#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 0.93 -3.98 1.61 7.64 -1.26 -5.04 113.62 113.52 1wee n SER 2 Ca 0.00 0.59 -0.09 0.00 1.01 0.00 0.00 58.87 60.37 1wee n SER 2 Cb 0.00 -1.50 -0.11 0.00 -1.01 0.00 0.00 64.21 61.59 1wee n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1wee s SER 3 N -2.09 0.24 -0.76 6.43 0.01 -1.26 -5.11 113.70 111.16 1wee s SER 3 Ca 0.73 -0.47 -0.14 0.00 1.31 0.00 0.00 55.95 57.38 1wee s SER 3 Cb -0.29 0.09 0.20 0.00 0.21 0.00 0.00 66.02 66.23 1wee s SER 3 CO 0.51 -0.28 0.70 -0.83 0.41 0.00 0.00 173.24 173.76 1wee s GLY 4 N -1.37 2.54 -0.18 3.44 0.00 -1.26 -5.04 107.32 105.45 1wee s GLY 4 Ca -0.15 -3.16 -0.08 0.00 0.00 0.00 0.00 44.72 41.33 1wee s GLY 4 CO -0.01 1.24 0.10 -1.35 0.00 0.00 0.00 173.10 173.09 1wee s SER 5 N 2.42 6.00 0.23 1.64 1.04 -1.26 -5.10 113.70 118.67 1wee s SER 5 Ca 0.15 0.20 -0.01 0.00 0.48 0.00 0.00 55.95 56.77 1wee s SER 5 Cb -0.14 -2.02 -0.04 0.00 0.10 0.00 0.00 66.02 63.91 1wee s SER 5 CO -0.06 0.21 0.43 -0.55 0.98 0.00 0.00 173.24 174.25 1wee s SER 6 N 0.16 6.38 0.00 7.02 0.15 -1.26 -4.99 113.70 121.15 1wee s SER 6 Ca 0.07 0.44 0.00 0.00 0.70 0.00 0.00 55.95 57.16 1wee s SER 6 Cb -0.12 -2.02 0.00 0.00 -1.71 0.00 0.00 66.02 62.17 1wee s SER 6 CO -0.00 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 174.95 1wee n GLY 7 N -0.87 -0.52 3.51 9.45 0.00 -1.26 -5.08 105.19 110.42 1wee n GLY 7 Ca -0.04 0.04 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1wee n GLY 7 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1wee n MET 8 N 0.00 0.20 -1.46 1.61 0.00 -1.26 -4.70 117.12 111.51 1wee n MET 8 Ca 0.00 -0.01 -0.46 0.00 -0.00 0.00 0.00 57.70 57.23 1wee n MET 8 Cb 0.00 -1.88 -0.09 0.00 0.00 0.00 0.00 33.22 31.25 1wee n MET 8 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1wee n GLU 9 N 8.55 0.60 -3.74 2.12 -0.58 -1.26 -4.89 120.64 121.46 1wee n GLU 9 Ca 0.60 0.10 -0.12 0.00 -0.42 0.00 0.00 57.16 57.32 1wee n GLU 9 Cb 0.13 -2.25 -0.13 0.00 -0.57 0.00 0.00 31.44 28.62 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 7.44 0.21 0.00 3.49 1.81 -1.26 -4.96 118.95 125.68 1wee s ARG 10 Ca 1.17 0.50 0.00 0.00 -1.72 0.00 0.00 55.73 55.68 1wee s ARG 10 Cb -0.92 -0.10 0.00 0.00 -0.45 0.00 0.00 34.95 33.48 1wee s ARG 10 CO 0.47 -0.15 0.00 0.41 -0.68 0.00 0.00 175.30 175.35 1wee n GLY 11 N 4.10 2.63 3.24 -3.53 0.00 -1.26 -5.11 105.19 105.26 1wee n GLY 11 Ca -0.24 -0.37 -0.26 0.00 0.00 0.00 0.00 46.02 45.15 1wee n GLY 11 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wee s VAL 12 N 0.00 1.64 1.30 1.61 1.01 -1.26 -4.91 120.40 119.79 1wee s VAL 12 Ca 0.00 -1.15 -0.17 0.00 0.00 0.00 0.00 61.98 60.66 1wee s VAL 12 Cb 0.00 -1.42 0.33 0.00 0.00 0.00 0.00 36.38 35.29 1wee s VAL 12 CO 0.00 0.23 0.97 -1.81 0.00 0.00 0.00 175.10 174.50 1wee s ASP 13 N -1.08 -0.13 0.31 3.32 1.11 -1.26 -4.82 116.67 114.12 1wee s ASP 13 Ca 0.07 1.23 0.04 0.00 0.18 0.00 0.00 52.55 54.07 1wee s ASP 13 Cb -0.09 -1.86 0.81 0.00 1.07 0.00 0.00 42.92 42.85 1wee s ASP 13 CO 0.01 -4.84 1.57 -1.13 1.18 0.00 0.00 175.17 171.96 1wee h ASN 14 N -3.06 -0.41 -2.86 0.27 -0.73 -2.01 -3.36 115.58 103.42 1wee h ASN 14 Ca -0.55 0.28 -0.56 0.00 1.87 0.00 0.00 56.30 57.34 1wee h ASN 14 Cb 1.34 0.47 -0.03 0.00 0.27 0.00 0.00 38.32 40.37 1wee h ASN 14 CO 0.41 -0.37 0.95 -1.66 -0.37 0.00 0.00 177.43 176.40 1wee s TRP 15 N -5.96 2.64 -0.27 0.67 -2.14 -1.26 -4.96 118.94 107.65 1wee s TRP 15 Ca -0.13 0.82 -0.29 0.00 2.66 0.00 0.00 56.10 59.17 1wee s TRP 15 Cb 0.30 -3.63 -0.01 0.00 -3.10 0.00 0.00 33.47 27.03 1wee s TRP 15 CO 0.78 -2.17 1.49 0.21 -2.66 0.00 0.00 176.95 174.60 1wee s LYS 16 N 3.69 3.80 -0.38 3.25 2.20 -1.26 -4.98 119.74 126.06 1wee s LYS 16 Ca 0.59 1.44 -0.02 0.00 -0.36 0.00 0.00 55.97 57.63 1wee s LYS 16 Cb -0.24 -3.99 0.10 0.00 -1.51 0.00 0.00 37.83 32.19 1wee s LYS 16 CO 0.18 -1.28 0.14 0.08 -0.36 0.00 0.00 175.35 174.12 1wee s VAL 17 N 5.00 3.07 -0.18 4.02 1.01 -1.26 -2.03 120.40 130.02 1wee s VAL 17 Ca 0.65 -1.99 -0.04 0.00 0.00 0.00 0.00 61.98 60.60 1wee s VAL 17 Cb -0.21 -3.07 0.06 0.00 0.00 0.00 0.00 36.38 33.16 1wee s VAL 17 CO 0.27 -0.58 0.07 -0.62 0.00 0.00 0.00 175.10 174.25 1wee s ASP 18 N 1.57 2.57 0.37 3.32 2.15 -1.26 -4.59 116.67 120.80 1wee s ASP 18 Ca 0.06 -0.70 0.08 0.00 0.43 0.00 0.00 52.55 52.43 1wee s ASP 18 Cb -0.22 -0.38 -0.07 0.00 -0.30 0.00 0.00 42.92 41.96 1wee s ASP 18 CO -0.04 -0.33 -0.02 0.00 -0.17 0.00 0.00 175.17 174.60 1wee h LYS 20 N 1.86 0.17 -0.83 0.00 2.10 -2.00 -3.36 116.57 114.51 1wee h LYS 20 Ca -0.43 -0.29 0.20 0.00 -2.00 0.00 0.00 60.65 58.14 1wee h LYS 20 Cb 1.25 0.11 -0.14 0.00 -0.90 0.00 0.00 32.23 32.54 1wee h LYS 20 CO 0.73 0.99 0.06 0.00 -2.00 0.00 0.00 179.45 179.23 1wee n GLY 22 N -1.43 0.22 3.68 0.00 0.00 -1.26 -5.15 105.19 101.26 1wee n GLY 22 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.23 4.89 -0.18 2.61 2.01 -1.26 -4.99 115.64 118.48 1wee s THR 23 Ca 0.00 -0.01 -0.04 0.00 0.31 0.00 0.00 61.69 61.95 1wee s THR 23 Cb 0.00 -3.18 -0.10 0.00 0.01 0.00 0.00 72.50 69.23 1wee s THR 23 CO 0.00 0.50 -0.20 2.29 -0.69 0.00 0.00 174.62 176.52 1wee n LYS 24 N 3.14 0.42 -4.72 4.92 2.85 -1.26 -3.56 118.16 119.96 1wee n LYS 24 Ca -0.17 0.14 -0.33 0.00 -1.05 0.00 0.00 58.31 56.90 1wee n LYS 24 Cb 0.53 -1.27 -0.07 0.00 -0.65 0.00 0.00 35.03 33.57 1wee n LYS 24 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 1wee n ASP 25 N -3.43 3.29 -4.64 -5.58 5.75 -1.26 -4.68 116.55 106.00 1wee n ASP 25 Ca -0.34 -3.27 -0.43 0.00 -0.01 0.00 0.00 54.79 50.74 1wee n ASP 25 Cb 0.80 0.41 -0.03 0.00 -1.03 0.00 0.00 41.12 41.27 1wee n ASP 25 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1wee s ASP 26 N -3.83 6.39 -0.12 -1.12 -1.08 -1.26 -4.88 116.67 110.76 1wee s ASP 26 Ca 0.01 1.94 -0.18 0.00 -0.52 0.00 0.00 52.55 53.80 1wee s ASP 26 Cb 0.00 -2.53 -0.26 0.00 -1.46 0.00 0.00 42.92 38.67 1wee s ASP 26 CO 0.01 -1.20 0.54 0.44 0.52 0.00 0.00 175.17 175.48 1wee h ASP 27 N 10.75 0.29 0.00 -0.34 3.32 -2.01 -3.49 116.42 124.95 1wee h ASP 27 Ca -0.38 -0.82 0.00 0.00 0.02 0.00 0.00 57.03 55.85 1wee h ASP 27 Cb 1.18 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.63 1wee h ASP 27 CO 0.98 1.53 0.00 0.61 -1.72 0.00 0.00 179.24 180.64 1wee n GLY 28 N 1.68 0.76 3.80 2.75 0.00 -1.26 -5.15 105.19 107.78 1wee n GLY 28 Ca -0.24 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.45 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 2.83 0.62 1.61 0.41 -1.26 -5.02 118.70 117.90 1wee s GLU 29 Ca 0.00 1.09 -0.16 0.00 -0.41 0.00 0.00 54.97 55.49 1wee s GLU 29 Cb 0.00 -1.97 -0.02 0.00 -1.78 0.00 0.00 34.13 30.36 1wee s GLU 29 CO 0.00 -1.19 1.09 0.50 -0.49 0.00 0.00 175.26 175.18 1wee s ARG 30 N -4.75 3.04 0.12 1.61 6.06 -1.26 -5.07 118.95 118.71 1wee s ARG 30 Ca 0.61 1.36 0.03 0.00 -2.50 0.00 0.00 55.73 55.23 1wee s ARG 30 Cb -0.16 -1.98 -0.04 0.00 0.06 0.00 0.00 34.95 32.83 1wee s ARG 30 CO 0.51 -1.05 -0.09 -1.64 -2.50 0.00 0.00 175.30 170.53 1wee s MET 31 N -3.97 0.94 -0.05 5.12 -1.94 -1.26 -4.02 119.30 114.10 1wee s MET 31 Ca 0.67 -1.36 0.05 0.00 -1.71 0.00 0.00 55.69 53.34 1wee s MET 31 Cb -0.19 -0.43 -0.01 0.00 2.01 0.00 0.00 34.83 36.21 1wee s MET 31 CO 0.38 0.04 -0.22 -1.17 -0.01 0.00 0.00 175.02 174.03 1wee s LEU 32 N -3.02 2.02 0.33 -0.03 2.96 -0.68 -4.84 118.68 115.40 1wee s LEU 32 Ca 0.13 -0.46 -0.23 0.00 -0.22 0.00 0.00 54.13 53.35 1wee s LEU 32 Cb 0.03 -1.24 -0.10 0.00 0.50 0.00 0.00 46.19 45.38 1wee s LEU 32 CO -0.02 0.21 0.89 0.00 -1.32 0.00 0.00 176.35 176.11 1wee s ALA 33 N -0.08 3.22 -0.39 5.97 0.00 -1.25 0.43 121.76 129.66 1wee s ALA 33 Ca -0.04 0.39 -0.17 0.00 0.00 0.00 0.00 51.96 52.14 1wee s ALA 33 Cb -0.13 -3.08 0.01 0.00 0.00 0.00 0.00 23.12 19.92 1wee s ALA 33 CO 0.03 0.21 0.44 0.00 0.00 0.00 0.00 175.76 176.44 1wee h ASP 35 N 8.61 0.33 0.00 0.00 3.04 -1.76 0.36 116.42 127.01 1wee h ASP 35 Ca -0.28 0.02 0.00 0.00 -3.24 0.00 0.00 57.03 53.54 1wee h ASP 35 Cb 1.12 -0.04 0.00 0.00 -1.04 0.00 0.00 39.33 39.37 1wee h ASP 35 CO 0.77 0.16 0.00 0.61 -2.04 0.00 0.00 179.24 178.74 1wee n GLY 36 N -1.55 -2.73 0.38 7.15 0.00 -1.25 -4.56 105.19 102.64 1wee n GLY 36 Ca 0.15 0.20 -0.21 0.00 0.00 0.00 0.00 46.02 46.16 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 1.75 0.58 2.97 0.00 0.00 0.13 -4.99 105.19 105.63 1wee n GLY 38 Ca -0.39 -0.59 -0.17 0.00 0.00 0.00 0.00 46.02 44.87 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 0.50 -0.94 1.61 1.01 -1.25 -4.76 120.40 116.56 1wee s VAL 39 Ca 0.00 -0.25 -0.23 0.00 0.00 0.00 0.00 61.98 61.50 1wee s VAL 39 Cb 0.00 -0.43 0.05 0.00 0.00 0.00 0.00 36.38 36.00 1wee s VAL 39 CO 0.00 0.15 1.37 0.26 0.00 0.00 0.00 175.10 176.88 1wee s TRP 40 N -0.01 2.54 -0.21 5.22 0.52 -0.86 -1.40 118.94 124.74 1wee s TRP 40 Ca 0.01 -0.73 -0.14 0.00 0.02 0.00 0.00 56.10 55.26 1wee s TRP 40 Cb -0.04 -4.63 -0.04 0.00 -1.15 0.00 0.00 33.47 27.61 1wee s TRP 40 CO -0.00 -1.91 0.31 -1.01 0.02 0.00 0.00 176.95 174.36 1wee s HIS 41 N 4.87 3.36 -0.39 -1.98 3.76 0.17 -4.32 115.29 120.76 1wee s HIS 41 Ca 0.42 0.49 -0.38 0.00 -0.15 0.00 0.00 55.06 55.43 1wee s HIS 41 Cb -0.03 -2.43 -0.14 0.00 1.11 0.00 0.00 32.58 31.10 1wee s HIS 41 CO -0.04 0.03 2.14 0.72 -0.85 0.00 0.00 174.74 176.74 1wee n HIS 42 N 4.34 1.51 -0.39 1.40 8.25 -1.26 -1.69 115.22 127.37 1wee n HIS 42 Ca -0.11 0.44 0.31 0.00 -0.26 0.00 0.00 57.72 58.11 1wee n HIS 42 Cb 0.51 -2.46 0.59 0.00 1.12 0.00 0.00 29.99 29.76 1wee n HIS 42 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 1wee h THR 43 N 6.92 0.26 -0.06 1.59 1.35 -1.89 0.30 112.91 121.37 1wee h THR 43 Ca -0.24 -0.07 -0.03 0.00 -0.55 0.00 0.00 66.41 65.53 1wee h THR 43 Cb 1.35 0.04 -0.00 0.00 -1.73 0.00 0.00 68.15 67.81 1wee h THR 43 CO 1.03 0.04 -0.06 -0.09 -0.25 0.00 0.00 175.52 176.19 1wee h ARG 44 N 0.19 0.15 -0.28 4.72 9.65 -1.86 0.40 114.38 127.35 1wee h ARG 44 Ca 0.74 -0.08 0.05 0.00 -1.10 0.00 0.00 59.98 59.60 1wee h ARG 44 Cb 2.17 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 30.70 1wee h ARG 44 CO -0.41 0.59 -0.05 0.00 2.80 0.00 0.00 179.97 182.91 1wee h ILE 46 N 0.03 1.11 0.00 0.00 3.07 -1.29 -3.47 117.51 116.96 1wee h ILE 46 Ca 0.14 -0.33 0.00 0.00 1.55 0.00 0.00 64.86 66.21 1wee h ILE 46 Cb 0.20 0.05 0.00 0.00 -0.27 0.00 0.00 36.82 36.80 1wee h ILE 46 CO -0.27 0.18 0.00 0.61 -1.05 0.00 0.00 178.15 177.62 1wee n GLY 47 N -1.32 0.74 1.29 0.16 0.00 -0.76 -5.12 105.19 100.18 1wee n GLY 47 Ca 0.10 0.02 -0.18 0.00 0.00 0.00 0.00 46.02 45.95 1wee n GLY 47 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1wee n ILE 48 N 0.00 0.73 -1.37 -0.61 2.08 0.09 -4.79 119.36 115.48 1wee n ILE 48 Ca 0.00 -0.19 -0.30 0.00 0.56 0.00 0.00 62.75 62.82 1wee n ILE 48 Cb 0.00 0.00 0.10 0.00 -0.75 0.00 0.00 39.64 38.99 1wee n ILE 48 CO 0.00 0.00 0.00 -0.46 0.56 0.00 0.00 176.55 176.65 1wee n ASN 49 N 0.76 6.38 -2.25 4.38 6.94 -1.26 -3.92 115.26 126.29 1wee n ASN 49 Ca 0.07 -3.75 -0.04 0.00 -0.02 0.00 0.00 54.58 50.84 1wee n ASN 49 Cb 0.10 -0.88 -0.01 0.00 -2.36 0.00 0.00 39.78 36.63 1wee n ASN 49 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 1wee n ASN 50 N -0.96 -0.85 0.00 0.53 2.85 -1.26 -4.54 115.26 111.03 1wee n ASN 50 Ca 0.60 0.24 0.00 0.00 -0.11 0.00 0.00 54.58 55.30 1wee n ASN 50 Cb 0.93 -0.83 0.00 0.00 1.24 0.00 0.00 39.78 41.12 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 -2.09 2.40 -2.01 5.20 0.00 -1.26 -5.08 120.51 117.67 1wee n ALA 51 Ca 0.01 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.23 1wee n ALA 51 Cb 0.38 0.45 0.04 0.00 0.00 0.00 0.00 19.45 20.32 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 -4.34 5.30 1.38 0.00 1.11 -1.26 -5.09 116.67 113.77 1wee s ASP 52 Ca 0.00 0.09 -0.23 0.00 0.18 0.00 0.00 52.55 52.60 1wee s ASP 52 Cb 0.00 -1.00 0.35 0.00 1.07 0.00 0.00 42.92 43.34 1wee s ASP 52 CO 0.00 -1.14 0.95 0.00 1.18 0.00 0.00 175.17 176.16 1wee n ALA 53 N -2.38 -4.43 -2.32 5.23 0.00 -1.26 -4.92 120.51 110.43 1wee n ALA 53 Ca 0.07 -1.55 -0.35 0.00 0.00 0.00 0.00 53.44 51.61 1wee n ALA 53 Cb 0.59 -0.13 -0.06 0.00 0.00 0.00 0.00 19.45 19.86 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 -0.19 0.00 1.43 -1.26 -5.03 118.68 117.96 1wee s LEU 54 Ca 0.68 1.12 -0.29 0.00 -1.03 0.00 0.00 54.13 54.60 1wee s LEU 54 Cb -0.10 -3.36 -0.03 0.00 0.03 0.00 0.00 46.19 42.73 1wee s LEU 54 CO 0.55 0.07 1.59 -2.16 0.23 0.00 0.00 176.35 176.63 1wee s PRO 55 N -2.05 3.90 0.26 1.29 0.04 -1.26 -4.87 135.00 132.31 1wee s PRO 55 Ca 0.40 1.75 0.13 0.00 0.04 0.00 0.00 61.00 63.32 1wee s PRO 55 Cb -0.15 -4.00 0.91 0.00 0.04 0.00 0.00 34.50 31.30 1wee s PRO 55 CO 0.19 -1.17 1.13 0.43 0.04 0.00 0.00 177.00 177.63 1wee n SER 56 N 8.06 0.21 -3.83 6.66 7.64 -1.26 -4.23 113.62 126.86 1wee n SER 56 Ca 0.18 1.19 -0.12 0.00 1.01 0.00 0.00 58.87 61.13 1wee n SER 56 Cb 0.45 -0.56 -0.12 0.00 -1.01 0.00 0.00 64.21 62.96 1wee n SER 56 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 1wee s LYS 57 N -5.16 0.20 0.03 1.43 0.00 -1.26 -5.02 119.74 109.96 1wee s LYS 57 Ca -0.07 0.15 -0.02 0.00 0.00 0.00 0.00 55.97 56.03 1wee s LYS 57 Cb 0.24 0.09 -0.02 0.00 0.00 0.00 0.00 37.83 38.14 1wee s LYS 57 CO 0.56 -0.03 0.01 0.12 0.00 0.00 0.00 175.35 176.01 1wee s PHE 58 N -0.05 0.28 -0.02 1.78 2.19 -1.26 -5.02 117.98 115.88 1wee s PHE 58 Ca -0.01 -0.59 0.01 0.00 0.33 0.00 0.00 56.93 56.67 1wee s PHE 58 Cb -0.02 -0.20 0.01 0.00 -1.31 0.00 0.00 43.02 41.50 1wee s PHE 58 CO 0.00 -0.27 -0.04 -0.51 1.83 0.00 0.00 175.22 176.23 1wee s LEU 59 N -1.86 1.66 1.10 6.12 1.43 -1.26 -1.96 118.68 123.90 1wee s LEU 59 Ca -0.09 -0.10 -0.14 0.00 -1.03 0.00 0.00 54.13 52.77 1wee s LEU 59 Cb -0.05 -0.32 0.24 0.00 0.03 0.00 0.00 46.19 46.09 1wee s LEU 59 CO -0.03 0.00 1.08 0.00 0.23 0.00 0.00 176.35 177.63 1wee h PHE 61 N -2.26 -0.89 -0.40 0.00 -5.15 -2.01 0.21 116.94 106.45 1wee h PHE 61 Ca -0.54 0.01 0.08 0.00 -0.20 0.00 0.00 57.97 57.33 1wee h PHE 61 Cb 1.33 0.36 -0.02 0.00 0.22 0.00 0.00 35.95 37.84 1wee h PHE 61 CO -0.38 -0.45 0.28 0.07 -2.00 0.00 0.00 178.31 175.83 1wee h ARG 62 N -0.62 0.18 0.15 6.09 -0.00 -2.02 -2.59 114.38 115.58 1wee h ARG 62 Ca 0.01 -0.01 -0.01 0.00 -0.00 0.00 0.00 59.98 59.97 1wee h ARG 62 Cb 0.60 -0.04 0.00 0.00 -0.00 0.00 0.00 29.97 30.53 1wee h ARG 62 CO -0.13 0.12 -0.07 0.00 -0.00 0.00 0.00 179.97 179.89 1wee n ILE 64 N -4.92 -0.10 0.02 0.00 5.41 0.66 0.23 119.36 120.65 1wee n ILE 64 Ca -0.08 1.21 -0.21 0.00 1.00 0.00 0.00 62.75 64.66 1wee n ILE 64 Cb 0.27 -1.99 -0.14 0.00 -0.71 0.00 0.00 39.64 37.07 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 0.26 -0.85 0.38 5.08 -1.59 -3.35 114.58 114.50 1wee h GLU 65 Ca 0.66 -0.44 0.06 0.00 -1.00 0.00 0.00 59.36 58.65 1wee h GLU 65 Cb 2.40 0.16 -0.06 0.00 0.50 0.00 0.00 28.75 31.75 1wee h GLU 65 CO -0.18 1.21 0.53 -0.07 -1.00 0.00 0.00 179.01 179.49 1wee h LEU 66 N -0.31 0.82-10.25 1.33 3.38 0.30 -3.43 115.31 107.16 1wee h LEU 66 Ca -0.28 0.02 -0.50 0.00 0.09 0.00 0.00 57.88 57.21 1wee h LEU 66 Cb 1.75 -0.15 0.09 0.00 0.09 0.00 0.00 40.66 42.43 1wee h LEU 66 CO 0.07 0.52 0.37 -0.94 0.09 0.00 0.00 178.44 178.55 1wee s SER 67 N -5.76 5.33 0.00 -0.43 1.04 0.08 -4.49 113.70 109.47 1wee s SER 67 Ca -0.13 1.81 0.00 0.00 0.48 0.00 0.00 55.95 58.11 1wee s SER 67 Cb 0.18 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.78 1wee s SER 67 CO 0.79 -1.48 0.00 0.61 0.98 0.00 0.00 173.24 174.14 1wee n GLY 68 N -1.17 3.00 0.00 7.32 0.00 -1.26 -4.90 105.19 108.18 1wee n GLY 68 Ca 0.09 -0.60 0.08 0.00 0.00 0.00 0.00 46.02 45.59 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 0.41 -4.30 1.61 -0.04 -1.26 -4.72 135.00 126.71 1wee n PRO 69 Ca 0.00 0.04 -0.26 0.00 -0.04 0.00 0.00 63.50 63.24 1wee n PRO 69 Cb 0.00 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 31.87 1wee n PRO 69 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1wee s SER 70 N -2.16 4.32 -0.23 3.54 1.04 -1.26 -5.12 113.70 113.83 1wee s SER 70 Ca 0.21 -0.61 -0.01 0.00 0.48 0.00 0.00 55.95 56.02 1wee s SER 70 Cb 0.11 -0.75 0.02 0.00 0.10 0.00 0.00 66.02 65.50 1wee s SER 70 CO 0.19 0.07 -0.09 -0.94 0.98 0.00 0.00 173.24 173.46 1wee s SER 71 N -3.08 4.05 0.00 7.02 1.04 -1.26 -5.11 113.70 116.35 1wee s SER 71 Ca 0.27 -0.73 0.25 0.00 0.48 0.00 0.00 55.95 56.23 1wee s SER 71 Cb -0.08 -1.64 0.47 0.00 0.10 0.00 0.00 66.02 64.87 1wee s SER 71 CO 0.17 -0.08 1.42 0.61 0.98 0.00 0.00 173.24 176.34