#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wew n SER 2 N 0.00 1.85 -4.20 1.61 2.88 -1.26 -4.97 113.62 109.52 1wew n SER 2 Ca 0.00 0.51 -0.35 0.00 -1.33 0.00 0.00 58.87 57.70 1wew n SER 2 Cb 0.00 -0.90 -0.03 0.00 -0.75 0.00 0.00 64.21 62.52 1wew n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1wew n SER 3 N -4.50 -2.60 -4.91 -3.46 7.64 -1.26 -4.92 113.62 99.60 1wew n SER 3 Ca -0.22 -1.03 -0.27 0.00 1.01 0.00 0.00 58.87 58.36 1wew n SER 3 Cb 0.50 -2.70 -0.01 0.00 -1.01 0.00 0.00 64.21 60.99 1wew n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wew s GLY 4 N -3.50 1.58 0.04 0.23 0.00 -1.26 -5.10 107.32 99.31 1wew s GLY 4 Ca 0.60 -0.60 -0.28 0.00 0.00 0.00 0.00 44.72 44.44 1wew s GLY 4 CO 0.93 -0.48 0.97 -1.35 0.00 0.00 0.00 173.10 173.17 1wew s SER 5 N -3.78 -0.25 1.13 1.64 1.04 -1.26 -5.17 113.70 107.06 1wew s SER 5 Ca 0.45 -0.17 -0.17 0.00 0.48 0.00 0.00 55.95 56.55 1wew s SER 5 Cb -0.10 0.39 0.16 0.00 0.10 0.00 0.00 66.02 66.57 1wew s SER 5 CO 0.38 -0.67 0.32 -1.54 0.98 0.00 0.00 173.24 172.70 1wew n SER 6 N -0.34 -2.18 0.00 7.02 3.41 -1.26 -5.03 113.62 115.24 1wew n SER 6 Ca -0.07 -0.12 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 1wew n SER 6 Cb 0.61 -1.06 0.00 0.00 -0.26 0.00 0.00 64.21 63.51 1wew n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wew n GLY 7 N 1.71 4.27 3.91 5.00 0.00 -1.26 -5.15 105.19 113.66 1wew n GLY 7 Ca 0.01 -0.45 -0.31 0.00 0.00 0.00 0.00 46.02 45.28 1wew n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wew s GLU 8 N -2.21 3.54 0.19 1.61 2.02 -1.26 -5.10 118.70 117.49 1wew s GLU 8 Ca 0.00 -0.24 -0.01 0.00 0.02 0.00 0.00 54.97 54.74 1wew s GLU 8 Cb 0.00 -2.93 -0.04 0.00 0.10 0.00 0.00 34.13 31.26 1wew s GLU 8 CO 0.00 0.52 0.38 -0.51 0.02 0.00 0.00 175.26 175.67 1wew s ASP 9 N -2.48 6.39 0.00 -0.19 1.01 -1.26 -4.97 116.67 115.17 1wew s ASP 9 Ca 0.39 0.40 0.13 0.00 0.71 0.00 0.00 52.55 54.17 1wew s ASP 9 Cb -0.12 -2.01 0.75 0.00 1.01 0.00 0.00 42.92 42.55 1wew s ASP 9 CO 0.26 -0.02 1.18 -0.81 0.21 0.00 0.00 175.17 175.99 1wew n PRO 10 N -0.56 0.49 -2.79 8.23 -0.04 -1.26 -3.26 135.00 135.80 1wew n PRO 10 Ca -0.05 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.18 1wew n PRO 10 Cb 0.54 -1.40 -0.02 0.00 -0.04 0.00 0.00 33.50 32.57 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 -0.90 2.94 -2.29 0.54 3.72 -1.26 -5.09 117.46 115.12 1wew n PHE 11 Ca 0.09 -3.53 -0.34 0.00 -0.05 0.00 0.00 57.45 53.63 1wew n PHE 11 Cb 0.04 -0.33 -0.01 0.00 -0.94 0.00 0.00 39.48 38.25 1wew n PHE 11 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1wew s GLN 12 N -3.31 3.51 1.17 -1.08 -1.52 -1.20 -5.04 119.66 112.19 1wew s GLN 12 Ca 0.45 1.36 -0.18 0.00 -1.95 0.00 0.00 55.36 55.04 1wew s GLN 12 Cb 0.35 -2.05 0.27 0.00 -0.22 0.00 0.00 33.01 31.36 1wew s GLN 12 CO -0.13 -0.67 1.11 -1.25 -0.25 0.00 0.00 175.29 174.10 1wew s PRO 13 N -3.55 -0.96 -1.12 2.91 0.04 -1.26 -4.97 135.00 126.09 1wew s PRO 13 Ca 0.67 0.03 -0.09 0.00 0.04 0.00 0.00 61.00 61.65 1wew s PRO 13 Cb -0.18 -1.62 0.28 0.00 0.04 0.00 0.00 34.50 33.02 1wew s PRO 13 CO 0.28 -3.56 1.21 0.39 0.04 0.00 0.00 177.00 175.36 1wew n GLU 14 N -4.67 3.70 -4.32 4.56 1.02 -1.26 -5.01 120.64 114.66 1wew n GLU 14 Ca 0.12 -4.42 -0.28 0.00 -0.02 0.00 0.00 57.16 52.56 1wew n GLU 14 Cb 0.59 -2.58 -0.11 0.00 -0.02 0.00 0.00 31.44 29.32 1wew n GLU 14 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1wew s ILE 15 N -1.33 2.85 0.00 -3.67 1.01 -1.26 -4.95 121.20 113.85 1wew s ILE 15 Ca 0.32 -1.65 0.00 0.00 0.00 0.00 0.00 60.65 59.32 1wew s ILE 15 Cb -0.07 -2.35 0.00 0.00 0.01 0.00 0.00 42.46 40.05 1wew s ILE 15 CO -0.04 -0.00 0.00 1.17 0.00 0.00 0.00 174.94 176.07 1wew n LYS 16 N 0.48 0.00 -2.57 2.79 3.00 -1.26 -5.04 118.16 115.57 1wew n LYS 16 Ca -0.14 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.09 1wew n LYS 16 Cb 0.54 -0.40 0.04 0.00 0.00 0.00 0.00 35.03 35.21 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 -2.50 -3.93 -0.51 3.15 0.31 -1.26 -4.93 118.33 108.67 1wew n VAL 17 Ca 0.00 -0.44 -0.16 0.00 -0.01 0.00 0.00 64.34 63.73 1wew n VAL 17 Cb 0.24 -4.20 0.08 0.00 -0.91 0.00 0.00 33.84 29.05 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 -2.48 1.79 -0.86 5.55 1.74 -1.19 -4.71 116.66 116.51 1wew n ARG 18 Ca -0.10 -1.76 -0.30 0.00 -0.77 0.00 0.00 57.85 54.92 1wew n ARG 18 Cb 0.57 -1.69 0.17 0.00 -1.02 0.00 0.00 32.46 30.49 1wew n ARG 18 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1wew h VAL 20 N -1.88 1.34 -1.48 0.00 -1.51 -1.94 -3.19 116.25 107.58 1wew h VAL 20 Ca -0.49 -2.04 0.43 0.00 -1.23 0.00 0.00 66.70 63.36 1wew h VAL 20 Cb 1.28 2.31 -0.06 0.00 -2.13 0.00 0.00 31.29 32.70 1wew h VAL 20 CO 0.48 0.62 1.11 0.00 -1.23 0.00 0.00 177.57 178.55 1wew n GLY 22 N -1.82 0.40 3.19 0.00 0.00 -1.21 -5.02 105.19 100.74 1wew n GLY 22 Ca 0.33 -0.77 -0.40 0.00 0.00 0.00 0.00 46.02 45.18 1wew n GLY 22 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wew s ASN 23 N -2.94 5.74 0.56 1.61 -0.87 -1.26 -4.93 114.94 112.85 1wew s ASN 23 Ca 0.01 -2.36 0.41 0.00 -1.57 0.00 0.00 52.86 49.35 1wew s ASN 23 Cb -0.00 -1.99 1.56 0.00 -0.02 0.00 0.00 41.25 40.80 1wew s ASN 23 CO 0.01 -0.56 1.66 0.28 -2.57 0.00 0.00 177.10 175.92 1wew h SER 24 N 7.87 0.00 -3.36 -1.22 0.02 -1.95 -3.41 113.55 111.49 1wew h SER 24 Ca -0.09 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.33 1wew h SER 24 Cb 1.03 0.00 0.22 0.00 0.14 0.00 0.00 62.40 63.78 1wew h SER 24 CO 0.79 0.00 -0.60 0.00 -1.14 0.00 0.00 176.83 175.87 1wew n LEU 25 N -3.95 -0.36 -3.77 5.07 -0.00 -1.26 -4.85 117.00 107.88 1wew n LEU 25 Ca 0.32 0.31 -0.13 0.00 -0.00 0.00 0.00 56.01 56.52 1wew n LEU 25 Cb 1.58 -1.19 -0.09 0.00 -0.00 0.00 0.00 43.42 43.71 1wew n LEU 25 CO 0.40 -3.66 0.00 -1.83 -0.00 0.00 0.00 177.39 172.30 1wew s GLU 26 N -3.61 0.59 0.41 1.47 4.04 -1.26 -4.96 118.70 115.38 1wew s GLU 26 Ca 0.57 -0.05 0.07 0.00 0.04 0.00 0.00 54.97 55.60 1wew s GLU 26 Cb -0.21 0.26 -0.06 0.00 0.02 0.00 0.00 34.13 34.15 1wew s GLU 26 CO 0.68 -0.15 0.16 -0.08 -1.84 0.00 0.00 175.26 174.03 1wew s THR 27 N -0.97 2.28 -2.00 1.83 -1.32 -1.26 -5.01 115.64 109.19 1wew s THR 27 Ca -0.10 -1.73 0.26 0.00 -1.21 0.00 0.00 61.69 58.91 1wew s THR 27 Cb -0.05 -3.00 0.74 0.00 -1.51 0.00 0.00 72.50 68.68 1wew s THR 27 CO 0.03 -0.00 1.96 -0.67 -2.21 0.00 0.00 174.62 173.73 1wew n ASP 28 N -1.21 0.00 -3.77 8.08 2.03 -1.26 -4.34 116.55 116.08 1wew n ASP 28 Ca -0.01 -1.08 -0.29 0.00 0.52 0.00 0.00 54.79 53.92 1wew n ASP 28 Cb 0.65 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 40.92 1wew n ASP 28 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1wew s SER 29 N -1.86 3.81 0.23 1.67 0.01 -1.26 -5.09 113.70 111.21 1wew s SER 29 Ca 0.39 -2.85 -0.04 0.00 1.31 0.00 0.00 55.95 54.76 1wew s SER 29 Cb 0.18 -1.20 -0.03 0.00 0.21 0.00 0.00 66.02 65.18 1wew s SER 29 CO 0.30 -0.24 0.27 -0.04 0.41 0.00 0.00 173.24 173.94 1wew s MET 30 N 0.02 1.39 -0.08 12.44 -1.94 -1.26 -4.07 119.30 125.81 1wew s MET 30 Ca 0.19 -1.56 0.04 0.00 -1.71 0.00 0.00 55.69 52.65 1wew s MET 30 Cb -0.22 0.35 -0.01 0.00 2.01 0.00 0.00 34.83 36.96 1wew s MET 30 CO -0.02 -0.51 -0.21 0.96 -0.01 0.00 0.00 175.02 175.22 1wew s ILE 31 N -3.99 2.36 0.21 2.53 -4.36 -1.10 -4.94 121.20 111.92 1wew s ILE 31 Ca 0.34 -0.94 -0.07 0.00 -0.26 0.00 0.00 60.65 59.72 1wew s ILE 31 Cb 0.04 -1.90 -0.06 0.00 1.25 0.00 0.00 42.46 41.79 1wew s ILE 31 CO 0.13 0.56 0.49 -1.58 0.24 0.00 0.00 174.94 174.78 1wew s GLN 32 N -0.05 3.70 -0.05 0.37 0.74 -1.26 -1.72 119.66 121.38 1wew s GLN 32 Ca -0.06 0.08 -0.30 0.00 0.05 0.00 0.00 55.36 55.13 1wew s GLN 32 Cb -0.15 -2.72 -0.04 0.00 1.10 0.00 0.00 33.01 31.21 1wew s GLN 32 CO 0.05 0.35 1.27 0.00 -0.55 0.00 0.00 175.29 176.40 1wew h GLU 34 N 7.68 0.64 -6.65 0.00 4.57 -1.01 -3.34 114.58 116.48 1wew h GLU 34 Ca -0.34 -0.04 -0.57 0.00 -1.18 0.00 0.00 59.36 57.23 1wew h GLU 34 Cb 1.16 -0.15 0.08 0.00 -0.16 0.00 0.00 28.75 29.69 1wew h GLU 34 CO 0.90 0.43 0.69 -0.25 -1.18 0.00 0.00 179.01 179.60 1wew n ASP 35 N -4.83 3.09 -0.02 1.04 8.00 -1.26 -4.89 116.55 117.68 1wew n ASP 35 Ca 0.25 1.14 -0.13 0.00 0.71 0.00 0.00 54.79 56.77 1wew n ASP 35 Cb 0.67 -1.48 -0.10 0.00 -0.02 0.00 0.00 41.12 40.20 1wew n ASP 35 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1wew h PRO 36 N 4.38 0.02 -0.94 -0.24 0.13 -2.01 -0.31 132.00 133.04 1wew h PRO 36 Ca -0.46 -0.01 0.04 0.00 -0.87 0.00 0.00 66.00 64.70 1wew h PRO 36 Cb 1.26 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.33 1wew h PRO 36 CO 0.77 0.50 0.61 0.07 -0.23 0.00 0.00 178.00 179.72 1wew h ARG 37 N -0.46 1.13 0.04 0.86 0.11 -1.95 -3.26 114.38 110.85 1wew h ARG 37 Ca 0.00 -0.07 -0.00 0.00 0.10 0.00 0.00 59.98 60.01 1wew h ARG 37 Cb 0.50 -0.26 0.00 0.00 1.11 0.00 0.00 29.97 31.33 1wew h ARG 37 CO 0.00 0.75 -0.02 0.00 0.10 0.00 0.00 179.97 180.80 1wew n HIS 39 N -2.34 -1.66 -3.60 0.00 8.25 -0.13 -4.92 115.22 110.82 1wew n HIS 39 Ca -0.01 0.78 -0.31 0.00 -0.26 0.00 0.00 57.72 57.93 1wew n HIS 39 Cb 0.02 -2.86 -0.04 0.00 1.12 0.00 0.00 29.99 28.23 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 -3.34 5.12 0.03 1.59 -7.23 -1.26 -4.72 120.40 110.59 1wew s VAL 40 Ca 0.70 0.05 -0.09 0.00 -1.81 0.00 0.00 61.98 60.84 1wew s VAL 40 Cb -0.39 -3.65 -0.05 0.00 0.56 0.00 0.00 36.38 32.85 1wew s VAL 40 CO 0.94 -0.05 0.33 0.26 -0.31 0.00 0.00 175.10 176.27 1wew s TRP 41 N -1.76 3.59 -0.05 2.82 0.52 -1.26 -1.10 118.94 121.70 1wew s TRP 41 Ca 0.42 0.69 -0.02 0.00 0.02 0.00 0.00 56.10 57.21 1wew s TRP 41 Cb -0.12 -2.08 0.03 0.00 -1.15 0.00 0.00 33.47 30.16 1wew s TRP 41 CO 0.25 0.58 0.08 -0.65 0.02 0.00 0.00 176.95 177.23 1wew s GLN 42 N -1.73 -0.06 0.16 4.98 -1.52 -0.70 -3.17 119.66 117.62 1wew s GLN 42 Ca 0.29 0.41 -0.33 0.00 -1.95 0.00 0.00 55.36 53.77 1wew s GLN 42 Cb -0.14 -0.46 -0.16 0.00 -0.22 0.00 0.00 33.01 32.04 1wew s GLN 42 CO 0.16 -0.32 1.17 0.72 -0.25 0.00 0.00 175.29 176.77 1wew n HIS 43 N 5.27 1.28 -0.34 0.91 8.25 -1.26 -2.70 115.22 126.63 1wew n HIS 43 Ca -0.04 0.69 -0.02 0.00 -0.26 0.00 0.00 57.72 58.08 1wew n HIS 43 Cb 0.50 -2.28 0.10 0.00 1.12 0.00 0.00 29.99 29.44 1wew n HIS 43 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1wew h VAL 44 N 2.73 1.20 -0.21 1.59 2.07 -1.93 -1.66 116.25 120.04 1wew h VAL 44 Ca -0.44 -0.41 -0.10 0.00 0.82 0.00 0.00 66.70 66.58 1wew h VAL 44 Cb 1.35 -0.10 -0.06 0.00 -1.52 0.00 0.00 31.29 30.96 1wew h VAL 44 CO 0.71 0.22 0.12 0.61 0.02 0.00 0.00 177.57 179.25 1wew n GLY 45 N -1.35 2.44 0.00 2.17 0.00 -1.26 -2.36 105.19 104.83 1wew n GLY 45 Ca 0.11 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.15 0.73 -1.54 0.00 0.24 -1.13 -4.93 118.33 109.56 1wew n VAL 47 Ca 0.00 -0.04 -0.30 0.00 -2.04 0.00 0.00 64.34 61.96 1wew n VAL 47 Cb 0.35 -1.69 -0.06 0.00 -1.47 0.00 0.00 33.84 30.96 1wew n VAL 47 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1wew n ILE 48 N -3.55 -0.05 0.02 1.34 2.08 -0.99 -4.80 119.36 113.41 1wew n ILE 48 Ca -0.17 -0.62 -0.02 0.00 0.56 0.00 0.00 62.75 62.50 1wew n ILE 48 Cb 0.54 -2.19 -0.01 0.00 -0.75 0.00 0.00 39.64 37.24 1wew n ILE 48 CO 0.00 0.00 0.00 0.25 0.56 0.00 0.00 176.55 177.36 1wew h LEU 49 N 19.18 -0.11-10.02 1.39 5.85 -1.92 -3.44 115.31 126.24 1wew h LEU 49 Ca -0.14 0.00 -0.51 0.00 0.84 0.00 0.00 57.88 58.08 1wew h LEU 49 Cb 1.19 0.03 0.07 0.00 0.37 0.00 0.00 40.66 42.32 1wew h LEU 49 CO 1.17 0.24 0.47 -2.16 -0.34 0.00 0.00 178.44 177.82 1wew s PRO 50 N -1.91 3.66 -0.89 5.25 0.04 -1.26 -4.98 135.00 134.90 1wew s PRO 50 Ca -0.02 1.73 0.00 0.00 0.04 0.00 0.00 61.00 62.76 1wew s PRO 50 Cb 0.00 -2.31 0.31 0.00 0.04 0.00 0.00 34.50 32.54 1wew s PRO 50 CO 0.06 -0.63 1.36 -0.25 0.04 0.00 0.00 177.00 177.58 1wew n ASP 51 N -0.69 5.88 0.40 6.66 9.92 -1.26 -4.85 116.55 132.61 1wew n ASP 51 Ca 0.08 -3.55 -0.16 0.00 -0.53 0.00 0.00 54.79 50.63 1wew n ASP 51 Cb 0.49 -1.00 -0.08 0.00 -0.64 0.00 0.00 41.12 39.89 1wew n ASP 51 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 1wew h LYS 52 N 4.39 -1.00 -0.29 -1.24 1.57 -1.96 -3.29 116.57 114.75 1wew h LYS 52 Ca 0.29 0.07 -0.15 0.00 -1.87 0.00 0.00 60.65 58.99 1wew h LYS 52 Cb 0.51 0.23 -0.01 0.00 0.08 0.00 0.00 32.23 33.04 1wew h LYS 52 CO 1.11 -0.66 -0.41 -1.00 -0.57 0.00 0.00 179.45 177.91 1wew h PRO 53 N -1.27 0.70 -5.93 3.15 0.13 -1.85 -3.47 132.00 123.46 1wew h PRO 53 Ca -0.11 -0.37 -0.41 0.00 -0.87 0.00 0.00 66.00 64.25 1wew h PRO 53 Cb 0.80 0.01 0.10 0.00 0.13 0.00 0.00 31.00 32.05 1wew h PRO 53 CO 0.17 0.98 -0.71 -1.33 -0.23 0.00 0.00 178.00 176.88 1wew n MET 54 N -4.03 -7.25 -3.82 0.86 2.81 -1.24 -1.79 117.12 102.65 1wew n MET 54 Ca -0.02 0.78 -0.28 0.00 -1.81 0.00 0.00 57.70 56.36 1wew n MET 54 Cb 0.53 -5.78 0.04 0.00 -0.71 0.00 0.00 33.22 27.31 1wew n MET 54 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1wew n ASP 55 N -2.99 -5.26 0.00 7.83 8.00 -1.26 -4.90 116.55 117.97 1wew n ASP 55 Ca -0.03 -0.71 0.00 0.00 0.71 0.00 0.00 54.79 54.76 1wew n ASP 55 Cb 0.57 -4.22 0.00 0.00 -0.02 0.00 0.00 41.12 37.45 1wew n ASP 55 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wew n GLY 56 N -1.79 4.75 3.05 0.44 0.00 -0.74 -5.06 105.19 105.84 1wew n GLY 56 Ca 0.03 -0.58 -0.26 0.00 0.00 0.00 0.00 46.02 45.21 1wew n GLY 56 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wew s ASN 57 N 1.27 2.08 0.42 1.61 2.20 -1.26 -1.18 114.94 120.07 1wew s ASN 57 Ca 0.00 -0.35 -0.25 0.00 -0.94 0.00 0.00 52.86 51.32 1wew s ASN 57 Cb 0.00 -0.95 -0.08 0.00 -2.00 0.00 0.00 41.25 38.22 1wew s ASN 57 CO 0.00 0.04 1.18 -2.16 -2.94 0.00 0.00 177.10 173.22 1wew s PRO 58 N 0.72 3.97 0.92 3.55 0.04 -1.26 -5.01 135.00 137.93 1wew s PRO 58 Ca -0.13 1.86 -0.15 0.00 0.04 0.00 0.00 61.00 62.62 1wew s PRO 58 Cb -0.16 -2.62 0.23 0.00 0.04 0.00 0.00 34.50 31.99 1wew s PRO 58 CO 0.03 -0.40 0.82 -0.35 0.04 0.00 0.00 177.00 177.14 1wew n PRO 59 N -0.06 -2.61 -1.40 0.56 -0.04 -0.33 -4.12 135.00 127.01 1wew n PRO 59 Ca 0.05 -1.31 -0.40 0.00 -0.04 0.00 0.00 63.50 61.80 1wew n PRO 59 Cb 0.46 -1.22 0.02 0.00 -0.04 0.00 0.00 33.50 32.72 1wew n PRO 59 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1wew n LEU 60 N 0.00 -0.80 -4.70 1.53 -0.00 -1.26 -4.73 117.00 107.03 1wew n LEU 60 Ca 0.11 0.80 -0.42 0.00 -0.00 0.00 0.00 56.01 56.51 1wew n LEU 60 Cb 0.44 -1.05 -0.03 0.00 -0.00 0.00 0.00 43.42 42.78 1wew n LEU 60 CO 0.30 -3.44 1.11 -2.16 -0.00 0.00 0.00 177.39 173.21 1wew s PRO 61 N -1.54 4.29 0.04 1.47 0.04 -1.26 -4.95 135.00 133.09 1wew s PRO 61 Ca 0.63 2.03 -0.31 0.00 0.04 0.00 0.00 61.00 63.39 1wew s PRO 61 Cb -0.54 -3.46 -0.18 0.00 0.04 0.00 0.00 34.50 30.35 1wew s PRO 61 CO 0.59 -0.53 1.42 1.49 0.04 0.00 0.00 177.00 180.00 1wew h GLU 62 N 7.51 -0.92 -5.93 4.56 4.57 -1.98 -3.38 114.58 119.01 1wew h GLU 62 Ca -0.40 0.06 -0.46 0.00 -1.18 0.00 0.00 59.36 57.39 1wew h GLU 62 Cb 1.19 0.21 -0.04 0.00 -0.16 0.00 0.00 28.75 29.95 1wew h GLU 62 CO 0.89 -0.59 1.23 -1.12 -1.18 0.00 0.00 179.01 178.24 1wew s SER 63 N -4.42 5.25 0.10 1.04 0.01 -1.26 -4.64 113.70 109.79 1wew s SER 63 Ca -0.17 0.12 0.02 0.00 1.31 0.00 0.00 55.95 57.24 1wew s SER 63 Cb 0.02 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.68 1wew s SER 63 CO 0.55 -2.45 -0.08 0.12 0.41 0.00 0.00 173.24 171.79 1wew s PHE 64 N 9.27 0.96 -0.11 2.43 5.36 -1.26 -5.00 117.98 129.63 1wew s PHE 64 Ca 0.68 -0.83 -0.04 0.00 -0.96 0.00 0.00 56.93 55.78 1wew s PHE 64 Cb -0.11 -0.54 0.06 0.00 -0.34 0.00 0.00 43.02 42.09 1wew s PHE 64 CO 0.16 -0.09 0.21 0.71 -1.46 0.00 0.00 175.22 174.76 1wew s TYR 65 N -3.28 -0.31 1.02 10.12 2.02 -1.26 -0.43 117.35 125.23 1wew s TYR 65 Ca 0.10 0.79 -0.13 0.00 -0.37 0.00 0.00 57.07 57.46 1wew s TYR 65 Cb 0.03 -0.15 0.20 0.00 -0.40 0.00 0.00 41.96 41.63 1wew s TYR 65 CO -0.03 -0.32 0.43 0.00 -1.57 0.00 0.00 175.55 174.06 1wew h GLU 67 N -2.85 0.00 0.00 0.00 -0.00 -1.99 -0.24 114.58 109.51 1wew h GLU 67 Ca -0.21 0.00 -0.20 0.00 -0.00 0.00 0.00 59.36 58.95 1wew h GLU 67 Cb 0.71 0.00 -0.03 0.00 -0.00 0.00 0.00 28.75 29.43 1wew h GLU 67 CO 0.13 0.02 -1.14 0.82 -0.00 0.00 0.00 179.01 178.84 1wew h ILE 68 N 0.00 1.06 0.04 -1.06 2.04 -1.97 -3.25 117.51 114.37 1wew h ILE 68 Ca -0.00 -2.68 -0.20 0.00 1.00 0.00 0.00 64.86 62.98 1wew h ILE 68 Cb 0.47 2.48 -0.02 0.00 -0.74 0.00 0.00 36.82 39.01 1wew h ILE 68 CO 0.00 0.60 -1.07 0.00 0.00 0.00 0.00 178.15 177.68 1wew h ARG 70 N -0.74 0.64 -0.42 0.00 0.11 -1.20 0.14 114.38 112.91 1wew h ARG 70 Ca -0.27 -0.04 -0.01 0.00 0.10 0.00 0.00 59.98 59.76 1wew h ARG 70 Cb 1.41 -0.14 -0.02 0.00 1.11 0.00 0.00 29.97 32.33 1wew h ARG 70 CO -0.07 0.42 0.20 1.37 0.10 0.00 0.00 179.97 181.99 1wew h LEU 71 N 0.66 0.51 -6.98 0.08 8.10 -1.71 -3.29 115.31 112.68 1wew h LEU 71 Ca 0.50 -0.04 -0.72 0.00 0.11 0.00 0.00 57.88 57.73 1wew h LEU 71 Cb 0.74 -0.13 -0.11 0.00 -0.44 0.00 0.00 40.66 40.72 1wew h LEU 71 CO -0.38 0.44 2.22 0.35 -4.11 0.00 0.00 178.44 176.96 1wew n THR 72 N -4.41 3.98 -3.61 0.15 -2.24 0.50 -4.84 114.28 103.82 1wew n THR 72 Ca 0.03 -4.03 -0.02 0.00 -2.27 0.00 0.00 64.05 57.76 1wew n THR 72 Cb 0.12 -2.45 -0.06 0.00 -2.10 0.00 0.00 70.33 65.84 1wew n THR 72 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1wew s SER 73 N 2.80 -0.57 -0.43 3.42 0.15 -1.24 -4.97 113.70 112.85 1wew s SER 73 Ca 0.46 0.89 -0.27 0.00 0.70 0.00 0.00 55.95 57.72 1wew s SER 73 Cb 0.07 1.31 0.02 0.00 -1.71 0.00 0.00 66.02 65.71 1wew s SER 73 CO -0.00 -0.14 1.03 -0.83 1.20 0.00 0.00 173.24 174.51 1wew s GLY 74 N 1.54 1.43 -0.32 9.45 0.00 -1.26 -4.99 107.32 113.17 1wew s GLY 74 Ca -0.08 -0.49 -0.29 0.00 0.00 0.00 0.00 44.72 43.86 1wew s GLY 74 CO -0.16 2.22 1.68 2.56 0.00 0.00 0.00 173.10 179.41 1wew s PRO 75 N 3.97 3.48 -0.13 2.90 0.04 -1.26 -4.99 135.00 139.01 1wew s PRO 75 Ca 0.43 1.37 0.02 0.00 0.04 0.00 0.00 61.00 62.86 1wew s PRO 75 Cb -0.10 -4.13 0.01 0.00 0.04 0.00 0.00 34.50 30.33 1wew s PRO 75 CO 0.25 -1.68 -0.20 -1.12 0.04 0.00 0.00 177.00 174.29 1wew s SER 76 N 5.26 2.93 0.16 6.66 0.01 -1.26 -5.03 113.70 122.43 1wew s SER 76 Ca 0.74 -0.56 -0.20 0.00 1.31 0.00 0.00 55.95 57.24 1wew s SER 76 Cb -0.21 -1.35 0.06 0.00 0.21 0.00 0.00 66.02 64.73 1wew s SER 76 CO 0.33 0.06 1.26 -1.20 0.41 0.00 0.00 173.24 174.10 1wew n SER 77 N 4.13 -0.71 0.00 2.44 7.64 -1.26 -5.33 113.62 120.53 1wew n SER 77 Ca -0.20 1.44 0.00 0.00 1.01 0.00 0.00 58.87 61.12 1wew n SER 77 Cb 0.51 -0.25 0.00 0.00 -1.01 0.00 0.00 64.21 63.46 1wew n SER 77 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64