00 0.00 66.70 64.21 1wew h VAL 44 Cb 1.36 1.04 -0.03 0.00 -2.13 0.00 0.00 31.29 31.52 1wew h VAL 44 CO 0.71 0.26 0.07 0.61 -1.23 0.00 0.00 177.57 177.99 1wew n GLY 45 N -0.57 2.28 0.71 5.19 0.00 -1.26 -1.83 105.19 109.70 1wew n GLY 45 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1wew n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wew n VAL 47 N -2.56 1.00 -2.07 0.00 0.24 -1.18 -5.01 118.33 108.76 1wew n VAL 47 Ca 0.00 -0.49 -0.32 0.00 -2.04 0.00 0.00 64.34 61.50 1wew n VAL 47 Cb 0.35 -0.90 -0.00 0.00 -1.47 0.00 0.00 33.84 31.81 1wew n VAL 47 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1wew s ILE 48 N -2.35 4.52 0.80 1.34 -1.09 -0.76 -5.03 121.20 118.64 1wew s ILE 48 Ca -0.16 1.00 -0.13 0.00 -2.23 0.00 0.00 60.65 59.12 1wew s ILE 48 Cb 0.05 -3.74 0.08 0.00 -1.58 0.00 0.00 42.46 37.28 1wew s ILE 48 CO 0.49 -0.89 1.21 -0.76 -1.23 0.00 0.00 174.94 173.75 1wew s LEU 49 N -4.71 3.15 -0.51 2.97 2.01 -1.26 -4.69 118.68 115.64 1wew s LEU 49 Ca 0.57 2.37 -0.27 0.00 0.01 0.00 0.00 54.13 56.81 1wew s LEU 49 Cb -0.11 -4.59 -0.02 0.00 0.01 0.00 0.00 46.19 41.48 1wew s LEU 49 CO 0.44 -2.66 1.80 -2.16 1.01 0.00 0.00 176.35 174.77 1wew s PRO 50 N -4.13 2.94 -0.75 1.29 0.04 -1.26 -4.88 135.00 128.24 1wew s PRO 50 Ca 0.73 0.89 0.01 0.00 0.04 0.00 0.00 61.00 62.67 1wew s PRO 50 Cb -0.29 -4.29 0.36 0.00 0.04 0.00 0.00 34.50 30.32 1wew s PRO 50 CO 0.50 -2.35 1.61 -0.25 0.04 0.00 0.00 177.00 176.55 1wew n ASP 51 N 11.60 6.38 0.07 6.66 8.00 -1.26 -4.79 116.55 143.20 1wew n ASP 51 Ca 0.21 -3.76 -0.12 0.00 0.71 0.00 0.00 54.79 51.83 1wew n ASP 51 Cb 0.50 -0.87 -0.07 0.00 -0.02 0.00 0.00 41.12 40.66 1wew n ASP 51 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1wew h LYS 52 N 3.17 -0.12 -0.30 -1.24 3.64 -2.01 -3.11 116.57 116.59 1wew h LYS 52 Ca 0.43 0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.70 1wew h LYS 52 Cb 0.38 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1wew h LYS 52 CO 1.15 -0.08 -0.29 -1.00 -2.27 0.00 0.00 179.45 176.96 1wew h PRO 53 N -0.12 0.73 -5.50 1.90 0.13 -2.03 -3.41 132.00 123.70 1wew h PRO 53 Ca -0.00 -0.38 -0.24 0.00 -0.87 0.00 0.00 66.00 64.51 1wew h PRO 53 Cb 0.11 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.26 1wew h PRO 53 CO -0.01 1.00 0.82 -1.64 -0.23 0.00 0.00 178.00 177.95 1wew s MET 54 N -4.37 1.89 0.21 0.86 -1.94 -1.18 -4.80 119.30 109.97 1wew s MET 54 Ca -0.12 0.88 -0.09 0.00 -1.71 0.00 0.00 55.69 54.64 1wew s MET 54 Cb 0.09 -4.69 0.29 0.00 2.01 0.00 0.00 34.83 32.53 1wew s MET 54 CO 0.84 -3.84 1.73 0.22 -0.01 0.00 0.00 175.02 173.96 1wew h ASP 55 N 15.83 0.17 0.00 3.03 3.58 -1.82 -3.46 116.42 133.76 1wew h ASP 55 Ca -0.11 0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.42 1wew h ASP 55 Cb 1.13 0.08 0.00 0.00 1.72 0.00 0.00 39.33 42.26 1wew h ASP 55 CO 1.09 0.10 0.00 0.61 -2.88 0.00 0.00 179.24 178.16 1wew n GLY 56 N -1.30 1.05 3.69 -0.78 0.00 -1.26 -5.13 105.19 101.46 1wew n GLY 56 Ca 0.09 -0.06 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1wew n GLY 56 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1wew n ASN 57 N 0.00 1.52 -4.77 1.61 6.94 -1.26 -4.31 115.26 115.00 1wew n ASN 57 Ca 0.00 0.79 -0.39 0.00 -0.02 0.00 0.00 54.58 54.96 1wew n ASN 57 Cb 0.00 -1.50 -0.02 0.00 -2.36 0.00 0.00 39.78 35.90 1wew n ASN 57 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 1wew s PRO 58 N -3.27 4.07 1.14 -0.53 0.04 -1.26 -4.93 135.00 130.26 1wew s PRO 58 Ca 0.80 1.90 -0.17 0.00 0.04 0.00 0.00 61.00 63.57 1wew s PRO 58 Cb -0.38 -2.72 0.26 0.00 0.04 0.00 0.00 34.50 31.70 1wew s PRO 58 CO 0.43 -0.32 1.10 -1.25 0.04 0.00 0.00 177.00 177.00 1wew s PRO 59 N -2.24 -0.69 0.75 0.56 0.04 -1.26 -4.95 135.00 127.20 1wew s PRO 59 Ca 0.56 0.12 -0.17 0.00 0.04 0.00 0.00 61.00 61.55 1wew s PRO 59 Cb -0.32 -1.64 -0.15 0.00 0.04 0.00 0.00 34.50 32.43 1wew s PRO 59 CO 0.41 -3.40 -0.43 1.47 0.04 0.00 0.00 177.00 175.09 1wew n LEU 60 N -4.57 -4.69 -4.77 -3.56 -0.00 -1.26 -4.86 117.00 93.29 1wew n LEU 60 Ca 0.10 0.43 -0.39 0.00 -0.00 0.00 0.00 56.01 56.15 1wew n LEU 60 Cb 0.59 -0.82 -0.02 0.00 -0.00 0.00 0.00 43.42 43.17 1wew n LEU 60 CO 0.49 -5.35 0.87 -2.16 -0.00 0.00 0.00 177.39 171.24 1wew s PRO 61 N -1.53 4.11 0.31 1.47 0.04 -1.26 -4.90 135.00 133.23 1wew s PRO 61 Ca 0.49 1.91 0.06 0.00 0.04 0.00 0.00 61.00 63.50 1wew s PRO 61 Cb -0.34 -2.75 0.85 0.00 0.04 0.00 0.00 34.50 32.30 1wew s PRO 61 CO 0.74 -0.30 1.49 0.39 0.04 0.00 0.00 177.00 179.36 1wew n GLU 62 N 0.22 -0.07 -3.85 4.56 4.71 -1.26 -4.35 120.64 120.60 1wew n GLU 62 Ca 0.03 1.40 -0.13 0.00 -0.01 0.00 0.00 57.16 58.45 1wew n GLU 62 Cb 0.46 -2.28 -0.14 0.00 -1.01 0.00 0.00 31.44 28.46 1wew n GLU 62 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 1wew s SER 63 N -4.90 -0.00 -0.10 1.62 1.04 -1.26 -5.07 113.70 105.03 1wew s SER 63 Ca -0.11 0.04 -0.02 0.00 0.48 0.00 0.00 55.95 56.34 1wew s SER 63 Cb 0.29 0.02 0.04 0.00 0.10 0.00 0.00 66.02 66.47 1wew s SER 63 CO 0.74 -0.03 0.03 0.12 0.98 0.00 0.00 173.24 175.08 1wew s PHE 64 N 0.22 0.57 -0.28 5.02 5.36 -1.26 -5.07 117.98 122.55 1wew s PHE 64 Ca -0.02 -0.22 -0.08 0.00 -0.96 0.00 0.00 56.93 55.65 1wew s PHE 64 Cb -0.03 -0.77 -0.01 0.00 -0.34 0.00 0.00 43.02 41.87 1wew s PHE 64 CO -0.01 -0.37 0.09 0.71 -1.46 0.00 0.00 175.22 174.18 1wew s TYR 65 N 2.01 3.12 0.99 10.12 2.02 -1.26 -2.98 117.35 131.36 1wew s TYR 65 Ca 0.04 -0.60 -0.15 0.00 -0.37 0.00 0.00 57.07 55.98 1wew s TYR 65 Cb -0.13 -2.27 0.09 0.00 -0.40 0.00 0.00 41.96 39.25 1wew s TYR 65 CO -0.06 -0.44 -0.04 0.00 -1.57 0.00 0.00 175.55 173.44 1wew n GLU 67 N -0.91 0.09 -0.01 0.00 -0.00 -1.26 -1.94 120.64 116.61 1wew n GLU 67 Ca 0.03 0.33 -0.05 0.00 -0.00 0.00 0.00 57.16 57.47 1wew n GLU 67 Cb 0.44 -1.68 -0.12 0.00 -0.00 0.00 0.00 31.44 30.08 1wew n GLU 67 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 1wew n ILE 68 N -1.85 1.40 0.10 3.84 5.41 -1.26 -3.93 119.36 123.06 1wew n ILE 68 Ca 0.03 -0.76 -0.20 0.00 1.00 0.00 0.00 62.75 62.82 1wew n ILE 68 Cb 0.20 -0.84 -0.15 0.00 -0.71 0.00 0.00 39.64 38.14 1wew n ILE 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1wew h ARG 70 N 0.10 0.24 0.00 0.00 0.11 -1.56 -0.92 114.38 112.35 1wew h ARG 70 Ca -0.25 -0.01 -0.11 0.00 0.10 0.00 0.00 59.98 59.70 1wew h ARG 70 Cb 2.07 -0.05 -0.02 0.00 1.11 0.00 0.00 29.97 33.08 1wew h ARG 70 CO 0.21 0.16 -0.53 1.37 0.10 0.00 0.00 179.97 181.28 1wew h LEU 71 N 0.24 0.00 0.00 0.08 8.10 -1.68 -3.46 115.31 118.59 1wew h LEU 71 Ca 0.07 0.00 -0.21 0.00 0.11 0.00 0.00 57.88 57.84 1wew h LEU 71 Cb -0.03 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.18 1wew h LEU 71 CO -0.01 0.53 -0.09 0.35 -4.11 0.00 0.00 178.44 175.10 1wew n THR 72 N -3.36 0.00 -1.45 0.15 -2.24 -0.35 -5.01 114.28 102.03 1wew n THR 72 Ca 0.01 -0.81 -0.52 0.00 -2.27 0.00 0.00 64.05 60.46 1wew n THR 72 Cb 0.68 -0.37 -0.07 0.00 -2.10 0.00 0.00 70.33 68.46 1wew n THR 72 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1wew n SER 73 N -2.02 2.05 -2.70 3.42 2.88 -1.26 -4.81 113.62 111.18 1wew n SER 73 Ca -0.00 0.49 -0.04 0.00 -1.33 0.00 0.00 58.87 57.99 1wew n SER 73 Cb 0.23 -1.23 0.04 0.00 -0.75 0.00 0.00 64.21 62.51 1wew n SER 73 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wew n GLY 74 N 6.44 -1.32 3.74 0.46 0.00 -1.26 -4.93 105.19 108.33 1wew n GLY 74 Ca 0.41 0.96 -0.41 0.00 0.00 0.00 0.00 46.02 46.97 1wew n GLY 74 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wew s PRO 75 N 0.76 4.40 0.21 1.61 0.04 -1.26 -4.87 135.00 135.88 1wew s PRO 75 Ca 0.26 2.05 -0.19 0.00 0.04 0.00 0.00 61.00 63.16 1wew s PRO 75 Cb 0.13 -3.19 0.19 0.00 0.04 0.00 0.00 34.50 31.67 1wew s PRO 75 CO -0.10 -0.22 1.57 1.03 0.04 0.00 0.00 177.00 179.32 1wew h SER 76 N 5.13 -1.24 -6.67 6.66 0.87 -2.01 -3.44 113.55 112.85 1wew h SER 76 Ca -0.45 0.26 -0.54 0.00 -1.23 0.00 0.00 61.79 59.84 1wew h SER 76 Cb 1.22 0.64 -0.16 0.00 -0.44 0.00 0.00 62.40 63.66 1wew h SER 76 CO 0.76 -0.30 -0.85 -1.20 -0.53 0.00 0.00 176.83 174.72 1wew n SER 77 N -5.46 -2.57 0.00 6.23 7.64 -1.26 -4.97 113.62 113.23 1wew n SER 77 Ca 0.07 -1.00 0.00 0.00 1.01 0.00 0.00 58.87 58.95 1wew n SER 77 Cb 0.38 -2.88 0.00 0.00 -1.01 0.00 0.00 64.21 60.70 1wew n SER 77 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64