#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wxt s SER 2 N 0.00 2.27 1.19 1.61 0.15 -1.26 -5.13 113.70 112.53 1wxt s SER 2 Ca 0.00 -0.39 -0.18 0.00 0.70 0.00 0.00 55.95 56.08 1wxt s SER 2 Cb 0.00 -0.98 0.24 0.00 -1.71 0.00 0.00 66.02 63.57 1wxt s SER 2 CO 0.00 0.09 0.50 -1.20 1.20 0.00 0.00 173.24 173.83 1wxt n SER 3 N 3.61 -3.05 -0.26 5.45 7.64 -1.26 -4.88 113.62 120.86 1wxt n SER 3 Ca -0.21 -0.45 0.00 0.00 1.01 0.00 0.00 58.87 59.23 1wxt n SER 3 Cb 0.52 -0.94 0.00 0.00 -1.01 0.00 0.00 64.21 62.78 1wxt n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wxt n GLY 4 N 2.02 -2.16 3.08 0.23 0.00 -1.26 -5.02 105.19 102.07 1wxt n GLY 4 Ca 0.06 -0.95 -0.33 0.00 0.00 0.00 0.00 46.02 44.81 1wxt n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wxt s SER 5 N -0.19 4.69 -0.92 1.61 0.01 -1.26 -5.05 113.70 112.59 1wxt s SER 5 Ca 0.00 -1.66 -0.24 0.00 1.31 0.00 0.00 55.95 55.36 1wxt s SER 5 Cb 0.00 -1.63 0.01 0.00 0.21 0.00 0.00 66.02 64.61 1wxt s SER 5 CO 0.00 -0.29 1.64 -0.94 0.41 0.00 0.00 173.24 174.06 1wxt s SER 6 N 1.13 5.90 0.00 2.44 1.04 -1.26 -4.79 113.70 118.15 1wxt s SER 6 Ca -0.01 -0.94 0.00 0.00 0.48 0.00 0.00 55.95 55.48 1wxt s SER 6 Cb -0.20 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.36 1wxt s SER 6 CO -0.05 -2.04 0.00 0.61 0.98 0.00 0.00 173.24 172.74 1wxt n GLY 7 N 6.63 3.42 2.99 7.32 0.00 -1.26 -5.16 105.19 119.13 1wxt n GLY 7 Ca 0.31 -0.35 -0.19 0.00 0.00 0.00 0.00 46.02 45.79 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 1.87 0.03 0.99 0.20 -1.26 -5.10 118.68 115.41 1wxt s LEU 8 Ca 0.00 -0.16 0.02 0.00 0.69 0.00 0.00 54.13 54.69 1wxt s LEU 8 Cb 0.00 -0.46 -0.02 0.00 -0.43 0.00 0.00 46.19 45.28 1wxt s LEU 8 CO 0.00 0.07 -0.08 -0.54 -0.29 0.00 0.00 176.35 175.52 1wxt s LYS 9 N 0.04 0.53 0.10 1.98 1.02 -1.26 -0.78 119.74 121.38 1wxt s LYS 9 Ca -0.00 -0.62 -0.00 0.00 0.02 0.00 0.00 55.97 55.36 1wxt s LYS 9 Cb -0.06 -0.38 -0.04 0.00 -0.52 0.00 0.00 37.83 36.83 1wxt s LYS 9 CO -0.00 0.08 0.01 -1.64 -0.92 0.00 0.00 175.35 172.88 1wxt s MET 10 N -1.20 0.83 -0.10 1.68 -1.94 -0.20 -4.27 119.30 114.11 1wxt s MET 10 Ca -0.06 -1.37 0.04 0.00 -1.71 0.00 0.00 55.69 52.59 1wxt s MET 10 Cb -0.08 0.12 -0.00 0.00 2.01 0.00 0.00 34.83 36.87 1wxt s MET 10 CO 0.00 -0.17 -0.22 1.14 -0.01 0.00 0.00 175.02 175.77 1wxt s GLN 11 N -3.96 3.01 0.41 2.03 -2.07 -1.21 -0.81 119.66 117.06 1wxt s GLN 11 Ca 0.17 -0.85 -0.26 0.00 -1.82 0.00 0.00 55.36 52.60 1wxt s GLN 11 Cb 0.07 -2.33 -0.10 0.00 -1.09 0.00 0.00 33.01 29.56 1wxt s GLN 11 CO -0.03 0.23 1.34 0.28 -1.32 0.00 0.00 175.29 175.79 1wxt n VAL 12 N 3.40 2.47 -0.04 3.63 0.31 -0.08 -3.12 118.33 124.89 1wxt n VAL 12 Ca -0.19 -0.50 -0.05 0.00 -0.01 0.00 0.00 64.34 63.60 1wxt n VAL 12 Cb 0.53 -1.68 -0.06 0.00 -0.91 0.00 0.00 33.84 31.72 1wxt n VAL 12 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1wxt n LEU 13 N 0.22 0.79 -3.91 7.52 7.94 0.11 -1.41 117.00 128.26 1wxt n LEU 13 Ca 0.05 -0.01 -0.23 0.00 -1.11 0.00 0.00 56.01 54.71 1wxt n LEU 13 Cb 0.39 0.05 -0.17 0.00 0.53 0.00 0.00 43.42 44.23 1wxt n LEU 13 CO 0.60 0.32 -0.43 -0.31 -1.11 0.00 0.00 177.39 176.46 1wxt s TYR 14 N -2.19 1.06 0.24 1.96 2.02 -1.25 -4.64 117.35 114.55 1wxt s TYR 14 Ca -0.06 -0.39 -0.31 0.00 -0.37 0.00 0.00 57.07 55.94 1wxt s TYR 14 Cb 0.03 -0.90 -0.14 0.00 -0.40 0.00 0.00 41.96 40.55 1wxt s TYR 14 CO 0.30 -0.29 1.35 -1.91 -1.57 0.00 0.00 175.55 173.42 1wxt n GLU 15 N 4.32 1.90 -3.80 -0.62 0.00 -1.26 -4.58 120.64 116.59 1wxt n GLU 15 Ca -0.19 0.68 -0.16 0.00 0.00 0.00 0.00 57.16 57.48 1wxt n GLU 15 Cb 0.51 -2.29 -0.16 0.00 0.00 0.00 0.00 31.44 29.49 1wxt n GLU 15 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.13 177.25 1wxt s PHE 16 N -0.22 0.11 -0.15 4.31 2.19 -0.74 -4.96 117.98 118.52 1wxt s PHE 16 Ca 0.67 0.10 -0.15 0.00 0.33 0.00 0.00 56.93 57.88 1wxt s PHE 16 Cb -0.67 -0.30 -0.04 0.00 -1.31 0.00 0.00 43.02 40.69 1wxt s PHE 16 CO 0.52 -0.11 0.35 -2.00 1.83 0.00 0.00 175.22 175.81 1wxt s GLU 17 N 1.14 4.28 -0.18 10.12 -6.30 -1.26 -1.86 118.70 124.64 1wxt s GLU 17 Ca -0.08 0.21 -0.26 0.00 -2.50 0.00 0.00 54.97 52.33 1wxt s GLU 17 Cb -0.13 -3.43 -0.01 0.00 0.00 0.00 0.00 34.13 30.56 1wxt s GLU 17 CO -0.03 0.21 0.87 0.00 0.02 0.00 0.00 175.26 176.34 1wxt s ALA 18 N 0.52 3.55 -0.16 6.30 0.00 -1.26 -4.91 121.76 125.80 1wxt s ALA 18 Ca 0.19 0.05 0.15 0.00 0.00 0.00 0.00 51.96 52.36 1wxt s ALA 18 Cb -0.14 -3.30 -0.22 0.00 0.00 0.00 0.00 23.12 19.47 1wxt s ALA 18 CO 0.06 -0.75 0.08 0.54 0.00 0.00 0.00 175.76 175.70 1wxt n ARG 19 N 5.49 1.17 -2.89 0.00 1.74 -1.26 -4.86 116.66 116.05 1wxt n ARG 19 Ca 0.06 -0.02 -0.32 0.00 -0.77 0.00 0.00 57.85 56.79 1wxt n ARG 19 Cb 0.48 -1.44 -0.06 0.00 -1.02 0.00 0.00 32.46 30.43 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 -5.01 6.82 0.00 0.55 0.02 -1.26 -4.95 114.94 111.11 1wxt s ASN 20 Ca -0.08 1.49 0.15 0.00 -1.02 0.00 0.00 52.86 53.39 1wxt s ASN 20 Cb 0.06 -2.46 0.78 0.00 0.02 0.00 0.00 41.25 39.65 1wxt s ASN 20 CO 0.70 -0.33 1.40 -0.81 0.02 0.00 0.00 177.10 178.08 1wxt n PRO 21 N -0.69 0.26 -0.21 -0.60 -0.04 -1.26 -2.04 135.00 130.43 1wxt n PRO 21 Ca 0.05 0.12 0.09 0.00 -0.04 0.00 0.00 63.50 63.72 1wxt n PRO 21 Cb 0.54 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.67 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 -1.23 2.00 -3.51 0.54 1.85 -1.26 -5.03 116.66 110.02 1wxt n ARG 22 Ca 0.08 -2.61 -0.22 0.00 -1.00 0.00 0.00 57.85 54.10 1wxt n ARG 22 Cb 0.11 -1.60 -0.01 0.00 -1.05 0.00 0.00 32.46 29.91 1wxt n ARG 22 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1wxt n GLU 23 N -1.01 0.91 -3.71 2.89 1.02 -0.86 -2.68 120.64 117.21 1wxt n GLU 23 Ca 0.17 -2.72 -0.11 0.00 -0.02 0.00 0.00 57.16 54.48 1wxt n GLU 23 Cb 0.71 0.42 -0.12 0.00 -0.02 0.00 0.00 31.44 32.43 1wxt n GLU 23 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1wxt s LEU 24 N 0.00 0.11 0.32 -4.62 2.96 -1.26 -4.52 118.68 111.67 1wxt s LEU 24 Ca 0.17 0.72 -0.29 0.00 -0.22 0.00 0.00 54.13 54.52 1wxt s LEU 24 Cb -0.01 1.05 -0.10 0.00 0.50 0.00 0.00 46.19 47.63 1wxt s LEU 24 CO 0.11 -0.18 1.26 -0.89 -1.32 0.00 0.00 176.35 175.32 1wxt s THR 25 N 1.41 2.89 0.11 3.68 2.01 -1.26 -4.49 115.64 119.99 1wxt s THR 25 Ca -0.09 0.89 -0.05 0.00 0.31 0.00 0.00 61.69 62.75 1wxt s THR 25 Cb -0.10 -3.57 -0.02 0.00 0.01 0.00 0.00 72.50 68.83 1wxt s THR 25 CO -0.11 0.21 0.13 0.68 -0.69 0.00 0.00 174.62 174.84 1wxt s VAL 26 N -1.16 0.13 0.04 3.82 -7.23 -0.77 -4.97 120.40 110.26 1wxt s VAL 26 Ca 0.48 -1.56 0.01 0.00 -1.81 0.00 0.00 61.98 59.11 1wxt s VAL 26 Cb -0.38 -1.67 -0.03 0.00 0.56 0.00 0.00 36.38 34.86 1wxt s VAL 26 CO 0.50 -0.60 -0.05 0.68 -0.31 0.00 0.00 175.10 175.32 1wxt s VAL 27 N -3.95 0.33 0.50 1.32 -7.23 -1.26 -1.79 120.40 108.32 1wxt s VAL 27 Ca 0.13 -1.16 -0.21 0.00 -1.81 0.00 0.00 61.98 58.93 1wxt s VAL 27 Cb 0.06 -0.65 -0.09 0.00 0.56 0.00 0.00 36.38 36.25 1wxt s VAL 27 CO -0.05 -0.55 0.76 1.67 -0.31 0.00 0.00 175.10 176.62 1wxt n GLN 28 N 1.24 0.85 0.00 4.82 7.27 -1.26 -1.70 117.38 128.59 1wxt n GLN 28 Ca -0.21 0.32 0.00 0.00 0.07 0.00 0.00 57.00 57.17 1wxt n GLN 28 Cb 0.56 -1.85 0.00 0.00 2.41 0.00 0.00 30.24 31.36 1wxt n GLN 28 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1wxt n GLY 29 N 1.51 2.14 3.63 1.69 0.00 -0.50 -4.97 105.19 108.69 1wxt n GLY 29 Ca 0.11 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 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 0.76 -4.40 1.61 4.07 -0.69 -4.69 120.64 117.29 1wxt n GLU 30 Ca 0.00 0.31 -0.31 0.00 -0.06 0.00 0.00 57.16 57.10 1wxt n GLU 30 Cb 0.00 -2.24 -0.10 0.00 -0.06 0.00 0.00 31.44 29.04 1wxt n GLU 30 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 1wxt s LYS 31 N -3.08 2.42 0.16 5.31 1.02 -1.26 -0.91 119.74 123.40 1wxt s LYS 31 Ca 0.76 -0.82 -0.09 0.00 0.02 0.00 0.00 55.97 55.85 1wxt s LYS 31 Cb -0.38 -2.44 -0.01 0.00 -0.52 0.00 0.00 37.83 34.48 1wxt s LYS 31 CO 0.47 0.57 0.27 -0.51 -0.92 0.00 0.00 175.35 175.23 1wxt s LEU 32 N -1.66 1.04 -0.26 3.17 1.43 0.01 -4.83 118.68 117.58 1wxt s LEU 32 Ca 0.18 -0.86 -0.06 0.00 -1.03 0.00 0.00 54.13 52.36 1wxt s LEU 32 Cb -0.11 1.14 -0.01 0.00 0.03 0.00 0.00 46.19 47.24 1wxt s LEU 32 CO 0.10 -0.87 0.05 -0.70 0.23 0.00 0.00 176.35 175.15 1wxt s GLU 33 N -3.96 3.39 0.24 1.70 2.12 -1.13 -1.03 118.70 120.02 1wxt s GLU 33 Ca 0.16 -0.65 -0.30 0.00 0.36 0.00 0.00 54.97 54.55 1wxt s GLU 33 Cb 0.04 -3.28 -0.09 0.00 0.26 0.00 0.00 34.13 31.06 1wxt s GLU 33 CO -0.01 -0.28 1.35 0.08 -0.54 0.00 0.00 175.26 175.86 1wxt s VAL 34 N 1.54 2.95 -0.00 3.70 1.01 0.04 -2.38 120.40 127.26 1wxt s VAL 34 Ca 0.05 0.81 -0.05 0.00 0.00 0.00 0.00 61.98 62.79 1wxt s VAL 34 Cb -0.16 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 1wxt s VAL 34 CO 0.02 0.14 -0.10 0.18 0.00 0.00 0.00 175.10 175.33 1wxt n LEU 35 N 2.25 1.20 -4.01 3.92 4.77 0.19 -4.42 117.00 120.90 1wxt n LEU 35 Ca 0.05 0.18 -0.31 0.00 -0.03 0.00 0.00 56.01 55.90 1wxt n LEU 35 Cb 0.42 -0.41 -0.15 0.00 -2.33 0.00 0.00 43.42 40.94 1wxt n LEU 35 CO 0.59 -0.45 -0.38 -0.62 -1.33 0.00 0.00 177.39 175.20 1wxt s ASP 36 N -5.93 4.52 -0.57 -1.43 2.15 -1.19 -4.96 116.67 109.26 1wxt s ASP 36 Ca -0.09 -1.78 0.01 0.00 0.43 0.00 0.00 52.55 51.12 1wxt s ASP 36 Cb 0.02 -1.50 0.43 0.00 -0.30 0.00 0.00 42.92 41.56 1wxt s ASP 36 CO 0.13 -0.31 1.69 0.00 -0.17 0.00 0.00 175.17 176.52 1wxt n HIS 37 N 4.39 3.08 -0.01 -5.34 1.44 -1.26 -2.29 115.22 115.23 1wxt n HIS 37 Ca -0.04 -2.69 -0.03 0.00 -2.01 0.00 0.00 57.72 52.95 1wxt n HIS 37 Cb 0.42 -0.94 -0.01 0.00 0.12 0.00 0.00 29.99 29.59 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 -0.74 1.00 -4.72 4.39 2.88 -1.26 -5.04 113.62 110.13 1wxt n SER 38 Ca 0.53 0.15 -0.32 0.00 -1.33 0.00 0.00 58.87 57.91 1wxt n SER 38 Cb 0.66 -0.44 0.12 0.00 -0.75 0.00 0.00 64.21 63.80 1wxt n SER 38 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1wxt s LYS 39 N -1.95 1.81 0.11 -1.46 -0.14 -1.26 -4.90 119.74 111.94 1wxt s LYS 39 Ca -0.09 1.46 -0.21 0.00 -1.36 0.00 0.00 55.97 55.77 1wxt s LYS 39 Cb 0.01 -1.82 -0.05 0.00 -1.68 0.00 0.00 37.83 34.29 1wxt s LYS 39 CO 0.14 -2.03 1.18 0.54 -0.76 0.00 0.00 175.35 174.42 1wxt n ARG 40 N -3.52 -0.30 -3.00 1.68 3.00 -1.26 -4.13 116.66 109.13 1wxt n ARG 40 Ca 0.11 1.16 -0.40 0.00 -0.01 0.00 0.00 57.85 58.71 1wxt n ARG 40 Cb 0.52 -1.71 -0.05 0.00 0.00 0.00 0.00 32.46 31.22 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 -4.98 3.63 0.35 -1.55 0.52 -1.26 -4.30 118.94 111.35 1wxt s TRP 41 Ca -0.08 1.35 -0.09 0.00 0.02 0.00 0.00 56.10 57.31 1wxt s TRP 41 Cb 0.07 -2.83 -0.06 0.00 -1.15 0.00 0.00 33.47 29.50 1wxt s TRP 41 CO 0.42 0.14 0.67 -1.58 0.02 0.00 0.00 176.95 176.62 1wxt s TRP 42 N 0.53 3.46 -0.24 -1.98 0.52 0.34 -4.83 118.94 116.75 1wxt s TRP 42 Ca 0.39 0.89 -0.06 0.00 0.02 0.00 0.00 56.10 57.33 1wxt s TRP 42 Cb -0.19 -2.31 -0.02 0.00 -1.15 0.00 0.00 33.47 29.80 1wxt s TRP 42 CO 0.20 0.03 0.04 -1.17 0.02 0.00 0.00 176.95 176.07 1wxt s LEU 43 N -3.63 3.30 0.31 2.99 2.96 -0.97 -0.39 118.68 123.26 1wxt s LEU 43 Ca 0.48 -0.28 0.10 0.00 -0.22 0.00 0.00 54.13 54.21 1wxt s LEU 43 Cb -0.10 -1.87 -0.06 0.00 0.50 0.00 0.00 46.19 44.66 1wxt s LEU 43 CO 0.29 -0.04 -0.13 0.68 -1.32 0.00 0.00 176.35 175.83 1wxt s VAL 44 N 1.57 2.28 -0.02 1.68 -7.23 -1.09 0.55 120.40 118.13 1wxt s VAL 44 Ca 0.06 -2.27 0.03 0.00 -1.81 0.00 0.00 61.98 57.99 1wxt s VAL 44 Cb -0.15 -2.50 -0.00 0.00 0.56 0.00 0.00 36.38 34.29 1wxt s VAL 44 CO 0.02 -0.29 -0.11 -0.75 -0.31 0.00 0.00 175.10 173.65 1wxt s LYS 45 N -3.58 1.06 0.43 4.82 2.20 -1.00 -1.76 119.74 121.91 1wxt s LYS 45 Ca 0.31 -0.40 -0.05 0.00 -0.36 0.00 0.00 55.97 55.46 1wxt s LYS 45 Cb -0.00 -0.99 0.10 0.00 -1.51 0.00 0.00 37.83 35.42 1wxt s LYS 45 CO 0.15 0.20 0.59 0.27 -0.36 0.00 0.00 175.35 176.20 1wxt n ASN 46 N 3.01 0.24 0.10 1.43 6.94 0.57 -2.86 115.26 124.69 1wxt n ASN 46 Ca -0.16 -1.33 -0.05 0.00 -0.02 0.00 0.00 54.58 53.02 1wxt n ASN 46 Cb 0.55 -0.43 0.04 0.00 -2.36 0.00 0.00 39.78 37.58 1wxt n ASN 46 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 1wxt h GLU 47 N 0.00 0.06 0.00 -3.83 4.81 -1.88 -3.12 114.58 110.63 1wxt h GLU 47 Ca -0.19 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 58.92 1wxt h GLU 47 Cb 0.57 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 1wxt h GLU 47 CO 0.15 0.82 -0.24 0.00 -0.73 0.00 0.00 179.01 179.01 1wxt h ALA 48 N 1.16 1.39 0.00 2.92 0.00 -2.02 -3.46 119.26 119.25 1wxt h ALA 48 Ca -0.02 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1wxt h ALA 48 Cb 1.39 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1wxt h ALA 48 CO 0.11 0.30 0.00 0.41 0.00 0.00 0.00 179.25 180.07 1wxt n GLY 49 N -0.60 1.80 3.77 0.00 0.00 -1.18 -5.11 105.19 103.88 1wxt n GLY 49 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 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 4.32 -0.04 1.61 0.52 -1.26 -4.75 118.95 119.35 1wxt s ARG 50 Ca 0.00 1.63 0.02 0.00 -0.52 0.00 0.00 55.73 56.86 1wxt s ARG 50 Cb 0.00 -2.77 0.01 0.00 0.52 0.00 0.00 34.95 32.71 1wxt s ARG 50 CO 0.00 -0.03 -0.10 -1.54 0.02 0.00 0.00 175.30 173.65 1wxt s SER 51 N -1.31 1.42 0.09 0.23 1.04 -1.26 -0.32 113.70 113.59 1wxt s SER 51 Ca 0.53 -0.23 0.03 0.00 0.48 0.00 0.00 55.95 56.76 1wxt s SER 51 Cb -0.26 -0.54 -0.04 0.00 0.10 0.00 0.00 66.02 65.29 1wxt s SER 51 CO 0.33 0.04 -0.08 -0.83 0.98 0.00 0.00 173.24 173.67 1wxt s GLY 52 N 0.48 0.76 -0.17 7.32 0.00 -0.72 -4.77 107.32 110.22 1wxt s GLY 52 Ca -0.09 -1.17 -0.29 0.00 0.00 0.00 0.00 44.72 43.17 1wxt s GLY 52 CO 0.02 -1.25 1.02 -0.19 0.00 0.00 0.00 173.10 172.71 1wxt s TYR 53 N -2.64 3.43 0.08 1.90 2.02 -1.09 -2.69 117.35 118.36 1wxt s TYR 53 Ca 0.05 1.53 0.05 0.00 -0.37 0.00 0.00 57.07 58.34 1wxt s TYR 53 Cb -0.01 -3.23 -0.03 0.00 -0.40 0.00 0.00 41.96 38.29 1wxt s TYR 53 CO -0.01 -0.35 -0.15 0.96 -1.57 0.00 0.00 175.55 174.43 1wxt s ILE 54 N 2.59 1.18 0.13 2.71 -4.36 0.48 -4.47 121.20 119.46 1wxt s ILE 54 Ca 0.46 -1.37 -0.31 0.00 -0.26 0.00 0.00 60.65 59.17 1wxt s ILE 54 Cb -0.17 -1.17 -0.08 0.00 1.25 0.00 0.00 42.46 42.30 1wxt s ILE 54 CO 0.12 -0.24 1.35 -2.16 0.24 0.00 0.00 174.94 174.25 1wxt s PRO 55 N -1.87 4.35 0.00 0.37 0.04 -1.26 -0.50 135.00 136.13 1wxt s PRO 55 Ca -0.00 2.04 0.02 0.00 0.04 0.00 0.00 61.00 63.09 1wxt s PRO 55 Cb -0.09 -3.24 0.07 0.00 0.04 0.00 0.00 34.50 31.27 1wxt s PRO 55 CO 0.02 -0.37 1.04 -1.13 0.04 0.00 0.00 177.00 176.61 1wxt n SER 56 N 3.59 0.00 -0.15 6.66 3.41 -1.26 -1.93 113.62 123.94 1wxt n SER 56 Ca 0.10 0.48 -0.10 0.00 -0.26 0.00 0.00 58.87 59.09 1wxt n SER 56 Cb 0.43 -0.49 -0.01 0.00 -0.26 0.00 0.00 64.21 63.88 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 0.77 -0.15 4.04 4.21 -1.93 -2.44 115.58 120.08 1wxt h ASN 57 Ca 0.00 -0.32 0.00 0.00 1.21 0.00 0.00 56.30 57.19 1wxt h ASN 57 Cb 0.03 -0.21 0.00 0.00 -1.12 0.00 0.00 38.32 37.02 1wxt h ASN 57 CO 0.00 0.90 0.00 2.30 -1.29 0.00 0.00 177.43 179.34 1wxt n ILE 58 N -4.38 0.26 -4.14 2.81 -5.35 -0.81 -4.84 119.36 102.91 1wxt n ILE 58 Ca -0.00 -0.22 -0.28 0.00 -0.27 0.00 0.00 62.75 61.97 1wxt n ILE 58 Cb 0.31 0.03 -0.07 0.00 -1.74 0.00 0.00 39.64 38.17 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 -0.94 3.50 0.04 7.28 1.43 -0.92 0.05 118.68 129.11 1wxt s LEU 59 Ca 0.11 -0.23 -0.06 0.00 -1.03 0.00 0.00 54.13 52.92 1wxt s LEU 59 Cb 0.06 -2.18 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 1wxt s LEU 59 CO 0.07 0.13 0.11 -1.83 0.23 0.00 0.00 176.35 175.05 1wxt s GLU 60 N -2.68 0.60 -1.19 1.70 -1.05 -1.18 -4.88 118.70 110.02 1wxt s GLU 60 Ca 0.27 -0.74 -0.23 0.00 -0.15 0.00 0.00 54.97 54.13 1wxt s GLU 60 Cb -0.11 0.24 -0.09 0.00 -0.44 0.00 0.00 34.13 33.73 1wxt s GLU 60 CO 0.20 -0.15 1.93 -0.35 0.95 0.00 0.00 175.26 177.84 1wxt n PRO 61 N 0.75 1.61 -0.23 -4.83 -0.04 -1.26 -3.32 135.00 127.68 1wxt n PRO 61 Ca -0.19 -2.48 0.00 0.00 -0.04 0.00 0.00 63.50 60.80 1wxt n PRO 61 Cb 0.59 -3.73 0.08 0.00 -0.04 0.00 0.00 33.50 30.39 1wxt n PRO 61 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1wxt h LEU 62 N 17.74 -0.61 -1.28 1.53 6.46 -1.90 -3.44 115.31 133.81 1wxt h LEU 62 Ca 0.22 0.20 -0.56 0.00 -0.12 0.00 0.00 57.88 57.62 1wxt h LEU 62 Cb 0.94 0.41 -0.33 0.00 -0.73 0.00 0.00 40.66 40.95 1wxt h LEU 62 CO 1.23 -0.22 -0.81 -1.54 -0.62 0.00 0.00 178.44 176.47 1wxt n SER 63 N -5.45 -1.38 -4.51 1.25 3.41 -1.26 -4.78 113.62 100.90 1wxt n SER 63 Ca 0.09 -1.11 -0.39 0.00 -0.26 0.00 0.00 58.87 57.19 1wxt n SER 63 Cb 0.36 -1.42 0.03 0.00 -0.26 0.00 0.00 64.21 62.91 1wxt n SER 63 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wxt n GLY 64 N -1.14 -1.12 0.06 5.00 0.00 -1.26 -4.93 105.19 101.80 1wxt n GLY 64 Ca 0.07 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1wxt n GLY 64 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wxt h PRO 65 N 0.61 -0.01 -7.10 1.61 0.13 -2.03 -3.45 132.00 121.77 1wxt h PRO 65 Ca -0.45 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.19 1wxt h PRO 65 Cb 1.38 0.00 0.06 0.00 0.13 0.00 0.00 31.00 32.58 1wxt h PRO 65 CO 0.50 0.48 0.41 -1.12 -0.23 0.00 0.00 178.00 178.04 1wxt s SER 66 N -5.68 5.85 -0.16 1.44 0.01 -1.26 -5.06 113.70 108.84 1wxt s SER 66 Ca -0.16 2.06 -0.10 0.00 1.31 0.00 0.00 55.95 59.06 1wxt s SER 66 Cb 0.02 -2.57 0.05 0.00 0.21 0.00 0.00 66.02 63.73 1wxt s SER 66 CO 0.67 -1.12 0.40 -0.55 0.41 0.00 0.00 173.24 173.05 1wxt s SER 67 N -1.99 -0.48 0.00 2.44 0.15 -1.26 -5.14 113.70 107.42 1wxt s SER 67 Ca 0.70 0.86 0.00 0.00 0.70 0.00 0.00 55.95 58.21 1wxt s SER 67 Cb -0.21 0.77 0.00 0.00 -1.71 0.00 0.00 66.02 64.88 1wxt s SER 67 CO 0.27 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.14