#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wyh s SER 2 N 0.00 4.35 -0.27 1.61 0.15 -1.26 -4.95 113.70 113.32 1wyh s SER 2 Ca 0.00 -2.02 -0.13 0.00 0.70 0.00 0.00 55.95 54.50 1wyh s SER 2 Cb 0.00 -1.26 -0.13 0.00 -1.71 0.00 0.00 66.02 62.92 1wyh s SER 2 CO 0.00 -0.38 -0.31 -1.20 1.20 0.00 0.00 173.24 172.55 1wyh n SER 3 N 4.39 1.96 -0.89 5.45 7.64 -1.26 -5.12 113.62 125.80 1wyh n SER 3 Ca 0.02 0.30 0.00 0.00 1.01 0.00 0.00 58.87 60.20 1wyh n SER 3 Cb 0.41 -0.80 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 1wyh n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wyh n GLY 4 N 1.35 -4.10 0.12 0.23 0.00 -1.26 -4.99 105.19 96.54 1wyh n GLY 4 Ca -0.53 -0.64 -0.23 0.00 0.00 0.00 0.00 46.02 44.62 1wyh n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wyh n SER 5 N 0.45 1.95 -4.76 1.61 3.41 -1.26 -4.90 113.62 110.12 1wyh n SER 5 Ca 0.00 0.33 -0.36 0.00 -0.26 0.00 0.00 58.87 58.58 1wyh n SER 5 Cb 0.00 -0.90 -0.07 0.00 -0.26 0.00 0.00 64.21 62.98 1wyh n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1wyh s SER 6 N -6.97 6.39 0.10 4.04 1.04 -1.26 -5.08 113.70 111.95 1wyh s SER 6 Ca -0.29 0.45 -0.16 0.00 0.48 0.00 0.00 55.95 56.44 1wyh s SER 6 Cb 0.07 -2.14 0.03 0.00 0.10 0.00 0.00 66.02 64.08 1wyh s SER 6 CO 0.62 0.19 0.38 -0.83 0.98 0.00 0.00 173.24 174.58 1wyh s GLY 7 N 0.09 -0.24 0.39 7.32 0.00 -1.26 -3.86 107.32 109.77 1wyh s GLY 7 Ca 0.14 0.01 -0.27 0.00 0.00 0.00 0.00 44.72 44.60 1wyh s GLY 7 CO 0.03 -0.24 1.38 0.00 0.00 0.00 0.00 173.10 174.26 1wyh n SER 9 N 0.32 0.67 -0.06 0.00 2.88 -0.01 -2.27 113.62 115.15 1wyh n SER 9 Ca 0.02 -0.43 -0.03 0.00 -1.33 0.00 0.00 58.87 57.11 1wyh n SER 9 Cb 0.42 0.82 -0.01 0.00 -0.75 0.00 0.00 64.21 64.68 1wyh n SER 9 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wyh h ALA 10 N 2.73 0.00 0.00 -1.46 0.00 -1.92 -3.41 119.26 115.20 1wyh h ALA 10 Ca 0.00 -0.25 -0.35 0.00 0.00 0.00 0.00 54.91 54.32 1wyh h ALA 10 Cb 0.64 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.59 1wyh h ALA 10 CO 0.00 0.23 -2.17 0.00 0.00 0.00 0.00 179.25 177.31 1wyh n GLY 12 N 1.72 1.89 1.63 0.00 0.00 -0.96 -5.05 105.19 104.42 1wyh n GLY 12 Ca -0.28 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.64 1wyh n GLY 12 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wyh n GLU 13 N -1.37 -1.23 -3.66 1.61 -0.58 -1.26 -4.13 120.64 110.02 1wyh n GLU 13 Ca 0.00 -0.46 -0.39 0.00 -0.42 0.00 0.00 57.16 55.89 1wyh n GLU 13 Cb 0.00 -0.83 -0.11 0.00 -0.57 0.00 0.00 31.44 29.93 1wyh n GLU 13 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1wyh s THR 14 N -1.38 4.16 -0.38 2.62 2.01 -1.26 0.63 115.64 122.04 1wyh s THR 14 Ca 0.21 -1.11 -0.29 0.00 0.31 0.00 0.00 61.69 60.81 1wyh s THR 14 Cb -0.04 -3.40 0.02 0.00 0.01 0.00 0.00 72.50 69.10 1wyh s THR 14 CO 0.18 -0.28 1.14 -0.69 -0.69 0.00 0.00 174.62 174.28 1wyh s VAL 15 N 1.46 4.33 0.32 3.82 1.01 -1.25 -4.85 120.40 125.23 1wyh s VAL 15 Ca 0.01 1.46 -0.18 0.00 0.00 0.00 0.00 61.98 63.27 1wyh s VAL 15 Cb -0.20 -4.44 -0.09 0.00 0.00 0.00 0.00 36.38 31.64 1wyh s VAL 15 CO 0.04 -0.68 0.79 -0.04 0.00 0.00 0.00 175.10 175.20 1wyh s MET 16 N 4.06 4.15 0.27 2.72 -1.94 -1.26 -4.69 119.30 122.61 1wyh s MET 16 Ca 0.48 0.84 0.05 0.00 -1.71 0.00 0.00 55.69 55.35 1wyh s MET 16 Cb -0.11 -2.52 0.36 0.00 2.01 0.00 0.00 34.83 34.57 1wyh s MET 16 CO 0.23 0.19 1.65 -1.00 -0.01 0.00 0.00 175.02 176.07 1wyh h PRO 17 N 2.54 0.30 -1.95 2.03 0.13 -1.98 -3.19 132.00 129.88 1wyh h PRO 17 Ca -0.48 -0.16 -0.04 0.00 -0.87 0.00 0.00 66.00 64.46 1wyh h PRO 17 Cb 1.18 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 1wyh h PRO 17 CO 0.65 0.70 0.05 0.41 -0.23 0.00 0.00 178.00 179.57 1wyh n GLY 18 N -0.04 2.68 3.59 1.56 0.00 -1.26 -4.76 105.19 106.96 1wyh n GLY 18 Ca -0.02 -0.13 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 1wyh n GLY 18 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wyh s SER 19 N 1.80 -0.50 -0.10 1.61 0.01 -1.21 -5.13 113.70 110.18 1wyh s SER 19 Ca 0.04 0.74 -0.40 0.00 1.31 0.00 0.00 55.95 57.64 1wyh s SER 19 Cb 0.03 0.68 -0.19 0.00 0.21 0.00 0.00 66.02 66.75 1wyh s SER 19 CO -0.00 -0.33 1.31 0.54 0.41 0.00 0.00 173.24 175.17 1wyh n ARG 20 N 1.46 0.43 -3.83 12.44 3.00 -1.26 -4.83 116.66 124.07 1wyh n ARG 20 Ca -0.13 0.16 -0.08 0.00 -0.01 0.00 0.00 57.85 57.79 1wyh n ARG 20 Cb 0.57 -1.71 0.01 0.00 0.00 0.00 0.00 32.46 31.32 1wyh n ARG 20 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 1wyh s LYS 21 N 1.06 2.01 0.07 5.56 -2.85 -1.26 -4.03 119.74 120.31 1wyh s LYS 21 Ca 0.93 -1.24 0.04 0.00 -1.00 0.00 0.00 55.97 54.70 1wyh s LYS 21 Cb -1.21 0.60 -0.03 0.00 -2.06 0.00 0.00 37.83 35.13 1wyh s LYS 21 CO 0.60 -0.93 -0.12 -0.51 0.10 0.00 0.00 175.35 174.48 1wyh s LEU 22 N -3.03 2.30 -0.17 2.77 1.43 0.12 -4.74 118.68 117.36 1wyh s LEU 22 Ca 0.14 -0.65 -0.04 0.00 -1.03 0.00 0.00 54.13 52.55 1wyh s LEU 22 Cb -0.05 -0.41 0.08 0.00 0.03 0.00 0.00 46.19 45.84 1wyh s LEU 22 CO 0.09 -0.14 0.28 -1.61 0.23 0.00 0.00 176.35 175.21 1wyh s GLU 23 N -1.95 0.20 -0.07 1.70 2.02 -1.26 -1.37 118.70 117.97 1wyh s GLU 23 Ca -0.02 0.60 -0.00 0.00 0.02 0.00 0.00 54.97 55.57 1wyh s GLU 23 Cb -0.08 -0.37 0.03 0.00 0.10 0.00 0.00 34.13 33.80 1wyh s GLU 23 CO 0.02 -0.43 -0.03 0.71 0.02 0.00 0.00 175.26 175.55 1wyh s TYR 24 N 2.43 0.83 0.00 1.61 1.51 -1.16 -5.01 117.35 117.56 1wyh s TYR 24 Ca 0.04 -0.27 0.00 0.00 -1.01 0.00 0.00 57.07 55.83 1wyh s TYR 24 Cb -0.13 -0.83 0.00 0.00 -0.11 0.00 0.00 41.96 40.89 1wyh s TYR 24 CO -0.11 -0.31 0.00 0.41 -1.11 0.00 0.00 175.55 174.43 1wyh n GLY 25 N 4.73 1.82 0.00 0.71 0.00 -1.26 -2.92 105.19 108.27 1wyh n GLY 25 Ca -0.14 0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1wyh n GLY 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wyh n GLY 26 N 0.00 -1.63 3.82 -0.02 0.00 -1.26 -5.10 105.19 101.00 1wyh n GLY 26 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1wyh n GLY 26 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wyh s GLN 27 N -0.10 2.22 -0.08 1.61 -1.52 -1.15 -5.11 119.66 115.53 1wyh s GLN 27 Ca 0.00 -2.25 -0.04 0.00 -1.95 0.00 0.00 55.36 51.11 1wyh s GLN 27 Cb 0.00 -1.76 0.04 0.00 -0.22 0.00 0.00 33.01 31.07 1wyh s GLN 27 CO 0.00 -0.47 0.19 0.99 -0.25 0.00 0.00 175.29 175.76 1wyh s THR 28 N -2.84 -0.04 0.10 -0.19 2.01 -1.26 -2.98 115.64 110.45 1wyh s THR 28 Ca 0.17 0.13 0.08 0.00 0.31 0.00 0.00 61.69 62.37 1wyh s THR 28 Cb 0.00 -0.30 -0.03 0.00 0.01 0.00 0.00 72.50 72.18 1wyh s THR 28 CO 0.10 0.05 -0.19 0.26 -0.69 0.00 0.00 174.62 174.15 1wyh s TRP 29 N 0.98 1.67 0.42 4.92 0.51 -0.47 -0.83 118.94 126.14 1wyh s TRP 29 Ca -0.07 -0.44 -0.23 0.00 -2.12 0.00 0.00 56.10 53.24 1wyh s TRP 29 Cb -0.09 -0.91 -0.09 0.00 -0.81 0.00 0.00 33.47 31.57 1wyh s TRP 29 CO -0.06 0.19 1.04 -1.01 -0.51 0.00 0.00 176.95 176.60 1wyh s HIS 30 N -1.30 3.20 -0.13 -1.98 3.76 -1.26 0.16 115.29 117.74 1wyh s HIS 30 Ca 0.06 1.62 0.12 0.00 -0.15 0.00 0.00 55.06 56.71 1wyh s HIS 30 Cb -0.09 -3.09 0.63 0.00 1.11 0.00 0.00 32.58 31.13 1wyh s HIS 30 CO 0.04 -0.64 1.25 -1.91 -0.85 0.00 0.00 174.74 172.63 1wyh n GLU 31 N -0.35 0.08 -0.00 1.40 2.13 -1.26 0.94 120.64 123.57 1wyh n GLU 31 Ca 0.06 0.53 0.05 0.00 0.66 0.00 0.00 57.16 58.46 1wyh n GLU 31 Cb 0.51 -2.00 -0.07 0.00 0.27 0.00 0.00 31.44 30.15 1wyh n GLU 31 CO 0.00 0.00 0.00 -2.39 -0.41 0.00 0.00 177.13 174.33 1wyh n HIS 32 N -1.94 0.00 -0.04 4.31 1.44 -1.26 -4.45 115.22 113.28 1wyh n HIS 32 Ca -0.01 0.00 -0.19 0.00 -2.01 0.00 0.00 57.72 55.51 1wyh n HIS 32 Cb 0.26 -0.09 -0.13 0.00 0.12 0.00 0.00 29.99 30.15 1wyh n HIS 32 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1wyh s PHE 34 N -2.55 1.61 0.52 0.00 5.36 0.74 -4.87 117.98 118.80 1wyh s PHE 34 Ca -0.24 0.86 0.01 0.00 -0.96 0.00 0.00 56.93 56.60 1wyh s PHE 34 Cb 0.07 -4.03 -0.00 0.00 -0.34 0.00 0.00 43.02 38.72 1wyh s PHE 34 CO 0.73 -2.27 0.02 -0.51 -1.46 0.00 0.00 175.22 171.72 1wyh s LEU 35 N 9.54 2.25 0.12 6.12 1.43 -1.26 -2.27 118.68 134.62 1wyh s LEU 35 Ca 0.71 -1.67 -0.13 0.00 -1.03 0.00 0.00 54.13 52.00 1wyh s LEU 35 Cb -0.12 -0.73 -0.07 0.00 0.03 0.00 0.00 46.19 45.30 1wyh s LEU 35 CO 0.19 -0.90 0.51 0.00 0.23 0.00 0.00 176.35 176.38 1wyh n SER 37 N 0.89 2.66 0.00 0.00 7.64 0.10 -1.64 113.62 123.27 1wyh n SER 37 Ca -0.06 -2.33 0.00 0.00 1.01 0.00 0.00 58.87 57.48 1wyh n SER 37 Cb 0.52 -0.57 0.00 0.00 -1.01 0.00 0.00 64.21 63.15 1wyh n SER 37 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wyh n GLY 38 N 0.13 0.00 0.14 0.23 0.00 -1.26 -4.89 105.19 99.53 1wyh n GLY 38 Ca 0.11 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.16 1wyh n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wyh n GLU 40 N -0.40 -5.77 -3.84 0.00 1.02 -0.65 -4.94 120.64 106.06 1wyh n GLU 40 Ca 0.03 0.75 -0.34 0.00 -0.02 0.00 0.00 57.16 57.58 1wyh n GLU 40 Cb 0.14 -5.41 -0.05 0.00 -0.02 0.00 0.00 31.44 26.09 1wyh n GLU 40 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1wyh s GLN 41 N -5.88 3.50 -0.77 3.49 -1.52 -1.26 -4.61 119.66 112.61 1wyh s GLN 41 Ca 0.40 -0.22 -0.25 0.00 -1.95 0.00 0.00 55.36 53.34 1wyh s GLN 41 Cb -0.18 -3.08 -0.03 0.00 -0.22 0.00 0.00 33.01 29.49 1wyh s GLN 41 CO 0.50 0.66 1.91 -1.25 -0.25 0.00 0.00 175.29 176.86 1wyh s PRO 42 N -1.87 2.59 0.00 2.91 0.04 -1.26 -0.32 135.00 137.08 1wyh s PRO 42 Ca 0.27 0.13 0.14 0.00 0.04 0.00 0.00 61.00 61.58 1wyh s PRO 42 Cb -0.13 -4.75 0.82 0.00 0.04 0.00 0.00 34.50 30.49 1wyh s PRO 42 CO 0.17 -3.08 1.34 1.28 0.04 0.00 0.00 177.00 176.75 1wyh n LEU 43 N 13.40 0.00 0.00 -3.56 4.77 -0.96 -3.51 117.00 127.15 1wyh n LEU 43 Ca 0.31 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.32 1wyh n LEU 43 Cb 0.49 0.00 0.18 0.00 -2.33 0.00 0.00 43.42 41.76 1wyh n LEU 43 CO 0.65 0.00 0.52 0.61 -1.33 0.00 0.00 177.39 177.84 1wyh n GLY 44 N 0.36 -0.47 0.29 -0.72 0.00 -1.24 -3.11 105.19 100.30 1wyh n GLY 44 Ca 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1wyh n GLY 44 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wyh n SER 45 N -1.24 2.43 -4.97 1.61 3.41 -1.23 -5.00 113.62 108.63 1wyh n SER 45 Ca 0.04 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.43 1wyh n SER 45 Cb 0.05 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.02 1wyh n SER 45 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wyh s ARG 46 N -1.85 2.82 0.79 4.33 1.70 -1.18 -5.10 118.95 120.46 1wyh s ARG 46 Ca 0.00 -0.72 -0.12 0.00 -0.47 0.00 0.00 55.73 54.42 1wyh s ARG 46 Cb 0.00 -2.56 0.07 0.00 -0.57 0.00 0.00 34.95 31.88 1wyh s ARG 46 CO 0.00 -0.44 1.15 -1.12 -1.08 0.00 0.00 175.30 173.82 1wyh s SER 47 N -4.31 4.64 0.18 -2.89 0.01 -1.26 -4.74 113.70 105.33 1wyh s SER 47 Ca 0.52 0.90 -0.14 0.00 1.31 0.00 0.00 55.95 58.55 1wyh s SER 47 Cb -0.10 -1.49 0.05 0.00 0.21 0.00 0.00 66.02 64.69 1wyh s SER 47 CO 0.37 -1.83 0.67 2.22 0.41 0.00 0.00 173.24 175.08 1wyh n PHE 48 N -3.29 -1.42 -3.85 2.43 -1.74 -1.26 -3.94 117.46 104.39 1wyh n PHE 48 Ca 0.08 -1.04 -0.28 0.00 -0.56 0.00 0.00 57.45 55.65 1wyh n PHE 48 Cb 0.60 0.51 -0.16 0.00 1.52 0.00 0.00 39.48 41.95 1wyh n PHE 48 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 1wyh s VAL 49 N -2.26 0.97 -0.36 1.97 1.01 0.21 -4.80 120.40 117.13 1wyh s VAL 49 Ca 0.14 -0.59 -0.28 0.00 0.00 0.00 0.00 61.98 61.26 1wyh s VAL 49 Cb -0.03 -1.20 -0.01 0.00 0.00 0.00 0.00 36.38 35.14 1wyh s VAL 49 CO 0.05 0.07 1.71 -2.16 0.00 0.00 0.00 175.10 174.77 1wyh s PRO 50 N 1.69 3.36 0.47 2.72 0.04 -1.26 -2.36 135.00 139.65 1wyh s PRO 50 Ca 0.00 1.27 0.04 0.00 0.04 0.00 0.00 61.00 62.35 1wyh s PRO 50 Cb -0.16 -4.17 0.04 0.00 0.04 0.00 0.00 34.50 30.25 1wyh s PRO 50 CO -0.07 -1.83 0.29 -3.47 0.04 0.00 0.00 177.00 171.96 1wyh n ASP 51 N 10.06 2.65 -4.50 6.66 2.03 0.16 -4.98 116.55 128.63 1wyh n ASP 51 Ca 0.21 -2.70 -0.39 0.00 0.52 0.00 0.00 54.79 52.43 1wyh n ASP 51 Cb 0.47 0.03 -0.15 0.00 -0.72 0.00 0.00 41.12 40.74 1wyh n ASP 51 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1wyh n LYS 52 N -1.53 0.02 -2.34 -0.67 5.02 -1.26 -0.52 118.16 116.88 1wyh n LYS 52 Ca -0.05 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 1wyh n LYS 52 Cb 0.55 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.07 1wyh n LYS 52 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wyh n GLY 53 N 6.41 -0.45 2.88 0.72 0.00 -1.26 -4.85 105.19 108.64 1wyh n GLY 53 Ca 0.66 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.53 1wyh n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wyh s ALA 54 N -1.89 -0.20 -0.43 4.61 0.00 0.32 -5.09 121.76 119.08 1wyh s ALA 54 Ca 0.00 0.61 -0.16 0.00 0.00 0.00 0.00 51.96 52.41 1wyh s ALA 54 Cb 0.00 -0.54 0.03 0.00 0.00 0.00 0.00 23.12 22.62 1wyh s ALA 54 CO 0.00 -0.26 0.35 -1.01 0.00 0.00 0.00 175.76 174.83 1wyh s HIS 55 N 1.48 3.22 -0.12 0.00 0.09 -1.26 0.35 115.29 119.06 1wyh s HIS 55 Ca -0.06 -0.61 0.00 0.00 -0.00 0.00 0.00 55.06 54.39 1wyh s HIS 55 Cb -0.12 -2.77 -0.02 0.00 -0.00 0.00 0.00 32.58 29.67 1wyh s HIS 55 CO -0.06 -0.66 -0.12 0.71 -0.00 0.00 0.00 174.74 174.62 1wyh s TYR 56 N 1.78 2.83 1.17 1.40 2.02 -1.00 0.02 117.35 125.57 1wyh s TYR 56 Ca 0.06 -0.48 -0.13 0.00 -0.37 0.00 0.00 57.07 56.15 1wyh s TYR 56 Cb -0.20 -1.82 0.28 0.00 -0.40 0.00 0.00 41.96 39.83 1wyh s TYR 56 CO 0.10 -0.09 1.03 0.00 -1.57 0.00 0.00 175.55 175.02 1wyh n VAL 58 N -4.89 -0.52 0.07 0.00 0.31 -1.25 0.16 118.33 112.20 1wyh n VAL 58 Ca 0.03 2.25 -0.12 0.00 -0.01 0.00 0.00 64.34 66.49 1wyh n VAL 58 Cb 0.55 -2.95 -0.08 0.00 -0.91 0.00 0.00 33.84 30.45 1wyh n VAL 58 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1wyh h PRO 59 N 0.00 -0.20 0.00 5.55 0.13 -1.94 -0.62 132.00 134.91 1wyh h PRO 59 Ca 0.32 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.46 1wyh h PRO 59 Cb 0.55 0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.73 1wyh h PRO 59 CO -0.94 0.20 0.30 0.00 -0.23 0.00 0.00 178.00 177.33 1wyh n TYR 61 N -2.73 0.58 0.28 0.00 9.36 0.12 -3.66 117.16 121.10 1wyh n TYR 61 Ca -0.02 0.25 0.13 0.00 3.32 0.00 0.00 57.90 61.58 1wyh n TYR 61 Cb 0.34 -0.89 0.79 0.00 -0.63 0.00 0.00 39.34 38.95 1wyh n TYR 61 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 1wyh h GLU 62 N -1.00 0.00 -0.01 2.98 5.08 -0.48 -1.02 114.58 120.13 1wyh h GLU 62 Ca -0.29 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.06 1wyh h GLU 62 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 1wyh h GLU 62 CO -0.18 0.08 -0.03 -0.91 -1.00 0.00 0.00 179.01 176.97 1wyh h ASN 63 N 0.00 0.03 -0.62 1.42 2.35 -0.24 0.33 115.58 118.85 1wyh h ASN 63 Ca -0.00 -0.67 -0.08 0.00 -0.55 0.00 0.00 56.30 55.00 1wyh h ASN 63 Cb 0.21 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 1wyh h ASN 63 CO 0.01 0.70 0.07 0.50 -1.65 0.00 0.00 177.43 177.05 1wyh h LYS 64 N -0.63 1.05 -0.48 0.81 3.64 -1.56 -2.39 116.57 117.01 1wyh h LYS 64 Ca -0.00 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1wyh h LYS 64 Cb 0.70 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1wyh h LYS 64 CO 0.01 1.00 0.00 1.19 -2.27 0.00 0.00 179.45 179.37 1wyh n PHE 65 N -4.24 0.67 0.37 1.91 3.01 -0.41 -4.41 117.46 114.37 1wyh n PHE 65 Ca 0.03 -0.31 -0.17 0.00 1.01 0.00 0.00 57.45 58.01 1wyh n PHE 65 Cb 0.31 -0.05 -0.09 0.00 -0.01 0.00 0.00 39.48 39.64 1wyh n PHE 65 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1wyh h ALA 66 N 3.70 -1.23 -1.55 4.37 0.00 -0.37 -3.45 119.26 120.73 1wyh h ALA 66 Ca 0.00 -0.22 -0.52 0.00 0.00 0.00 0.00 54.91 54.17 1wyh h ALA 66 Cb 0.70 0.55 -0.05 0.00 0.00 0.00 0.00 17.79 18.99 1wyh h ALA 66 CO 0.04 -1.19 -0.42 0.45 0.00 0.00 0.00 179.25 178.13 1wyh s SER 67 N -3.87 4.82 0.00 0.00 0.15 -1.26 -5.07 113.70 108.46 1wyh s SER 67 Ca -0.16 -0.87 0.00 0.00 0.70 0.00 0.00 55.95 55.62 1wyh s SER 67 Cb 0.03 -0.54 0.00 0.00 -1.71 0.00 0.00 66.02 63.79 1wyh s SER 67 CO 0.52 -0.60 0.00 0.61 1.20 0.00 0.00 173.24 174.96 1wyh n GLY 68 N -1.43 2.22 0.11 9.45 0.00 -1.26 -5.04 105.19 109.25 1wyh n GLY 68 Ca 0.02 -0.81 -0.13 0.00 0.00 0.00 0.00 46.02 45.10 1wyh n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wyh h PRO 69 N 0.00 0.26 -1.49 1.61 0.13 -2.02 -3.48 132.00 127.01 1wyh h PRO 69 Ca 0.00 -0.14 0.30 0.00 -0.87 0.00 0.00 66.00 65.29 1wyh h PRO 69 Cb 0.00 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 30.99 1wyh h PRO 69 CO 0.00 0.67 0.81 -1.54 -0.23 0.00 0.00 178.00 177.71 1wyh s SER 70 N -6.00 -0.09 -1.11 1.44 1.04 -1.26 -5.08 113.70 102.64 1wyh s SER 70 Ca -0.15 -0.10 -0.21 0.00 0.48 0.00 0.00 55.95 55.98 1wyh s SER 70 Cb 0.04 0.17 0.06 0.00 0.10 0.00 0.00 66.02 66.39 1wyh s SER 70 CO 0.73 -0.30 1.54 -0.55 0.98 0.00 0.00 173.24 175.64 1wyh s SER 71 N -2.70 6.61 0.00 7.02 0.15 -1.26 -5.22 113.70 118.31 1wyh s SER 71 Ca 0.12 -1.79 0.00 0.00 0.70 0.00 0.00 55.95 54.99 1wyh s SER 71 Cb 0.03 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 1wyh s SER 71 CO -0.04 -1.39 0.00 0.61 1.20 0.00 0.00 173.24 173.62