#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wee n SER 2 N 0.00 4.03 -2.10 1.61 2.88 -1.26 -4.85 113.62 113.92 1wee n SER 2 Ca 0.00 0.93 -0.17 0.00 -1.33 0.00 0.00 58.87 58.31 1wee n SER 2 Cb 0.00 -1.51 -0.08 0.00 -0.75 0.00 0.00 64.21 61.87 1wee n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1wee n SER 3 N 7.00 5.84 -0.11 -3.46 7.64 -1.26 -4.28 113.62 124.99 1wee n SER 3 Ca 0.20 -2.80 -0.19 0.00 1.01 0.00 0.00 58.87 57.09 1wee n SER 3 Cb 0.38 -1.28 -0.07 0.00 -1.01 0.00 0.00 64.21 62.24 1wee n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wee n GLY 4 N 1.54 -0.56 3.70 0.23 0.00 -1.26 -4.97 105.19 103.88 1wee n GLY 4 Ca 0.39 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 1wee n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wee s SER 5 N -6.67 5.67 0.30 1.61 0.01 -1.26 -4.99 113.70 108.37 1wee s SER 5 Ca -0.32 0.19 0.02 0.00 1.31 0.00 0.00 55.95 57.14 1wee s SER 5 Cb 0.09 -1.84 0.75 0.00 0.21 0.00 0.00 66.02 65.23 1wee s SER 5 CO 0.45 0.29 1.58 0.28 0.41 0.00 0.00 173.24 176.26 1wee h SER 6 N 5.82 -0.41 -0.71 2.44 0.02 -1.93 -3.46 113.55 115.32 1wee h SER 6 Ca -0.45 0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 1wee h SER 6 Cb 1.19 0.45 0.00 0.00 0.14 0.00 0.00 62.40 64.18 1wee h SER 6 CO 0.63 -0.33 0.00 0.61 -1.14 0.00 0.00 176.83 176.59 1wee n GLY 7 N -1.48 0.53 2.23 -3.77 0.00 -1.26 -5.03 105.19 96.41 1wee n GLY 7 Ca 0.23 -0.22 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 1wee n GLY 7 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1wee n MET 8 N -0.35 3.39 0.00 1.61 0.00 -1.26 -4.67 117.12 115.84 1wee n MET 8 Ca 0.00 -4.22 0.00 0.00 0.00 0.00 0.00 57.70 53.48 1wee n MET 8 Cb 0.17 -2.20 0.00 0.00 0.00 0.00 0.00 33.22 31.18 1wee n MET 8 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 175.97 175.12 1wee n GLU 9 N -0.61 1.61 -2.05 0.03 0.00 -1.26 -5.06 120.64 113.30 1wee n GLU 9 Ca 0.39 0.00 -0.41 0.00 0.00 0.00 0.00 57.16 57.14 1wee n GLU 9 Cb 0.86 -0.86 -0.02 0.00 0.00 0.00 0.00 31.44 31.42 1wee n GLU 9 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 1wee s ARG 10 N -1.72 4.30 0.00 3.44 3.52 -1.26 -4.75 118.95 122.49 1wee s ARG 10 Ca 0.00 2.28 0.00 0.00 -0.13 0.00 0.00 55.73 57.88 1wee s ARG 10 Cb 0.00 -3.07 0.00 0.00 -1.56 0.00 0.00 34.95 30.32 1wee s ARG 10 CO 0.00 -0.29 0.00 0.41 -0.81 0.00 0.00 175.30 174.61 1wee n GLY 11 N 1.17 -1.86 3.52 8.12 0.00 -1.26 -4.92 105.19 109.96 1wee n GLY 11 Ca 0.02 -1.15 -0.52 0.00 0.00 0.00 0.00 46.02 44.37 1wee n GLY 11 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1wee n VAL 12 N 0.21 0.72 -1.96 1.61 3.14 -1.26 -4.88 118.33 115.91 1wee n VAL 12 Ca 0.00 -0.18 -0.29 0.00 -2.96 0.00 0.00 64.34 60.91 1wee n VAL 12 Cb 0.00 -0.42 0.03 0.00 -1.06 0.00 0.00 33.84 32.39 1wee n VAL 12 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 1wee n ASP 13 N 1.89 5.74 0.00 6.55 8.00 -1.26 -4.62 116.55 132.86 1wee n ASP 13 Ca 0.17 -3.76 0.00 0.00 0.71 0.00 0.00 54.79 51.91 1wee n ASP 13 Cb 0.19 -0.58 0.00 0.00 -0.02 0.00 0.00 41.12 40.71 1wee n ASP 13 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1wee n ASN 14 N -0.69 0.36 -3.96 -2.24 5.15 -1.26 -5.06 115.26 107.56 1wee n ASN 14 Ca 0.48 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 54.18 1wee n ASN 14 Cb 0.76 0.00 -0.17 0.00 -0.53 0.00 0.00 39.78 39.85 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 -1.90 1.71 -0.93 1.20 0.51 -1.26 -5.05 118.94 113.22 1wee s TRP 15 Ca 0.00 -0.88 -0.26 0.00 -2.12 0.00 0.00 56.10 52.84 1wee s TRP 15 Cb 0.00 -1.34 -0.18 0.00 -0.81 0.00 0.00 33.47 31.14 1wee s TRP 15 CO 0.00 -0.54 2.27 0.21 -0.51 0.00 0.00 176.95 178.38 1wee s LYS 16 N 1.52 1.41 -0.39 4.98 2.20 -1.26 -4.88 119.74 123.31 1wee s LYS 16 Ca 0.03 0.04 -0.17 0.00 -0.36 0.00 0.00 55.97 55.51 1wee s LYS 16 Cb -0.13 -4.88 0.01 0.00 -1.51 0.00 0.00 37.83 31.32 1wee s LYS 16 CO -0.08 -4.95 0.45 0.08 -0.36 0.00 0.00 175.35 170.49 1wee s VAL 17 N 15.81 5.08 -0.25 4.02 1.01 -1.26 -2.44 120.40 142.36 1wee s VAL 17 Ca 0.87 -0.13 -0.12 0.00 0.00 0.00 0.00 61.98 62.61 1wee s VAL 17 Cb -0.09 -3.99 0.09 0.00 0.00 0.00 0.00 36.38 32.39 1wee s VAL 17 CO 0.13 -0.33 0.59 -0.62 0.00 0.00 0.00 175.10 174.86 1wee s ASP 18 N 1.80 -0.82 0.09 3.32 -1.08 -1.23 -4.27 116.67 114.48 1wee s ASP 18 Ca 0.14 1.34 0.01 0.00 -0.52 0.00 0.00 52.55 53.52 1wee s ASP 18 Cb -0.16 1.51 -0.04 0.00 -1.46 0.00 0.00 42.92 42.76 1wee s ASP 18 CO 0.14 -0.22 -0.06 0.00 0.52 0.00 0.00 175.17 175.54 1wee h LYS 20 N 2.99 0.72 -1.12 0.00 2.10 -1.98 -0.27 116.57 119.01 1wee h LYS 20 Ca -0.35 -0.04 0.31 0.00 -2.00 0.00 0.00 60.65 58.57 1wee h LYS 20 Cb 1.16 -0.16 -0.08 0.00 -0.90 0.00 0.00 32.23 32.25 1wee h LYS 20 CO 0.65 0.48 0.75 0.00 -2.00 0.00 0.00 179.45 179.32 1wee n GLY 22 N -1.57 1.81 3.51 0.00 0.00 -0.11 -5.09 105.19 103.75 1wee n GLY 22 Ca 0.27 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.00 4.57 -0.06 2.61 2.01 -1.24 -4.90 115.64 116.63 1wee s THR 23 Ca 0.00 0.19 -0.18 0.00 0.31 0.00 0.00 61.69 62.01 1wee s THR 23 Cb 0.00 -4.41 -0.30 0.00 0.01 0.00 0.00 72.50 67.79 1wee s THR 23 CO 0.00 -0.91 0.77 0.07 -0.69 0.00 0.00 174.62 173.86 1wee h LYS 24 N 9.13 0.31 -6.22 4.92 2.10 -1.92 -3.14 116.57 121.76 1wee h LYS 24 Ca -0.26 -0.53 -0.61 0.00 -2.00 0.00 0.00 60.65 57.25 1wee h LYS 24 Cb 1.08 0.20 -0.14 0.00 -0.90 0.00 0.00 32.23 32.46 1wee h LYS 24 CO 1.02 1.25 -0.77 0.16 -2.00 0.00 0.00 179.45 179.12 1wee s ASP 25 N -7.08 3.52 -0.53 7.07 1.47 -1.26 -4.24 116.67 115.62 1wee s ASP 25 Ca -0.16 -1.01 -0.28 0.00 1.18 0.00 0.00 52.55 52.28 1wee s ASP 25 Cb 0.03 -0.29 0.01 0.00 -0.34 0.00 0.00 42.92 42.33 1wee s ASP 25 CO 0.82 0.04 1.44 1.51 0.68 0.00 0.00 175.17 179.66 1wee s ASP 26 N -3.41 6.12 0.00 2.11 1.47 -1.26 -4.88 116.67 116.82 1wee s ASP 26 Ca 0.29 0.41 -0.23 0.00 1.18 0.00 0.00 52.55 54.20 1wee s ASP 26 Cb -0.05 -2.54 -0.18 0.00 -0.34 0.00 0.00 42.92 39.81 1wee s ASP 26 CO 0.14 -1.69 1.28 -0.78 0.68 0.00 0.00 175.17 174.80 1wee h ASP 27 N 11.22 0.18 0.00 2.11 1.82 -1.99 -3.46 116.42 126.30 1wee h ASP 27 Ca -0.27 -0.51 0.00 0.00 -0.39 0.00 0.00 57.03 55.86 1wee h ASP 27 Cb 1.10 -0.05 0.00 0.00 0.68 0.00 0.00 39.33 41.06 1wee h ASP 27 CO 1.16 0.65 0.00 0.61 -1.61 0.00 0.00 179.24 180.05 1wee n GLY 28 N 0.28 0.00 3.37 -0.78 0.00 -1.26 -5.17 105.19 101.63 1wee n GLY 28 Ca -0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.71 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 0.14 1.61 0.41 -1.26 -5.11 118.70 115.88 1wee s GLU 29 Ca 0.00 -1.49 -0.30 0.00 -0.41 0.00 0.00 54.97 52.76 1wee s GLU 29 Cb 0.00 -1.51 -0.08 0.00 -1.78 0.00 0.00 34.13 30.76 1wee s GLU 29 CO 0.00 0.31 1.28 0.50 -0.49 0.00 0.00 175.26 176.85 1wee s ARG 30 N -2.89 4.41 0.33 1.61 3.52 -1.26 -5.00 118.95 119.66 1wee s ARG 30 Ca 0.19 1.95 0.04 0.00 -0.13 0.00 0.00 55.73 57.78 1wee s ARG 30 Cb -0.06 -3.25 -0.03 0.00 -1.56 0.00 0.00 34.95 30.04 1wee s ARG 30 CO 0.08 -0.26 0.16 -1.64 -0.81 0.00 0.00 175.30 172.84 1wee s MET 31 N 0.43 1.68 -0.12 5.12 -1.94 -1.26 -2.31 119.30 120.91 1wee s MET 31 Ca 0.58 -1.97 -0.07 0.00 -1.71 0.00 0.00 55.69 52.52 1wee s MET 31 Cb -0.34 -0.17 0.04 0.00 2.01 0.00 0.00 34.83 36.37 1wee s MET 31 CO 0.34 -0.47 0.29 -0.48 -0.01 0.00 0.00 175.02 174.69 1wee s LEU 32 N -3.42 0.42 -0.05 -0.03 2.34 -0.65 -4.84 118.68 112.45 1wee s LEU 32 Ca 0.34 0.62 -0.30 0.00 0.06 0.00 0.00 54.13 54.85 1wee s LEU 32 Cb 0.04 0.93 -0.02 0.00 -0.56 0.00 0.00 46.19 46.58 1wee s LEU 32 CO 0.18 -0.16 1.02 0.00 -1.06 0.00 0.00 176.35 176.33 1wee s ALA 33 N 1.02 3.31 -0.41 1.48 0.00 -1.26 -2.14 121.76 123.75 1wee s ALA 33 Ca -0.07 0.48 -0.27 0.00 0.00 0.00 0.00 51.96 52.10 1wee s ALA 33 Cb -0.08 -3.40 -0.07 0.00 0.00 0.00 0.00 23.12 19.57 1wee s ALA 33 CO -0.07 -0.45 2.36 0.00 0.00 0.00 0.00 175.76 177.60 1wee n ASP 35 N 14.63 0.12 0.00 0.00 2.03 -1.04 -0.77 116.55 131.53 1wee n ASP 35 Ca 0.35 0.97 0.00 0.00 0.52 0.00 0.00 54.79 56.64 1wee n ASP 35 Cb 0.51 -0.48 0.00 0.00 -0.72 0.00 0.00 41.12 40.43 1wee n ASP 35 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wee n GLY 36 N -1.46 0.24 0.36 0.27 0.00 -1.26 -4.68 105.19 98.65 1wee n GLY 36 Ca 0.31 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.17 0.90 3.54 0.00 0.00 0.05 -4.96 105.19 103.55 1wee n GLY 38 Ca -0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.56 4.17 0.24 1.61 1.01 -1.26 -4.60 120.40 120.01 1wee s VAL 39 Ca 0.00 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.42 1wee s VAL 39 Cb 0.00 -2.84 -0.09 0.00 0.00 0.00 0.00 36.38 33.45 1wee s VAL 39 CO 0.00 0.48 0.94 0.26 0.00 0.00 0.00 175.10 176.79 1wee s TRP 40 N 0.37 3.97 -0.01 5.22 0.52 -1.02 -1.29 118.94 126.70 1wee s TRP 40 Ca -0.02 1.91 -0.07 0.00 0.02 0.00 0.00 56.10 57.94 1wee s TRP 40 Cb -0.14 -2.98 0.01 0.00 -1.15 0.00 0.00 33.47 29.21 1wee s TRP 40 CO 0.02 0.44 0.15 -1.01 0.02 0.00 0.00 176.95 176.57 1wee s HIS 41 N -1.19 -0.01 -0.10 -1.98 3.76 -0.91 -3.65 115.29 111.21 1wee s HIS 41 Ca 0.41 0.00 -0.29 0.00 -0.15 0.00 0.00 55.06 55.04 1wee s HIS 41 Cb -0.26 -0.02 -0.06 0.00 1.11 0.00 0.00 32.58 33.35 1wee s HIS 41 CO 0.32 -0.25 1.90 -1.01 -0.85 0.00 0.00 174.74 174.85 1wee s HIS 42 N -1.07 1.55 0.17 1.40 0.09 -1.26 -1.63 115.29 114.54 1wee s HIS 42 Ca -0.12 0.10 -0.23 0.00 -0.00 0.00 0.00 55.06 54.81 1wee s HIS 42 Cb -0.06 -4.06 0.07 0.00 -0.00 0.00 0.00 32.58 28.52 1wee s HIS 42 CO 0.01 -4.36 1.59 1.79 -0.00 0.00 0.00 174.74 173.77 1wee h THR 43 N 6.09 0.19 -0.56 1.30 1.35 -1.67 0.27 112.91 119.89 1wee h THR 43 Ca -0.42 0.00 0.07 0.00 -0.55 0.00 0.00 66.41 65.51 1wee h THR 43 Cb 1.21 0.19 -0.03 0.00 -1.73 0.00 0.00 68.15 67.78 1wee h THR 43 CO 0.96 0.00 0.37 0.08 -0.25 0.00 0.00 175.52 176.68 1wee h ARG 44 N -0.24 0.46 -0.40 4.72 0.11 -1.26 0.22 114.38 117.99 1wee h ARG 44 Ca 0.18 -0.03 -0.09 0.00 0.10 0.00 0.00 59.98 60.14 1wee h ARG 44 Cb 0.55 -0.10 -0.02 0.00 1.11 0.00 0.00 29.97 31.51 1wee h ARG 44 CO -0.59 0.31 -0.14 0.00 0.10 0.00 0.00 179.97 179.65 1wee h ILE 46 N 0.65 0.23 0.00 0.00 3.07 0.27 -3.48 117.51 118.24 1wee h ILE 46 Ca 0.11 -1.36 0.00 0.00 1.55 0.00 0.00 64.86 65.16 1wee h ILE 46 Cb 0.60 1.93 0.00 0.00 -0.27 0.00 0.00 36.82 39.09 1wee h ILE 46 CO 0.04 0.13 0.00 0.61 -1.05 0.00 0.00 178.15 177.88 1wee n GLY 47 N 1.18 3.79 3.55 0.16 0.00 0.63 -5.08 105.19 109.43 1wee n GLY 47 Ca 0.01 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 45.06 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 0.00 3.18 0.33 -0.61 1.09 -0.54 -4.69 121.20 119.97 1wee s ILE 48 Ca 0.00 0.10 -0.26 0.00 -1.10 0.00 0.00 60.65 59.39 1wee s ILE 48 Cb 0.00 -3.49 -0.10 0.00 -1.06 0.00 0.00 42.46 37.82 1wee s ILE 48 CO 0.00 -0.47 0.97 0.20 -0.10 0.00 0.00 174.94 175.54 1wee s ASN 49 N 10.12 7.25 0.27 3.58 0.01 -1.26 -0.84 114.94 134.07 1wee s ASN 49 Ca 0.82 1.91 0.14 0.00 -0.71 0.00 0.00 52.86 55.02 1wee s ASN 49 Cb -0.15 -2.59 0.95 0.00 0.41 0.00 0.00 41.25 39.88 1wee s ASN 49 CO 0.23 -0.14 1.16 -3.20 -1.51 0.00 0.00 177.10 173.64 1wee n ASN 50 N 0.54 0.23 -0.38 -1.22 2.85 -1.26 -0.33 115.26 115.70 1wee n ASN 50 Ca 0.02 1.22 -0.10 0.00 -0.11 0.00 0.00 54.58 55.61 1wee n ASN 50 Cb 0.49 -0.58 -0.09 0.00 1.24 0.00 0.00 39.78 40.84 1wee n ASN 50 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1wee n ALA 51 N -2.52 -0.57 -1.96 5.20 0.00 -1.26 -4.51 120.51 114.89 1wee n ALA 51 Ca 0.27 0.76 -0.24 0.00 0.00 0.00 0.00 53.44 54.23 1wee n ALA 51 Cb 0.91 -0.11 0.07 0.00 0.00 0.00 0.00 19.45 20.33 1wee n ALA 51 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1wee s ASP 52 N -5.37 4.82 0.75 0.00 1.01 0.55 -5.11 116.67 113.33 1wee s ASP 52 Ca -0.11 0.13 -0.04 0.00 0.71 0.00 0.00 52.55 53.24 1wee s ASP 52 Cb 0.10 -0.79 0.09 0.00 1.01 0.00 0.00 42.92 43.33 1wee s ASP 52 CO 0.56 -1.53 0.58 0.00 0.21 0.00 0.00 175.17 174.99 1wee n ALA 53 N -2.73 -0.28 -2.71 5.23 0.00 -1.26 -4.74 120.51 114.02 1wee n ALA 53 Ca 0.10 -0.95 -0.33 0.00 0.00 0.00 0.00 53.44 52.26 1wee n ALA 53 Cb 0.60 0.07 -0.05 0.00 0.00 0.00 0.00 19.45 20.08 1wee n ALA 53 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1wee s LEU 54 N 0.00 4.32 0.92 0.00 1.02 -1.26 -4.91 118.68 118.77 1wee s LEU 54 Ca 0.36 0.58 -0.12 0.00 0.02 0.00 0.00 54.13 54.97 1wee s LEU 54 Cb -0.02 -3.04 0.15 0.00 0.02 0.00 0.00 46.19 43.30 1wee s LEU 54 CO 0.24 0.14 1.09 -2.16 0.02 0.00 0.00 176.35 175.69 1wee s PRO 55 N -2.27 1.03 0.21 1.29 0.04 -1.26 -4.96 135.00 129.08 1wee s PRO 55 Ca 0.35 0.74 -0.09 0.00 0.04 0.00 0.00 61.00 62.04 1wee s PRO 55 Cb -0.13 -1.79 0.15 0.00 0.04 0.00 0.00 34.50 32.78 1wee s PRO 55 CO 0.22 -2.38 1.81 0.77 0.04 0.00 0.00 177.00 177.46 1wee h SER 56 N -1.64 0.98 -3.96 6.66 0.02 -2.06 -3.43 113.55 110.11 1wee h SER 56 Ca -0.51 -0.11 -0.21 0.00 -0.84 0.00 0.00 61.79 60.12 1wee h SER 56 Cb 1.30 -0.25 -0.26 0.00 0.14 0.00 0.00 62.40 63.32 1wee h SER 56 CO 0.55 0.82 -0.68 -1.59 -1.14 0.00 0.00 176.83 174.79 1wee s LYS 57 N -5.78 0.09 0.00 3.45 0.00 -1.26 -5.07 119.74 111.17 1wee s LYS 57 Ca -0.13 -0.06 -0.01 0.00 0.00 0.00 0.00 55.97 55.77 1wee s LYS 57 Cb 0.15 0.04 -0.01 0.00 0.00 0.00 0.00 37.83 38.01 1wee s LYS 57 CO 0.81 -0.02 0.01 0.12 0.00 0.00 0.00 175.35 176.28 1wee s PHE 58 N -0.24 0.08 -0.04 1.78 5.36 -1.26 -5.07 117.98 118.59 1wee s PHE 58 Ca -0.03 -0.16 0.04 0.00 -0.96 0.00 0.00 56.93 55.82 1wee s PHE 58 Cb -0.02 -0.07 -0.00 0.00 -0.34 0.00 0.00 43.02 42.59 1wee s PHE 58 CO -0.00 -0.10 -0.16 -0.51 -1.46 0.00 0.00 175.22 172.99 1wee s LEU 59 N -0.61 1.90 0.93 6.12 1.43 -1.26 -2.50 118.68 124.69 1wee s LEU 59 Ca -0.07 -0.33 -0.11 0.00 -1.03 0.00 0.00 54.13 52.59 1wee s LEU 59 Cb -0.04 -0.92 0.15 0.00 0.03 0.00 0.00 46.19 45.41 1wee s LEU 59 CO -0.00 0.14 1.10 0.00 0.23 0.00 0.00 176.35 177.82 1wee h PHE 61 N -1.77 -0.76 -0.74 0.00 -1.00 -2.00 0.13 116.94 110.79 1wee h PHE 61 Ca -0.49 0.05 0.18 0.00 2.81 0.00 0.00 57.97 60.52 1wee h PHE 61 Cb 1.28 0.38 -0.14 0.00 3.61 0.00 0.00 35.95 41.08 1wee h PHE 61 CO 0.44 -0.17 -0.06 0.54 -1.61 0.00 0.00 178.31 177.45 1wee n ARG 62 N -3.90 -0.06 -0.05 1.51 5.12 -1.26 0.16 116.66 118.18 1wee n ARG 62 Ca 0.00 1.13 -0.11 0.00 -1.93 0.00 0.00 57.85 56.94 1wee n ARG 62 Cb 0.12 -1.75 -0.05 0.00 -1.16 0.00 0.00 32.46 29.62 1wee n ARG 62 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1wee n ILE 64 N -4.81 -0.33 0.00 0.00 2.08 0.42 0.19 119.36 116.92 1wee n ILE 64 Ca -0.04 1.58 -0.15 0.00 0.56 0.00 0.00 62.75 64.70 1wee n ILE 64 Cb 0.16 -2.56 -0.14 0.00 -0.75 0.00 0.00 39.64 36.35 1wee n ILE 64 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 1wee h GLU 65 N 0.00 0.14 -0.68 0.38 4.39 -1.41 -3.37 114.58 114.04 1wee h GLU 65 Ca 0.65 -0.24 0.04 0.00 0.34 0.00 0.00 59.36 60.15 1wee h GLU 65 Cb 1.73 0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 30.42 1wee h GLU 65 CO -0.60 0.88 0.41 1.25 -1.16 0.00 0.00 179.01 179.79 1wee h LEU 66 N 0.04 0.66 -8.03 1.33 7.12 0.27 -3.36 115.31 113.34 1wee h LEU 66 Ca -0.33 0.01 -0.71 0.00 0.13 0.00 0.00 57.88 56.98 1wee h LEU 66 Cb 2.02 -0.13 -0.30 0.00 -0.53 0.00 0.00 40.66 41.72 1wee h LEU 66 CO 0.10 0.45 -0.50 -0.94 -0.13 0.00 0.00 178.44 177.41 1wee s SER 67 N -5.69 5.48 0.00 1.25 1.04 0.66 -5.03 113.70 111.42 1wee s SER 67 Ca -0.13 -1.63 0.00 0.00 0.48 0.00 0.00 55.95 54.67 1wee s SER 67 Cb 0.15 -1.93 0.00 0.00 0.10 0.00 0.00 66.02 64.35 1wee s SER 67 CO 0.76 -0.52 0.00 0.61 0.98 0.00 0.00 173.24 175.07 1wee n GLY 68 N 4.81 1.69 0.00 7.32 0.00 -1.26 -4.58 105.19 113.18 1wee n GLY 68 Ca -0.08 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.99 1wee n GLY 68 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wee n PRO 69 N 0.00 0.49 -3.18 1.61 -0.04 -1.26 -4.85 135.00 127.77 1wee n PRO 69 Ca 0.00 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.32 1wee n PRO 69 Cb 0.00 -1.36 0.07 0.00 -0.04 0.00 0.00 33.50 32.17 1wee n PRO 69 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1wee n SER 70 N -0.86 -3.77 -4.43 3.54 7.64 -1.26 -4.97 113.62 109.51 1wee n SER 70 Ca 0.08 -0.59 -0.44 0.00 1.01 0.00 0.00 58.87 58.94 1wee n SER 70 Cb 0.04 -4.66 -0.08 0.00 -1.01 0.00 0.00 64.21 58.49 1wee n SER 70 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1wee s SER 71 N -3.85 6.15 0.00 6.43 0.01 -1.26 -5.21 113.70 115.97 1wee s SER 71 Ca 0.17 -1.08 0.00 0.00 1.31 0.00 0.00 55.95 56.36 1wee s SER 71 Cb -0.02 -2.19 0.00 0.00 0.21 0.00 0.00 66.02 64.02 1wee s SER 71 CO 0.65 -0.59 0.00 0.61 0.41 0.00 0.00 173.24 174.32