#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wxt n SER 2 N 0.00 1.83 -4.72 1.61 2.88 -1.26 -4.85 113.62 109.11 1wxt n SER 2 Ca 0.00 0.55 -0.42 0.00 -1.33 0.00 0.00 58.87 57.67 1wxt n SER 2 Cb 0.00 -1.16 -0.03 0.00 -0.75 0.00 0.00 64.21 62.27 1wxt n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1wxt s SER 3 N 6.59 6.57 0.00 -3.46 0.15 -1.26 -4.86 113.70 117.43 1wxt s SER 3 Ca 1.11 2.66 0.00 0.00 0.70 0.00 0.00 55.95 60.42 1wxt s SER 3 Cb -1.03 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 60.68 1wxt s SER 3 CO 0.55 -0.83 0.00 0.61 1.20 0.00 0.00 173.24 174.77 1wxt n GLY 4 N 3.49 0.88 3.74 9.45 0.00 -1.26 -5.09 105.19 116.40 1wxt n GLY 4 Ca 0.13 -1.92 -0.40 0.00 0.00 0.00 0.00 46.02 43.82 1wxt n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wxt s SER 5 N -0.34 7.32 -0.30 1.61 0.15 -1.26 -5.04 113.70 115.84 1wxt s SER 5 Ca 0.00 1.58 -0.11 0.00 0.70 0.00 0.00 55.95 58.12 1wxt s SER 5 Cb 0.00 -2.51 0.13 0.00 -1.71 0.00 0.00 66.02 61.92 1wxt s SER 5 CO 0.00 -0.00 0.66 -0.44 1.20 0.00 0.00 173.24 174.66 1wxt s SER 6 N -0.09 -1.12 0.00 5.45 0.01 -1.26 -5.09 113.70 111.59 1wxt s SER 6 Ca 0.41 1.56 0.00 0.00 1.31 0.00 0.00 55.95 59.23 1wxt s SER 6 Cb -0.22 2.20 0.00 0.00 0.21 0.00 0.00 66.02 68.21 1wxt s SER 6 CO 0.26 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.30 1wxt n GLY 7 N 5.31 1.88 3.71 3.44 0.00 -1.26 -5.15 105.19 113.13 1wxt n GLY 7 Ca -0.13 -0.49 -0.32 0.00 0.00 0.00 0.00 46.02 45.08 1wxt n GLY 7 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wxt s LEU 8 N 0.00 3.61 -0.05 0.99 2.96 -1.25 -5.02 118.68 119.91 1wxt s LEU 8 Ca 0.00 0.01 0.03 0.00 -0.22 0.00 0.00 54.13 53.95 1wxt s LEU 8 Cb 0.00 -2.13 0.00 0.00 0.50 0.00 0.00 46.19 44.57 1wxt s LEU 8 CO 0.00 0.26 -0.15 -0.54 -1.32 0.00 0.00 176.35 174.60 1wxt s LYS 9 N -1.74 1.75 0.11 1.98 1.02 -1.26 0.69 119.74 122.28 1wxt s LYS 9 Ca 0.22 -0.52 0.04 0.00 0.02 0.00 0.00 55.97 55.73 1wxt s LYS 9 Cb -0.12 -1.48 -0.04 0.00 -0.52 0.00 0.00 37.83 35.68 1wxt s LYS 9 CO 0.13 0.14 -0.11 -1.64 -0.92 0.00 0.00 175.35 172.95 1wxt s MET 10 N 0.32 0.93 0.12 1.68 -1.94 -0.85 -4.61 119.30 114.94 1wxt s MET 10 Ca -0.09 -1.24 0.03 0.00 -1.71 0.00 0.00 55.69 52.68 1wxt s MET 10 Cb -0.13 -0.62 -0.04 0.00 2.01 0.00 0.00 34.83 36.05 1wxt s MET 10 CO 0.03 0.10 0.21 1.14 -0.01 0.00 0.00 175.02 176.49 1wxt s GLN 11 N -2.97 3.26 0.29 2.03 -2.07 -0.99 -2.41 119.66 116.80 1wxt s GLN 11 Ca 0.08 -0.63 -0.23 0.00 -1.82 0.00 0.00 55.36 52.76 1wxt s GLN 11 Cb -0.02 -2.89 -0.09 0.00 -1.09 0.00 0.00 33.01 28.92 1wxt s GLN 11 CO 0.01 0.54 0.86 0.08 -1.32 0.00 0.00 175.29 175.46 1wxt s VAL 12 N -1.65 4.35 -0.17 3.63 1.01 -0.68 -0.91 120.40 125.98 1wxt s VAL 12 Ca 0.33 1.60 0.07 0.00 0.00 0.00 0.00 61.98 63.98 1wxt s VAL 12 Cb -0.11 -3.93 -0.15 0.00 0.00 0.00 0.00 36.38 32.19 1wxt s VAL 12 CO 0.27 0.13 -0.07 -0.11 0.00 0.00 0.00 175.10 175.32 1wxt n LEU 13 N 0.53 1.64 -3.80 3.92 7.94 0.55 -2.19 117.00 125.60 1wxt n LEU 13 Ca 0.01 -0.06 -0.13 0.00 -1.11 0.00 0.00 56.01 54.73 1wxt n LEU 13 Cb 0.51 -0.20 -0.12 0.00 0.53 0.00 0.00 43.42 44.14 1wxt n LEU 13 CO 0.43 0.61 -0.12 -0.31 -1.11 0.00 0.00 177.39 176.90 1wxt s TYR 14 N -2.37 -0.23 0.59 1.96 2.02 -1.26 -4.73 117.35 113.34 1wxt s TYR 14 Ca -0.17 0.57 -0.19 0.00 -0.37 0.00 0.00 57.07 56.90 1wxt s TYR 14 Cb 0.06 0.08 -0.04 0.00 -0.40 0.00 0.00 41.96 41.65 1wxt s TYR 14 CO 0.51 -0.13 1.15 -1.91 -1.57 0.00 0.00 175.55 173.60 1wxt n GLU 15 N 2.88 1.16 -3.53 -0.62 2.13 -1.26 -4.49 120.64 116.91 1wxt n GLU 15 Ca -0.13 0.44 -0.19 0.00 0.66 0.00 0.00 57.16 57.94 1wxt n GLU 15 Cb 0.58 -2.35 -0.14 0.00 0.27 0.00 0.00 31.44 29.80 1wxt n GLU 15 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 1wxt s PHE 16 N -1.41 -0.21 -0.78 4.31 5.36 -0.71 -4.94 117.98 119.60 1wxt s PHE 16 Ca 0.76 0.20 -0.26 0.00 -0.96 0.00 0.00 56.93 56.67 1wxt s PHE 16 Cb -0.41 -0.39 0.03 0.00 -0.34 0.00 0.00 43.02 41.90 1wxt s PHE 16 CO 0.46 -0.56 1.39 -2.00 -1.46 0.00 0.00 175.22 173.05 1wxt s GLU 17 N 2.30 3.18 -0.36 10.12 2.12 -1.26 -2.74 118.70 132.06 1wxt s GLU 17 Ca 0.06 -0.30 -0.44 0.00 0.36 0.00 0.00 54.97 54.65 1wxt s GLU 17 Cb -0.15 -4.43 -0.18 0.00 0.26 0.00 0.00 34.13 29.63 1wxt s GLU 17 CO -0.11 -2.26 1.60 0.00 -0.54 0.00 0.00 175.26 173.95 1wxt n ALA 18 N 9.78 -1.11 -0.06 6.30 0.00 -1.26 -4.85 120.51 129.31 1wxt n ALA 18 Ca 0.11 0.47 -0.14 0.00 0.00 0.00 0.00 53.44 53.88 1wxt n ALA 18 Cb 0.50 -2.02 -0.14 0.00 0.00 0.00 0.00 19.45 17.78 1wxt n ALA 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1wxt n ARG 19 N 4.23 0.68 -3.42 0.00 1.74 -1.26 -4.91 116.66 113.71 1wxt n ARG 19 Ca 0.28 0.17 -0.30 0.00 -0.77 0.00 0.00 57.85 57.23 1wxt n ARG 19 Cb 0.03 -1.63 -0.04 0.00 -1.02 0.00 0.00 32.46 29.79 1wxt n ARG 19 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1wxt s ASN 20 N -6.22 6.51 0.00 0.55 -0.87 -1.26 -4.97 114.94 108.68 1wxt s ASN 20 Ca -0.17 0.75 0.15 0.00 -1.57 0.00 0.00 52.86 52.02 1wxt s ASN 20 Cb 0.07 -2.16 0.87 0.00 -0.02 0.00 0.00 41.25 40.01 1wxt s ASN 20 CO 0.76 -0.11 1.38 -0.81 -2.57 0.00 0.00 177.10 175.74 1wxt n PRO 21 N -0.52 0.38 0.00 -0.60 -0.04 -1.26 -1.84 135.00 131.12 1wxt n PRO 21 Ca -0.01 0.06 0.07 0.00 -0.04 0.00 0.00 63.50 63.57 1wxt n PRO 21 Cb 0.53 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.41 1wxt n PRO 21 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1wxt n ARG 22 N -1.11 2.29 -3.41 0.54 1.85 -1.26 -4.99 116.66 110.56 1wxt n ARG 22 Ca 0.10 -0.04 -0.26 0.00 -1.00 0.00 0.00 57.85 56.64 1wxt n ARG 22 Cb 0.08 -1.17 -0.02 0.00 -1.05 0.00 0.00 32.46 30.29 1wxt n ARG 22 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 1wxt s GLU 23 N -2.31 3.54 -0.13 2.89 2.02 -0.77 -2.39 118.70 121.55 1wxt s GLU 23 Ca 0.06 -0.21 0.01 0.00 0.02 0.00 0.00 54.97 54.85 1wxt s GLU 23 Cb 0.11 -2.69 -0.00 0.00 0.10 0.00 0.00 34.13 31.65 1wxt s GLU 23 CO 0.57 0.22 -0.17 -1.17 0.02 0.00 0.00 175.26 174.73 1wxt s LEU 24 N -3.85 2.44 0.23 1.80 2.96 -1.25 -4.76 118.68 116.25 1wxt s LEU 24 Ca 0.41 -0.46 -0.30 0.00 -0.22 0.00 0.00 54.13 53.56 1wxt s LEU 24 Cb -0.10 -1.54 -0.10 0.00 0.50 0.00 0.00 46.19 44.95 1wxt s LEU 24 CO 0.33 0.13 1.51 -0.89 -1.32 0.00 0.00 176.35 176.10 1wxt s THR 25 N 0.57 2.53 0.16 3.68 2.01 -1.26 -4.61 115.64 118.71 1wxt s THR 25 Ca -0.10 0.42 0.00 0.00 0.31 0.00 0.00 61.69 62.32 1wxt s THR 25 Cb -0.16 -3.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.03 1wxt s THR 25 CO 0.04 0.06 0.04 0.68 -0.69 0.00 0.00 174.62 174.75 1wxt s VAL 26 N 0.33 0.31 0.15 3.82 -7.23 -1.11 -4.97 120.40 111.72 1wxt s VAL 26 Ca 0.63 -1.94 0.04 0.00 -1.81 0.00 0.00 61.98 58.90 1wxt s VAL 26 Cb -0.44 -2.13 -0.05 0.00 0.56 0.00 0.00 36.38 34.33 1wxt s VAL 26 CO 0.41 -0.42 -0.09 0.68 -0.31 0.00 0.00 175.10 175.37 1wxt s VAL 27 N -3.91 1.12 0.48 1.32 -7.23 -1.26 -1.73 120.40 109.19 1wxt s VAL 27 Ca 0.26 -2.05 -0.24 0.00 -1.81 0.00 0.00 61.98 58.14 1wxt s VAL 27 Cb 0.07 -1.90 -0.07 0.00 0.56 0.00 0.00 36.38 35.04 1wxt s VAL 27 CO 0.04 -0.70 1.38 -1.58 -0.31 0.00 0.00 175.10 173.93 1wxt s GLN 28 N -3.77 3.53 0.00 4.82 0.74 -1.26 -2.42 119.66 121.30 1wxt s GLN 28 Ca 0.18 2.30 0.00 0.00 0.05 0.00 0.00 55.36 57.89 1wxt s GLN 28 Cb 0.03 -2.52 0.00 0.00 1.10 0.00 0.00 33.01 31.62 1wxt s GLN 28 CO 0.01 -0.91 0.00 0.41 -0.55 0.00 0.00 175.29 174.26 1wxt n GLY 29 N 0.63 2.00 3.61 2.59 0.00 -0.93 -4.96 105.19 108.13 1wxt n GLY 29 Ca 0.07 -0.09 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1wxt n GLY 29 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1wxt n GLU 30 N 0.00 1.18 -4.12 1.61 2.13 -1.02 -4.57 120.64 115.86 1wxt n GLU 30 Ca 0.00 0.43 -0.34 0.00 0.66 0.00 0.00 57.16 57.91 1wxt n GLU 30 Cb 0.00 -2.07 -0.07 0.00 0.27 0.00 0.00 31.44 29.56 1wxt n GLU 30 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1wxt s LYS 31 N -2.26 3.13 0.11 5.31 1.02 -1.26 -1.69 119.74 124.10 1wxt s LYS 31 Ca 0.67 -0.39 -0.06 0.00 0.02 0.00 0.00 55.97 56.21 1wxt s LYS 31 Cb -0.50 -2.92 -0.02 0.00 -0.52 0.00 0.00 37.83 33.88 1wxt s LYS 31 CO 0.54 0.69 0.16 -0.51 -0.92 0.00 0.00 175.35 175.31 1wxt s LEU 32 N -1.38 1.53 -0.23 3.17 1.43 -1.01 -4.90 118.68 117.29 1wxt s LEU 32 Ca 0.19 -0.84 -0.07 0.00 -1.03 0.00 0.00 54.13 52.38 1wxt s LEU 32 Cb -0.12 0.83 -0.03 0.00 0.03 0.00 0.00 46.19 46.91 1wxt s LEU 32 CO 0.09 -0.75 0.06 -0.70 0.23 0.00 0.00 176.35 175.28 1wxt s GLU 33 N -3.92 3.72 0.28 1.70 2.12 -1.16 -2.01 118.70 119.43 1wxt s GLU 33 Ca 0.11 -0.46 -0.29 0.00 0.36 0.00 0.00 54.97 54.69 1wxt s GLU 33 Cb 0.05 -3.25 -0.10 0.00 0.26 0.00 0.00 34.13 31.09 1wxt s GLU 33 CO -0.06 -0.05 1.12 0.08 -0.54 0.00 0.00 175.26 175.81 1wxt s VAL 34 N 1.23 3.42 0.02 3.70 1.01 0.22 -2.15 120.40 127.84 1wxt s VAL 34 Ca 0.04 1.41 -0.04 0.00 0.00 0.00 0.00 61.98 63.40 1wxt s VAL 34 Cb -0.14 -3.90 -0.01 0.00 0.00 0.00 0.00 36.38 32.32 1wxt s VAL 34 CO 0.03 0.33 -0.07 0.18 0.00 0.00 0.00 175.10 175.57 1wxt n LEU 35 N 1.22 1.12 -4.14 3.92 4.77 0.76 -3.91 117.00 120.74 1wxt n LEU 35 Ca -0.01 0.16 -0.34 0.00 -0.03 0.00 0.00 56.01 55.79 1wxt n LEU 35 Cb 0.44 -0.37 -0.14 0.00 -2.33 0.00 0.00 43.42 41.03 1wxt n LEU 35 CO 0.55 -0.51 -0.34 -0.62 -1.33 0.00 0.00 177.39 175.13 1wxt s ASP 36 N -5.89 4.87 -0.52 -1.43 -1.08 -1.22 -4.97 116.67 106.44 1wxt s ASP 36 Ca -0.06 -1.46 0.02 0.00 -0.52 0.00 0.00 52.55 50.52 1wxt s ASP 36 Cb 0.01 -1.70 0.52 0.00 -1.46 0.00 0.00 42.92 40.29 1wxt s ASP 36 CO 0.09 -0.30 1.84 0.00 0.52 0.00 0.00 175.17 177.32 1wxt n HIS 37 N 4.56 2.89 -0.01 -5.34 1.44 -1.26 -2.75 115.22 114.76 1wxt n HIS 37 Ca -0.10 -2.46 -0.01 0.00 -2.01 0.00 0.00 57.72 53.14 1wxt n HIS 37 Cb 0.43 -1.08 -0.00 0.00 0.12 0.00 0.00 29.99 29.45 1wxt n HIS 37 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1wxt n SER 38 N -0.98 0.39 -4.71 4.39 2.88 -1.26 -5.01 113.62 109.32 1wxt n SER 38 Ca 0.57 0.06 -0.42 0.00 -1.33 0.00 0.00 58.87 57.74 1wxt n SER 38 Cb 1.02 -0.38 -0.01 0.00 -0.75 0.00 0.00 64.21 64.09 1wxt n SER 38 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1wxt n LYS 39 N -2.88 2.21 -0.47 -1.46 5.02 -1.26 -4.77 118.16 114.55 1wxt n LYS 39 Ca -0.02 0.78 0.37 0.00 -2.02 0.00 0.00 58.31 57.41 1wxt n LYS 39 Cb 0.08 -2.39 0.58 0.00 -0.02 0.00 0.00 35.03 33.29 1wxt n LYS 39 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 1wxt n ARG 40 N 0.65 -0.01 -3.67 1.97 0.00 -1.26 -3.66 116.66 110.68 1wxt n ARG 40 Ca 0.05 0.87 -0.38 0.00 -0.00 0.00 0.00 57.85 58.39 1wxt n ARG 40 Cb 0.36 -1.89 -0.12 0.00 -0.00 0.00 0.00 32.46 30.81 1wxt n ARG 40 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 1wxt s TRP 41 N -4.58 3.16 0.16 2.89 0.52 -1.26 -4.31 118.94 115.52 1wxt s TRP 41 Ca -0.04 -0.24 -0.30 0.00 0.02 0.00 0.00 56.10 55.53 1wxt s TRP 41 Cb 0.22 -2.32 -0.07 0.00 -1.15 0.00 0.00 33.47 30.14 1wxt s TRP 41 CO 0.66 -0.30 0.99 -1.58 0.02 0.00 0.00 176.95 176.73 1wxt s TRP 42 N 1.67 3.81 -0.32 -1.98 0.52 0.04 -4.70 118.94 117.98 1wxt s TRP 42 Ca 0.06 1.79 -0.14 0.00 0.02 0.00 0.00 56.10 57.84 1wxt s TRP 42 Cb -0.16 -3.09 -0.03 0.00 -1.15 0.00 0.00 33.47 29.05 1wxt s TRP 42 CO 0.07 0.09 0.29 -1.17 0.02 0.00 0.00 176.95 176.26 1wxt s LEU 43 N -0.39 4.29 0.30 2.99 2.96 -1.11 0.15 118.68 127.88 1wxt s LEU 43 Ca 0.46 -0.14 0.10 0.00 -0.22 0.00 0.00 54.13 54.33 1wxt s LEU 43 Cb -0.25 -2.25 -0.05 0.00 0.50 0.00 0.00 46.19 44.13 1wxt s LEU 43 CO 0.32 -0.22 -0.05 0.68 -1.32 0.00 0.00 176.35 175.76 1wxt s VAL 44 N 1.89 2.85 0.02 1.68 -7.23 -0.80 -0.17 120.40 118.64 1wxt s VAL 44 Ca 0.10 -2.06 0.04 0.00 -1.81 0.00 0.00 61.98 58.24 1wxt s VAL 44 Cb -0.16 -2.69 -0.02 0.00 0.56 0.00 0.00 36.38 34.07 1wxt s VAL 44 CO 0.11 -0.31 -0.11 -0.75 -0.31 0.00 0.00 175.10 173.73 1wxt s LYS 45 N -3.65 0.82 0.65 4.82 2.20 -0.91 -0.73 119.74 122.94 1wxt s LYS 45 Ca 0.32 -0.58 0.01 0.00 -0.36 0.00 0.00 55.97 55.36 1wxt s LYS 45 Cb -0.03 -0.79 0.13 0.00 -1.51 0.00 0.00 37.83 35.62 1wxt s LYS 45 CO 0.18 0.20 0.89 0.27 -0.36 0.00 0.00 175.35 176.53 1wxt n ASN 46 N 2.24 1.35 0.16 1.43 0.23 -1.05 -2.96 115.26 116.66 1wxt n ASN 46 Ca -0.17 -2.10 0.02 0.00 -0.53 0.00 0.00 54.58 51.80 1wxt n ASN 46 Cb 0.55 -0.56 0.35 0.00 -2.08 0.00 0.00 39.78 38.05 1wxt n ASN 46 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1wxt h GLU 47 N 0.00 0.10 -0.66 -3.83 5.08 -1.91 -2.92 114.58 110.44 1wxt h GLU 47 Ca -0.29 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.06 1wxt h GLU 47 Cb 1.12 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.33 1wxt h GLU 47 CO 0.33 0.40 0.41 0.00 -1.00 0.00 0.00 179.01 179.15 1wxt h ALA 48 N 1.60 0.85 0.00 3.43 0.00 -2.03 -3.46 119.26 119.65 1wxt h ALA 48 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1wxt h ALA 48 Cb 0.59 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1wxt h ALA 48 CO 0.04 0.17 0.00 0.41 0.00 0.00 0.00 179.25 179.87 1wxt n GLY 49 N -1.28 0.68 3.64 0.00 0.00 -1.10 -5.12 105.19 102.01 1wxt n GLY 49 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 1wxt n GLY 49 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wxt s ARG 50 N 0.00 4.07 -0.17 1.61 0.52 -1.26 -4.90 118.95 118.82 1wxt s ARG 50 Ca 0.00 -0.04 -0.05 0.00 -0.52 0.00 0.00 55.73 55.11 1wxt s ARG 50 Cb 0.00 -3.59 -0.03 0.00 0.52 0.00 0.00 34.95 31.85 1wxt s ARG 50 CO 0.00 -0.10 0.01 -1.54 0.02 0.00 0.00 175.30 173.69 1wxt s SER 51 N 1.31 5.16 0.06 0.23 1.04 -1.26 -2.53 113.70 117.71 1wxt s SER 51 Ca 0.13 -0.05 0.02 0.00 0.48 0.00 0.00 55.95 56.53 1wxt s SER 51 Cb -0.15 -1.87 -0.03 0.00 0.10 0.00 0.00 66.02 64.08 1wxt s SER 51 CO 0.08 0.16 -0.07 -0.83 0.98 0.00 0.00 173.24 173.55 1wxt s GLY 52 N 0.46 0.56 0.30 7.32 0.00 0.09 -4.78 107.32 111.27 1wxt s GLY 52 Ca -0.00 -0.92 -0.29 0.00 0.00 0.00 0.00 44.72 43.51 1wxt s GLY 52 CO 0.02 -0.99 1.07 -0.19 0.00 0.00 0.00 173.10 173.01 1wxt s TYR 53 N -2.04 3.57 0.01 1.90 2.02 -1.01 -1.91 117.35 119.89 1wxt s TYR 53 Ca -0.04 1.72 -0.10 0.00 -0.37 0.00 0.00 57.07 58.27 1wxt s TYR 53 Cb -0.05 -3.22 0.01 0.00 -0.40 0.00 0.00 41.96 38.29 1wxt s TYR 53 CO -0.01 -0.45 0.21 0.96 -1.57 0.00 0.00 175.55 174.69 1wxt s ILE 54 N -1.25 0.08 0.07 2.71 -4.36 0.12 -3.92 121.20 114.65 1wxt s ILE 54 Ca 0.46 -0.67 -0.31 0.00 -0.26 0.00 0.00 60.65 59.88 1wxt s ILE 54 Cb -0.30 -0.62 -0.07 0.00 1.25 0.00 0.00 42.46 42.73 1wxt s ILE 54 CO 0.38 -0.37 1.40 -2.16 0.24 0.00 0.00 174.94 174.43 1wxt s PRO 55 N -1.67 4.31 0.10 0.37 0.04 -1.26 -0.78 135.00 136.10 1wxt s PRO 55 Ca -0.12 2.03 0.06 0.00 0.04 0.00 0.00 61.00 63.01 1wxt s PRO 55 Cb -0.05 -3.39 0.33 0.00 0.04 0.00 0.00 34.50 31.43 1wxt s PRO 55 CO 0.01 -0.49 1.17 -1.13 0.04 0.00 0.00 177.00 176.60 1wxt n SER 56 N 4.54 0.16 0.02 6.66 3.41 -1.26 -1.35 113.62 125.81 1wxt n SER 56 Ca 0.12 0.55 -0.02 0.00 -0.26 0.00 0.00 58.87 59.27 1wxt n SER 56 Cb 0.43 -0.57 0.24 0.00 -0.26 0.00 0.00 64.21 64.05 1wxt n SER 56 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1wxt h ASN 57 N 0.00 0.45 -0.50 4.04 4.21 -1.93 -2.41 115.58 119.44 1wxt h ASN 57 Ca 0.00 -0.13 -0.18 0.00 1.21 0.00 0.00 56.30 57.20 1wxt h ASN 57 Cb 0.05 -0.12 -0.11 0.00 -1.12 0.00 0.00 38.32 37.02 1wxt h ASN 57 CO 0.00 0.65 0.23 2.30 -1.29 0.00 0.00 177.43 179.33 1wxt n ILE 58 N -4.17 2.07 -4.38 2.81 -5.35 -0.46 -4.83 119.36 105.05 1wxt n ILE 58 Ca 0.00 -1.03 -0.21 0.00 -0.27 0.00 0.00 62.75 61.24 1wxt n ILE 58 Cb 0.36 -0.55 -0.13 0.00 -1.74 0.00 0.00 39.64 37.58 1wxt n ILE 58 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1wxt s LEU 59 N -1.87 2.19 0.04 7.28 1.43 -0.91 -0.33 118.68 126.52 1wxt s LEU 59 Ca 0.34 -0.51 -0.04 0.00 -1.03 0.00 0.00 54.13 52.90 1wxt s LEU 59 Cb 0.28 -0.68 -0.02 0.00 0.03 0.00 0.00 46.19 45.80 1wxt s LEU 59 CO 0.08 0.04 0.05 -1.61 0.23 0.00 0.00 176.35 175.15 1wxt s GLU 60 N -1.28 0.58 -0.86 1.70 0.41 -0.09 -4.82 118.70 114.33 1wxt s GLU 60 Ca 0.03 -0.87 -0.25 0.00 -0.41 0.00 0.00 54.97 53.47 1wxt s GLU 60 Cb -0.08 0.22 -0.04 0.00 -1.78 0.00 0.00 34.13 32.44 1wxt s GLU 60 CO 0.02 -0.13 1.93 -1.25 -0.49 0.00 0.00 175.26 175.34 1wxt s PRO 61 N -2.88 2.57 0.22 0.39 0.04 -1.26 -2.35 135.00 131.72 1wxt s PRO 61 Ca -0.03 -0.17 -0.30 0.00 0.04 0.00 0.00 61.00 60.54 1wxt s PRO 61 Cb 0.00 -4.97 -0.08 0.00 0.04 0.00 0.00 34.50 29.49 1wxt s PRO 61 CO -0.06 -3.29 1.06 -0.48 0.04 0.00 0.00 177.00 174.27 1wxt s LEU 62 N 9.94 4.54 0.29 -3.56 0.05 -1.26 -4.98 118.68 123.70 1wxt s LEU 62 Ca 0.70 2.10 0.01 0.00 0.05 0.00 0.00 54.13 56.99 1wxt s LEU 62 Cb -0.07 -3.61 -0.02 0.00 -2.05 0.00 0.00 46.19 40.43 1wxt s LEU 62 CO 0.02 -0.12 0.30 -0.94 -0.55 0.00 0.00 176.35 175.07 1wxt s SER 63 N -0.53 0.98 0.34 1.48 1.04 -1.26 -4.95 113.70 110.80 1wxt s SER 63 Ca 0.46 -1.54 0.03 0.00 0.48 0.00 0.00 55.95 55.38 1wxt s SER 63 Cb -0.29 0.54 -0.01 0.00 0.10 0.00 0.00 66.02 66.36 1wxt s SER 63 CO 0.36 -1.07 0.12 0.61 0.98 0.00 0.00 173.24 174.24 1wxt n GLY 64 N -0.50 3.40 0.00 7.32 0.00 -1.26 -5.01 105.19 109.13 1wxt n GLY 64 Ca 0.04 -2.09 0.08 0.00 0.00 0.00 0.00 46.02 44.04 1wxt n GLY 64 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wxt n PRO 65 N -0.77 0.42 -1.20 1.61 -0.04 -1.26 -4.86 135.00 128.90 1wxt n PRO 65 Ca -0.05 0.04 -0.52 0.00 -0.04 0.00 0.00 63.50 62.92 1wxt n PRO 65 Cb 0.51 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.38 1wxt n PRO 65 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1wxt n SER 66 N -1.07 0.78 -4.65 3.54 7.64 -1.26 -4.91 113.62 113.69 1wxt n SER 66 Ca 0.11 0.74 -0.19 0.00 1.01 0.00 0.00 58.87 60.53 1wxt n SER 66 Cb 0.07 -0.73 0.05 0.00 -1.01 0.00 0.00 64.21 62.58 1wxt n SER 66 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1wxt n SER 67 N 4.94 2.10 0.00 6.43 3.41 -1.26 -5.24 113.62 124.00 1wxt n SER 67 Ca 0.37 -2.49 0.00 0.00 -0.26 0.00 0.00 58.87 56.49 1wxt n SER 67 Cb -0.04 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.62 1wxt n SER 67 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49