#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 2.08 -0.14 1.61 1.04 -1.26 -5.08 113.70 111.95 1wen s SER 2 Ca 0.00 -1.02 -0.12 0.00 0.48 0.00 0.00 55.95 55.29 1wen s SER 2 Cb 0.00 -0.06 -0.06 0.00 0.10 0.00 0.00 66.02 66.00 1wen s SER 2 CO 0.00 -0.28 -0.26 -1.20 0.98 0.00 0.00 173.24 172.48 1wen n SER 3 N -0.27 1.62 0.00 7.02 7.64 -1.26 -5.15 113.62 123.22 1wen n SER 3 Ca -0.09 0.27 0.00 0.00 1.01 0.00 0.00 58.87 60.06 1wen n SER 3 Cb 0.61 -0.62 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 1wen n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wen n GLY 4 N 1.89 0.63 3.02 0.23 0.00 -1.26 -5.10 105.19 104.60 1wen n GLY 4 Ca -0.22 -2.14 -0.11 0.00 0.00 0.00 0.00 46.02 43.55 1wen n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wen s SER 5 N -4.00 0.05 0.39 1.61 1.04 -1.26 -5.14 113.70 106.39 1wen s SER 5 Ca 0.00 -0.16 -0.27 0.00 0.48 0.00 0.00 55.95 56.00 1wen s SER 5 Cb 0.00 0.16 -0.11 0.00 0.10 0.00 0.00 66.02 66.18 1wen s SER 5 CO 0.00 -0.23 1.46 -0.24 0.98 0.00 0.00 173.24 175.21 1wen n SER 6 N 2.07 3.62 0.00 7.02 2.88 -1.26 -4.92 113.62 123.02 1wen n SER 6 Ca -0.19 1.21 0.00 0.00 -1.33 0.00 0.00 58.87 58.55 1wen n SER 6 Cb 0.57 -1.61 0.00 0.00 -0.75 0.00 0.00 64.21 62.42 1wen n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wen n GLY 7 N 0.50 0.00 3.49 0.46 0.00 -1.26 -5.10 105.19 103.28 1wen n GLY 7 Ca 0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.90 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 -4.24 -0.60 -0.13 1.61 -1.08 -1.26 -5.16 116.67 105.80 1wen s ASP 8 Ca 0.00 1.04 -0.06 0.00 -0.52 0.00 0.00 52.55 53.01 1wen s ASP 8 Cb 0.00 1.04 -0.04 0.00 -1.46 0.00 0.00 42.92 42.46 1wen s ASP 8 CO 0.00 -0.30 0.07 -0.04 0.52 0.00 0.00 175.17 175.41 1wen s MET 9 N -0.09 3.52 0.51 4.34 -1.94 -1.26 -5.11 119.30 119.27 1wen s MET 9 Ca -0.03 -0.30 -0.09 0.00 -1.71 0.00 0.00 55.69 53.56 1wen s MET 9 Cb -0.04 -3.08 0.13 0.00 2.01 0.00 0.00 34.83 33.85 1wen s MET 9 CO 0.03 0.56 0.45 -0.35 -0.01 0.00 0.00 175.02 175.70 1wen n PRO 10 N 2.65 -1.92 -0.78 2.03 -0.04 -1.26 -5.01 135.00 130.66 1wen n PRO 10 Ca -0.18 -0.73 -0.29 0.00 -0.04 0.00 0.00 63.50 62.26 1wen n PRO 10 Cb 0.53 -0.68 0.20 0.00 -0.04 0.00 0.00 33.50 33.51 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 -1.82 2.21 0.06 0.52 -7.23 -1.26 -5.06 120.40 107.82 1wen s VAL 11 Ca 0.30 0.07 -0.27 0.00 -1.81 0.00 0.00 61.98 60.27 1wen s VAL 11 Cb -0.03 -2.25 0.09 0.00 0.56 0.00 0.00 36.38 34.75 1wen s VAL 11 CO 0.23 -0.09 0.81 1.51 -0.31 0.00 0.00 175.10 177.25 1wen s ASP 12 N -2.83 -0.40 0.21 4.85 1.47 -1.26 -5.05 116.67 113.65 1wen s ASP 12 Ca 0.66 -0.05 -0.03 0.00 1.18 0.00 0.00 52.55 54.31 1wen s ASP 12 Cb -0.22 0.46 0.17 0.00 -0.34 0.00 0.00 42.92 42.99 1wen s ASP 12 CO 0.60 -0.76 1.56 1.55 0.68 0.00 0.00 175.17 178.81 1wen h PRO 13 N 2.00 0.62 -0.72 2.11 0.13 -2.02 -3.24 132.00 130.88 1wen h PRO 13 Ca -0.25 -0.32 0.14 0.00 -0.87 0.00 0.00 66.00 64.69 1wen h PRO 13 Cb 1.26 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 32.26 1wen h PRO 13 CO 0.32 0.92 -0.20 -0.91 -0.23 0.00 0.00 178.00 177.90 1wen h ASN 14 N 0.50 -0.75 -3.40 1.44 4.21 -2.02 -3.25 115.58 112.31 1wen h ASN 14 Ca 0.04 0.22 -0.76 0.00 1.21 0.00 0.00 56.30 57.01 1wen h ASN 14 Cb 0.94 0.47 -0.26 0.00 -1.12 0.00 0.00 38.32 38.35 1wen h ASN 14 CO 0.08 -0.25 -0.18 -1.61 -1.29 0.00 0.00 177.43 174.18 1wen s GLU 15 N -6.21 3.01 0.37 0.81 2.02 -1.22 -5.06 118.70 112.42 1wen s GLU 15 Ca -0.14 -1.98 -0.27 0.00 0.02 0.00 0.00 54.97 52.60 1wen s GLU 15 Cb 0.21 -4.21 -0.09 0.00 0.10 0.00 0.00 34.13 30.13 1wen s GLU 15 CO 0.74 -1.28 1.20 -1.25 0.02 0.00 0.00 175.26 174.69 1wen s PRO 16 N 1.05 4.20 0.21 0.39 0.04 -1.23 -4.67 135.00 135.00 1wen s PRO 16 Ca 0.08 1.95 -0.29 0.00 0.04 0.00 0.00 61.00 62.79 1wen s PRO 16 Cb -0.23 -2.85 -0.08 0.00 0.04 0.00 0.00 34.50 31.37 1wen s PRO 16 CO -0.01 -0.22 0.89 0.95 0.04 0.00 0.00 177.00 178.64 1wen s THR 17 N -1.30 4.19 0.00 1.26 -4.23 -1.26 -4.66 115.64 109.65 1wen s THR 17 Ca 0.53 1.97 0.00 0.00 -1.18 0.00 0.00 61.69 63.01 1wen s THR 17 Cb -0.34 -4.27 0.00 0.00 1.34 0.00 0.00 72.50 69.23 1wen s THR 17 CO 0.43 0.50 0.00 -1.22 -0.54 0.00 0.00 174.62 173.79 1wen n TYR 18 N 1.61 0.00 -0.97 3.99 4.01 -1.16 -4.91 117.16 119.73 1wen n TYR 18 Ca -0.03 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.35 1wen n TYR 18 Cb 0.48 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.56 1wen n TYR 18 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1wen h LEU 20 N -1.10 0.37 -0.56 0.00 4.07 -1.97 -0.91 115.31 115.21 1wen h LEU 20 Ca -0.43 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.53 1wen h LEU 20 Cb 1.32 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.98 1wen h LEU 20 CO 0.24 0.27 0.26 0.00 -1.08 0.00 0.00 178.44 178.13 1wen n HIS 22 N -1.78 -1.72 -4.48 0.00 8.25 -0.35 -5.05 115.22 110.09 1wen n HIS 22 Ca -0.01 0.67 -0.29 0.00 -0.26 0.00 0.00 57.72 57.83 1wen n HIS 22 Cb 0.27 -4.00 -0.08 0.00 1.12 0.00 0.00 29.99 27.30 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 -4.52 2.12 0.36 -0.41 -1.52 -1.26 -4.89 119.66 109.54 1wen s GLN 23 Ca 0.17 -2.13 0.00 0.00 -1.95 0.00 0.00 55.36 51.45 1wen s GLN 23 Cb -0.02 -1.73 -0.03 0.00 -0.22 0.00 0.00 33.01 31.01 1wen s GLN 23 CO 0.54 -0.21 0.57 0.14 -0.25 0.00 0.00 175.29 176.09 1wen s VAL 24 N -2.74 5.09 -0.39 1.09 -7.23 -1.26 -2.99 120.40 111.96 1wen s VAL 24 Ca 0.28 -0.41 -0.38 0.00 -1.81 0.00 0.00 61.98 59.66 1wen s VAL 24 Cb 0.05 -3.86 -0.14 0.00 0.56 0.00 0.00 36.38 32.99 1wen s VAL 24 CO 0.15 -0.59 2.14 -0.24 -0.31 0.00 0.00 175.10 176.25 1wen n SER 25 N -1.83 1.71 -3.74 4.85 2.88 -1.26 -4.90 113.62 111.32 1wen n SER 25 Ca -0.04 0.55 -0.11 0.00 -1.33 0.00 0.00 58.87 57.93 1wen n SER 25 Cb 0.56 -1.14 -0.07 0.00 -0.75 0.00 0.00 64.21 62.82 1wen n SER 25 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 1wen s TYR 26 N 6.61 -0.10 0.00 0.66 -0.85 -1.26 -5.12 117.35 117.29 1wen s TYR 26 Ca 1.12 -0.10 0.00 0.00 -0.52 0.00 0.00 57.07 57.57 1wen s TYR 26 Cb -1.08 0.11 0.00 0.00 0.38 0.00 0.00 41.96 41.37 1wen s TYR 26 CO 0.56 -0.54 0.00 0.41 -1.52 0.00 0.00 175.55 174.45 1wen n GLY 27 N 0.37 1.68 3.75 5.49 0.00 -1.26 -4.54 105.19 110.69 1wen n GLY 27 Ca -0.18 -0.48 -0.37 0.00 0.00 0.00 0.00 46.02 44.99 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 0.00 4.19 0.06 1.61 0.41 -1.26 -5.03 118.70 118.68 1wen s GLU 28 Ca 0.00 0.29 0.01 0.00 -0.41 0.00 0.00 54.97 54.87 1wen s GLU 28 Cb 0.00 -3.38 -0.03 0.00 -1.78 0.00 0.00 34.13 28.94 1wen s GLU 28 CO 0.00 0.33 -0.06 -1.64 -0.49 0.00 0.00 175.26 173.40 1wen s MET 29 N 0.13 0.64 0.31 1.61 -1.94 -1.26 -0.93 119.30 117.86 1wen s MET 29 Ca 0.22 -1.04 0.06 0.00 -1.71 0.00 0.00 55.69 53.22 1wen s MET 29 Cb -0.15 -0.14 -0.06 0.00 2.01 0.00 0.00 34.83 36.50 1wen s MET 29 CO 0.08 -0.01 -0.03 0.96 -0.01 0.00 0.00 175.02 176.02 1wen s ILE 30 N -2.65 1.60 -0.32 2.53 -0.00 -1.14 -4.96 121.20 116.25 1wen s ILE 30 Ca 0.00 -2.09 -0.01 0.00 -0.00 0.00 0.00 60.65 58.56 1wen s ILE 30 Cb -0.01 -2.59 0.07 0.00 -0.00 0.00 0.00 42.46 39.92 1wen s ILE 30 CO -0.03 -0.20 0.04 -0.83 -0.00 0.00 0.00 174.94 173.92 1wen s GLY 31 N -3.49 1.82 0.46 6.27 0.00 -1.26 -3.38 107.32 107.74 1wen s GLY 31 Ca 0.32 -2.02 -0.20 0.00 0.00 0.00 0.00 44.72 42.81 1wen s GLY 31 CO 0.14 0.79 0.23 0.00 0.00 0.00 0.00 173.10 174.25 1wen h ASP 33 N 0.36 0.55 -1.75 0.00 3.58 -1.97 -3.46 116.42 113.73 1wen h ASP 33 Ca -0.40 -0.70 -0.68 0.00 0.42 0.00 0.00 57.03 55.67 1wen h ASP 33 Cb 1.43 -0.18 0.02 0.00 1.72 0.00 0.00 39.33 42.32 1wen h ASP 33 CO 0.47 1.57 0.88 -3.20 -2.88 0.00 0.00 179.24 176.08 1wen n ASN 34 N -3.56 2.62 0.25 2.28 5.15 -1.26 -4.84 115.26 115.91 1wen n ASN 34 Ca -0.17 1.05 0.14 0.00 -0.60 0.00 0.00 54.58 55.00 1wen n ASN 34 Cb 1.06 -1.23 0.61 0.00 -0.53 0.00 0.00 39.78 39.69 1wen n ASN 34 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1wen h PRO 35 N 7.27 0.00 0.10 1.20 0.13 -2.02 -3.01 132.00 135.67 1wen h PRO 35 Ca -0.47 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.38 1wen h PRO 35 Cb 1.30 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.45 1wen h PRO 35 CO 0.92 0.11 -1.20 0.22 -0.23 0.00 0.00 178.00 177.83 1wen h ASP 36 N 0.00 0.73 -0.97 1.44 1.82 -1.99 -3.46 116.42 113.98 1wen h ASP 36 Ca -0.00 -0.68 -0.73 0.00 -0.39 0.00 0.00 57.03 55.24 1wen h ASP 36 Cb 0.57 -0.23 0.07 0.00 0.68 0.00 0.00 39.33 40.42 1wen h ASP 36 CO 0.01 1.49 -0.15 0.00 -1.61 0.00 0.00 179.24 178.99 1wen n SER 38 N 1.64 2.07 0.15 0.00 2.88 -1.26 -4.56 113.62 114.54 1wen n SER 38 Ca 0.19 0.27 -0.07 0.00 -1.33 0.00 0.00 58.87 57.93 1wen n SER 38 Cb 0.14 -0.90 -0.03 0.00 -0.75 0.00 0.00 64.21 62.67 1wen n SER 38 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 1wen h ILE 39 N -0.18 0.00 -4.55 2.46 2.04 -1.92 -3.47 117.51 111.89 1wen h ILE 39 Ca -0.41 -0.30 -0.39 0.00 1.00 0.00 0.00 64.86 64.76 1wen h ILE 39 Cb 1.86 0.00 0.02 0.00 -0.74 0.00 0.00 36.82 37.97 1wen h ILE 39 CO 0.02 0.00 -0.58 -0.62 0.00 0.00 0.00 178.15 176.97 1wen n GLU 40 N -3.98 -4.25 -3.48 2.37 1.02 -1.26 -4.95 120.64 106.11 1wen n GLU 40 Ca -0.05 0.81 0.01 0.00 -0.02 0.00 0.00 57.16 57.91 1wen n GLU 40 Cb 0.17 -5.62 -0.04 0.00 -0.02 0.00 0.00 31.44 25.93 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 -3.09 -0.97 -0.06 -0.32 0.52 -1.25 -3.72 118.94 110.04 1wen s TRP 41 Ca 0.29 1.64 -0.07 0.00 0.02 0.00 0.00 56.10 57.98 1wen s TRP 41 Cb -0.13 0.57 0.02 0.00 -1.15 0.00 0.00 33.47 32.77 1wen s TRP 41 CO 0.36 -0.49 0.20 -0.06 0.02 0.00 0.00 176.95 176.98 1wen s PHE 42 N 2.66 -0.18 0.25 -1.98 0.40 -1.22 -2.86 117.98 115.05 1wen s PHE 42 Ca -0.03 0.43 -0.30 0.00 -0.60 0.00 0.00 56.93 56.44 1wen s PHE 42 Cb -0.09 0.06 -0.09 0.00 0.51 0.00 0.00 43.02 43.41 1wen s PHE 42 CO -0.18 -0.15 1.12 -1.01 0.70 0.00 0.00 175.22 175.71 1wen s HIS 43 N -0.17 3.54 0.04 0.36 3.76 -1.26 -2.89 115.29 118.67 1wen s HIS 43 Ca -0.03 1.63 -0.13 0.00 -0.15 0.00 0.00 55.06 56.39 1wen s HIS 43 Cb -0.02 -3.32 -0.05 0.00 1.11 0.00 0.00 32.58 30.29 1wen s HIS 43 CO 0.01 -0.71 1.20 0.74 -0.85 0.00 0.00 174.74 175.13 1wen h PHE 44 N 4.25 -0.57 -0.95 1.40 -1.00 -1.37 -0.54 116.94 118.16 1wen h PHE 44 Ca -0.46 0.02 0.27 0.00 2.81 0.00 0.00 57.97 60.61 1wen h PHE 44 Cb 1.21 0.25 -0.17 0.00 3.61 0.00 0.00 35.95 40.85 1wen h PHE 44 CO 0.60 -0.21 0.11 0.00 -1.61 0.00 0.00 178.31 177.20 1wen h ALA 45 N -1.11 1.24 0.03 2.45 0.00 -1.84 0.35 119.26 120.37 1wen h ALA 45 Ca 0.00 0.30 0.01 0.00 0.00 0.00 0.00 54.91 55.23 1wen h ALA 45 Cb 0.26 0.51 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1wen h ALA 45 CO -0.13 -0.57 -0.07 0.00 0.00 0.00 0.00 179.25 178.48 1wen n VAL 47 N -5.19 1.93 -3.83 0.00 0.24 0.88 -4.92 118.33 107.43 1wen n VAL 47 Ca -0.06 -0.92 -0.28 0.00 -2.04 0.00 0.00 64.34 61.03 1wen n VAL 47 Cb 0.12 -0.60 0.00 0.00 -1.47 0.00 0.00 33.84 31.89 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 -0.12 -1.23 3.09 7.63 0.00 0.83 -4.91 105.19 110.48 1wen n GLY 48 Ca 0.26 0.56 -0.36 0.00 0.00 0.00 0.00 46.02 46.47 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 -5.42 5.22 0.33 0.99 1.43 -0.52 -4.93 118.68 115.78 1wen s LEU 49 Ca 0.09 -2.75 0.01 0.00 -1.03 0.00 0.00 54.13 50.45 1wen s LEU 49 Cb -0.05 -1.85 0.59 0.00 0.03 0.00 0.00 46.19 44.91 1wen s LEU 49 CO 0.91 -0.39 1.99 0.74 0.23 0.00 0.00 176.35 179.83 1wen h THR 50 N 5.42 1.16 -4.13 5.49 2.02 -1.91 -3.42 112.91 117.54 1wen h THR 50 Ca -0.03 -0.32 -0.11 0.00 0.77 0.00 0.00 66.41 66.72 1wen h THR 50 Cb 0.96 0.15 -0.15 0.00 -1.74 0.00 0.00 68.15 67.37 1wen h THR 50 CO 0.71 0.17 -0.60 0.42 0.37 0.00 0.00 175.52 176.60 1wen s THR 51 N -5.79 0.19 0.07 3.16 -4.23 -1.26 -5.12 115.64 102.66 1wen s THR 51 Ca -0.10 -1.65 -0.31 0.00 -1.18 0.00 0.00 61.69 58.45 1wen s THR 51 Cb 0.18 -1.50 -0.08 0.00 1.34 0.00 0.00 72.50 72.44 1wen s THR 51 CO 0.77 -0.88 1.61 -0.75 -0.54 0.00 0.00 174.62 174.83 1wen s LYS 52 N -3.91 4.21 -0.54 3.99 2.20 -1.26 -4.92 119.74 119.51 1wen s LYS 52 Ca 0.07 2.28 -0.27 0.00 -0.36 0.00 0.00 55.97 57.69 1wen s LYS 52 Cb 0.07 -3.55 -0.02 0.00 -1.51 0.00 0.00 37.83 32.82 1wen s LYS 52 CO -0.10 -0.70 1.82 -1.25 -0.36 0.00 0.00 175.35 174.77 1wen s PRO 53 N 2.45 2.83 -1.22 4.03 0.04 -1.26 -4.90 135.00 136.98 1wen s PRO 53 Ca 0.72 0.80 -0.21 0.00 0.04 0.00 0.00 61.00 62.35 1wen s PRO 53 Cb -0.39 -4.33 -0.03 0.00 0.04 0.00 0.00 34.50 29.79 1wen s PRO 53 CO 0.31 -2.48 1.87 0.54 0.04 0.00 0.00 177.00 177.29 1wen n ARG 54 N 8.96 2.22 -0.63 4.56 3.00 -1.26 -4.74 116.66 128.77 1wen n ARG 54 Ca 0.21 -2.74 0.00 0.00 -0.01 0.00 0.00 57.85 55.31 1wen n ARG 54 Cb 0.51 -3.59 0.00 0.00 0.00 0.00 0.00 32.46 29.38 1wen n ARG 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1wen n GLY 55 N 5.52 0.68 3.74 -0.13 0.00 -1.26 -5.10 105.19 108.64 1wen n GLY 55 Ca 0.47 -1.79 -0.42 0.00 0.00 0.00 0.00 46.02 44.28 1wen n GLY 55 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wen n LYS 56 N 0.00 2.63 -3.63 1.61 5.02 -1.26 -5.00 118.16 117.53 1wen n LYS 56 Ca 0.00 0.93 -0.22 0.00 -2.02 0.00 0.00 58.31 57.00 1wen n LYS 56 Cb 0.00 -2.69 -0.17 0.00 -0.02 0.00 0.00 35.03 32.16 1wen n LYS 56 CO 0.00 0.00 0.00 -0.46 -0.52 0.00 0.00 177.40 176.42 1wen s TRP 57 N -0.30 0.04 -0.42 2.13 -0.00 -1.26 -5.09 118.94 114.05 1wen s TRP 57 Ca 0.62 0.08 -0.16 0.00 -0.00 0.00 0.00 56.10 56.63 1wen s TRP 57 Cb -0.50 -0.52 0.02 0.00 -0.00 0.00 0.00 33.47 32.47 1wen s TRP 57 CO 0.53 -0.37 0.38 -0.06 -0.00 0.00 0.00 176.95 177.42 1wen s PHE 58 N 2.19 3.20 0.73 5.86 0.08 -1.26 -3.35 117.98 125.43 1wen s PHE 58 Ca 0.04 -0.47 -0.18 0.00 0.12 0.00 0.00 56.93 56.44 1wen s PHE 58 Cb -0.14 -2.76 -0.15 0.00 -0.57 0.00 0.00 43.02 39.40 1wen s PHE 58 CO -0.07 -0.65 -0.42 0.00 -0.10 0.00 0.00 175.22 173.98 1wen n PRO 60 N 1.92 0.49 -0.03 0.00 -0.04 -1.26 -2.08 135.00 134.00 1wen n PRO 60 Ca 0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1wen n PRO 60 Cb 0.51 -1.05 -0.08 0.00 -0.04 0.00 0.00 33.50 32.84 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 -0.55 1.32 -0.06 0.54 1.74 -1.26 -4.07 116.66 114.32 1wen n ARG 61 Ca 0.01 -0.05 -0.22 0.00 -0.77 0.00 0.00 57.85 56.82 1wen n ARG 61 Cb 0.01 -1.26 -0.13 0.00 -1.02 0.00 0.00 32.46 30.06 1wen n ARG 61 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1wen h SER 63 N -0.39 0.90 -0.07 0.00 0.87 -1.70 -3.18 113.55 109.99 1wen h SER 63 Ca -0.45 -0.55 -0.08 0.00 -1.23 0.00 0.00 61.79 59.48 1wen h SER 63 Cb 1.75 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 63.41 1wen h SER 63 CO -0.08 1.28 -0.04 1.67 -0.53 0.00 0.00 176.83 179.13 1wen n GLN 64 N -4.07 1.33 -5.03 2.24 7.27 -1.26 -4.81 117.38 113.04 1wen n GLN 64 Ca -0.05 -0.42 -0.28 0.00 0.07 0.00 0.00 57.00 56.32 1wen n GLN 64 Cb 0.61 -1.30 -0.16 0.00 2.41 0.00 0.00 30.24 31.80 1wen n GLN 64 CO 0.00 0.00 0.00 -2.00 0.07 0.00 0.00 177.06 175.13 1wen s GLU 65 N 0.01 1.97 -1.38 3.69 2.56 -1.20 -4.73 118.70 119.62 1wen s GLU 65 Ca 0.19 -0.75 -0.08 0.00 0.00 0.00 0.00 54.97 54.33 1wen s GLU 65 Cb 0.10 -1.76 0.03 0.00 2.00 0.00 0.00 34.13 34.50 1wen s GLU 65 CO -0.01 0.36 1.09 0.43 -0.56 0.00 0.00 175.26 176.57 1wen n SER 66 N 2.87 -5.15 0.00 -1.70 7.64 -1.26 -4.91 113.62 111.11 1wen n SER 66 Ca -0.17 -0.62 0.00 0.00 1.01 0.00 0.00 58.87 59.09 1wen n SER 66 Cb 0.53 -4.71 0.00 0.00 -1.01 0.00 0.00 64.21 59.01 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 -1.80 3.97 3.60 0.23 0.00 -1.26 -5.11 105.19 104.82 1wen n GLY 67 Ca -0.04 -0.32 -0.43 0.00 0.00 0.00 0.00 46.02 45.24 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 4.47 3.35 0.26 1.61 0.04 -1.26 -4.95 135.00 138.52 1wen s PRO 68 Ca 0.00 1.26 -0.16 0.00 0.04 0.00 0.00 61.00 62.14 1wen s PRO 68 Cb 0.00 -4.17 0.00 0.00 0.04 0.00 0.00 34.50 30.38 1wen s PRO 68 CO 0.00 -1.84 0.56 -1.12 0.04 0.00 0.00 177.00 174.64 1wen s SER 69 N 5.68 -0.15 -0.14 6.66 0.01 -1.26 -4.93 113.70 119.57 1wen s SER 69 Ca 0.74 -0.82 -0.13 0.00 1.31 0.00 0.00 55.95 57.06 1wen s SER 69 Cb -0.20 0.64 -0.04 0.00 0.21 0.00 0.00 66.02 66.62 1wen s SER 69 CO 0.33 -1.21 -0.25 -0.24 0.41 0.00 0.00 173.24 172.27 1wen n SER 70 N -0.41 1.61 0.00 2.44 2.88 -1.26 -5.21 113.62 113.67 1wen n SER 70 Ca -0.02 0.37 0.00 0.00 -1.33 0.00 0.00 58.87 57.89 1wen n SER 70 Cb 0.61 -0.74 0.00 0.00 -0.75 0.00 0.00 64.21 63.33 1wen n SER 70 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42