#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wee s SER 2 N 0.00 0.79 -0.28 1.61 1.04 -1.26 -5.18 113.70 110.43 1wee s SER 2 Ca 0.00 -1.46 -0.22 0.00 0.48 0.00 0.00 55.95 54.75 1wee s SER 2 Cb 0.00 0.56 0.09 0.00 0.10 0.00 0.00 66.02 66.76 1wee s SER 2 CO 0.00 -1.11 0.79 -0.44 0.98 0.00 0.00 173.24 173.46 1wee s SER 3 N -3.22 -0.73 -1.08 7.02 0.01 -1.26 -5.07 113.70 109.36 1wee s SER 3 Ca 0.34 1.32 -0.25 0.00 1.31 0.00 0.00 55.95 58.67 1wee s SER 3 Cb 0.02 1.33 -0.16 0.00 0.21 0.00 0.00 66.02 67.42 1wee s SER 3 CO 0.19 -0.22 2.07 -0.83 0.41 0.00 0.00 173.24 174.85 1wee s GLY 4 N 0.76 -0.56 0.62 3.44 0.00 -1.26 -4.91 107.32 105.40 1wee s GLY 4 Ca -0.03 -1.66 -0.07 0.00 0.00 0.00 0.00 44.72 42.97 1wee s GLY 4 CO -0.07 3.98 0.94 -0.56 0.00 0.00 0.00 173.10 177.38 1wee s SER 5 N 8.00 5.51 0.35 1.64 0.01 -1.26 -5.02 113.70 122.93 1wee s SER 5 Ca 0.77 0.76 -0.29 0.00 1.31 0.00 0.00 55.95 58.50 1wee s SER 5 Cb -0.04 -1.70 -0.11 0.00 0.21 0.00 0.00 66.02 64.38 1wee s SER 5 CO 0.14 -1.14 1.50 -0.44 0.41 0.00 0.00 173.24 173.71 1wee s SER 6 N -4.33 6.39 0.00 2.44 0.01 -1.26 -4.87 113.70 112.08 1wee s SER 6 Ca 0.55 2.99 0.00 0.00 1.31 0.00 0.00 55.95 60.80 1wee s SER 6 Cb -0.11 -2.66 0.00 0.00 0.21 0.00 0.00 66.02 63.47 1wee s SER 6 CO 0.46 -0.86 0.00 0.61 0.41 0.00 0.00 173.24 173.86 1wee n GLY 7 N 0.98 3.20 3.11 3.44 0.00 -1.26 -5.08 105.19 109.59 1wee n GLY 7 Ca 0.03 -0.73 -0.37 0.00 0.00 0.00 0.00 46.02 44.95 1wee n GLY 7 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1wee s MET 8 N -3.27 2.56 -0.47 1.61 1.00 -1.26 -5.05 119.30 114.43 1wee s MET 8 Ca 0.00 -2.45 -0.44 0.00 0.00 0.00 0.00 55.69 52.79 1wee s MET 8 Cb 0.00 -3.75 -0.19 0.00 0.00 0.00 0.00 34.83 30.89 1wee s MET 8 CO 0.00 -1.17 1.84 0.39 0.00 0.00 0.00 175.02 176.08 1wee n GLU 9 N 3.63 0.19 -2.10 2.03 -0.58 -1.26 -4.92 120.64 117.63 1wee n GLU 9 Ca 0.07 0.07 -0.28 0.00 -0.42 0.00 0.00 57.16 56.59 1wee n GLU 9 Cb 0.39 -1.63 0.18 0.00 -0.57 0.00 0.00 31.44 29.81 1wee n GLU 9 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1wee s ARG 10 N 4.33 0.68 0.00 3.49 3.00 -1.26 -5.11 118.95 124.08 1wee s ARG 10 Ca 1.10 -0.68 0.00 0.00 0.00 0.00 0.00 55.73 56.15 1wee s ARG 10 Cb -1.41 -1.95 0.00 0.00 0.00 0.00 0.00 34.95 31.59 1wee s ARG 10 CO 0.73 -2.31 0.00 0.41 0.00 0.00 0.00 175.30 174.12 1wee n GLY 11 N -3.61 3.82 3.10 -3.53 0.00 -1.26 -5.16 105.19 98.56 1wee n GLY 11 Ca 0.16 -1.14 -0.26 0.00 0.00 0.00 0.00 46.02 44.79 1wee n GLY 11 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1wee n VAL 12 N 0.00 0.00 -0.04 1.61 0.24 -1.26 -5.00 118.33 113.89 1wee n VAL 12 Ca 0.00 -0.13 -0.08 0.00 -2.04 0.00 0.00 64.34 62.09 1wee n VAL 12 Cb 0.00 -0.45 -0.03 0.00 -1.47 0.00 0.00 33.84 31.89 1wee n VAL 12 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1wee n ASP 13 N -0.65 0.59 -2.53 -1.34 5.75 -1.26 -4.84 116.55 112.27 1wee n ASP 13 Ca 0.02 0.09 -0.16 0.00 -0.01 0.00 0.00 54.79 54.73 1wee n ASP 13 Cb 0.50 -0.22 0.02 0.00 -1.03 0.00 0.00 41.12 40.40 1wee n ASP 13 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1wee n ASN 14 N -3.32 3.12 -4.03 -1.12 5.15 -1.26 -5.07 115.26 108.73 1wee n ASN 14 Ca -0.15 -3.13 -0.09 0.00 -0.60 0.00 0.00 54.58 50.62 1wee n ASN 14 Cb 0.60 -0.47 -0.09 0.00 -0.53 0.00 0.00 39.78 39.29 1wee n ASN 14 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 1wee s TRP 15 N -3.43 0.52 -0.32 1.20 0.51 -1.26 -5.08 118.94 111.08 1wee s TRP 15 Ca 0.38 -0.95 0.14 0.00 -2.12 0.00 0.00 56.10 53.55 1wee s TRP 15 Cb 0.41 -0.27 0.47 0.00 -0.81 0.00 0.00 33.47 33.27 1wee s TRP 15 CO -0.06 -0.54 1.09 1.63 -0.51 0.00 0.00 176.95 178.57 1wee n LYS 16 N -0.06 2.39 -1.70 4.98 5.02 -1.26 -4.89 118.16 122.63 1wee n LYS 16 Ca -0.10 -3.82 -0.60 0.00 -2.02 0.00 0.00 58.31 51.77 1wee n LYS 16 Cb 0.63 -1.81 -0.08 0.00 -0.02 0.00 0.00 35.03 33.74 1wee n LYS 16 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1wee n VAL 17 N -0.46 0.18 -3.19 -0.18 0.31 -1.26 -4.22 118.33 109.50 1wee n VAL 17 Ca 0.23 -0.03 0.01 0.00 -0.01 0.00 0.00 64.34 64.54 1wee n VAL 17 Cb 0.82 -0.92 -0.02 0.00 -0.91 0.00 0.00 33.84 32.81 1wee n VAL 17 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1wee s ASP 18 N 2.95 -1.06 0.53 4.52 2.15 -1.14 -4.47 116.67 120.15 1wee s ASP 18 Ca 0.99 0.62 0.04 0.00 0.43 0.00 0.00 52.55 54.63 1wee s ASP 18 Cb -1.20 1.92 0.04 0.00 -0.30 0.00 0.00 42.92 43.39 1wee s ASP 18 CO 0.68 -0.28 0.73 0.00 -0.17 0.00 0.00 175.17 176.14 1wee h LYS 20 N 0.21 0.37 -0.75 0.00 2.10 -1.95 -3.34 116.57 113.21 1wee h LYS 20 Ca -0.40 -0.64 0.00 0.00 -2.00 0.00 0.00 60.65 57.61 1wee h LYS 20 Cb 1.29 0.24 -0.04 0.00 -0.90 0.00 0.00 32.23 32.82 1wee h LYS 20 CO 0.47 1.28 0.47 0.00 -2.00 0.00 0.00 179.45 179.67 1wee n GLY 22 N -1.23 1.68 3.70 0.00 0.00 -1.26 -5.12 105.19 102.96 1wee n GLY 22 Ca 0.07 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 1wee n GLY 22 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wee s THR 23 N 0.00 2.50 -0.04 2.61 2.01 -1.26 -4.71 115.64 116.74 1wee s THR 23 Ca 0.00 0.08 0.06 0.00 0.31 0.00 0.00 61.69 62.14 1wee s THR 23 Cb 0.00 -3.05 0.09 0.00 0.01 0.00 0.00 72.50 69.55 1wee s THR 23 CO 0.00 0.00 0.98 2.29 -0.69 0.00 0.00 174.62 177.20 1wee n LYS 24 N 5.40 0.75 -4.06 4.92 -0.00 -1.26 -0.57 118.16 123.33 1wee n LYS 24 Ca 0.17 -1.50 -0.13 0.00 -0.00 0.00 0.00 58.31 56.86 1wee n LYS 24 Cb 0.38 -0.88 -0.11 0.00 -0.00 0.00 0.00 35.03 34.41 1wee n LYS 24 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1wee s ASP 25 N -1.47 0.85 -0.11 -5.58 2.15 -1.26 -4.36 116.67 106.89 1wee s ASP 25 Ca 0.10 -0.56 -0.29 0.00 0.43 0.00 0.00 52.55 52.23 1wee s ASP 25 Cb 0.09 0.04 -0.05 0.00 -0.30 0.00 0.00 42.92 42.70 1wee s ASP 25 CO 0.01 -0.21 1.77 1.51 -0.17 0.00 0.00 175.17 178.08 1wee s ASP 26 N -1.61 6.38 0.00 -0.34 -4.77 -1.26 -4.85 116.67 110.23 1wee s ASP 26 Ca -0.10 2.06 -0.06 0.00 -3.30 0.00 0.00 52.55 51.16 1wee s ASP 26 Cb -0.10 -2.53 -0.02 0.00 -1.09 0.00 0.00 42.92 39.18 1wee s ASP 26 CO 0.00 -1.19 -0.12 0.47 0.70 0.00 0.00 175.17 175.04 1wee n ASP 27 N 8.21 1.38 0.00 2.11 8.00 -1.26 -5.05 116.55 129.93 1wee n ASP 27 Ca 0.20 0.20 0.00 0.00 0.71 0.00 0.00 54.79 55.90 1wee n ASP 27 Cb 0.44 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 41.06 1wee n ASP 27 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wee n GLY 28 N 2.80 0.01 3.72 0.44 0.00 -1.26 -5.13 105.19 105.78 1wee n GLY 28 Ca -0.05 -0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 1wee n GLY 28 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wee s GLU 29 N -0.49 4.50 0.71 1.61 8.01 -1.26 -4.99 118.70 126.79 1wee s GLU 29 Ca 0.00 1.75 -0.16 0.00 0.01 0.00 0.00 54.97 56.57 1wee s GLU 29 Cb 0.00 -3.31 -0.03 0.00 -4.31 0.00 0.00 34.13 26.48 1wee s GLU 29 CO 0.00 -0.11 0.63 -2.13 0.01 0.00 0.00 175.26 173.66 1wee n ARG 30 N 3.19 0.36 -3.90 1.61 3.00 -1.26 -4.89 116.66 114.78 1wee n ARG 30 Ca 0.06 0.16 -0.09 0.00 -0.00 0.00 0.00 57.85 57.99 1wee n ARG 30 Cb 0.46 -1.91 -0.07 0.00 0.00 0.00 0.00 32.46 30.94 1wee n ARG 30 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.63 175.99 1wee s MET 31 N -2.85 0.87 -0.07 -0.14 -1.94 -1.26 -2.52 119.30 111.40 1wee s MET 31 Ca 0.67 -1.02 -0.03 0.00 -1.71 0.00 0.00 55.69 53.60 1wee s MET 31 Cb -0.35 0.33 0.03 0.00 2.01 0.00 0.00 34.83 36.86 1wee s MET 31 CO 0.56 -0.28 0.15 -0.48 -0.01 0.00 0.00 175.02 174.96 1wee s LEU 32 N -2.89 0.83 0.15 -0.03 2.34 -0.92 -4.82 118.68 113.35 1wee s LEU 32 Ca 0.07 0.31 -0.13 0.00 0.06 0.00 0.00 54.13 54.44 1wee s LEU 32 Cb 0.05 0.40 -0.07 0.00 -0.56 0.00 0.00 46.19 46.01 1wee s LEU 32 CO -0.09 -0.13 0.54 0.00 -1.06 0.00 0.00 176.35 175.61 1wee s ALA 33 N 0.99 3.59 -0.14 1.48 0.00 -1.26 -1.38 121.76 125.04 1wee s ALA 33 Ca -0.08 -0.17 -0.29 0.00 0.00 0.00 0.00 51.96 51.43 1wee s ALA 33 Cb -0.10 -2.50 -0.06 0.00 0.00 0.00 0.00 23.12 20.47 1wee s ALA 33 CO -0.05 0.47 2.00 0.00 0.00 0.00 0.00 175.76 178.18 1wee h ASP 35 N 12.63 0.27 0.00 0.00 1.82 -1.85 0.13 116.42 129.41 1wee h ASP 35 Ca -0.42 0.16 0.00 0.00 -0.39 0.00 0.00 57.03 56.38 1wee h ASP 35 Cb 1.22 0.15 0.00 0.00 0.68 0.00 0.00 39.33 41.37 1wee h ASP 35 CO 0.97 -0.22 0.00 0.61 -1.61 0.00 0.00 179.24 178.99 1wee n GLY 36 N -1.48 -0.12 0.01 -0.78 0.00 -1.26 -4.68 105.19 96.87 1wee n GLY 36 Ca 0.37 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.39 1wee n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wee n GLY 38 N 0.19 0.78 3.10 0.00 0.00 0.43 -4.93 105.19 104.76 1wee n GLY 38 Ca -0.00 -0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 1wee n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wee s VAL 39 N 0.00 2.30 0.68 1.61 1.01 -1.26 -4.24 120.40 120.50 1wee s VAL 39 Ca 0.00 -1.48 -0.17 0.00 0.00 0.00 0.00 61.98 60.33 1wee s VAL 39 Cb 0.00 -2.29 0.01 0.00 0.00 0.00 0.00 36.38 34.10 1wee s VAL 39 CO 0.00 0.05 1.23 0.26 0.00 0.00 0.00 175.10 176.64 1wee s TRP 40 N 1.16 2.11 -0.10 5.22 0.52 -1.25 -2.75 118.94 123.85 1wee s TRP 40 Ca -0.06 1.55 -0.18 0.00 0.02 0.00 0.00 56.10 57.43 1wee s TRP 40 Cb -0.19 -3.54 0.04 0.00 -1.15 0.00 0.00 33.47 28.63 1wee s TRP 40 CO -0.05 -2.65 0.43 -1.01 0.02 0.00 0.00 176.95 173.69 1wee s HIS 41 N -1.74 -0.41 -0.36 -1.98 3.76 -0.48 -2.86 115.29 111.22 1wee s HIS 41 Ca 0.77 0.87 -0.30 0.00 -0.15 0.00 0.00 55.06 56.26 1wee s HIS 41 Cb -0.32 0.18 -0.08 0.00 1.11 0.00 0.00 32.58 33.47 1wee s HIS 41 CO 0.42 -0.34 2.29 0.72 -0.85 0.00 0.00 174.74 176.97 1wee n HIS 42 N 2.02 1.66 -0.37 1.40 8.25 -1.26 -2.16 115.22 124.75 1wee n HIS 42 Ca -0.17 0.07 0.35 0.00 -0.26 0.00 0.00 57.72 57.71 1wee n HIS 42 Cb 0.57 -2.63 0.62 0.00 1.12 0.00 0.00 29.99 29.66 1wee n HIS 42 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1wee n THR 43 N 7.65 -0.37 0.23 1.59 -2.24 -1.05 -0.53 114.28 119.57 1wee n THR 43 Ca 0.37 1.97 -0.11 0.00 -2.27 0.00 0.00 64.05 64.00 1wee n THR 43 Cb 0.39 -3.20 -0.06 0.00 -2.10 0.00 0.00 70.33 65.36 1wee n THR 43 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1wee h ARG 44 N 0.00 -0.63 -0.70 -0.78 9.65 -1.77 0.64 114.38 120.80 1wee h ARG 44 Ca 0.86 0.04 0.14 0.00 -1.10 0.00 0.00 59.98 59.92 1wee h ARG 44 Cb 2.44 0.14 -0.13 0.00 -1.39 0.00 0.00 29.97 31.03 1wee h ARG 44 CO -0.68 -0.38 -0.22 0.00 2.80 0.00 0.00 179.97 181.49 1wee h ILE 46 N -0.04 0.50 0.00 0.00 3.07 -1.23 -3.45 117.51 116.36 1wee h ILE 46 Ca 0.32 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.73 1wee h ILE 46 Cb 0.53 0.91 0.00 0.00 -0.27 0.00 0.00 36.82 37.99 1wee h ILE 46 CO -0.73 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 176.98 1wee n GLY 47 N -1.37 0.88 2.74 0.16 0.00 0.34 -5.11 105.19 102.84 1wee n GLY 47 Ca -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 1wee n GLY 47 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wee s ILE 48 N -1.15 -0.29 0.49 -0.61 1.01 0.22 -4.98 121.20 115.89 1wee s ILE 48 Ca 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 60.65 60.56 1wee s ILE 48 Cb 0.00 -0.63 -0.00 0.00 0.01 0.00 0.00 42.46 41.84 1wee s ILE 48 CO 0.00 -0.18 0.73 0.20 0.00 0.00 0.00 174.94 175.69 1wee s ASN 49 N 2.30 5.80 0.27 3.58 0.01 -1.26 -2.56 114.94 123.08 1wee s ASN 49 Ca 0.06 0.43 -0.02 0.00 -0.71 0.00 0.00 52.86 52.62 1wee s ASN 49 Cb -0.15 -1.62 0.59 0.00 0.41 0.00 0.00 41.25 40.47 1wee s ASN 49 CO -0.11 -0.78 1.64 0.78 -1.51 0.00 0.00 177.10 177.12 1wee h ASN 50 N 0.25 -0.18 -0.99 -1.22 2.35 -2.00 0.37 115.58 114.16 1wee h ASN 50 Ca -0.46 0.20 0.23 0.00 -0.55 0.00 0.00 56.30 55.72 1wee h ASN 50 Cb 1.25 0.31 -0.19 0.00 0.05 0.00 0.00 38.32 39.74 1wee h ASN 50 CO 0.58 -0.17 -0.12 0.00 -1.65 0.00 0.00 177.43 176.08 1wee h ALA 51 N 1.76 0.90 -2.60 -0.83 0.00 -2.05 -3.38 119.26 113.06 1wee h ALA 51 Ca 0.49 0.37 -0.55 0.00 0.00 0.00 0.00 54.91 55.21 1wee h ALA 51 Cb 0.94 0.68 -0.04 0.00 0.00 0.00 0.00 17.79 19.37 1wee h ALA 51 CO -0.67 -0.47 -0.04 -0.51 0.00 0.00 0.00 179.25 177.55 1wee s ASP 52 N -5.14 6.91 0.73 0.00 1.01 0.12 -5.08 116.67 115.22 1wee s ASP 52 Ca -0.14 1.17 -0.07 0.00 0.71 0.00 0.00 52.55 54.22 1wee s ASP 52 Cb 0.28 -2.33 0.08 0.00 1.01 0.00 0.00 42.92 41.96 1wee s ASP 52 CO 0.78 0.12 1.05 0.00 0.21 0.00 0.00 175.17 177.33 1wee s ALA 53 N -1.41 3.09 0.00 5.23 0.00 -1.26 -4.67 121.76 122.75 1wee s ALA 53 Ca 0.37 -0.97 -0.30 0.00 0.00 0.00 0.00 51.96 51.05 1wee s ALA 53 Cb -0.16 -2.60 -0.03 0.00 0.00 0.00 0.00 23.12 20.33 1wee s ALA 53 CO 0.19 -1.42 1.00 -0.51 0.00 0.00 0.00 175.76 175.03 1wee s LEU 54 N -5.31 4.37 -0.02 0.00 1.43 -1.26 -5.00 118.68 112.89 1wee s LEU 54 Ca 0.62 1.69 -0.30 0.00 -1.03 0.00 0.00 54.13 55.11 1wee s LEU 54 Cb -0.10 -3.57 -0.05 0.00 0.03 0.00 0.00 46.19 42.50 1wee s LEU 54 CO 0.46 -0.29 1.46 -2.16 0.23 0.00 0.00 176.35 176.05 1wee s PRO 55 N 1.04 4.25 0.31 1.29 0.04 -1.26 -4.88 135.00 135.79 1wee s PRO 55 Ca 0.53 2.02 0.16 0.00 0.04 0.00 0.00 61.00 63.74 1wee s PRO 55 Cb -0.22 -3.67 1.09 0.00 0.04 0.00 0.00 34.50 31.74 1wee s PRO 55 CO 0.28 -0.66 1.34 0.45 0.04 0.00 0.00 177.00 178.46 1wee n SER 56 N 5.84 0.25 -4.13 6.66 2.88 -1.26 -4.19 113.62 119.68 1wee n SER 56 Ca 0.14 1.42 -0.23 0.00 -1.33 0.00 0.00 58.87 58.87 1wee n SER 56 Cb 0.43 -0.67 -0.15 0.00 -0.75 0.00 0.00 64.21 63.07 1wee n SER 56 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1wee s LYS 57 N -5.36 1.19 -0.06 -1.46 1.02 -1.26 -4.97 119.74 108.84 1wee s LYS 57 Ca -0.08 -0.58 -0.02 0.00 0.02 0.00 0.00 55.97 55.31 1wee s LYS 57 Cb 0.29 -1.17 0.03 0.00 -0.52 0.00 0.00 37.83 36.46 1wee s LYS 57 CO 0.66 0.32 0.06 0.12 -0.92 0.00 0.00 175.35 175.59 1wee s PHE 58 N -0.42 0.11 -0.23 3.18 5.36 -1.26 -5.01 117.98 119.69 1wee s PHE 58 Ca 0.05 0.16 -0.08 0.00 -0.96 0.00 0.00 56.93 56.10 1wee s PHE 58 Cb -0.06 -0.52 -0.04 0.00 -0.34 0.00 0.00 43.02 42.06 1wee s PHE 58 CO -0.00 -0.24 0.10 -0.51 -1.46 0.00 0.00 175.22 173.11 1wee s LEU 59 N 2.16 3.73 0.84 6.12 2.01 -1.26 -2.41 118.68 129.87 1wee s LEU 59 Ca 0.05 -0.05 -0.11 0.00 0.01 0.00 0.00 54.13 54.02 1wee s LEU 59 Cb -0.13 -1.99 0.10 0.00 0.01 0.00 0.00 46.19 44.18 1wee s LEU 59 CO -0.04 0.03 1.15 0.00 1.01 0.00 0.00 176.35 178.50 1wee n PHE 61 N -3.75 -0.34 -0.09 0.00 3.01 -1.26 -0.00 117.46 115.04 1wee n PHE 61 Ca 0.12 0.95 -0.08 0.00 1.01 0.00 0.00 57.45 59.45 1wee n PHE 61 Cb 0.52 -0.55 -0.01 0.00 -0.01 0.00 0.00 39.48 39.42 1wee n PHE 61 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1wee h ARG 62 N 0.00 -0.24 0.33 -1.08 3.08 -2.01 -2.68 114.38 111.78 1wee h ARG 62 Ca 0.12 0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 1wee h ARG 62 Cb 0.31 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.39 1wee h ARG 62 CO -0.72 -0.16 -0.42 0.00 -1.07 0.00 0.00 179.97 177.60 1wee n ILE 64 N -4.93 -0.15 -0.04 0.00 5.41 1.00 0.16 119.36 120.81 1wee n ILE 64 Ca -0.09 1.23 -0.20 0.00 1.00 0.00 0.00 62.75 64.68 1wee n ILE 64 Cb 0.37 -2.02 -0.13 0.00 -0.71 0.00 0.00 39.64 37.15 1wee n ILE 64 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 1wee h GLU 65 N 0.00 0.12 -0.71 0.38 5.08 -1.10 -3.36 114.58 114.99 1wee h GLU 65 Ca 0.63 -0.21 0.11 0.00 -1.00 0.00 0.00 59.36 58.89 1wee h GLU 65 Cb 2.11 0.08 -0.08 0.00 0.50 0.00 0.00 28.75 31.36 1wee h GLU 65 CO -0.27 1.10 0.32 -0.07 -1.00 0.00 0.00 179.01 179.09 1wee h LEU 66 N -0.64 0.36 -8.51 1.33 3.38 0.36 -3.43 115.31 108.17 1wee h LEU 66 Ca -0.28 0.08 -0.59 0.00 0.09 0.00 0.00 57.88 57.18 1wee h LEU 66 Cb 1.49 0.03 0.14 0.00 0.09 0.00 0.00 40.66 42.42 1wee h LEU 66 CO -0.04 0.19 -0.86 -0.24 0.09 0.00 0.00 178.44 177.58 1wee n SER 67 N -4.93 -2.57 0.00 -0.43 2.88 0.45 -4.63 113.62 104.38 1wee n SER 67 Ca 0.12 0.80 0.00 0.00 -1.33 0.00 0.00 58.87 58.45 1wee n SER 67 Cb 0.32 -0.84 0.00 0.00 -0.75 0.00 0.00 64.21 62.94 1wee n SER 67 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wee n GLY 68 N 2.18 1.05 3.56 0.46 0.00 -1.26 -4.84 105.19 106.33 1wee n GLY 68 Ca 0.11 -2.05 -0.27 0.00 0.00 0.00 0.00 46.02 43.81 1wee n GLY 68 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wee s PRO 69 N -1.65 2.56 -0.31 1.61 0.04 -1.26 -4.76 135.00 131.23 1wee s PRO 69 Ca 0.00 -0.23 0.08 0.00 0.04 0.00 0.00 61.00 60.89 1wee s PRO 69 Cb 0.00 -5.02 0.46 0.00 0.04 0.00 0.00 34.50 29.98 1wee s PRO 69 CO 0.00 -3.33 1.17 0.43 0.04 0.00 0.00 177.00 175.30 1wee n SER 70 N 13.89 4.51 -3.99 6.66 7.64 -1.26 -4.97 113.62 136.11 1wee n SER 70 Ca 0.39 -3.56 -0.31 0.00 1.01 0.00 0.00 58.87 56.40 1wee n SER 70 Cb 0.47 -0.37 -0.15 0.00 -1.01 0.00 0.00 64.21 63.15 1wee n SER 70 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wee s SER 71 N -3.60 4.67 0.00 6.43 0.15 -1.26 -5.17 113.70 114.91 1wee s SER 71 Ca 0.48 -2.07 0.30 0.00 0.70 0.00 0.00 55.95 55.35 1wee s SER 71 Cb 0.40 -1.53 1.48 0.00 -1.71 0.00 0.00 66.02 64.66 1wee s SER 71 CO -0.00 -0.38 1.99 0.61 1.20 0.00 0.00 173.24 176.66