#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wgp n SER 2 N 0.00 -1.78 -3.63 1.61 7.64 -1.26 -5.16 113.62 111.04 1wgp n SER 2 Ca 0.00 0.59 0.02 0.00 1.01 0.00 0.00 58.87 60.49 1wgp n SER 2 Cb 0.00 1.79 -0.00 0.00 -1.01 0.00 0.00 64.21 64.99 1wgp n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wgp s SER 3 N -3.63 -0.05 0.32 6.43 0.15 -1.26 -5.04 113.70 110.63 1wgp s SER 3 Ca 0.00 -0.13 -0.19 0.00 0.70 0.00 0.00 55.95 56.33 1wgp s SER 3 Cb 0.00 0.15 0.04 0.00 -1.71 0.00 0.00 66.02 64.49 1wgp s SER 3 CO 0.00 -0.27 0.76 -0.83 1.20 0.00 0.00 173.24 174.10 1wgp s GLY 4 N -3.05 0.11 -0.44 9.45 0.00 -1.26 -5.11 107.32 107.02 1wgp s GLY 4 Ca 0.15 -0.49 0.06 0.00 0.00 0.00 0.00 44.72 44.44 1wgp s GLY 4 CO -0.04 -0.14 0.46 1.44 0.00 0.00 0.00 173.10 174.82 1wgp n SER 5 N -0.89 0.38 -3.62 1.64 7.64 -1.26 -5.06 113.62 112.45 1wgp n SER 5 Ca -0.06 -2.65 -0.05 0.00 1.01 0.00 0.00 58.87 57.13 1wgp n SER 5 Cb 0.59 -0.61 -0.04 0.00 -1.01 0.00 0.00 64.21 63.14 1wgp n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1wgp s SER 6 N -0.75 -0.15 1.37 6.43 0.01 -1.26 -5.09 113.70 114.27 1wgp s SER 6 Ca 0.34 0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.73 1wgp s SER 6 Cb 0.09 0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.45 1wgp s SER 6 CO -0.15 -0.15 0.00 0.61 0.41 0.00 0.00 173.24 173.96 1wgp n GLY 7 N 0.49 0.75 3.14 3.44 0.00 -1.11 -4.67 105.19 107.23 1wgp n GLY 7 Ca -0.03 0.55 -0.28 0.00 0.00 0.00 0.00 46.02 46.27 1wgp n GLY 7 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1wgp n VAL 8 N 0.00 0.00 -0.08 1.61 3.14 -1.17 -4.14 118.33 117.69 1wgp n VAL 8 Ca 0.00 -0.17 0.00 0.00 -2.96 0.00 0.00 64.34 61.21 1wgp n VAL 8 Cb 0.00 -0.48 0.00 0.00 -1.06 0.00 0.00 33.84 32.30 1wgp n VAL 8 CO 0.00 0.00 0.00 -1.14 -6.46 0.00 0.00 176.83 169.23 1wgp n ARG 9 N -1.35 -0.22 -1.21 1.45 0.63 -1.26 -4.80 116.66 109.90 1wgp n ARG 9 Ca 0.02 0.16 -0.07 0.00 -0.92 0.00 0.00 57.85 57.04 1wgp n ARG 9 Cb 0.54 -0.18 -0.03 0.00 0.45 0.00 0.00 32.46 33.24 1wgp n ARG 9 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1wgp n ARG 10 N -0.74 -1.09 -2.11 -0.14 5.12 -1.26 -4.98 116.66 111.47 1wgp n ARG 10 Ca 0.00 0.67 -0.30 0.00 -1.93 0.00 0.00 57.85 56.29 1wgp n ARG 10 Cb 0.00 -4.69 0.00 0.00 -1.16 0.00 0.00 32.46 26.61 1wgp n ARG 10 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1wgp s VAL 11 N -1.98 4.73 -1.10 1.55 -7.23 -1.26 -4.95 120.40 110.15 1wgp s VAL 11 Ca 0.00 0.79 0.22 0.00 -1.81 0.00 0.00 61.98 61.18 1wgp s VAL 11 Cb 0.00 -3.85 0.23 0.00 0.56 0.00 0.00 36.38 33.33 1wgp s VAL 11 CO 0.00 -1.02 1.71 -0.81 -0.31 0.00 0.00 175.10 174.67 1wgp n PRO 12 N -2.47 0.08 0.26 4.82 -0.04 -1.26 -3.54 135.00 132.86 1wgp n PRO 12 Ca 0.05 0.11 -0.11 0.00 -0.04 0.00 0.00 63.50 63.52 1wgp n PRO 12 Cb 0.54 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.45 1wgp n PRO 12 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1wgp h LEU 13 N 0.00 -0.60 -4.80 1.53 3.38 -1.99 -3.26 115.31 109.57 1wgp h LEU 13 Ca 0.00 0.02 -0.57 0.00 0.09 0.00 0.00 57.88 57.42 1wgp h LEU 13 Cb 0.33 0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 1wgp h LEU 13 CO 0.00 -0.29 2.85 0.49 0.09 0.00 0.00 178.44 181.58 1wgp n PHE 14 N -4.66 1.89 -0.10 1.13 3.72 -1.23 -4.35 117.46 113.86 1wgp n PHE 14 Ca -0.09 -2.73 -0.19 0.00 -0.05 0.00 0.00 57.45 54.39 1wgp n PHE 14 Cb 0.28 -2.27 -0.10 0.00 -0.94 0.00 0.00 39.48 36.45 1wgp n PHE 14 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1wgp h GLU 15 N 4.53 0.00 0.00 -1.08 5.08 -1.75 -3.39 114.58 117.97 1wgp h GLU 15 Ca 0.72 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.87 1wgp h GLU 15 Cb 0.55 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.77 1wgp h GLU 15 CO 1.43 0.89 -1.42 -2.95 -1.00 0.00 0.00 179.01 175.96 1wgp h ASN 16 N -1.00 0.00 -2.81 1.42 -1.07 -1.87 -3.47 115.58 106.77 1wgp h ASN 16 Ca -0.28 0.00 -0.53 0.00 0.07 0.00 0.00 56.30 55.56 1wgp h ASN 16 Cb 1.18 0.00 0.23 0.00 -2.07 0.00 0.00 38.32 37.66 1wgp h ASN 16 CO -0.17 0.76 -1.06 0.80 0.07 0.00 0.00 177.43 177.83 1wgp n MET 17 N -3.01 -0.35 -4.11 4.14 1.56 -1.26 -4.99 117.12 109.09 1wgp n MET 17 Ca -0.11 -0.08 -0.25 0.00 -0.27 0.00 0.00 57.70 57.00 1wgp n MET 17 Cb 0.92 -1.58 -0.05 0.00 2.15 0.00 0.00 33.22 34.65 1wgp n MET 17 CO 0.00 0.00 0.00 -0.51 -0.73 0.00 0.00 175.97 174.73 1wgp s ASP 18 N -1.69 5.41 0.14 6.12 1.11 -1.26 -5.02 116.67 121.48 1wgp s ASP 18 Ca 0.51 -0.20 -0.23 0.00 0.18 0.00 0.00 52.55 52.81 1wgp s ASP 18 Cb -0.18 -1.37 0.00 0.00 1.07 0.00 0.00 42.92 42.44 1wgp s ASP 18 CO 0.71 0.04 1.65 -0.33 1.18 0.00 0.00 175.17 178.42 1wgp h GLU 19 N 2.19 -0.23 -1.20 8.23 5.08 -1.98 0.71 114.58 127.38 1wgp h GLU 19 Ca -0.48 0.02 0.35 0.00 -1.00 0.00 0.00 59.36 58.25 1wgp h GLU 19 Cb 1.21 0.05 -0.10 0.00 0.50 0.00 0.00 28.75 30.41 1wgp h GLU 19 CO 0.62 -0.15 0.79 0.00 -1.00 0.00 0.00 179.01 179.27 1wgp h ARG 20 N -0.24 0.20 -0.17 2.33 2.47 -1.99 1.50 114.38 118.48 1wgp h ARG 20 Ca 0.11 -0.01 -0.20 0.00 -1.26 0.00 0.00 59.98 58.62 1wgp h ARG 20 Cb 0.40 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.68 1wgp h ARG 20 CO -0.31 0.13 -0.69 1.25 0.56 0.00 0.00 179.97 180.92 1wgp h LEU 21 N 0.20 0.81 0.12 3.04 5.85 -1.29 -1.11 115.31 122.94 1wgp h LEU 21 Ca 0.69 -0.50 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 1wgp h LEU 21 Cb 2.11 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.91 1wgp h LEU 21 CO -0.29 1.27 -0.06 -0.07 -0.34 0.00 0.00 178.44 178.95 1wgp h LEU 22 N 0.50 -0.14 0.14 2.25 -0.00 0.29 1.29 115.31 119.65 1wgp h LEU 22 Ca -0.02 -0.09 0.00 0.00 -0.00 0.00 0.00 57.88 57.77 1wgp h LEU 22 Cb 1.29 0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 41.97 1wgp h LEU 22 CO 0.14 -0.00 -0.14 -0.78 -0.00 0.00 0.00 178.44 177.65 1wgp h ASP 23 N -0.27 -0.38 0.76 -0.43 3.58 -0.77 1.26 116.42 120.18 1wgp h ASP 23 Ca -0.02 0.04 -0.03 0.00 0.42 0.00 0.00 57.03 57.44 1wgp h ASP 23 Cb 0.22 0.13 -0.00 0.00 1.72 0.00 0.00 39.33 41.40 1wgp h ASP 23 CO 0.03 -0.22 -0.43 0.00 -2.88 0.00 0.00 179.24 175.74 1wgp h ALA 24 N 0.52 -1.13 -0.72 -0.78 0.00 -1.07 1.30 119.26 117.37 1wgp h ALA 24 Ca 0.00 -0.23 0.16 0.00 0.00 0.00 0.00 54.91 54.84 1wgp h ALA 24 Cb 0.30 0.51 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 1wgp h ALA 24 CO -0.04 -1.15 0.49 0.82 0.00 0.00 0.00 179.25 179.38 1wgp h ILE 25 N -1.11 0.75 0.40 0.00 2.04 0.18 0.10 117.51 119.89 1wgp h ILE 25 Ca -0.10 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 65.64 1wgp h ILE 25 Cb 0.88 0.44 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 1wgp h ILE 25 CO 0.13 0.05 -0.19 0.00 0.00 0.00 0.00 178.15 178.13 1wgp h GLU 27 N -1.04 0.00 -0.23 0.00 5.08 0.25 1.50 114.58 120.14 1wgp h GLU 27 Ca -0.06 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.14 1wgp h GLU 27 Cb 0.42 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 1wgp h GLU 27 CO 0.09 0.00 -0.52 0.00 -1.00 0.00 0.00 179.01 177.58 1wgp h ARG 28 N 0.00 0.66 -5.46 2.33 2.47 -0.73 -3.45 114.38 110.21 1wgp h ARG 28 Ca 0.51 -0.40 -0.80 0.00 -1.26 0.00 0.00 59.98 58.03 1wgp h ARG 28 Cb 2.34 0.04 0.01 0.00 -1.65 0.00 0.00 29.97 30.71 1wgp h ARG 28 CO -0.01 1.02 0.64 1.28 0.56 0.00 0.00 179.97 183.46 1wgp n LEU 29 N -3.98 1.09 -4.88 3.04 4.77 0.51 -4.90 117.00 112.65 1wgp n LEU 29 Ca -0.03 1.08 -0.29 0.00 -0.03 0.00 0.00 56.01 56.74 1wgp n LEU 29 Cb 0.60 -0.80 -0.04 0.00 -2.33 0.00 0.00 43.42 40.84 1wgp n LEU 29 CO 0.48 -0.76 -0.17 -0.54 -1.33 0.00 0.00 177.39 175.07 1wgp s LYS 30 N 2.77 3.25 -0.29 3.23 1.02 -1.12 -4.84 119.74 123.76 1wgp s LYS 30 Ca 0.96 -0.61 -0.29 0.00 0.02 0.00 0.00 55.97 56.05 1wgp s LYS 30 Cb -1.37 -2.89 -0.00 0.00 -0.52 0.00 0.00 37.83 33.05 1wgp s LYS 30 CO 0.74 0.55 1.34 -1.25 -0.92 0.00 0.00 175.35 175.82 1wgp s PRO 31 N -2.80 3.89 0.11 -1.68 0.04 -1.26 -2.70 135.00 130.59 1wgp s PRO 31 Ca 0.33 1.29 -0.11 0.00 0.04 0.00 0.00 61.00 62.55 1wgp s PRO 31 Cb -0.12 -3.90 0.01 0.00 0.04 0.00 0.00 34.50 30.53 1wgp s PRO 31 CO 0.26 -1.16 0.26 0.00 0.04 0.00 0.00 177.00 176.40 1wgp s LEU 33 N -2.86 1.97 -0.31 0.00 2.96 -1.26 -4.14 118.68 115.04 1wgp s LEU 33 Ca 0.06 -0.53 -0.03 0.00 -0.22 0.00 0.00 54.13 53.41 1wgp s LEU 33 Cb 0.04 0.43 0.04 0.00 0.50 0.00 0.00 46.19 47.20 1wgp s LEU 33 CO -0.10 -0.44 0.03 -0.36 -1.32 0.00 0.00 176.35 174.15 1wgp s PHE 34 N -2.27 3.24 0.00 5.38 0.08 -1.24 -5.07 117.98 118.11 1wgp s PHE 34 Ca -0.08 -1.71 0.00 0.00 0.12 0.00 0.00 56.93 55.26 1wgp s PHE 34 Cb -0.03 -2.15 0.00 0.00 -0.57 0.00 0.00 43.02 40.26 1wgp s PHE 34 CO -0.03 -0.77 0.00 0.25 -0.10 0.00 0.00 175.22 174.56 1wgp n THR 35 N 4.68 0.00 -2.26 0.64 -2.24 -1.26 -3.54 114.28 110.30 1wgp n THR 35 Ca -0.13 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.25 1wgp n THR 35 Cb 0.44 -1.98 -0.03 0.00 -2.10 0.00 0.00 70.33 66.66 1wgp n THR 35 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1wgp s GLU 36 N -2.45 4.37 -0.83 -0.78 -1.05 -1.26 -2.71 118.70 113.99 1wgp s GLU 36 Ca 0.00 2.01 -0.00 0.00 -0.15 0.00 0.00 54.97 56.83 1wgp s GLU 36 Cb 0.00 -3.02 0.00 0.00 -0.44 0.00 0.00 34.13 30.67 1wgp s GLU 36 CO 0.00 -0.10 0.00 1.63 0.95 0.00 0.00 175.26 177.75 1wgp n LYS 37 N 0.76 -0.80 -3.46 -4.83 5.02 -1.12 -4.99 118.16 108.74 1wgp n LYS 37 Ca 0.01 0.47 -0.39 0.00 -2.02 0.00 0.00 58.31 56.38 1wgp n LYS 37 Cb 0.44 -4.51 -0.09 0.00 -0.02 0.00 0.00 35.03 30.85 1wgp n LYS 37 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1wgp s SER 38 N -2.57 6.20 -0.45 4.39 0.01 -1.10 -4.92 113.70 115.26 1wgp s SER 38 Ca 0.00 0.22 -0.13 0.00 1.31 0.00 0.00 55.95 57.35 1wgp s SER 38 Cb -0.00 -2.18 0.07 0.00 0.21 0.00 0.00 66.02 64.12 1wgp s SER 38 CO 0.00 -0.12 0.34 -0.31 0.41 0.00 0.00 173.24 173.56 1wgp s TYR 39 N 1.84 3.28 0.02 2.43 1.51 -1.26 -0.95 117.35 124.22 1wgp s TYR 39 Ca 0.13 -1.13 -0.27 0.00 -1.01 0.00 0.00 57.07 54.78 1wgp s TYR 39 Cb -0.16 -3.06 -0.16 0.00 -0.11 0.00 0.00 41.96 38.47 1wgp s TYR 39 CO 0.10 -0.81 1.18 -0.07 -1.11 0.00 0.00 175.55 174.84 1wgp h LEU 40 N 8.62 -0.74 -8.32 -1.29 4.07 -1.96 -3.46 115.31 112.23 1wgp h LEU 40 Ca -0.26 -0.01 -0.28 0.00 0.08 0.00 0.00 57.88 57.41 1wgp h LEU 40 Cb 1.10 0.19 -0.19 0.00 1.08 0.00 0.00 40.66 42.85 1wgp h LEU 40 CO 0.83 -0.38 -0.73 0.68 -1.08 0.00 0.00 178.44 177.77 1wgp s VAL 41 N -4.82 0.71 0.24 1.22 -7.23 -1.26 -4.99 120.40 104.27 1wgp s VAL 41 Ca -0.15 -1.47 0.03 0.00 -1.81 0.00 0.00 61.98 58.58 1wgp s VAL 41 Cb 0.02 -1.12 -0.05 0.00 0.56 0.00 0.00 36.38 35.79 1wgp s VAL 41 CO 0.47 -0.56 0.03 -0.60 -0.31 0.00 0.00 175.10 174.13 1wgp s ARG 42 N -2.52 1.37 -0.54 4.82 3.52 -1.24 -2.51 118.95 121.85 1wgp s ARG 42 Ca 0.00 -1.71 -0.19 0.00 -0.13 0.00 0.00 55.73 53.70 1wgp s ARG 42 Cb -0.04 -0.50 0.08 0.00 -1.56 0.00 0.00 34.95 32.93 1wgp s ARG 42 CO -0.01 -0.17 0.65 -2.00 -0.81 0.00 0.00 175.30 172.95 1wgp s GLU 43 N -3.92 3.09 0.00 5.12 -6.30 -1.26 -3.83 118.70 111.60 1wgp s GLU 43 Ca 0.32 -1.07 0.00 0.00 -2.50 0.00 0.00 54.97 51.72 1wgp s GLU 43 Cb 0.07 -4.16 0.00 0.00 0.00 0.00 0.00 34.13 30.03 1wgp s GLU 43 CO 0.10 -1.33 0.00 0.41 0.02 0.00 0.00 175.26 174.46 1wgp n GLY 44 N 5.21 1.61 3.83 -1.50 0.00 -1.25 -5.00 105.19 108.10 1wgp n GLY 44 Ca -0.08 -0.45 -0.33 0.00 0.00 0.00 0.00 46.02 45.16 1wgp n GLY 44 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1wgp s ASP 45 N -0.54 6.53 0.91 1.61 -4.77 -1.26 -4.92 116.67 114.24 1wgp s ASP 45 Ca 0.00 1.67 -0.12 0.00 -3.30 0.00 0.00 52.55 50.80 1wgp s ASP 45 Cb 0.00 -2.52 0.14 0.00 -1.09 0.00 0.00 42.92 39.44 1wgp s ASP 45 CO 0.00 -0.65 1.14 -2.16 0.70 0.00 0.00 175.17 174.20 1wgp s PRO 46 N -3.80 1.14 -0.33 2.11 0.04 -1.26 -3.34 135.00 129.56 1wgp s PRO 46 Ca 0.61 0.29 0.01 0.00 0.04 0.00 0.00 61.00 61.95 1wgp s PRO 46 Cb -0.11 -1.84 0.09 0.00 0.04 0.00 0.00 34.50 32.67 1wgp s PRO 46 CO 0.27 -2.20 0.05 0.08 0.04 0.00 0.00 177.00 175.24 1wgp s VAL 47 N -3.28 2.64 -0.05 -0.36 1.01 0.49 -4.80 120.40 116.05 1wgp s VAL 47 Ca 0.64 -1.96 -0.23 0.00 0.00 0.00 0.00 61.98 60.43 1wgp s VAL 47 Cb -0.15 -2.76 -0.28 0.00 0.00 0.00 0.00 36.38 33.19 1wgp s VAL 47 CO 0.53 -0.42 0.92 -1.13 0.00 0.00 0.00 175.10 175.00 1wgp h ASN 48 N 7.82 0.38 -4.93 3.32 -0.73 -1.95 -3.39 115.58 116.10 1wgp h ASN 48 Ca -0.12 -0.91 -0.17 0.00 1.87 0.00 0.00 56.30 56.97 1wgp h ASN 48 Cb 1.04 -0.12 -0.21 0.00 0.27 0.00 0.00 38.32 39.29 1wgp h ASN 48 CO 0.55 1.26 -0.68 -1.83 -0.37 0.00 0.00 177.43 176.37 1wgp s GLU 49 N -2.60 0.32 0.11 6.67 1.03 -1.26 -2.46 118.70 120.51 1wgp s GLU 49 Ca -0.15 -0.56 -0.06 0.00 0.03 0.00 0.00 54.97 54.24 1wgp s GLU 49 Cb 0.01 0.12 -0.05 0.00 -0.80 0.00 0.00 34.13 33.40 1wgp s GLU 49 CO 0.80 -0.06 0.35 1.41 -1.33 0.00 0.00 175.26 176.44 1wgp s MET 50 N -1.39 3.63 -0.22 -4.83 1.75 0.52 -4.83 119.30 113.93 1wgp s MET 50 Ca -0.15 -0.06 -0.00 0.00 -1.25 0.00 0.00 55.69 54.22 1wgp s MET 50 Cb -0.09 -2.92 0.02 0.00 2.84 0.00 0.00 34.83 34.68 1wgp s MET 50 CO -0.01 0.52 -0.12 -0.51 -0.65 0.00 0.00 175.02 174.25 1wgp s LEU 51 N -2.39 2.72 -0.57 4.11 2.01 -1.26 0.51 118.68 123.81 1wgp s LEU 51 Ca 0.37 -0.74 -0.19 0.00 0.01 0.00 0.00 54.13 53.58 1wgp s LEU 51 Cb -0.13 -1.59 0.09 0.00 0.01 0.00 0.00 46.19 44.57 1wgp s LEU 51 CO 0.22 -0.06 0.70 -0.36 1.01 0.00 0.00 176.35 177.86 1wgp s PHE 52 N 1.32 2.99 0.00 0.29 0.08 -1.00 -3.63 117.98 118.03 1wgp s PHE 52 Ca 0.02 -0.80 -0.32 0.00 0.12 0.00 0.00 56.93 55.96 1wgp s PHE 52 Cb -0.15 -3.88 -0.10 0.00 -0.57 0.00 0.00 43.02 38.31 1wgp s PHE 52 CO -0.08 -1.24 1.92 -0.89 -0.10 0.00 0.00 175.22 174.83 1wgp n ILE 53 N 5.60 0.64 -0.11 0.64 2.08 -1.26 -3.61 119.36 123.34 1wgp n ILE 53 Ca -0.08 -0.12 -0.20 0.00 0.56 0.00 0.00 62.75 62.92 1wgp n ILE 53 Cb 0.44 -2.11 -0.07 0.00 -0.75 0.00 0.00 39.64 37.15 1wgp n ILE 53 CO 0.00 0.00 0.00 -0.38 0.56 0.00 0.00 176.55 176.73 1wgp n ILE 54 N 5.26 1.51 -3.64 1.39 2.08 -1.18 -3.04 119.36 121.74 1wgp n ILE 54 Ca 0.21 -0.12 -0.05 0.00 0.56 0.00 0.00 62.75 63.35 1wgp n ILE 54 Cb 0.36 -2.11 -0.06 0.00 -0.75 0.00 0.00 39.64 37.08 1wgp n ILE 54 CO 0.00 0.00 0.00 -0.60 0.56 0.00 0.00 176.55 176.51 1wgp s ARG 55 N -2.65 0.65 0.00 0.38 3.00 -0.96 -2.77 118.95 116.61 1wgp s ARG 55 Ca -0.33 1.23 0.00 0.00 -1.00 0.00 0.00 55.73 55.63 1wgp s ARG 55 Cb 0.09 0.30 0.00 0.00 0.00 0.00 0.00 34.95 35.34 1wgp s ARG 55 CO 0.46 -0.15 0.00 0.41 0.00 0.00 0.00 175.30 176.01 1wgp n GLY 56 N 4.53 -0.32 3.29 8.12 0.00 -1.26 -2.27 105.19 117.28 1wgp n GLY 56 Ca -0.18 -0.89 -0.14 0.00 0.00 0.00 0.00 46.02 44.82 1wgp n GLY 56 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1wgp s ARG 57 N -2.00 0.64 0.25 1.61 6.06 -1.26 -4.86 118.95 119.39 1wgp s ARG 57 Ca 0.00 0.10 -0.07 0.00 -2.50 0.00 0.00 55.73 53.26 1wgp s ARG 57 Cb 0.00 0.30 -0.01 0.00 0.06 0.00 0.00 34.95 35.29 1wgp s ARG 57 CO 0.00 -0.16 0.37 -0.51 -2.50 0.00 0.00 175.30 172.50 1wgp s LEU 58 N -0.80 0.71 -0.11 -0.88 1.02 -1.26 -4.37 118.68 112.99 1wgp s LEU 58 Ca -0.09 -1.18 0.01 0.00 0.02 0.00 0.00 54.13 52.90 1wgp s LEU 58 Cb -0.04 1.27 0.02 0.00 0.02 0.00 0.00 46.19 47.46 1wgp s LEU 58 CO 0.04 -1.07 -0.15 -1.83 0.02 0.00 0.00 176.35 173.36 1wgp s GLU 59 N -3.90 2.21 -0.15 1.70 -1.05 -1.07 -3.85 118.70 112.59 1wgp s GLU 59 Ca 0.29 -0.55 -0.11 0.00 -0.15 0.00 0.00 54.97 54.44 1wgp s GLU 59 Cb 0.02 -1.91 -0.05 0.00 -0.44 0.00 0.00 34.13 31.75 1wgp s GLU 59 CO 0.12 -0.09 0.22 0.45 0.95 0.00 0.00 175.26 176.91 1wgp s SER 60 N 1.07 6.38 0.06 0.83 0.15 0.48 -2.58 113.70 120.11 1wgp s SER 60 Ca -0.05 0.44 0.01 0.00 0.70 0.00 0.00 55.95 57.06 1wgp s SER 60 Cb -0.15 -2.14 -0.03 0.00 -1.71 0.00 0.00 66.02 61.99 1wgp s SER 60 CO -0.03 0.20 -0.06 -0.69 1.20 0.00 0.00 173.24 173.85 1wgp s VAL 61 N 0.06 0.53 0.01 4.45 1.01 -0.90 0.15 120.40 125.71 1wgp s VAL 61 Ca 0.14 -1.50 0.02 0.00 0.00 0.00 0.00 61.98 60.64 1wgp s VAL 61 Cb -0.12 -1.13 -0.01 0.00 0.00 0.00 0.00 36.38 35.12 1wgp s VAL 61 CO 0.03 -0.66 -0.07 0.28 0.00 0.00 0.00 175.10 174.67 1wgp s THR 62 N -2.60 0.52 -0.41 3.92 -1.32 -1.18 -2.37 115.64 112.21 1wgp s THR 62 Ca 0.00 -0.47 0.05 0.00 -1.21 0.00 0.00 61.69 60.06 1wgp s THR 62 Cb -0.02 -0.48 0.31 0.00 -1.51 0.00 0.00 72.50 70.80 1wgp s THR 62 CO -0.03 0.02 1.20 1.07 -2.21 0.00 0.00 174.62 174.67 1wgp n THR 63 N 2.56 0.00 -1.23 5.08 5.66 -1.26 -3.39 114.28 121.70 1wgp n THR 63 Ca -0.15 -1.16 -0.36 0.00 -3.05 0.00 0.00 64.05 59.33 1wgp n THR 63 Cb 0.57 1.33 0.08 0.00 -1.55 0.00 0.00 70.33 70.75 1wgp n THR 63 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1wgp n ASP 64 N 0.63 -1.08 -4.95 1.09 2.03 -1.26 -4.99 116.55 108.03 1wgp n ASP 64 Ca 0.02 0.58 -0.21 0.00 0.52 0.00 0.00 54.79 55.70 1wgp n ASP 64 Cb 0.71 -1.24 -0.02 0.00 -0.72 0.00 0.00 41.12 39.85 1wgp n ASP 64 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1wgp s GLY 65 N -1.53 1.30 0.00 0.27 0.00 -1.26 -4.42 107.32 101.68 1wgp s GLY 65 Ca 0.66 -1.30 0.00 0.00 0.00 0.00 0.00 44.72 44.08 1wgp s GLY 65 CO 0.58 -1.30 0.00 0.61 0.00 0.00 0.00 173.10 172.98 1wgp n GLY 66 N -1.41 2.75 2.82 0.20 0.00 -1.26 -4.83 105.19 103.46 1wgp n GLY 66 Ca -0.07 -0.66 -0.14 0.00 0.00 0.00 0.00 46.02 45.14 1wgp n GLY 66 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wgp s ARG 67 N 0.00 0.46 0.23 1.61 1.81 -1.26 -5.14 118.95 116.66 1wgp s ARG 67 Ca 0.00 -0.26 -0.10 0.00 -1.72 0.00 0.00 55.73 53.64 1wgp s ARG 67 Cb 0.00 -0.54 -0.01 0.00 -0.45 0.00 0.00 34.95 33.95 1wgp s ARG 67 CO 0.00 -1.08 0.40 0.45 -0.68 0.00 0.00 175.30 174.39 1wgp s SER 68 N 2.14 -0.04 0.00 0.23 0.15 -1.26 -4.95 113.70 109.97 1wgp s SER 68 Ca 0.12 -1.01 0.00 0.00 0.70 0.00 0.00 55.95 55.76 1wgp s SER 68 Cb -0.13 0.54 0.00 0.00 -1.71 0.00 0.00 66.02 64.72 1wgp s SER 68 CO -0.23 -1.07 0.00 0.61 1.20 0.00 0.00 173.24 173.75 1wgp n GLY 69 N -0.35 1.42 3.92 9.45 0.00 -1.26 -5.13 105.19 113.24 1wgp n GLY 69 Ca -0.01 -0.14 -0.26 0.00 0.00 0.00 0.00 46.02 45.60 1wgp n GLY 69 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wgp s PHE 70 N 0.93 3.18 -0.28 1.61 0.08 -1.26 -5.05 117.98 117.19 1wgp s PHE 70 Ca 0.00 0.60 -0.15 0.00 0.12 0.00 0.00 56.93 57.49 1wgp s PHE 70 Cb 0.00 -2.83 -0.03 0.00 -0.57 0.00 0.00 43.02 39.58 1wgp s PHE 70 CO 0.00 -0.95 0.38 0.71 -0.10 0.00 0.00 175.22 175.27 1wgp s TYR 71 N -3.04 3.24 -0.75 0.36 1.51 -1.26 -4.90 117.35 112.51 1wgp s TYR 71 Ca 0.55 0.39 -0.23 0.00 -1.01 0.00 0.00 57.07 56.77 1wgp s TYR 71 Cb -0.11 -2.60 0.07 0.00 -0.11 0.00 0.00 41.96 39.21 1wgp s TYR 71 CO 0.45 -0.25 1.11 1.21 -1.11 0.00 0.00 175.55 176.96 1wgp s ASN 72 N 1.64 6.26 0.47 2.29 3.84 -1.22 -4.93 114.94 123.29 1wgp s ASN 72 Ca 0.15 -1.05 -0.21 0.00 0.21 0.00 0.00 52.86 51.97 1wgp s ASN 72 Cb -0.16 -2.47 -0.09 0.00 -0.55 0.00 0.00 41.25 37.98 1wgp s ASN 72 CO 0.10 -1.50 1.01 -0.60 -2.79 0.00 0.00 177.10 173.33 1wgp s ARG 73 N 4.38 3.93 0.30 0.43 3.52 -1.26 -3.08 118.95 127.17 1wgp s ARG 73 Ca 0.29 1.30 -0.12 0.00 -0.13 0.00 0.00 55.73 57.07 1wgp s ARG 73 Cb -0.11 -2.14 0.01 0.00 -1.56 0.00 0.00 34.95 31.15 1wgp s ARG 73 CO 0.07 -0.31 0.58 -1.54 -0.81 0.00 0.00 175.30 173.29 1wgp s SER 74 N -2.01 0.13 0.08 -2.12 1.04 0.39 -4.97 113.70 106.24 1wgp s SER 74 Ca 0.65 -1.05 0.03 0.00 0.48 0.00 0.00 55.95 56.06 1wgp s SER 74 Cb -0.15 0.68 -0.03 0.00 0.10 0.00 0.00 66.02 66.62 1wgp s SER 74 CO 0.18 -1.33 -0.08 -0.22 0.98 0.00 0.00 173.24 172.77 1wgp s LEU 75 N -3.06 2.39 0.25 2.42 2.96 -1.26 -0.38 118.68 121.99 1wgp s LEU 75 Ca 0.21 -0.78 0.12 0.00 -0.22 0.00 0.00 54.13 53.45 1wgp s LEU 75 Cb -0.02 -0.18 -0.05 0.00 0.50 0.00 0.00 46.19 46.44 1wgp s LEU 75 CO 0.12 -0.31 -0.19 -0.76 -1.32 0.00 0.00 176.35 173.89 1wgp s LEU 76 N -2.33 2.61 0.00 -0.68 1.43 -1.25 -4.84 118.68 113.62 1wgp s LEU 76 Ca 0.02 -0.94 0.00 0.00 -1.03 0.00 0.00 54.13 52.18 1wgp s LEU 76 Cb -0.03 -1.19 -0.00 0.00 0.03 0.00 0.00 46.19 45.01 1wgp s LEU 76 CO -0.01 0.06 0.01 2.29 0.23 0.00 0.00 176.35 178.92 1wgp n LYS 77 N -0.40 1.50 -2.22 1.70 2.85 -1.26 -4.56 118.16 115.77 1wgp n LYS 77 Ca -0.07 -0.81 -0.42 0.00 -1.05 0.00 0.00 58.31 55.95 1wgp n LYS 77 Cb 0.59 0.27 -0.03 0.00 -0.65 0.00 0.00 35.03 35.22 1wgp n LYS 77 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 177.40 175.52 1wgp s GLU 78 N -2.39 4.23 0.00 -1.58 -1.05 -1.26 -2.81 118.70 113.84 1wgp s GLU 78 Ca 0.01 1.94 0.00 0.00 -0.15 0.00 0.00 54.97 56.77 1wgp s GLU 78 Cb 0.00 -3.77 0.00 0.00 -0.44 0.00 0.00 34.13 29.92 1wgp s GLU 78 CO 0.01 -0.70 0.00 0.41 0.95 0.00 0.00 175.26 175.93 1wgp n GLY 79 N 3.79 0.81 3.76 -3.83 0.00 -1.26 -4.71 105.19 103.75 1wgp n GLY 79 Ca 0.15 -0.06 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 1wgp n GLY 79 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1wgp s ASP 80 N -0.74 7.29 0.25 1.61 2.15 -1.12 -4.75 116.67 121.35 1wgp s ASP 80 Ca 0.00 2.22 0.00 0.00 0.43 0.00 0.00 52.55 55.20 1wgp s ASP 80 Cb 0.00 -2.62 0.00 0.00 -0.30 0.00 0.00 42.92 40.00 1wgp s ASP 80 CO 0.00 -0.13 0.01 2.22 -0.17 0.00 0.00 175.17 177.11 1wgp n PHE 81 N 1.15 0.46 -4.28 -5.34 1.16 -1.26 -4.29 117.46 105.05 1wgp n PHE 81 Ca -0.01 -1.20 -0.15 0.00 -1.87 0.00 0.00 57.45 54.22 1wgp n PHE 81 Cb 0.45 -0.17 -0.10 0.00 -1.61 0.00 0.00 39.48 38.06 1wgp n PHE 81 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1wgp n GLY 83 N -0.30 -0.35 0.37 0.00 0.00 -1.26 -4.40 105.19 99.25 1wgp n GLY 83 Ca -0.07 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1wgp n GLY 83 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1wgp h ASP 84 N -0.80 1.07 -0.87 1.61 2.03 -1.97 -0.45 116.42 117.04 1wgp h ASP 84 Ca -0.54 -0.01 0.25 0.00 -0.73 0.00 0.00 57.03 56.01 1wgp h ASP 84 Cb 1.24 -0.24 -0.03 0.00 -0.83 0.00 0.00 39.33 39.46 1wgp h ASP 84 CO 0.80 0.73 0.96 -0.33 -1.03 0.00 0.00 179.24 180.37 1wgp h GLU 85 N 1.24 0.00 -0.40 4.15 4.39 -1.95 1.09 114.58 123.10 1wgp h GLU 85 Ca 0.40 0.00 0.01 0.00 0.34 0.00 0.00 59.36 60.10 1wgp h GLU 85 Cb 0.01 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 1wgp h GLU 85 CO -0.13 0.00 0.26 1.25 -1.16 0.00 0.00 179.01 179.24 1wgp h LEU 86 N 0.00 0.45 -0.53 1.33 5.85 -1.42 0.18 115.31 121.18 1wgp h LEU 86 Ca 0.41 -0.01 0.11 0.00 0.84 0.00 0.00 57.88 59.23 1wgp h LEU 86 Cb 2.33 -0.11 -0.10 0.00 0.37 0.00 0.00 40.66 43.14 1wgp h LEU 86 CO -0.00 0.33 -0.14 0.25 -0.34 0.00 0.00 178.44 178.53 1wgp h LEU 87 N 0.54 -0.53 -0.62 2.25 5.85 0.11 0.18 115.31 123.09 1wgp h LEU 87 Ca 0.15 0.16 -0.09 0.00 0.84 0.00 0.00 57.88 58.94 1wgp h LEU 87 Cb -0.06 0.34 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1wgp h LEU 87 CO -0.04 -0.19 0.03 0.74 -0.34 0.00 0.00 178.44 178.65 1wgp h THR 88 N -0.02 1.27 -0.18 1.05 2.02 -1.46 0.06 112.91 115.65 1wgp h THR 88 Ca 0.25 -1.12 0.05 0.00 0.77 0.00 0.00 66.41 66.36 1wgp h THR 88 Cb 0.40 0.75 -0.07 0.00 -1.74 0.00 0.00 68.15 67.50 1wgp h THR 88 CO -0.55 0.41 -0.28 -0.25 0.37 0.00 0.00 175.52 175.22 1wgp h TRP 89 N 0.99 -0.77 -0.13 3.16 7.01 0.18 1.10 115.95 127.49 1wgp h TRP 89 Ca 0.18 0.04 -0.05 0.00 2.11 0.00 0.00 58.89 61.17 1wgp h TRP 89 Cb 0.53 0.37 -0.01 0.00 -2.10 0.00 0.00 29.16 27.94 1wgp h TRP 89 CO 0.04 -0.36 -0.16 0.00 -2.79 0.00 0.00 178.44 175.17 1wgp h ALA 90 N 0.59 1.50 -0.02 2.65 0.00 -0.59 0.88 119.26 124.26 1wgp h ALA 90 Ca 0.11 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1wgp h ALA 90 Cb 0.50 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1wgp h ALA 90 CO -0.36 0.36 0.00 1.28 0.00 0.00 0.00 179.25 180.53 1wgp n LEU 91 N -4.26 0.29 -3.66 0.00 4.32 0.75 -4.41 117.00 110.02 1wgp n LEU 91 Ca -0.01 -0.12 -0.30 0.00 -0.02 0.00 0.00 56.01 55.57 1wgp n LEU 91 Cb 0.28 -0.01 -0.14 0.00 -1.62 0.00 0.00 43.42 41.92 1wgp n LEU 91 CO 0.38 0.06 -0.32 -0.62 -1.22 0.00 0.00 177.39 175.67 1wgp s ASP 92 N -1.66 3.77 0.28 -1.43 -1.08 0.35 -4.97 116.67 111.93 1wgp s ASP 92 Ca 0.32 -1.79 0.14 0.00 -0.52 0.00 0.00 52.55 50.70 1wgp s ASP 92 Cb 0.15 -0.75 0.32 0.00 -1.46 0.00 0.00 42.92 41.19 1wgp s ASP 92 CO 0.25 -0.39 1.57 1.55 0.52 0.00 0.00 175.17 178.67 1wgp h PRO 93 N 7.82 0.00 0.00 4.34 0.13 -1.77 -2.97 132.00 139.55 1wgp h PRO 93 Ca -0.11 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.00 1wgp h PRO 93 Cb 1.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.12 1wgp h PRO 93 CO 0.44 0.58 -0.12 0.87 -0.23 0.00 0.00 178.00 179.54 1wgp h LYS 94 N 0.00 0.00 -7.38 0.86 1.79 -1.93 -3.43 116.57 106.48 1wgp h LYS 94 Ca -0.01 0.00 -0.45 0.00 -2.18 0.00 0.00 60.65 58.01 1wgp h LYS 94 Cb 1.20 0.00 0.16 0.00 -1.58 0.00 0.00 32.23 32.00 1wgp h LYS 94 CO 0.08 0.12 0.20 -1.12 -1.08 0.00 0.00 179.45 177.65 1wgp s SER 95 N -7.01 2.61 0.00 0.86 0.01 -1.12 -4.98 113.70 104.06 1wgp s SER 95 Ca -0.04 1.10 0.00 0.00 1.31 0.00 0.00 55.95 58.32 1wgp s SER 95 Cb 0.16 -1.73 0.00 0.00 0.21 0.00 0.00 66.02 64.66 1wgp s SER 95 CO 0.69 -3.13 0.00 0.61 0.41 0.00 0.00 173.24 171.82 1wgp n GLY 96 N -1.27 -0.60 4.16 3.44 0.00 -1.26 -5.03 105.19 104.64 1wgp n GLY 96 Ca 0.05 0.63 -0.32 0.00 0.00 0.00 0.00 46.02 46.39 1wgp n GLY 96 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wgp n SER 97 N 0.00 -1.32 -0.58 1.61 7.64 -1.26 -4.48 113.62 115.23 1wgp n SER 97 Ca 0.00 -1.07 0.08 0.00 1.01 0.00 0.00 58.87 58.88 1wgp n SER 97 Cb 0.00 -2.58 -0.02 0.00 -1.01 0.00 0.00 64.21 60.59 1wgp n SER 97 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1wgp n ASN 98 N -2.81 -3.46 -4.57 6.43 5.15 -1.26 -4.86 115.26 109.88 1wgp n ASN 98 Ca -0.14 0.31 -0.34 0.00 -0.60 0.00 0.00 54.58 53.82 1wgp n ASN 98 Cb 0.60 -1.81 0.12 0.00 -0.53 0.00 0.00 39.78 38.16 1wgp n ASN 98 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1wgp n LEU 99 N -2.72 2.32 -4.81 1.20 4.77 -1.26 -4.97 117.00 111.53 1wgp n LEU 99 Ca -0.01 0.50 -0.30 0.00 -0.03 0.00 0.00 56.01 56.17 1wgp n LEU 99 Cb 0.27 -1.36 0.08 0.00 -2.33 0.00 0.00 43.42 40.07 1wgp n LEU 99 CO 0.01 -2.56 0.71 -2.16 -1.33 0.00 0.00 177.39 172.06 1wgp s PRO 100 N -3.76 2.29 -0.09 3.23 0.04 -1.26 -4.64 135.00 130.81 1wgp s PRO 100 Ca 0.67 0.71 0.04 0.00 0.04 0.00 0.00 61.00 62.46 1wgp s PRO 100 Cb -0.28 -1.94 -0.00 0.00 0.04 0.00 0.00 34.50 32.33 1wgp s PRO 100 CO 0.57 -1.49 -0.24 -1.12 0.04 0.00 0.00 177.00 174.77 1wgp s SER 101 N -3.88 3.03 0.83 6.66 0.01 -1.26 0.18 113.70 119.27 1wgp s SER 101 Ca 0.60 -0.54 -0.10 0.00 1.31 0.00 0.00 55.95 57.21 1wgp s SER 101 Cb -0.14 -1.31 0.09 0.00 0.21 0.00 0.00 66.02 64.87 1wgp s SER 101 CO 0.54 0.17 1.12 -0.55 0.41 0.00 0.00 173.24 174.93 1wgp s SER 102 N 0.29 3.87 -0.27 2.44 0.15 -1.21 -4.90 113.70 114.06 1wgp s SER 102 Ca -0.17 1.98 0.09 0.00 0.70 0.00 0.00 55.95 58.56 1wgp s SER 102 Cb -0.17 -2.54 0.47 0.00 -1.71 0.00 0.00 66.02 62.06 1wgp s SER 102 CO 0.08 -2.46 1.35 0.35 1.20 0.00 0.00 173.24 173.76 1wgp n THR 103 N -3.77 2.46 -3.57 6.45 -2.24 -1.26 -3.78 114.28 108.57 1wgp n THR 103 Ca 0.10 -3.18 -0.10 0.00 -2.27 0.00 0.00 64.05 58.60 1wgp n THR 103 Cb 0.53 -0.44 -0.04 0.00 -2.10 0.00 0.00 70.33 68.27 1wgp n THR 103 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wgp s ARG 104 N -3.32 0.62 0.15 -0.78 1.70 -1.26 -4.99 118.95 111.06 1wgp s ARG 104 Ca 0.44 0.06 0.06 0.00 -0.47 0.00 0.00 55.73 55.82 1wgp s ARG 104 Cb 0.40 0.29 -0.04 0.00 -0.57 0.00 0.00 34.95 35.03 1wgp s ARG 104 CO -0.02 -0.21 0.03 0.99 -1.08 0.00 0.00 175.30 175.00 1wgp s THR 105 N -1.50 3.97 -0.01 4.99 2.01 -1.00 -3.71 115.64 120.40 1wgp s THR 105 Ca -0.00 -1.23 -0.20 0.00 0.31 0.00 0.00 61.69 60.57 1wgp s THR 105 Cb -0.01 -2.98 0.04 0.00 0.01 0.00 0.00 72.50 69.57 1wgp s THR 105 CO -0.00 -0.05 0.44 -0.69 -0.69 0.00 0.00 174.62 173.62 1wgp s VAL 106 N -1.62 0.04 -0.02 3.82 1.01 -1.04 -2.12 120.40 120.47 1wgp s VAL 106 Ca 0.28 -0.35 -0.06 0.00 0.00 0.00 0.00 61.98 61.85 1wgp s VAL 106 Cb -0.10 -0.81 0.01 0.00 0.00 0.00 0.00 36.38 35.47 1wgp s VAL 106 CO 0.20 -0.19 0.14 -0.75 0.00 0.00 0.00 175.10 174.49 1wgp s LYS 107 N -1.64 0.36 -0.39 2.72 2.20 -1.06 -3.53 119.74 118.39 1wgp s LYS 107 Ca -0.10 -0.17 -0.23 0.00 -0.36 0.00 0.00 55.97 55.11 1wgp s LYS 107 Cb -0.03 0.15 0.01 0.00 -1.51 0.00 0.00 37.83 36.46 1wgp s LYS 107 CO 0.04 -0.08 0.77 0.00 -0.36 0.00 0.00 175.35 175.72 1wgp s ALA 108 N -0.82 3.38 -0.14 3.13 0.00 -0.12 -2.61 121.76 124.58 1wgp s ALA 108 Ca -0.09 -0.80 0.21 0.00 0.00 0.00 0.00 51.96 51.28 1wgp s ALA 108 Cb -0.05 -3.38 -0.17 0.00 0.00 0.00 0.00 23.12 19.52 1wgp s ALA 108 CO 0.01 -1.63 0.72 1.28 0.00 0.00 0.00 175.76 176.13 1wgp n LEU 109 N 6.49 0.49 -4.23 0.00 4.32 -1.26 -2.77 117.00 120.03 1wgp n LEU 109 Ca 0.02 0.20 -0.13 0.00 -0.02 0.00 0.00 56.01 56.08 1wgp n LEU 109 Cb 0.48 0.04 -0.10 0.00 -1.62 0.00 0.00 43.42 42.22 1wgp n LEU 109 CO 0.55 0.01 -0.25 0.28 -1.22 0.00 0.00 177.39 176.76 1wgp s THR 110 N -3.24 0.20 -0.23 -5.08 -1.32 -1.26 -4.93 115.64 99.77 1wgp s THR 110 Ca -0.04 -1.99 -0.33 0.00 -1.21 0.00 0.00 61.69 58.12 1wgp s THR 110 Cb 0.11 -2.49 -0.09 0.00 -1.51 0.00 0.00 72.50 68.52 1wgp s THR 110 CO 0.84 -0.06 2.12 1.21 -2.21 0.00 0.00 174.62 176.52 1wgp n GLU 111 N -0.31 1.69 -4.31 7.08 2.13 -1.26 -4.81 120.64 120.85 1wgp n GLU 111 Ca 0.00 0.52 -0.34 0.00 0.66 0.00 0.00 57.16 58.00 1wgp n GLU 111 Cb 0.66 -2.78 -0.09 0.00 0.27 0.00 0.00 31.44 29.50 1wgp n GLU 111 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1wgp s VAL 112 N 6.75 4.31 -0.23 6.31 1.01 -1.23 -4.62 120.40 132.69 1wgp s VAL 112 Ca 1.02 -0.39 0.01 0.00 0.00 0.00 0.00 61.98 62.62 1wgp s VAL 112 Cb -0.63 -2.87 0.06 0.00 0.00 0.00 0.00 36.38 32.93 1wgp s VAL 112 CO 0.45 0.49 -0.07 -1.61 0.00 0.00 0.00 175.10 174.36 1wgp s GLU 113 N -1.23 1.83 0.33 2.72 8.01 -0.96 -3.67 118.70 125.73 1wgp s GLU 113 Ca 0.17 -1.03 -0.18 0.00 0.01 0.00 0.00 54.97 53.93 1wgp s GLU 113 Cb -0.11 -2.61 0.04 0.00 -4.31 0.00 0.00 34.13 27.13 1wgp s GLU 113 CO 0.07 -0.56 0.77 0.00 0.01 0.00 0.00 175.26 175.55 1wgp s ALA 114 N 1.34 -0.99 0.35 5.21 0.00 -1.26 -2.26 121.76 124.15 1wgp s ALA 114 Ca -0.06 -0.53 0.08 0.00 0.00 0.00 0.00 51.96 51.45 1wgp s ALA 114 Cb -0.19 0.75 -0.04 0.00 0.00 0.00 0.00 23.12 23.65 1wgp s ALA 114 CO -0.06 -1.01 0.20 -0.06 0.00 0.00 0.00 175.76 174.82 1wgp s PHE 115 N -3.00 2.73 0.20 0.00 0.40 -1.24 -3.96 117.98 113.11 1wgp s PHE 115 Ca 0.14 -0.40 0.07 0.00 -0.60 0.00 0.00 56.93 56.14 1wgp s PHE 115 Cb -0.05 -1.76 -0.04 0.00 0.51 0.00 0.00 43.02 41.68 1wgp s PHE 115 CO 0.09 0.25 0.03 0.00 0.70 0.00 0.00 175.22 176.29 1wgp s ALA 116 N -2.43 3.27 -0.06 5.36 0.00 -1.10 -2.36 121.76 124.44 1wgp s ALA 116 Ca 0.40 -1.41 -0.03 0.00 0.00 0.00 0.00 51.96 50.92 1wgp s ALA 116 Cb -0.02 -1.02 0.04 0.00 0.00 0.00 0.00 23.12 22.11 1wgp s ALA 116 CO 0.24 0.42 0.11 -1.17 0.00 0.00 0.00 175.76 175.36 1wgp s LEU 117 N -3.19 0.03 0.21 0.00 1.98 0.18 -2.80 118.68 115.10 1wgp s LEU 117 Ca 0.29 0.21 -0.21 0.00 -2.89 0.00 0.00 54.13 51.53 1wgp s LEU 117 Cb -0.09 0.07 -0.08 0.00 0.66 0.00 0.00 46.19 46.76 1wgp s LEU 117 CO 0.20 -0.25 0.74 -0.51 -1.89 0.00 0.00 176.35 174.64 1wgp s ILE 118 N 2.23 4.51 0.05 6.68 2.07 -1.26 0.19 121.20 135.67 1wgp s ILE 118 Ca 0.04 1.41 -0.25 0.00 -1.41 0.00 0.00 60.65 60.43 1wgp s ILE 118 Cb -0.12 -3.93 -0.17 0.00 0.13 0.00 0.00 42.46 38.37 1wgp s ILE 118 CO -0.04 0.29 1.55 0.00 -1.91 0.00 0.00 174.94 174.82 1wgp h ALA 119 N 3.66 -0.20 -0.08 1.50 0.00 -1.83 -1.32 119.26 120.99 1wgp h ALA 119 Ca -0.48 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.33 1wgp h ALA 119 Cb 1.20 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 1wgp h ALA 119 CO 0.65 -0.53 -0.05 -0.44 0.00 0.00 0.00 179.25 178.88 1wgp h ASP 120 N -0.35 -0.17 -0.91 0.00 5.19 -1.94 1.82 116.42 120.06 1wgp h ASP 120 Ca -0.02 0.03 0.22 0.00 -0.62 0.00 0.00 57.03 56.63 1wgp h ASP 120 Cb 0.28 0.08 -0.06 0.00 0.18 0.00 0.00 39.33 39.80 1wgp h ASP 120 CO 0.03 -0.02 0.61 -0.33 -3.12 0.00 0.00 179.24 176.41 1wgp h GLU 121 N -0.00 0.31 0.03 3.56 4.39 -1.98 0.97 114.58 121.87 1wgp h GLU 121 Ca 0.01 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 1wgp h GLU 121 Cb 0.03 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 1wgp h GLU 121 CO -0.07 0.21 -0.01 1.25 -1.16 0.00 0.00 179.01 179.22 1wgp h LEU 122 N 0.32 -0.03 -0.95 1.33 6.46 0.22 -1.75 115.31 120.91 1wgp h LEU 122 Ca 0.47 0.00 0.27 0.00 -0.12 0.00 0.00 57.88 58.50 1wgp h LEU 122 Cb 1.30 0.01 -0.17 0.00 -0.73 0.00 0.00 40.66 41.07 1wgp h LEU 122 CO -0.15 -0.02 0.11 0.50 -0.62 0.00 0.00 178.44 178.26 1wgp h LYS 123 N -0.05 0.05 0.00 1.25 3.64 0.27 0.56 116.57 122.29 1wgp h LYS 123 Ca -0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1wgp h LYS 123 Cb 0.03 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1wgp h LYS 123 CO 0.01 0.04 0.00 0.34 -2.27 0.00 0.00 179.45 177.56 1wgp n PHE 124 N -5.41 0.00 -0.34 1.91 7.35 0.30 0.19 117.46 121.45 1wgp n PHE 124 Ca 0.23 0.00 0.18 0.00 -0.76 0.00 0.00 57.45 57.11 1wgp n PHE 124 Cb 0.77 -0.37 0.41 0.00 0.35 0.00 0.00 39.48 40.63 1wgp n PHE 124 CO 0.00 0.00 0.00 -0.24 -0.76 0.00 0.00 176.76 175.76 1wgp h VAL 125 N 0.00 0.54 0.26 -2.13 3.04 -0.34 1.39 116.25 119.02 1wgp h VAL 125 Ca 0.00 -0.19 -0.01 0.00 -1.01 0.00 0.00 66.70 65.49 1wgp h VAL 125 Cb 0.00 -0.06 0.00 0.00 -2.01 0.00 0.00 31.29 29.22 1wgp h VAL 125 CO 0.00 0.10 -0.12 0.00 -1.01 0.00 0.00 177.57 176.54 1wgp h ALA 126 N 1.71 -0.34 0.03 3.17 0.00 0.67 -2.31 119.26 122.19 1wgp h ALA 126 Ca 0.63 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.46 1wgp h ALA 126 Cb 1.26 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1wgp h ALA 126 CO -0.44 -0.68 -0.02 1.03 0.00 0.00 0.00 179.25 179.14 1wgp h SER 127 N -0.36 -0.04 -0.94 0.00 0.87 0.52 0.63 113.55 114.23 1wgp h SER 127 Ca -0.04 -0.24 0.24 0.00 -1.23 0.00 0.00 61.79 60.52 1wgp h SER 127 Cb 0.28 0.01 -0.18 0.00 -0.44 0.00 0.00 62.40 62.07 1wgp h SER 127 CO 0.06 0.22 -0.05 0.00 -0.53 0.00 0.00 176.83 176.54 1wgp n GLN 128 N -4.99 -0.08 0.05 2.24 1.13 0.45 0.37 117.38 116.55 1wgp n GLN 128 Ca -0.08 1.43 -0.20 0.00 -1.94 0.00 0.00 57.00 56.21 1wgp n GLN 128 Cb 0.16 -2.23 -0.13 0.00 0.11 0.00 0.00 30.24 28.15 1wgp n GLN 128 CO 0.00 0.00 0.00 0.35 -1.44 0.00 0.00 177.06 175.97 1wgp h PHE 129 N 0.00 0.70 -3.30 1.08 3.57 -1.26 -3.46 116.94 114.27 1wgp h PHE 129 Ca 0.54 -0.45 -0.58 0.00 3.53 0.00 0.00 57.97 61.02 1wgp h PHE 129 Cb 1.05 -0.05 0.15 0.00 2.79 0.00 0.00 35.95 39.88 1wgp h PHE 129 CO -0.54 1.31 0.12 -2.13 -2.23 0.00 0.00 178.31 174.84 1wgp n ARG 130 N -4.06 1.13 0.03 1.11 0.63 0.16 -4.93 116.66 110.74 1wgp n ARG 130 Ca -0.13 0.42 0.00 0.00 -0.92 0.00 0.00 57.85 57.22 1wgp n ARG 130 Cb 0.82 -2.09 0.00 0.00 0.45 0.00 0.00 32.46 31.65 1wgp n ARG 130 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1wgp n ARG 131 N -0.35 0.00 0.00 -0.14 1.74 -1.26 -4.88 116.66 111.77 1wgp n ARG 131 Ca 0.11 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.19 1wgp n ARG 131 Cb 0.43 -0.31 0.00 0.00 -1.02 0.00 0.00 32.46 31.56 1wgp n ARG 131 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1wgp n SER 132 N -3.08 0.00 0.00 0.55 2.88 -1.26 -4.91 113.62 107.80 1wgp n SER 132 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1wgp n SER 132 Cb 0.19 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.65 1wgp n SER 132 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wgp n GLY 133 N 0.00 1.92 3.55 0.46 0.00 -1.26 -4.23 105.19 105.63 1wgp n GLY 133 Ca 0.00 -0.44 -0.36 0.00 0.00 0.00 0.00 46.02 45.21 1wgp n GLY 133 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wgp n PRO 134 N 13.02 2.41 -3.93 1.61 -0.04 -1.26 -4.87 135.00 141.93 1wgp n PRO 134 Ca 0.00 -2.85 -0.29 0.00 -0.04 0.00 0.00 63.50 60.31 1wgp n PRO 134 Cb 0.00 -3.59 -0.16 0.00 -0.04 0.00 0.00 33.50 29.71 1wgp n PRO 134 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wgp s SER 135 N 5.26 3.21 0.15 3.54 0.15 -1.26 -5.12 113.70 119.63 1wgp s SER 135 Ca 0.61 -0.83 0.08 0.00 0.70 0.00 0.00 55.95 56.51 1wgp s SER 135 Cb 0.02 -1.07 -0.04 0.00 -1.71 0.00 0.00 66.02 63.22 1wgp s SER 135 CO 0.10 -0.18 -0.11 -0.55 1.20 0.00 0.00 173.24 173.70 1wgp s SER 136 N 1.51 4.22 0.00 5.45 0.15 -1.26 -5.16 113.70 118.61 1wgp s SER 136 Ca -0.01 -0.53 0.24 0.00 0.70 0.00 0.00 55.95 56.35 1wgp s SER 136 Cb -0.16 -0.72 1.45 0.00 -1.71 0.00 0.00 66.02 64.88 1wgp s SER 136 CO -0.08 0.13 1.81 0.61 1.20 0.00 0.00 173.24 176.92