#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wen s SER 2 N 0.00 1.20 -0.29 1.61 0.15 -1.26 -5.17 113.70 109.93 1wen s SER 2 Ca 0.00 -1.64 -0.18 0.00 0.70 0.00 0.00 55.95 54.83 1wen s SER 2 Cb 0.00 0.51 0.18 0.00 -1.71 0.00 0.00 66.02 65.00 1wen s SER 2 CO 0.00 -1.00 1.18 -0.94 1.20 0.00 0.00 173.24 173.68 1wen s SER 3 N -3.30 -0.23 0.00 5.45 1.04 -1.26 -5.16 113.70 110.23 1wen s SER 3 Ca 0.40 0.39 0.00 0.00 0.48 0.00 0.00 55.95 57.22 1wen s SER 3 Cb 0.04 0.92 0.00 0.00 0.10 0.00 0.00 66.02 67.08 1wen s SER 3 CO 0.23 -0.06 0.00 0.61 0.98 0.00 0.00 173.24 174.99 1wen n GLY 4 N 2.96 1.37 3.32 7.32 0.00 -1.26 -5.16 105.19 113.75 1wen n GLY 4 Ca -0.16 0.50 -0.01 0.00 0.00 0.00 0.00 46.02 46.34 1wen n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wen s SER 5 N 0.00 -0.92 -0.03 1.61 0.01 -1.26 -5.15 113.70 107.96 1wen s SER 5 Ca 0.00 1.07 0.00 0.00 1.31 0.00 0.00 55.95 58.34 1wen s SER 5 Cb 0.00 1.96 0.03 0.00 0.21 0.00 0.00 66.02 68.22 1wen s SER 5 CO 0.00 -0.25 -0.00 -0.94 0.41 0.00 0.00 173.24 172.46 1wen s SER 6 N 2.80 0.42 0.00 2.44 1.04 -1.26 -5.15 113.70 113.99 1wen s SER 6 Ca 0.06 -0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.46 1wen s SER 6 Cb -0.13 -0.22 0.00 0.00 0.10 0.00 0.00 66.02 65.76 1wen s SER 6 CO -0.18 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 174.55 1wen n GLY 7 N 4.10 4.39 3.64 7.32 0.00 -1.26 -5.17 105.19 118.21 1wen n GLY 7 Ca -0.27 -1.87 -0.06 0.00 0.00 0.00 0.00 46.02 43.82 1wen n GLY 7 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1wen s ASP 8 N 0.39 -0.23 -0.44 1.61 2.15 -1.26 -5.13 116.67 113.76 1wen s ASP 8 Ca 0.00 0.40 -0.15 0.00 0.43 0.00 0.00 52.55 53.23 1wen s ASP 8 Cb 0.00 0.40 0.05 0.00 -0.30 0.00 0.00 42.92 43.06 1wen s ASP 8 CO 0.00 -0.10 0.35 -0.04 -0.17 0.00 0.00 175.17 175.21 1wen s MET 9 N -0.12 2.97 0.00 4.34 -1.94 -1.26 -4.93 119.30 118.36 1wen s MET 9 Ca 0.05 -1.19 0.06 0.00 -1.71 0.00 0.00 55.69 52.89 1wen s MET 9 Cb -0.04 -4.05 0.33 0.00 2.01 0.00 0.00 34.83 33.08 1wen s MET 9 CO -0.10 -0.89 0.80 -0.35 -0.01 0.00 0.00 175.02 174.47 1wen n PRO 10 N 5.18 0.49 -3.13 2.03 -0.04 -1.26 -4.76 135.00 133.51 1wen n PRO 10 Ca -0.12 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.11 1wen n PRO 10 Cb 0.45 -1.18 0.00 0.00 -0.04 0.00 0.00 33.50 32.73 1wen n PRO 10 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1wen s VAL 11 N -2.00 4.53 -0.01 0.52 -7.23 -1.26 -5.11 120.40 109.83 1wen s VAL 11 Ca 0.08 -0.43 -0.28 0.00 -1.81 0.00 0.00 61.98 59.54 1wen s VAL 11 Cb 0.04 -3.67 0.10 0.00 0.56 0.00 0.00 36.38 33.41 1wen s VAL 11 CO 0.06 -0.47 0.84 1.51 -0.31 0.00 0.00 175.10 176.74 1wen s ASP 12 N -4.13 -0.43 0.28 4.85 -4.77 -1.26 -5.05 116.67 106.16 1wen s ASP 12 Ca 0.45 0.14 0.06 0.00 -3.30 0.00 0.00 52.55 49.90 1wen s ASP 12 Cb -0.10 0.42 0.39 0.00 -1.09 0.00 0.00 42.92 42.54 1wen s ASP 12 CO 0.38 -0.62 1.66 1.55 0.70 0.00 0.00 175.17 178.83 1wen h PRO 13 N 2.20 0.25 -0.91 2.11 0.13 -2.01 -3.29 132.00 130.48 1wen h PRO 13 Ca -0.24 -0.13 0.10 0.00 -0.87 0.00 0.00 66.00 64.86 1wen h PRO 13 Cb 1.23 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.24 1wen h PRO 13 CO 0.33 0.66 -0.48 0.09 -0.23 0.00 0.00 178.00 178.37 1wen n ASN 14 N -3.99 -0.85 -4.70 1.44 4.13 -1.26 -4.41 115.26 105.62 1wen n ASN 14 Ca -0.02 1.62 -0.43 0.00 1.68 0.00 0.00 54.58 57.43 1wen n ASN 14 Cb 0.51 -0.26 -0.01 0.00 -1.54 0.00 0.00 39.78 38.49 1wen n ASN 14 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1wen n GLU 15 N -5.21 2.13 -1.21 3.52 4.71 -1.24 -4.97 120.64 118.37 1wen n GLU 15 Ca 0.04 0.75 -0.30 0.00 -0.01 0.00 0.00 57.16 57.64 1wen n GLU 15 Cb 0.28 -2.33 0.13 0.00 -1.01 0.00 0.00 31.44 28.51 1wen n GLU 15 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 1wen s PRO 16 N -1.87 1.42 -0.02 3.49 0.04 -1.26 -4.92 135.00 131.88 1wen s PRO 16 Ca 0.55 0.88 0.01 0.00 0.04 0.00 0.00 61.00 62.48 1wen s PRO 16 Cb -0.57 -1.82 0.01 0.00 0.04 0.00 0.00 34.50 32.16 1wen s PRO 16 CO 0.62 -2.14 -0.01 0.95 0.04 0.00 0.00 177.00 176.46 1wen s THR 17 N -2.93 0.18 0.01 1.26 -4.23 -1.26 -3.84 115.64 104.83 1wen s THR 17 Ca 0.63 0.01 -0.01 0.00 -1.18 0.00 0.00 61.69 61.14 1wen s THR 17 Cb -0.18 -0.23 -0.00 0.00 1.34 0.00 0.00 72.50 73.43 1wen s THR 17 CO 0.57 0.11 -0.01 -1.22 -0.54 0.00 0.00 174.62 173.52 1wen n TYR 18 N 3.67 0.00 -1.02 3.99 4.02 -1.13 -4.92 117.16 121.76 1wen n TYR 18 Ca -0.21 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.32 1wen n TYR 18 Cb 0.54 -0.02 0.04 0.00 -0.02 0.00 0.00 39.34 39.88 1wen n TYR 18 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1wen h LEU 20 N -0.90 0.13 0.00 0.00 4.07 -1.96 -1.90 115.31 114.76 1wen h LEU 20 Ca -0.44 -0.04 0.00 0.00 0.08 0.00 0.00 57.88 57.49 1wen h LEU 20 Cb 1.32 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 43.02 1wen h LEU 20 CO 0.25 0.39 0.00 0.00 -1.08 0.00 0.00 178.44 178.01 1wen n HIS 22 N -1.24 -1.89 -4.44 0.00 8.25 -0.71 -5.03 115.22 110.16 1wen n HIS 22 Ca 0.04 0.77 -0.25 0.00 -0.26 0.00 0.00 57.72 58.02 1wen n HIS 22 Cb 0.05 -4.43 -0.10 0.00 1.12 0.00 0.00 29.99 26.63 1wen n HIS 22 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1wen s GLN 23 N -4.93 1.94 0.85 -0.41 -1.52 -1.26 -4.96 119.66 109.37 1wen s GLN 23 Ca 0.08 -1.83 -0.09 0.00 -1.95 0.00 0.00 55.36 51.57 1wen s GLN 23 Cb -0.01 -1.82 0.16 0.00 -0.22 0.00 0.00 33.01 31.12 1wen s GLN 23 CO 0.61 0.15 1.17 0.14 -0.25 0.00 0.00 175.29 177.11 1wen s VAL 24 N -2.56 2.06 0.11 1.09 -7.23 -1.25 -2.83 120.40 109.80 1wen s VAL 24 Ca 0.33 -0.28 -0.31 0.00 -1.81 0.00 0.00 61.98 59.92 1wen s VAL 24 Cb 0.01 -2.79 -0.10 0.00 0.56 0.00 0.00 36.38 34.06 1wen s VAL 24 CO 0.18 0.00 1.87 -1.54 -0.31 0.00 0.00 175.10 175.30 1wen n SER 25 N -3.32 4.12 -3.56 4.85 3.41 -1.26 -4.91 113.62 112.95 1wen n SER 25 Ca 0.15 0.97 -0.07 0.00 -0.26 0.00 0.00 58.87 59.66 1wen n SER 25 Cb 0.60 -1.55 -0.02 0.00 -0.26 0.00 0.00 64.21 62.98 1wen n SER 25 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1wen s TYR 26 N 3.06 -0.28 0.08 7.33 -0.85 -1.26 -5.15 117.35 120.27 1wen s TYR 26 Ca 0.83 0.12 0.00 0.00 -0.52 0.00 0.00 57.07 57.50 1wen s TYR 26 Cb -0.46 0.56 0.00 0.00 0.38 0.00 0.00 41.96 42.44 1wen s TYR 26 CO 0.38 -0.56 0.00 0.41 -1.52 0.00 0.00 175.55 174.25 1wen n GLY 27 N -0.28 -0.57 3.72 5.49 0.00 -1.26 -4.56 105.19 107.73 1wen n GLY 27 Ca -0.08 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.11 1wen n GLY 27 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wen s GLU 28 N -0.85 4.38 0.32 1.61 8.01 -1.26 -4.98 118.70 125.93 1wen s GLU 28 Ca 0.00 1.99 0.04 0.00 0.01 0.00 0.00 54.97 57.02 1wen s GLU 28 Cb 0.00 -3.25 -0.06 0.00 -4.31 0.00 0.00 34.13 26.51 1wen s GLU 28 CO 0.00 -0.32 0.04 -1.64 0.01 0.00 0.00 175.26 173.35 1wen s MET 29 N 0.61 1.65 0.06 1.61 -1.94 -1.26 -1.67 119.30 118.36 1wen s MET 29 Ca 0.60 -1.90 -0.00 0.00 -1.71 0.00 0.00 55.69 52.68 1wen s MET 29 Cb -0.35 -0.95 -0.04 0.00 2.01 0.00 0.00 34.83 35.50 1wen s MET 29 CO 0.33 -0.14 -0.04 0.96 -0.01 0.00 0.00 175.02 176.12 1wen s ILE 30 N -3.22 0.33 -0.31 2.53 -0.00 -1.09 -4.95 121.20 114.48 1wen s ILE 30 Ca 0.35 -1.74 -0.05 0.00 -0.00 0.00 0.00 60.65 59.21 1wen s ILE 30 Cb 0.08 -1.43 0.03 0.00 -0.00 0.00 0.00 42.46 41.15 1wen s ILE 30 CO 0.15 -0.91 0.07 -0.83 -0.00 0.00 0.00 174.94 173.41 1wen s GLY 31 N -2.79 1.79 0.96 6.27 0.00 -1.26 -3.21 107.32 109.08 1wen s GLY 31 Ca 0.06 -1.66 -0.15 0.00 0.00 0.00 0.00 44.72 42.97 1wen s GLY 31 CO -0.08 0.71 -0.25 0.00 0.00 0.00 0.00 173.10 173.48 1wen n ASP 33 N 1.39 4.07 -4.16 0.00 9.92 -0.71 -4.98 116.55 122.08 1wen n ASP 33 Ca 0.02 -3.79 -0.31 0.00 -0.53 0.00 0.00 54.79 50.19 1wen n ASP 33 Cb 0.55 -0.58 -0.17 0.00 -0.64 0.00 0.00 41.12 40.28 1wen n ASP 33 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 1wen s ASN 34 N -2.86 2.82 0.55 -2.24 2.47 -1.26 -5.01 114.94 109.42 1wen s ASN 34 Ca 0.50 -0.51 0.34 0.00 0.42 0.00 0.00 52.86 53.60 1wen s ASN 34 Cb 0.42 -1.29 1.41 0.00 -1.45 0.00 0.00 41.25 40.35 1wen s ASN 34 CO 0.00 0.11 2.00 1.55 -3.72 0.00 0.00 177.10 177.04 1wen h PRO 35 N 6.95 0.00 0.01 0.43 0.13 -2.03 -2.84 132.00 134.65 1wen h PRO 35 Ca -0.25 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.64 1wen h PRO 35 Cb 1.22 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 1wen h PRO 35 CO 0.49 0.00 -1.22 0.22 -0.23 0.00 0.00 178.00 177.26 1wen h ASP 36 N 0.00 0.04 -2.86 1.44 3.58 -2.02 -3.46 116.42 113.13 1wen h ASP 36 Ca 0.00 -0.05 -0.59 0.00 0.42 0.00 0.00 57.03 56.81 1wen h ASP 36 Cb 0.49 -0.01 0.15 0.00 1.72 0.00 0.00 39.33 41.67 1wen h ASP 36 CO 0.00 1.04 -0.15 0.00 -2.88 0.00 0.00 179.24 177.25 1wen n SER 38 N 0.60 2.09 0.05 0.00 7.64 -1.26 -4.75 113.62 117.98 1wen n SER 38 Ca 0.11 0.03 -0.05 0.00 1.01 0.00 0.00 58.87 59.98 1wen n SER 38 Cb 0.42 -0.44 -0.03 0.00 -1.01 0.00 0.00 64.21 63.16 1wen n SER 38 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1wen h ILE 39 N -0.29 0.12 -5.69 0.44 2.04 -1.93 -3.48 117.51 108.72 1wen h ILE 39 Ca -0.49 -0.90 -0.41 0.00 1.00 0.00 0.00 64.86 64.05 1wen h ILE 39 Cb 1.62 0.22 0.09 0.00 -0.74 0.00 0.00 36.82 38.00 1wen h ILE 39 CO -0.17 0.04 -0.68 -0.62 0.00 0.00 0.00 178.15 176.72 1wen n GLU 40 N -4.92 -6.91 -3.56 2.37 1.02 -1.26 -4.97 120.64 102.41 1wen n GLU 40 Ca -0.04 0.79 -0.01 0.00 -0.02 0.00 0.00 57.16 57.88 1wen n GLU 40 Cb 0.12 -5.78 -0.05 0.00 -0.02 0.00 0.00 31.44 25.71 1wen n GLU 40 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1wen s TRP 41 N -3.28 -0.79 0.20 -0.32 0.52 -1.25 -3.72 118.94 110.30 1wen s TRP 41 Ca 0.55 1.46 -0.07 0.00 0.02 0.00 0.00 56.10 58.06 1wen s TRP 41 Cb -0.25 0.47 -0.02 0.00 -1.15 0.00 0.00 33.47 32.52 1wen s TRP 41 CO 0.68 -0.39 0.28 -0.06 0.02 0.00 0.00 176.95 177.48 1wen s PHE 42 N 2.02 0.67 -0.21 -1.98 0.40 -1.20 -3.40 117.98 114.28 1wen s PHE 42 Ca -0.06 -0.99 -0.09 0.00 -0.60 0.00 0.00 56.93 55.19 1wen s PHE 42 Cb -0.06 -0.18 -0.04 0.00 0.51 0.00 0.00 43.02 43.25 1wen s PHE 42 CO -0.17 -0.76 0.11 -1.01 0.70 0.00 0.00 175.22 174.09 1wen s HIS 43 N -4.05 3.29 0.00 0.36 3.76 -1.26 -2.69 115.29 114.70 1wen s HIS 43 Ca 0.27 0.14 0.00 0.00 -0.15 0.00 0.00 55.06 55.32 1wen s HIS 43 Cb 0.04 -2.18 0.00 0.00 1.11 0.00 0.00 32.58 31.55 1wen s HIS 43 CO 0.07 0.11 0.81 1.19 -0.85 0.00 0.00 174.74 176.06 1wen n PHE 44 N 3.91 0.00 -0.34 1.40 3.01 -0.67 0.31 117.46 125.08 1wen n PHE 44 Ca -0.16 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.44 1wen n PHE 44 Cb 0.52 -0.39 0.28 0.00 -0.01 0.00 0.00 39.48 39.88 1wen n PHE 44 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1wen h ALA 45 N -0.89 1.14 0.33 4.37 0.00 -1.85 0.29 119.26 122.65 1wen h ALA 45 Ca 0.00 0.35 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 1wen h ALA 45 Cb 0.00 0.61 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1wen h ALA 45 CO 0.00 -0.56 -0.16 0.00 0.00 0.00 0.00 179.25 178.53 1wen n VAL 47 N -5.25 1.20 -3.83 0.00 0.24 0.90 -4.88 118.33 106.71 1wen n VAL 47 Ca -0.10 -0.34 -0.29 0.00 -2.04 0.00 0.00 64.34 61.56 1wen n VAL 47 Cb 0.22 -0.79 0.01 0.00 -1.47 0.00 0.00 33.84 31.81 1wen n VAL 47 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wen n GLY 48 N 0.17 -0.70 3.18 7.63 0.00 0.51 -4.86 105.19 111.12 1wen n GLY 48 Ca 0.10 0.29 -0.40 0.00 0.00 0.00 0.00 46.02 46.01 1wen n GLY 48 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wen s LEU 49 N -6.02 5.82 0.31 0.99 1.43 -0.70 -4.92 118.68 115.59 1wen s LEU 49 Ca 0.25 -3.12 0.06 0.00 -1.03 0.00 0.00 54.13 50.29 1wen s LEU 49 Cb -0.14 -2.00 0.74 0.00 0.03 0.00 0.00 46.19 44.82 1wen s LEU 49 CO 0.68 -0.36 1.78 0.71 0.23 0.00 0.00 176.35 179.40 1wen h THR 50 N 4.66 0.72 -3.27 5.49 1.35 -1.89 -3.43 112.91 116.55 1wen h THR 50 Ca 0.08 -0.26 -0.16 0.00 -0.55 0.00 0.00 66.41 65.52 1wen h THR 50 Cb 0.93 -0.12 -0.24 0.00 -1.73 0.00 0.00 68.15 67.00 1wen h THR 50 CO 0.79 0.14 -0.45 -0.89 -0.25 0.00 0.00 175.52 174.86 1wen s THR 51 N -5.85 0.03 -0.22 6.82 2.01 -1.26 -5.11 115.64 112.06 1wen s THR 51 Ca -0.11 -0.25 -0.40 0.00 0.31 0.00 0.00 61.69 61.24 1wen s THR 51 Cb 0.25 -0.38 -0.16 0.00 0.01 0.00 0.00 72.50 72.21 1wen s THR 51 CO 0.80 -0.14 1.65 1.17 -0.69 0.00 0.00 174.62 177.42 1wen n LYS 52 N 2.33 1.06 -2.05 4.92 4.81 -1.26 -4.80 118.16 123.18 1wen n LYS 52 Ca -0.17 0.39 -0.27 0.00 -0.87 0.00 0.00 58.31 57.40 1wen n LYS 52 Cb 0.57 -2.05 -0.05 0.00 0.02 0.00 0.00 35.03 33.52 1wen n LYS 52 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1wen s PRO 53 N 2.92 2.55 0.37 1.64 0.04 -1.26 -4.95 135.00 136.31 1wen s PRO 53 Ca 0.96 -0.32 -0.26 0.00 0.04 0.00 0.00 61.00 61.43 1wen s PRO 53 Cb -1.08 -5.07 -0.12 0.00 0.04 0.00 0.00 34.50 28.27 1wen s PRO 53 CO 0.63 -3.40 1.09 2.89 0.04 0.00 0.00 177.00 178.26 1wen n ARG 54 N 8.84 1.57 0.00 4.56 1.85 -1.26 -4.32 116.66 127.89 1wen n ARG 54 Ca 0.40 0.56 0.00 0.00 -1.00 0.00 0.00 57.85 57.81 1wen n ARG 54 Cb 0.47 -2.08 0.00 0.00 -1.05 0.00 0.00 32.46 29.79 1wen n ARG 54 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1wen n GLY 55 N 1.07 1.44 3.42 2.89 0.00 -1.26 -4.86 105.19 107.89 1wen n GLY 55 Ca 0.08 -0.76 -0.32 0.00 0.00 0.00 0.00 46.02 45.02 1wen n GLY 55 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wen s LYS 56 N 0.00 2.40 0.09 1.61 -2.85 -1.26 -5.13 119.74 114.60 1wen s LYS 56 Ca 0.00 -0.77 0.06 0.00 -1.00 0.00 0.00 55.97 54.26 1wen s LYS 56 Cb 0.00 -2.28 -0.03 0.00 -2.06 0.00 0.00 37.83 33.46 1wen s LYS 56 CO 0.00 0.60 -0.16 -0.46 0.10 0.00 0.00 175.35 175.43 1wen s TRP 57 N -0.67 1.39 -0.05 1.78 -0.00 -1.26 -5.02 118.94 115.10 1wen s TRP 57 Ca 0.10 -0.48 -0.01 0.00 -0.00 0.00 0.00 56.10 55.71 1wen s TRP 57 Cb -0.11 -0.76 0.03 0.00 -0.00 0.00 0.00 33.47 32.63 1wen s TRP 57 CO 0.00 0.12 0.03 -0.06 -0.00 0.00 0.00 176.95 177.03 1wen s PHE 58 N -1.51 0.33 0.76 5.86 0.08 -1.26 -1.73 117.98 120.51 1wen s PHE 58 Ca 0.03 0.05 -0.16 0.00 0.12 0.00 0.00 56.93 56.97 1wen s PHE 58 Cb -0.08 -0.58 -0.06 0.00 -0.57 0.00 0.00 43.02 41.72 1wen s PHE 58 CO 0.03 -0.23 0.19 0.00 -0.10 0.00 0.00 175.22 175.11 1wen n PRO 60 N 0.03 0.49 -0.01 0.00 -0.04 -1.26 -1.79 135.00 132.42 1wen n PRO 60 Ca 0.07 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.57 1wen n PRO 60 Cb 0.51 -1.15 -0.09 0.00 -0.04 0.00 0.00 33.50 32.73 1wen n PRO 60 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1wen n ARG 61 N -0.65 0.67 -0.09 0.54 1.74 -1.26 -4.49 116.66 113.11 1wen n ARG 61 Ca 0.04 -0.09 -0.10 0.00 -0.77 0.00 0.00 57.85 56.92 1wen n ARG 61 Cb 0.02 -1.28 -0.14 0.00 -1.02 0.00 0.00 32.46 30.03 1wen n ARG 61 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1wen n SER 63 N -2.74 2.93 -2.03 0.00 2.88 -0.74 -4.34 113.62 109.58 1wen n SER 63 Ca -0.32 -2.43 -0.08 0.00 -1.33 0.00 0.00 58.87 54.71 1wen n SER 63 Cb 1.09 -0.59 -0.12 0.00 -0.75 0.00 0.00 64.21 63.85 1wen n SER 63 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wen n GLN 64 N 0.11 1.48 -3.70 -1.46 6.02 -1.26 -4.58 117.38 113.99 1wen n GLN 64 Ca 0.14 -0.68 -0.23 0.00 -0.01 0.00 0.00 57.00 56.22 1wen n GLN 64 Cb 0.72 -1.79 0.05 0.00 1.02 0.00 0.00 30.24 30.24 1wen n GLN 64 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1wen n GLU 65 N 2.46 -5.77 -0.57 -1.09 2.13 -1.26 -4.94 120.64 111.60 1wen n GLU 65 Ca 0.29 0.68 -0.30 0.00 0.66 0.00 0.00 57.16 58.49 1wen n GLU 65 Cb 0.68 -5.47 0.22 0.00 0.27 0.00 0.00 31.44 27.14 1wen n GLU 65 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1wen n SER 66 N -3.00 -1.98 -3.83 4.31 7.64 -1.26 -4.70 113.62 110.80 1wen n SER 66 Ca -0.16 -0.12 -0.55 0.00 1.01 0.00 0.00 58.87 59.05 1wen n SER 66 Cb 0.62 -1.14 -0.08 0.00 -1.01 0.00 0.00 64.21 62.60 1wen n SER 66 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wen n GLY 67 N 1.43 0.13 3.57 0.23 0.00 -1.26 -4.90 105.19 104.40 1wen n GLY 67 Ca 0.02 0.81 -0.30 0.00 0.00 0.00 0.00 46.02 46.54 1wen n GLY 67 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wen s PRO 68 N 2.29 -1.63 -1.74 1.61 0.04 -1.26 -3.95 135.00 130.36 1wen s PRO 68 Ca 0.84 -0.21 -0.17 0.00 0.04 0.00 0.00 61.00 61.51 1wen s PRO 68 Cb -1.20 -1.56 0.17 0.00 0.04 0.00 0.00 34.50 31.94 1wen s PRO 68 CO 0.65 -3.96 0.42 -1.13 0.04 0.00 0.00 177.00 173.03 1wen n SER 69 N -4.91 -1.02 -4.26 6.66 3.41 -1.26 -4.80 113.62 107.44 1wen n SER 69 Ca 0.15 -1.22 -0.36 0.00 -0.26 0.00 0.00 58.87 57.19 1wen n SER 69 Cb 0.60 -1.55 0.06 0.00 -0.26 0.00 0.00 64.21 63.07 1wen n SER 69 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1wen n SER 70 N -2.48 -3.48 0.00 4.04 3.41 -1.25 -5.30 113.62 108.55 1wen n SER 70 Ca -0.00 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 59.00 1wen n SER 70 Cb 0.50 -1.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.45 1wen n SER 70 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49