#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 7.06 -0.19 1.61 0.15 -1.26 -4.95 113.70 116.12 1wee s SER 2 Ca 0.00 1.99 -0.15 0.00 0.70 0.00 0.00 55.95 58.49 1wee s SER 2 Cb 0.00 -2.57 -0.10 0.00 -1.71 0.00 0.00 66.02 61.63 1wee s SER 2 CO 0.00 -0.50 -0.09 -0.24 1.20 0.00 0.00 173.24 173.61 1wee n SER 3 N 4.17 1.87 0.00 5.45 2.88 -1.26 -5.12 113.62 121.61 1wee n SER 3 Ca 0.09 0.48 0.00 0.00 -1.33 0.00 0.00 58.87 58.11 1wee n SER 3 Cb 0.46 -0.88 0.00 0.00 -0.75 0.00 0.00 64.21 63.04 1wee n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wee n GLY 4 N 1.48 -1.56 0.04 0.46 0.00 -1.26 -5.04 105.19 99.30 1wee n GLY 4 Ca -0.24 -1.53 -0.02 0.00 0.00 0.00 0.00 46.02 44.23 1wee n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1wee h SER 5 N 0.00 0.00 -0.74 1.61 0.87 -2.06 -3.49 113.55 109.74 1wee h SER 5 Ca 0.00 0.00 0.17 0.00 -1.23 0.00 0.00 61.79 60.73 1wee h SER 5 Cb 0.00 0.00 -0.21 0.00 -0.44 0.00 0.00 62.40 61.75 1wee h SER 5 CO 0.00 0.40 -0.03 -0.94 -0.53 0.00 0.00 176.83 175.74 1wee s SER 6 N -4.73 -0.87 -0.32 6.23 1.04 -1.26 -5.06 113.70 108.73 1wee s SER 6 Ca -0.06 0.63 0.07 0.00 0.48 0.00 0.00 55.95 57.07 1wee s SER 6 Cb 0.01 1.76 0.28 0.00 0.10 0.00 0.00 66.02 68.17 1wee s SER 6 CO 0.09 -0.16 1.25 0.61 0.98 0.00 0.00 173.24 176.01 1wee n GLY 7 N 5.40 0.81 2.66 7.32 0.00 -1.26 -5.06 105.19 115.06 1wee n GLY 7 Ca -0.05 -0.10 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 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 0.12 1.68 0.00 1.61 1.00 -1.26 -5.08 119.30 117.37 1wee s MET 8 Ca 0.12 -2.69 0.00 0.00 0.00 0.00 0.00 55.69 53.12 1wee s MET 8 Cb 0.29 -2.45 -0.00 0.00 0.00 0.00 0.00 34.83 32.67 1wee s MET 8 CO -0.07 -1.32 -0.01 -1.21 0.00 0.00 0.00 175.02 172.41 1wee s GLU 9 N -0.64 0.09 -0.02 2.03 2.02 -1.26 -5.15 118.70 115.77 1wee s GLU 9 Ca 0.28 -0.05 0.00 0.00 0.02 0.00 0.00 54.97 55.22 1wee s GLU 9 Cb -0.03 -0.07 0.02 0.00 0.10 0.00 0.00 34.13 34.15 1wee s GLU 9 CO -0.17 0.02 0.01 1.03 0.02 0.00 0.00 175.26 176.18 1wee s ARG 10 N -0.07 0.08 0.00 1.61 0.52 -1.26 -5.09 118.95 114.74 1wee s ARG 10 Ca -0.00 0.10 0.00 0.00 -0.52 0.00 0.00 55.73 55.31 1wee s ARG 10 Cb -0.01 -0.26 0.00 0.00 0.52 0.00 0.00 34.95 35.20 1wee s ARG 10 CO -0.00 -0.11 0.00 0.41 0.02 0.00 0.00 175.30 175.62 1wee n GLY 11 N 3.89 2.05 2.83 -3.53 0.00 -1.26 -4.99 105.19 104.18 1wee n GLY 11 Ca -0.24 -1.29 -0.34 0.00 0.00 0.00 0.00 46.02 44.15 1wee n GLY 11 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1wee n VAL 12 N 2.33 0.00 -0.04 1.61 0.31 -1.25 -4.81 118.33 116.48 1wee n VAL 12 Ca 0.00 -0.46 -0.01 0.00 -0.01 0.00 0.00 64.34 63.87 1wee n VAL 12 Cb 0.00 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 32.93 1wee n VAL 12 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1wee h ASP 13 N -0.55 0.00 -0.01 4.52 5.19 -1.98 -3.36 116.42 120.23 1wee h ASP 13 Ca -0.39 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.02 1wee h ASP 13 Cb 1.24 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.75 1wee h ASP 13 CO 0.28 0.38 -0.02 -1.13 -3.12 0.00 0.00 179.24 175.63 1wee h ASN 14 N -0.70 -0.06 -3.64 6.45 -0.73 -2.06 -3.37 115.58 111.48 1wee h ASN 14 Ca 0.00 0.01 -0.69 0.00 1.87 0.00 0.00 56.30 57.48 1wee h ASN 14 Cb 0.06 0.02 -0.27 0.00 0.27 0.00 0.00 38.32 38.40 1wee h ASN 14 CO 0.00 -0.01 -0.59 0.26 -0.37 0.00 0.00 177.43 176.71 1wee s TRP 15 N -3.08 3.22 -0.45 0.67 0.52 -1.26 -5.04 118.94 113.52 1wee s TRP 15 Ca -0.00 -1.21 -0.26 0.00 0.02 0.00 0.00 56.10 54.64 1wee s TRP 15 Cb 0.00 -2.30 -0.07 0.00 -1.15 0.00 0.00 33.47 29.96 1wee s TRP 15 CO 0.02 -0.67 2.39 1.63 0.02 0.00 0.00 176.95 180.34 1wee n LYS 16 N 4.86 1.18 -3.40 4.98 5.02 -1.26 -4.27 118.16 125.26 1wee n LYS 16 Ca -0.13 0.08 -0.44 0.00 -2.02 0.00 0.00 58.31 55.79 1wee n LYS 16 Cb 0.46 -3.40 -0.05 0.00 -0.02 0.00 0.00 35.03 32.02 1wee n LYS 16 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1wee s VAL 17 N 11.61 4.99 -0.04 -0.18 1.01 -1.26 -2.15 120.40 134.39 1wee s VAL 17 Ca 0.99 -1.98 0.02 0.00 0.00 0.00 0.00 61.98 61.02 1wee s VAL 17 Cb -0.21 -4.18 0.01 0.00 0.00 0.00 0.00 36.38 32.00 1wee s VAL 17 CO 0.28 -0.90 -0.10 -1.81 0.00 0.00 0.00 175.10 172.57 1wee s ASP 18 N 2.73 1.43 0.53 3.32 1.11 -1.25 -3.53 116.67 121.01 1wee s ASP 18 Ca 0.09 -0.23 0.01 0.00 0.18 0.00 0.00 52.55 52.60 1wee s ASP 18 Cb -0.22 -0.49 0.00 0.00 1.07 0.00 0.00 42.92 43.27 1wee s ASP 18 CO -0.02 0.05 0.03 0.00 1.18 0.00 0.00 175.17 176.42 1wee n LYS 20 N -1.34 0.70 -0.08 0.00 2.85 -1.26 -4.28 118.16 114.75 1wee n LYS 20 Ca -0.20 0.27 -0.12 0.00 -1.05 0.00 0.00 58.31 57.22 1wee n LYS 20 Cb 0.67 -1.74 -0.05 0.00 -0.65 0.00 0.00 35.03 33.26 1wee n LYS 20 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1wee n GLY 22 N -0.23 1.68 3.49 0.00 0.00 -1.26 -5.11 105.19 103.76 1wee n GLY 22 Ca -0.04 -0.14 -0.49 0.00 0.00 0.00 0.00 46.02 45.36 1wee n GLY 22 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1wee n THR 23 N 0.00 0.24 -1.16 2.61 -1.04 -1.26 -4.70 114.28 108.97 1wee n THR 23 Ca 0.00 -0.31 0.09 0.00 -2.04 0.00 0.00 64.05 61.79 1wee n THR 23 Cb 0.00 -1.90 0.15 0.00 -1.82 0.00 0.00 70.33 66.76 1wee n THR 23 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 1wee n LYS 24 N 8.30 1.31 -4.33 -2.82 0.00 -1.26 -2.11 118.16 117.25 1wee n LYS 24 Ca 0.38 -2.67 -0.18 0.00 -0.00 0.00 0.00 58.31 55.84 1wee n LYS 24 Cb 0.29 -1.51 -0.10 0.00 -0.00 0.00 0.00 35.03 33.72 1wee n LYS 24 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 1wee s ASP 25 N -2.91 1.42 -0.58 -5.58 -4.77 -1.23 -3.78 116.67 99.24 1wee s ASP 25 Ca 0.33 -1.49 -0.22 0.00 -3.30 0.00 0.00 52.55 47.87 1wee s ASP 25 Cb 0.29 0.30 0.06 0.00 -1.09 0.00 0.00 42.92 42.48 1wee s ASP 25 CO 0.01 -0.83 0.84 -1.81 0.70 0.00 0.00 175.17 174.09 1wee s ASP 26 N -3.35 6.24 -0.07 2.11 1.11 -1.26 -4.89 116.67 116.55 1wee s ASP 26 Ca 0.36 -0.82 -0.06 0.00 0.18 0.00 0.00 52.55 52.22 1wee s ASP 26 Cb 0.06 -2.38 -0.02 0.00 1.07 0.00 0.00 42.92 41.65 1wee s ASP 26 CO 0.16 -1.19 -0.11 -0.67 1.18 0.00 0.00 175.17 174.54 1wee n ASP 27 N 7.07 0.90 0.00 0.27 2.03 -1.26 -5.02 116.55 120.54 1wee n ASP 27 Ca -0.03 0.37 0.00 0.00 0.52 0.00 0.00 54.79 55.64 1wee n ASP 27 Cb 0.46 -0.67 0.00 0.00 -0.72 0.00 0.00 41.12 40.19 1wee n ASP 27 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wee n GLY 28 N 1.63 0.00 3.37 0.27 0.00 -1.26 -5.17 105.19 104.04 1wee n GLY 28 Ca -0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 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 0.00 1.39 0.23 1.61 2.02 -1.26 -5.10 118.70 117.58 1wee s GLU 29 Ca 0.00 -1.46 -0.31 0.00 0.02 0.00 0.00 54.97 53.22 1wee s GLU 29 Cb 0.00 -1.58 -0.11 0.00 0.10 0.00 0.00 34.13 32.54 1wee s GLU 29 CO 0.00 0.33 1.65 0.50 0.02 0.00 0.00 175.26 177.76 1wee s ARG 30 N -2.71 4.14 0.36 1.61 3.52 -1.26 -5.00 118.95 119.61 1wee s ARG 30 Ca 0.18 2.56 0.06 0.00 -0.13 0.00 0.00 55.73 58.39 1wee s ARG 30 Cb -0.07 -3.07 -0.03 0.00 -1.56 0.00 0.00 34.95 30.23 1wee s ARG 30 CO 0.08 -0.68 0.21 -1.64 -0.81 0.00 0.00 175.30 172.46 1wee s MET 31 N 0.58 1.82 -0.27 5.12 -1.94 -1.26 -3.32 119.30 120.03 1wee s MET 31 Ca 0.70 -2.08 -0.21 0.00 -1.71 0.00 0.00 55.69 52.38 1wee s MET 31 Cb -0.48 -0.06 0.08 0.00 2.01 0.00 0.00 34.83 36.38 1wee s MET 31 CO 0.37 -0.58 0.72 -0.48 -0.01 0.00 0.00 175.02 175.04 1wee s LEU 32 N -3.47 -0.82 0.23 -0.03 2.34 -1.16 -4.91 118.68 110.86 1wee s LEU 32 Ca 0.33 1.45 -0.30 0.00 0.06 0.00 0.00 54.13 55.68 1wee s LEU 32 Cb 0.02 2.41 -0.09 0.00 -0.56 0.00 0.00 46.19 47.98 1wee s LEU 32 CO 0.22 -0.24 1.01 0.00 -1.06 0.00 0.00 176.35 176.28 1wee s ALA 33 N 0.90 3.35 -0.43 1.48 0.00 -1.26 -2.25 121.76 123.54 1wee s ALA 33 Ca -0.04 0.72 -0.29 0.00 0.00 0.00 0.00 51.96 52.35 1wee s ALA 33 Cb -0.05 -3.27 0.02 0.00 0.00 0.00 0.00 23.12 19.82 1wee s ALA 33 CO -0.08 0.02 1.25 0.00 0.00 0.00 0.00 175.76 176.95 1wee h ASP 35 N 9.74 0.55 0.00 0.00 5.19 -1.77 1.19 116.42 131.32 1wee h ASP 35 Ca -0.25 0.13 0.00 0.00 -0.62 0.00 0.00 57.03 56.29 1wee h ASP 35 Cb 1.08 0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.64 1wee h ASP 35 CO 1.10 0.05 0.00 0.61 -3.12 0.00 0.00 179.24 177.88 1wee n GLY 36 N -1.38 -3.04 0.12 2.75 0.00 -1.25 -4.37 105.19 98.03 1wee n GLY 36 Ca 0.28 0.31 -0.23 0.00 0.00 0.00 0.00 46.02 46.37 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 1.58 1.43 3.56 0.00 0.00 0.41 -4.99 105.19 107.17 1wee n GLY 38 Ca -0.39 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.00 3.64 0.75 1.61 1.01 -1.24 -4.59 120.40 119.57 1wee s VAL 39 Ca 0.00 -0.50 -0.11 0.00 0.00 0.00 0.00 61.98 61.37 1wee s VAL 39 Cb 0.00 -2.49 0.04 0.00 0.00 0.00 0.00 36.38 33.93 1wee s VAL 39 CO 0.00 0.59 1.08 0.26 0.00 0.00 0.00 175.10 177.02 1wee s TRP 40 N -0.65 2.91 -0.08 5.22 0.52 -0.91 0.13 118.94 126.06 1wee s TRP 40 Ca 0.10 1.33 -0.31 0.00 0.02 0.00 0.00 56.10 57.24 1wee s TRP 40 Cb -0.11 -3.00 0.09 0.00 -1.15 0.00 0.00 33.47 29.29 1wee s TRP 40 CO 0.02 -1.55 0.76 -1.01 0.02 0.00 0.00 176.95 175.19 1wee s HIS 41 N -3.06 -0.58 -0.18 -1.98 3.76 -0.96 -3.74 115.29 108.55 1wee s HIS 41 Ca 0.60 1.01 -0.29 0.00 -0.15 0.00 0.00 55.06 56.23 1wee s HIS 41 Cb -0.15 0.42 -0.04 0.00 1.11 0.00 0.00 32.58 33.92 1wee s HIS 41 CO 0.55 -0.54 1.82 -1.01 -0.85 0.00 0.00 174.74 174.71 1wee s HIS 42 N -1.15 1.74 0.52 1.40 3.76 -1.26 -3.01 115.29 117.30 1wee s HIS 42 Ca -0.08 0.37 0.26 0.00 -0.15 0.00 0.00 55.06 55.45 1wee s HIS 42 Cb -0.00 -4.03 1.39 0.00 1.11 0.00 0.00 32.58 31.05 1wee s HIS 42 CO 0.08 -3.65 1.97 1.79 -0.85 0.00 0.00 174.74 174.07 1wee h THR 43 N 6.30 0.70 0.10 1.30 1.35 -1.80 0.99 112.91 121.85 1wee h THR 43 Ca -0.38 -0.01 -0.26 0.00 -0.55 0.00 0.00 66.41 65.20 1wee h THR 43 Cb 1.19 0.66 0.00 0.00 -1.73 0.00 0.00 68.15 68.27 1wee h THR 43 CO 0.98 0.01 -1.18 0.08 -0.25 0.00 0.00 175.52 175.16 1wee h ARG 44 N 0.04 0.28 0.06 4.72 0.11 -1.69 1.18 114.38 119.08 1wee h ARG 44 Ca 0.30 -0.45 -0.00 0.00 0.10 0.00 0.00 59.98 59.93 1wee h ARG 44 Cb 1.15 0.16 0.00 0.00 1.11 0.00 0.00 29.97 32.39 1wee h ARG 44 CO -0.01 1.19 -0.03 0.00 0.10 0.00 0.00 179.97 181.22 1wee h ILE 46 N -0.51 0.78 0.00 0.00 3.07 -1.23 -3.45 117.51 116.17 1wee h ILE 46 Ca -0.01 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.40 1wee h ILE 46 Cb 0.45 0.85 0.00 0.00 -0.27 0.00 0.00 36.82 37.85 1wee h ILE 46 CO 0.01 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.72 1wee n GLY 47 N -1.56 0.99 2.66 0.16 0.00 -1.15 -5.12 105.19 101.17 1wee n GLY 47 Ca 0.04 0.00 -0.23 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 -1.78 -0.14 1.04 -0.61 1.01 0.41 -4.99 121.20 116.13 1wee s ILE 48 Ca 0.00 -0.02 -0.13 0.00 0.00 0.00 0.00 60.65 60.50 1wee s ILE 48 Cb 0.00 -0.50 0.21 0.00 0.01 0.00 0.00 42.46 42.19 1wee s ILE 48 CO 0.00 -0.16 1.09 0.20 0.00 0.00 0.00 174.94 176.07 1wee s ASN 49 N 2.18 2.21 -0.36 3.58 0.01 -1.26 -2.02 114.94 119.28 1wee s ASN 49 Ca 0.03 1.14 -0.02 0.00 -0.71 0.00 0.00 52.86 53.30 1wee s ASN 49 Cb -0.15 -1.79 0.16 0.00 0.41 0.00 0.00 41.25 39.88 1wee s ASN 49 CO -0.08 -3.38 2.31 -0.46 -1.51 0.00 0.00 177.10 173.97 1wee n ASN 50 N -4.34 6.47 0.00 -1.22 6.94 -1.26 -3.98 115.26 117.87 1wee n ASN 50 Ca 0.05 -3.11 0.00 0.00 -0.02 0.00 0.00 54.58 51.50 1wee n ASN 50 Cb 0.57 -1.12 0.00 0.00 -2.36 0.00 0.00 39.78 36.87 1wee n ASN 50 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1wee n ALA 51 N 0.54 2.50 -1.91 -2.53 0.00 -1.26 -5.10 120.51 112.76 1wee n ALA 51 Ca 0.37 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.54 1wee n ALA 51 Cb 0.58 0.26 0.08 0.00 0.00 0.00 0.00 19.45 20.38 1wee n ALA 51 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1wee s ASP 52 N -4.27 4.60 0.83 0.00 2.15 -1.26 -5.08 116.67 113.65 1wee s ASP 52 Ca 0.00 0.62 -0.12 0.00 0.43 0.00 0.00 52.55 53.47 1wee s ASP 52 Cb 0.00 -1.16 0.10 0.00 -0.30 0.00 0.00 42.92 41.55 1wee s ASP 52 CO 0.00 -1.80 1.19 0.00 -0.17 0.00 0.00 175.17 174.39 1wee s ALA 53 N -3.44 2.52 0.13 3.66 0.00 -1.26 -4.95 121.76 118.41 1wee s ALA 53 Ca 0.62 -0.68 -0.10 0.00 0.00 0.00 0.00 51.96 51.79 1wee s ALA 53 Cb -0.11 -2.95 -0.06 0.00 0.00 0.00 0.00 23.12 20.00 1wee s ALA 53 CO 0.47 -1.81 0.46 -0.51 0.00 0.00 0.00 175.76 174.37 1wee s LEU 54 N -5.66 4.31 0.15 0.00 1.43 -1.26 -5.05 118.68 112.59 1wee s LEU 54 Ca 0.63 0.86 -0.31 0.00 -1.03 0.00 0.00 54.13 54.29 1wee s LEU 54 Cb -0.11 -3.21 -0.08 0.00 0.03 0.00 0.00 46.19 42.82 1wee s LEU 54 CO 0.50 0.10 1.34 -2.16 0.23 0.00 0.00 176.35 176.36 1wee s PRO 55 N -2.16 4.36 0.29 1.29 0.04 -1.26 -4.89 135.00 132.67 1wee s PRO 55 Ca 0.38 2.04 0.09 0.00 0.04 0.00 0.00 61.00 63.55 1wee s PRO 55 Cb -0.14 -3.23 0.89 0.00 0.04 0.00 0.00 34.50 32.06 1wee s PRO 55 CO 0.20 -0.34 1.36 0.43 0.04 0.00 0.00 177.00 178.69 1wee n SER 56 N 3.35 0.08 -4.05 6.66 7.64 -1.26 -4.32 113.62 121.72 1wee n SER 56 Ca 0.09 1.45 -0.16 0.00 1.01 0.00 0.00 58.87 61.26 1wee n SER 56 Cb 0.43 -0.61 -0.13 0.00 -1.01 0.00 0.00 64.21 62.89 1wee n SER 56 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1wee s LYS 57 N -5.60 0.64 -0.12 1.43 3.01 -1.26 -5.04 119.74 112.80 1wee s LYS 57 Ca -0.10 -0.55 -0.02 0.00 -1.01 0.00 0.00 55.97 54.30 1wee s LYS 57 Cb 0.27 -0.56 0.04 0.00 -1.01 0.00 0.00 37.83 36.57 1wee s LYS 57 CO 0.67 0.14 -0.00 0.12 0.51 0.00 0.00 175.35 176.79 1wee s PHE 58 N -0.74 0.95 -0.28 3.18 5.36 -1.26 -5.03 117.98 120.17 1wee s PHE 58 Ca -0.02 -0.52 -0.03 0.00 -0.96 0.00 0.00 56.93 55.41 1wee s PHE 58 Cb -0.06 -0.96 0.03 0.00 -0.34 0.00 0.00 43.02 41.69 1wee s PHE 58 CO 0.00 -0.46 -0.01 -0.51 -1.46 0.00 0.00 175.22 172.78 1wee s LEU 59 N 1.88 3.59 0.43 6.12 1.43 -1.26 -2.14 118.68 128.73 1wee s LEU 59 Ca 0.03 -0.99 -0.26 0.00 -1.03 0.00 0.00 54.13 51.88 1wee s LEU 59 Cb -0.14 -1.73 -0.09 0.00 0.03 0.00 0.00 46.19 44.26 1wee s LEU 59 CO -0.07 -0.19 1.43 0.00 0.23 0.00 0.00 176.35 177.75 1wee n PHE 61 N -0.03 0.35 0.03 0.00 3.72 -1.26 0.48 117.46 120.76 1wee n PHE 61 Ca 0.04 0.85 -0.15 0.00 -0.05 0.00 0.00 57.45 58.14 1wee n PHE 61 Cb 0.41 -0.97 -0.09 0.00 -0.94 0.00 0.00 39.48 37.89 1wee n PHE 61 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1wee h ARG 62 N 0.00 -0.61 -0.26 -1.08 2.47 -2.00 -2.86 114.38 110.05 1wee h ARG 62 Ca 0.38 0.04 0.03 0.00 -1.26 0.00 0.00 59.98 59.17 1wee h ARG 62 Cb 0.70 0.14 -0.04 0.00 -1.65 0.00 0.00 29.97 29.12 1wee h ARG 62 CO -0.69 -0.40 -0.24 0.00 0.56 0.00 0.00 179.97 179.19 1wee n ILE 64 N -3.87 -0.15 0.03 0.00 -0.00 -1.09 0.24 119.36 114.51 1wee n ILE 64 Ca -0.01 1.34 -0.20 0.00 -0.00 0.00 0.00 62.75 63.88 1wee n ILE 64 Cb 0.13 -2.20 -0.14 0.00 -0.00 0.00 0.00 39.64 37.43 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 0.28 -0.62 0.38 5.08 -0.19 -3.36 114.58 116.15 1wee h GLU 65 Ca 0.69 -0.48 -0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1wee h GLU 65 Cb 2.37 0.18 -0.03 0.00 0.50 0.00 0.00 28.75 31.77 1wee h GLU 65 CO -0.28 1.17 0.37 1.25 -1.00 0.00 0.00 179.01 180.53 1wee h LEU 66 N 0.08 0.74 -9.18 1.33 5.85 0.75 -3.43 115.31 111.45 1wee h LEU 66 Ca -0.37 -0.06 -0.71 0.00 0.84 0.00 0.00 57.88 57.59 1wee h LEU 66 Cb 2.05 -0.19 0.06 0.00 0.37 0.00 0.00 40.66 42.96 1wee h LEU 66 CO 0.12 0.58 0.18 -0.24 -0.34 0.00 0.00 178.44 178.75 1wee n SER 67 N -4.60 0.76 0.00 1.25 2.88 0.64 -4.92 113.62 109.62 1wee n SER 67 Ca 0.04 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.72 1wee n SER 67 Cb 0.05 -1.09 0.00 0.00 -0.75 0.00 0.00 64.21 62.43 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 2.00 5.01 3.56 0.46 0.00 -1.26 -5.02 105.19 109.94 1wee n GLY 68 Ca 0.18 -0.84 -0.27 0.00 0.00 0.00 0.00 46.02 45.09 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 3.33 2.56 0.32 1.61 0.04 -1.26 -4.86 135.00 136.73 1wee s PRO 69 Ca 0.00 -0.43 -0.16 0.00 0.04 0.00 0.00 61.00 60.45 1wee s PRO 69 Cb 0.00 -5.09 0.03 0.00 0.04 0.00 0.00 34.50 29.47 1wee s PRO 69 CO 0.00 -3.46 0.67 -1.12 0.04 0.00 0.00 177.00 173.13 1wee s SER 70 N 7.77 -0.00 0.17 6.66 0.01 -1.26 -5.19 113.70 121.86 1wee s SER 70 Ca 0.70 -0.96 -0.00 0.00 1.31 0.00 0.00 55.95 57.00 1wee s SER 70 Cb -0.06 0.74 -0.04 0.00 0.21 0.00 0.00 66.02 66.87 1wee s SER 70 CO 0.01 -1.43 0.06 -0.44 0.41 0.00 0.00 173.24 171.86 1wee s SER 71 N -3.03 0.60 0.00 2.44 0.01 -1.26 -5.24 113.70 107.23 1wee s SER 71 Ca 0.17 -1.25 0.00 0.00 1.31 0.00 0.00 55.95 56.18 1wee s SER 71 Cb -0.04 0.25 0.00 0.00 0.21 0.00 0.00 66.02 66.44 1wee s SER 71 CO 0.10 -0.71 0.00 0.61 0.41 0.00 0.00 173.24 173.65