#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wgp s SER 2 N 0.00 4.31 -0.16 1.61 0.01 -1.26 -5.13 113.70 113.08 1wgp s SER 2 Ca 0.00 -0.82 -0.01 0.00 1.31 0.00 0.00 55.95 56.42 1wgp s SER 2 Cb 0.00 -0.66 -0.01 0.00 0.21 0.00 0.00 66.02 65.56 1wgp s SER 2 CO 0.00 -0.10 -0.11 -0.94 0.41 0.00 0.00 173.24 172.50 1wgp s SER 3 N -3.68 4.03 0.00 2.44 1.04 -1.26 -5.03 113.70 111.23 1wgp s SER 3 Ca 0.33 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 56.38 1wgp s SER 3 Cb -0.04 -1.64 0.00 0.00 0.10 0.00 0.00 66.02 64.44 1wgp s SER 3 CO 0.19 0.09 0.00 0.61 0.98 0.00 0.00 173.24 175.11 1wgp n GLY 4 N 4.03 3.54 2.56 7.32 0.00 -1.26 -5.03 105.19 116.35 1wgp n GLY 4 Ca -0.18 -1.82 -0.27 0.00 0.00 0.00 0.00 46.02 43.74 1wgp n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wgp s SER 5 N 0.00 2.57 -0.29 1.61 1.04 -1.26 -5.03 113.70 112.34 1wgp s SER 5 Ca 0.00 -3.27 -0.01 0.00 0.48 0.00 0.00 55.95 53.15 1wgp s SER 5 Cb 0.00 -0.82 0.13 0.00 0.10 0.00 0.00 66.02 65.43 1wgp s SER 5 CO 0.00 -0.15 0.29 -0.55 0.98 0.00 0.00 173.24 173.81 1wgp s SER 6 N -0.37 1.69 -0.41 7.02 0.15 -1.26 -5.00 113.70 115.52 1wgp s SER 6 Ca 0.30 -0.73 0.07 0.00 0.70 0.00 0.00 55.95 56.28 1wgp s SER 6 Cb -0.00 0.49 0.33 0.00 -1.71 0.00 0.00 66.02 65.12 1wgp s SER 6 CO -0.18 -0.39 1.25 0.61 1.20 0.00 0.00 173.24 175.74 1wgp n GLY 7 N 5.31 0.65 3.15 9.45 0.00 -1.26 -5.09 105.19 117.40 1wgp n GLY 7 Ca -0.02 0.01 0.04 0.00 0.00 0.00 0.00 46.02 46.05 1wgp n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wgp s VAL 8 N 0.19 -0.93 -0.97 1.61 0.11 -1.26 -5.04 120.40 114.12 1wgp s VAL 8 Ca 0.20 0.00 -0.08 0.00 -2.93 0.00 0.00 61.98 59.17 1wgp s VAL 8 Cb 0.32 -0.95 -0.15 0.00 -1.53 0.00 0.00 36.38 34.06 1wgp s VAL 8 CO -0.08 0.00 3.14 0.54 -3.33 0.00 0.00 175.10 175.37 1wgp n ARG 9 N 5.40 2.95 -4.31 1.54 5.12 -1.26 -4.62 116.66 121.48 1wgp n ARG 9 Ca 0.03 -1.69 -0.32 0.00 -1.93 0.00 0.00 57.85 53.94 1wgp n ARG 9 Cb 0.53 -2.47 -0.09 0.00 -1.16 0.00 0.00 32.46 29.27 1wgp n ARG 9 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 1wgp n ARG 10 N 3.20 -1.14 -1.28 5.56 0.00 -1.26 -4.87 116.66 116.87 1wgp n ARG 10 Ca 0.63 0.12 -0.31 0.00 -0.00 0.00 0.00 57.85 58.29 1wgp n ARG 10 Cb 0.48 -3.77 0.09 0.00 0.00 0.00 0.00 32.46 29.26 1wgp n ARG 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 1wgp s VAL 11 N -4.25 3.22 0.20 5.15 -7.23 -1.26 -4.95 120.40 111.28 1wgp s VAL 11 Ca 0.08 0.42 0.06 0.00 -1.81 0.00 0.00 61.98 60.73 1wgp s VAL 11 Cb -0.04 -2.88 -0.10 0.00 0.56 0.00 0.00 36.38 33.92 1wgp s VAL 11 CO 0.99 -0.49 1.46 1.55 -0.31 0.00 0.00 175.10 178.30 1wgp h PRO 12 N -1.03 0.09 -0.39 4.82 0.13 -2.01 -3.32 132.00 130.30 1wgp h PRO 12 Ca -0.44 -0.09 0.04 0.00 -0.87 0.00 0.00 66.00 64.64 1wgp h PRO 12 Cb 1.24 0.02 -0.06 0.00 0.13 0.00 0.00 31.00 32.33 1wgp h PRO 12 CO 0.51 0.82 -0.35 -0.07 -0.23 0.00 0.00 178.00 178.68 1wgp h LEU 13 N 0.06 -1.20 -4.49 1.56 3.38 -2.01 0.36 115.31 112.97 1wgp h LEU 13 Ca -0.02 0.17 -0.41 0.00 0.09 0.00 0.00 57.88 57.71 1wgp h LEU 13 Cb 1.36 0.51 -0.07 0.00 0.09 0.00 0.00 40.66 42.55 1wgp h LEU 13 CO 0.11 -0.20 1.00 0.49 0.09 0.00 0.00 178.44 179.92 1wgp n PHE 14 N -4.33 1.10 -0.07 1.13 3.72 -1.25 -4.40 117.46 113.36 1wgp n PHE 14 Ca -0.01 -2.07 -0.11 0.00 -0.05 0.00 0.00 57.45 55.21 1wgp n PHE 14 Cb 0.19 -1.79 -0.10 0.00 -0.94 0.00 0.00 39.48 36.85 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 3.61 0.00 0.00 -1.08 4.39 -1.09 -3.32 114.58 117.09 1wgp h GLU 15 Ca 0.43 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.13 1wgp h GLU 15 Cb 0.97 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.62 1wgp h GLU 15 CO 0.83 0.74 0.00 -0.91 -1.16 0.00 0.00 179.01 178.51 1wgp h ASN 16 N -1.00 0.00 -3.50 1.42 2.35 -1.81 -3.46 115.58 109.57 1wgp h ASN 16 Ca -0.03 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 55.15 1wgp h ASN 16 Cb 0.78 0.00 0.15 0.00 0.05 0.00 0.00 38.32 39.30 1wgp h ASN 16 CO -0.02 0.00 0.24 0.23 -1.65 0.00 0.00 177.43 176.23 1wgp n MET 17 N -2.59 1.25 -4.07 0.81 2.81 -1.25 -5.00 117.12 109.08 1wgp n MET 17 Ca 0.04 0.46 -0.24 0.00 -1.81 0.00 0.00 57.70 56.16 1wgp n MET 17 Cb 0.44 -2.22 -0.04 0.00 -0.71 0.00 0.00 33.22 30.69 1wgp n MET 17 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1wgp s ASP 18 N -0.98 5.70 0.18 7.83 2.15 -1.26 -4.95 116.67 125.33 1wgp s ASP 18 Ca 0.70 -0.12 -0.22 0.00 0.43 0.00 0.00 52.55 53.34 1wgp s ASP 18 Cb -0.46 -1.52 0.11 0.00 -0.30 0.00 0.00 42.92 40.74 1wgp s ASP 18 CO 0.51 0.01 1.58 -0.33 -0.17 0.00 0.00 175.17 176.77 1wgp h GLU 19 N 1.87 -0.17 -0.60 4.34 5.08 -1.99 1.10 114.58 124.21 1wgp h GLU 19 Ca -0.49 0.01 0.17 0.00 -1.00 0.00 0.00 59.36 58.05 1wgp h GLU 19 Cb 1.22 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.48 1wgp h GLU 19 CO 0.62 -0.11 0.43 0.00 -1.00 0.00 0.00 179.01 178.95 1wgp h ARG 20 N -0.17 0.05 -0.07 2.33 2.47 -2.00 0.40 114.38 117.39 1wgp h ARG 20 Ca 0.22 -0.00 -0.20 0.00 -1.26 0.00 0.00 59.98 58.74 1wgp h ARG 20 Cb 0.55 -0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.86 1wgp h ARG 20 CO -0.69 0.03 -0.78 1.25 0.56 0.00 0.00 179.97 180.34 1wgp h LEU 21 N 0.05 0.55 -0.19 3.04 5.85 0.71 -0.72 115.31 124.60 1wgp h LEU 21 Ca 0.29 -0.38 -0.00 0.00 0.84 0.00 0.00 57.88 58.63 1wgp h LEU 21 Cb 1.08 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.94 1wgp h LEU 21 CO -0.02 1.14 0.11 -0.07 -0.34 0.00 0.00 178.44 179.27 1wgp h LEU 22 N 0.30 0.23 0.24 2.25 -0.00 0.27 0.53 115.31 119.14 1wgp h LEU 22 Ca -0.04 -0.06 -0.01 0.00 -0.00 0.00 0.00 57.88 57.76 1wgp h LEU 22 Cb 1.38 -0.06 0.00 0.00 -0.00 0.00 0.00 40.66 41.98 1wgp h LEU 22 CO 0.14 0.23 -0.12 -0.78 -0.00 0.00 0.00 178.44 177.91 1wgp h ASP 23 N 0.22 -0.27 0.06 -0.43 1.82 -1.27 -0.32 116.42 116.22 1wgp h ASP 23 Ca 0.07 -0.17 0.02 0.00 -0.39 0.00 0.00 57.03 56.56 1wgp h ASP 23 Cb 0.04 0.07 -0.05 0.00 0.68 0.00 0.00 39.33 40.07 1wgp h ASP 23 CO -0.01 0.03 -0.48 0.00 -1.61 0.00 0.00 179.24 177.16 1wgp h ALA 24 N 0.09 -0.85 -0.54 -0.78 0.00 -1.01 0.44 119.26 116.60 1wgp h ALA 24 Ca -0.03 -0.08 0.16 0.00 0.00 0.00 0.00 54.91 54.95 1wgp h ALA 24 Cb 0.43 0.84 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1wgp h ALA 24 CO 0.05 -1.06 0.44 0.82 0.00 0.00 0.00 179.25 179.50 1wgp h ILE 25 N -0.67 0.58 0.52 0.00 2.04 0.07 -1.18 117.51 118.86 1wgp h ILE 25 Ca 0.02 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.85 1wgp h ILE 25 Cb 0.71 0.68 0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1wgp h ILE 25 CO -0.31 0.00 -0.25 0.00 0.00 0.00 0.00 178.15 177.59 1wgp h GLU 27 N -0.92 0.00 -0.18 0.00 4.11 0.38 1.50 114.58 119.47 1wgp h GLU 27 Ca -0.07 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.21 1wgp h GLU 27 Cb 0.53 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1wgp h GLU 27 CO 0.12 0.00 -0.49 0.00 0.07 0.00 0.00 179.01 178.70 1wgp h ARG 28 N 0.00 0.49 -6.01 1.06 -0.00 -0.98 -3.44 114.38 105.51 1wgp h ARG 28 Ca 0.31 -0.28 -0.82 0.00 -0.50 0.00 0.00 59.98 58.68 1wgp h ARG 28 Cb 1.84 0.02 -0.01 0.00 0.00 0.00 0.00 29.97 31.82 1wgp h ARG 28 CO -0.00 0.88 0.99 1.28 0.00 0.00 0.00 179.97 183.11 1wgp n LEU 29 N -3.98 1.10 -4.92 3.04 4.77 0.51 -4.88 117.00 112.65 1wgp n LEU 29 Ca -0.02 0.95 -0.28 0.00 -0.03 0.00 0.00 56.01 56.63 1wgp n LEU 29 Cb 0.56 -0.91 -0.04 0.00 -2.33 0.00 0.00 43.42 40.71 1wgp n LEU 29 CO 0.46 -0.79 -0.13 -0.54 -1.33 0.00 0.00 177.39 175.05 1wgp s LYS 30 N 4.38 3.36 -0.42 3.23 -0.14 -1.13 -4.92 119.74 124.11 1wgp s LYS 30 Ca 1.11 -0.57 -0.29 0.00 -1.36 0.00 0.00 55.97 54.86 1wgp s LYS 30 Cb -1.46 -2.95 0.01 0.00 -1.68 0.00 0.00 37.83 31.75 1wgp s LYS 30 CO 0.74 0.55 1.41 -1.25 -0.76 0.00 0.00 175.35 176.04 1wgp s PRO 31 N -2.94 3.56 0.05 -1.68 0.04 -1.26 -3.25 135.00 129.51 1wgp s PRO 31 Ca 0.34 0.91 -0.11 0.00 0.04 0.00 0.00 61.00 62.18 1wgp s PRO 31 Cb -0.12 -4.03 0.01 0.00 0.04 0.00 0.00 34.50 30.40 1wgp s PRO 31 CO 0.28 -1.59 0.24 0.00 0.04 0.00 0.00 177.00 175.97 1wgp s LEU 33 N -2.21 2.24 -0.16 0.00 0.20 -1.26 -4.17 118.68 113.32 1wgp s LEU 33 Ca -0.03 -0.85 0.02 0.00 0.69 0.00 0.00 54.13 53.95 1wgp s LEU 33 Cb -0.00 0.35 0.01 0.00 -0.43 0.00 0.00 46.19 46.12 1wgp s LEU 33 CO -0.05 -0.58 -0.20 -0.36 -0.29 0.00 0.00 176.35 174.87 1wgp s PHE 34 N -3.53 2.73 0.33 5.38 0.08 -1.15 -5.07 117.98 116.75 1wgp s PHE 34 Ca 0.03 -1.37 0.04 0.00 0.12 0.00 0.00 56.93 55.76 1wgp s PHE 34 Cb 0.05 -1.86 0.04 0.00 -0.57 0.00 0.00 43.02 40.68 1wgp s PHE 34 CO -0.09 -0.64 0.36 0.25 -0.10 0.00 0.00 175.22 175.00 1wgp n THR 35 N 4.24 0.00 -1.70 0.64 -2.24 -1.26 -3.13 114.28 110.83 1wgp n THR 35 Ca -0.20 -1.21 -0.43 0.00 -2.27 0.00 0.00 64.05 59.94 1wgp n THR 35 Cb 0.51 -0.48 -0.02 0.00 -2.10 0.00 0.00 70.33 68.24 1wgp n THR 35 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1wgp n GLU 36 N -1.51 2.31 -2.59 -0.78 0.28 -1.26 -1.59 120.64 115.51 1wgp n GLU 36 Ca 0.04 0.82 -0.10 0.00 -0.16 0.00 0.00 57.16 57.77 1wgp n GLU 36 Cb 0.36 -2.53 0.02 0.00 1.43 0.00 0.00 31.44 30.72 1wgp n GLU 36 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1wgp n LYS 37 N 1.97 -2.18 -3.50 3.44 5.02 -0.97 -4.99 118.16 116.96 1wgp n LYS 37 Ca 0.10 0.41 -0.41 0.00 -2.02 0.00 0.00 58.31 56.39 1wgp n LYS 37 Cb 0.34 -4.25 -0.10 0.00 -0.02 0.00 0.00 35.03 31.00 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 -2.86 6.09 -0.42 4.39 0.01 -0.62 -4.89 113.70 115.40 1wgp s SER 38 Ca 0.13 -0.47 -0.16 0.00 1.31 0.00 0.00 55.95 56.76 1wgp s SER 38 Cb -0.06 -2.15 0.02 0.00 0.21 0.00 0.00 66.02 64.04 1wgp s SER 38 CO 0.16 -0.29 0.38 -0.31 0.41 0.00 0.00 173.24 173.60 1wgp s TYR 39 N 1.77 3.20 -0.03 2.43 2.02 -1.26 -0.48 117.35 125.00 1wgp s TYR 39 Ca 0.07 -0.49 -0.23 0.00 -0.37 0.00 0.00 57.07 56.05 1wgp s TYR 39 Cb -0.17 -2.79 -0.23 0.00 -0.40 0.00 0.00 41.96 38.36 1wgp s TYR 39 CO 0.11 -0.67 1.06 -0.07 -1.57 0.00 0.00 175.55 174.41 1wgp h LEU 40 N 8.88 0.31 -7.94 -1.29 4.07 -1.96 -3.46 115.31 113.93 1wgp h LEU 40 Ca -0.27 -0.76 -0.29 0.00 0.08 0.00 0.00 57.88 56.65 1wgp h LEU 40 Cb 1.11 -0.09 -0.26 0.00 1.08 0.00 0.00 40.66 42.50 1wgp h LEU 40 CO 0.78 1.03 -0.74 0.68 -1.08 0.00 0.00 178.44 179.10 1wgp s VAL 41 N -3.19 0.35 -0.01 1.22 -7.23 -1.26 -4.97 120.40 105.31 1wgp s VAL 41 Ca -0.15 -0.43 0.02 0.00 -1.81 0.00 0.00 61.98 59.61 1wgp s VAL 41 Cb 0.02 -0.34 -0.01 0.00 0.56 0.00 0.00 36.38 36.61 1wgp s VAL 41 CO 0.76 -0.06 -0.08 -0.13 -0.31 0.00 0.00 175.10 175.28 1wgp s ARG 42 N -0.53 0.66 -0.14 4.82 1.81 -1.26 -2.29 118.95 122.03 1wgp s ARG 42 Ca -0.02 -0.28 -0.29 0.00 -1.72 0.00 0.00 55.73 53.41 1wgp s ARG 42 Cb -0.04 -0.64 -0.02 0.00 -0.45 0.00 0.00 34.95 33.80 1wgp s ARG 42 CO -0.00 0.16 1.28 -2.00 -0.68 0.00 0.00 175.30 174.07 1wgp s GLU 43 N -0.15 4.25 0.00 3.54 2.12 -1.26 -3.14 118.70 124.06 1wgp s GLU 43 Ca 0.02 1.70 0.00 0.00 0.36 0.00 0.00 54.97 57.06 1wgp s GLU 43 Cb -0.04 -3.75 0.00 0.00 0.26 0.00 0.00 34.13 30.61 1wgp s GLU 43 CO -0.00 -0.68 0.00 0.41 -0.54 0.00 0.00 175.26 174.45 1wgp n GLY 44 N 3.61 3.25 3.89 -1.50 0.00 -1.26 -5.08 105.19 108.10 1wgp n GLY 44 Ca 0.14 -1.10 -0.31 0.00 0.00 0.00 0.00 46.02 44.74 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 0.00 6.56 0.87 1.61 1.47 -1.19 -5.00 116.67 121.00 1wgp s ASP 45 Ca 0.00 0.79 -0.12 0.00 1.18 0.00 0.00 52.55 54.40 1wgp s ASP 45 Cb 0.00 -2.17 0.11 0.00 -0.34 0.00 0.00 42.92 40.52 1wgp s ASP 45 CO 0.00 -0.06 1.12 -2.16 0.68 0.00 0.00 175.17 174.76 1wgp s PRO 46 N -2.88 1.47 -0.28 2.11 0.04 -1.26 -3.84 135.00 130.36 1wgp s PRO 46 Ca 0.45 0.41 -0.10 0.00 0.04 0.00 0.00 61.00 61.80 1wgp s PRO 46 Cb -0.11 -1.87 -0.04 0.00 0.04 0.00 0.00 34.50 32.52 1wgp s PRO 46 CO 0.23 -2.00 0.15 0.08 0.04 0.00 0.00 177.00 175.50 1wgp s VAL 47 N -3.24 4.88 -0.12 -0.36 1.01 0.17 -4.88 120.40 117.85 1wgp s VAL 47 Ca 0.63 -0.03 -0.10 0.00 0.00 0.00 0.00 61.98 62.47 1wgp s VAL 47 Cb -0.15 -3.34 -0.26 0.00 0.00 0.00 0.00 36.38 32.64 1wgp s VAL 47 CO 0.54 0.25 0.39 -1.13 0.00 0.00 0.00 175.10 175.15 1wgp h ASN 48 N 8.33 0.38 -5.12 3.32 -1.24 -1.96 -3.40 115.58 115.89 1wgp h ASN 48 Ca -0.36 -0.88 -0.11 0.00 0.71 0.00 0.00 56.30 55.66 1wgp h ASN 48 Cb 1.18 -0.12 -0.16 0.00 0.73 0.00 0.00 38.32 39.94 1wgp h ASN 48 CO 0.57 1.78 -0.50 -1.83 -1.29 0.00 0.00 177.43 176.17 1wgp s GLU 49 N -2.53 0.66 -0.05 6.67 1.03 -1.26 -2.60 118.70 120.63 1wgp s GLU 49 Ca -0.22 -0.86 -0.03 0.00 0.03 0.00 0.00 54.97 53.89 1wgp s GLU 49 Cb 0.06 0.26 -0.04 0.00 -0.80 0.00 0.00 34.13 33.61 1wgp s GLU 49 CO 0.75 -0.18 0.14 1.41 -1.33 0.00 0.00 175.26 176.05 1wgp s MET 50 N -3.09 3.33 -0.22 -4.83 1.75 0.55 -4.85 119.30 111.95 1wgp s MET 50 Ca -0.01 -0.31 -0.03 0.00 -1.25 0.00 0.00 55.69 54.10 1wgp s MET 50 Cb 0.02 -3.05 0.00 0.00 2.84 0.00 0.00 34.83 34.63 1wgp s MET 50 CO -0.07 0.70 -0.07 -0.51 -0.65 0.00 0.00 175.02 174.43 1wgp s LEU 51 N -1.55 2.84 -0.35 4.11 2.01 -1.26 0.18 118.68 124.66 1wgp s LEU 51 Ca 0.22 -0.51 -0.15 0.00 0.01 0.00 0.00 54.13 53.69 1wgp s LEU 51 Cb -0.12 -1.69 -0.01 0.00 0.01 0.00 0.00 46.19 44.38 1wgp s LEU 51 CO 0.12 -0.04 0.37 -0.36 1.01 0.00 0.00 176.35 177.45 1wgp s PHE 52 N 1.43 3.21 0.08 0.29 0.08 -0.76 -4.20 117.98 118.10 1wgp s PHE 52 Ca 0.05 -0.05 -0.31 0.00 0.12 0.00 0.00 56.93 56.74 1wgp s PHE 52 Cb -0.14 -2.68 -0.08 0.00 -0.57 0.00 0.00 43.02 39.54 1wgp s PHE 52 CO -0.05 -0.45 1.49 0.42 -0.10 0.00 0.00 175.22 176.53 1wgp s ILE 53 N 2.02 3.25 -0.19 0.64 -1.09 -1.07 -3.28 121.20 121.48 1wgp s ILE 53 Ca 0.12 0.79 -0.10 0.00 -2.23 0.00 0.00 60.65 59.22 1wgp s ILE 53 Cb -0.17 -3.51 -0.08 0.00 -1.58 0.00 0.00 42.46 37.12 1wgp s ILE 53 CO 0.12 0.02 -0.26 -0.38 -1.23 0.00 0.00 174.94 173.22 1wgp n ILE 54 N 4.38 1.11 -3.19 2.92 2.08 -1.22 -3.58 119.36 121.86 1wgp n ILE 54 Ca 0.13 -0.25 0.04 0.00 0.56 0.00 0.00 62.75 63.23 1wgp n ILE 54 Cb 0.42 -1.79 -0.01 0.00 -0.75 0.00 0.00 39.64 37.50 1wgp n ILE 54 CO 0.00 0.00 0.00 -0.13 0.56 0.00 0.00 176.55 176.98 1wgp s ARG 55 N -2.38 0.53 0.00 0.38 0.52 -1.09 -4.52 118.95 112.39 1wgp s ARG 55 Ca -0.27 0.97 0.00 0.00 -0.52 0.00 0.00 55.73 55.90 1wgp s ARG 55 Cb 0.10 0.54 0.00 0.00 0.52 0.00 0.00 34.95 36.11 1wgp s ARG 55 CO 0.35 -0.54 0.00 0.41 0.02 0.00 0.00 175.30 175.54 1wgp n GLY 56 N 5.43 -0.51 3.18 -3.53 0.00 -1.26 -2.75 105.19 105.74 1wgp n GLY 56 Ca -0.03 -0.96 -0.08 0.00 0.00 0.00 0.00 46.02 44.96 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 -1.44 0.81 0.29 1.61 6.06 -1.26 -4.75 118.95 120.27 1wgp s ARG 57 Ca 0.00 -1.09 -0.18 0.00 -2.50 0.00 0.00 55.73 51.96 1wgp s ARG 57 Cb 0.00 0.30 0.02 0.00 0.06 0.00 0.00 34.95 35.33 1wgp s ARG 57 CO 0.00 -0.24 0.67 -0.51 -2.50 0.00 0.00 175.30 172.73 1wgp s LEU 58 N -2.90 -0.06 -0.19 -0.88 1.02 -1.26 -4.47 118.68 109.93 1wgp s LEU 58 Ca 0.08 -0.79 0.01 0.00 0.02 0.00 0.00 54.13 53.46 1wgp s LEU 58 Cb 0.06 2.51 0.03 0.00 0.02 0.00 0.00 46.19 48.80 1wgp s LEU 58 CO -0.09 -1.36 -0.18 -1.83 0.02 0.00 0.00 176.35 172.92 1wgp s GLU 59 N -3.67 2.79 -0.08 1.70 -1.05 -0.91 -4.18 118.70 113.31 1wgp s GLU 59 Ca 0.15 -0.89 -0.13 0.00 -0.15 0.00 0.00 54.97 53.95 1wgp s GLU 59 Cb -0.05 -2.58 -0.05 0.00 -0.44 0.00 0.00 34.13 31.02 1wgp s GLU 59 CO 0.09 -0.27 0.33 0.45 0.95 0.00 0.00 175.26 176.80 1wgp s SER 60 N 1.28 6.62 0.01 0.83 0.15 -0.22 -2.56 113.70 119.80 1wgp s SER 60 Ca 0.03 0.73 -0.06 0.00 0.70 0.00 0.00 55.95 57.35 1wgp s SER 60 Cb -0.14 -2.20 -0.00 0.00 -1.71 0.00 0.00 66.02 61.97 1wgp s SER 60 CO -0.11 0.25 0.10 -0.69 1.20 0.00 0.00 173.24 173.99 1wgp s VAL 61 N -0.51 0.09 -0.19 4.45 1.01 -0.07 -0.35 120.40 124.83 1wgp s VAL 61 Ca 0.20 -0.78 -0.19 0.00 0.00 0.00 0.00 61.98 61.21 1wgp s VAL 61 Cb -0.15 -0.46 0.05 0.00 0.00 0.00 0.00 36.38 35.83 1wgp s VAL 61 CO 0.09 -0.43 0.54 0.28 0.00 0.00 0.00 175.10 175.57 1wgp s THR 62 N -1.56 0.00 -0.23 3.92 -1.32 -1.04 -0.97 115.64 114.44 1wgp s THR 62 Ca -0.14 -0.02 -0.01 0.00 -1.21 0.00 0.00 61.69 60.31 1wgp s THR 62 Cb -0.07 -0.76 -0.14 0.00 -1.51 0.00 0.00 72.50 70.02 1wgp s THR 62 CO 0.00 -0.01 -0.22 0.35 -2.21 0.00 0.00 174.62 172.53 1wgp n THR 63 N 2.61 1.31 -0.62 5.08 -2.24 -1.26 -1.45 114.28 117.71 1wgp n THR 63 Ca -0.14 -0.47 0.08 0.00 -2.27 0.00 0.00 64.05 61.25 1wgp n THR 63 Cb 0.56 -1.39 -0.02 0.00 -2.10 0.00 0.00 70.33 67.38 1wgp n THR 63 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1wgp n ASP 64 N -3.32 -3.66 -4.02 3.42 -0.08 -1.26 -4.78 116.55 102.85 1wgp n ASP 64 Ca -0.41 0.30 -0.23 0.00 -1.51 0.00 0.00 54.79 52.93 1wgp n ASP 64 Cb 0.91 -1.90 -0.08 0.00 2.34 0.00 0.00 41.12 42.39 1wgp n ASP 64 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 1wgp s GLY 65 N -4.69 2.43 0.00 0.27 0.00 -1.26 -5.01 107.32 99.06 1wgp s GLY 65 Ca 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 44.72 43.23 1wgp s GLY 65 CO 0.00 -1.73 0.00 0.61 0.00 0.00 0.00 173.10 171.98 1wgp n GLY 66 N -0.79 1.59 3.16 0.20 0.00 -1.26 -4.97 105.19 103.12 1wgp n GLY 66 Ca -0.03 -0.44 0.03 0.00 0.00 0.00 0.00 46.02 45.58 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 0.65 0.44 1.61 0.52 -1.26 -5.14 118.95 115.77 1wgp s ARG 67 Ca 0.00 0.15 0.00 0.00 -0.52 0.00 0.00 55.73 55.36 1wgp s ARG 67 Cb 0.00 0.17 0.00 0.00 0.52 0.00 0.00 34.95 35.64 1wgp s ARG 67 CO 0.00 -1.05 0.00 0.43 0.02 0.00 0.00 175.30 174.70 1wgp n SER 68 N 4.90 -8.33 0.00 0.23 7.64 -1.26 -5.07 113.62 111.72 1wgp n SER 68 Ca 0.08 0.90 0.00 0.00 1.01 0.00 0.00 58.87 60.86 1wgp n SER 68 Cb 0.56 -4.51 0.00 0.00 -1.01 0.00 0.00 64.21 59.25 1wgp n SER 68 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wgp n GLY 69 N -4.19 4.03 3.96 0.23 0.00 -1.26 -4.96 105.19 103.00 1wgp n GLY 69 Ca -0.03 -1.19 -0.19 0.00 0.00 0.00 0.00 46.02 44.61 1wgp n GLY 69 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1wgp s PHE 70 N -2.00 3.00 -0.33 1.61 -0.12 -1.26 -5.05 117.98 113.82 1wgp s PHE 70 Ca 0.00 -0.28 -0.29 0.00 -0.05 0.00 0.00 56.93 56.31 1wgp s PHE 70 Cb 0.00 -2.04 0.00 0.00 -0.63 0.00 0.00 43.02 40.35 1wgp s PHE 70 CO 0.00 -0.06 1.37 0.71 -0.05 0.00 0.00 175.22 177.20 1wgp s TYR 71 N -2.25 2.52 -0.52 3.49 1.51 -1.26 -4.76 117.35 116.09 1wgp s TYR 71 Ca 0.46 0.77 -0.25 0.00 -1.01 0.00 0.00 57.07 57.04 1wgp s TYR 71 Cb -0.09 -4.06 0.03 0.00 -0.11 0.00 0.00 41.96 37.74 1wgp s TYR 71 CO 0.30 -1.93 0.97 -0.80 -1.11 0.00 0.00 175.55 172.99 1wgp s ASN 72 N 3.35 6.42 0.13 2.29 -0.87 -0.52 -4.92 114.94 120.82 1wgp s ASN 72 Ca 0.59 -0.08 -0.14 0.00 -1.57 0.00 0.00 52.86 51.66 1wgp s ASN 72 Cb -0.16 -2.46 -0.07 0.00 -0.02 0.00 0.00 41.25 38.54 1wgp s ASN 72 CO 0.27 -1.19 0.54 -0.13 -2.57 0.00 0.00 177.10 174.02 1wgp s ARG 73 N 4.02 3.98 0.28 -0.60 0.52 -1.26 -2.51 118.95 123.37 1wgp s ARG 73 Ca 0.35 0.49 -0.15 0.00 -0.52 0.00 0.00 55.73 55.90 1wgp s ARG 73 Cb -0.11 -2.96 0.01 0.00 0.52 0.00 0.00 34.95 32.41 1wgp s ARG 73 CO 0.23 0.50 0.58 -1.12 0.02 0.00 0.00 175.30 175.52 1wgp s SER 74 N -1.66 -0.05 0.16 0.23 0.01 0.53 -5.00 113.70 107.91 1wgp s SER 74 Ca 0.37 -0.90 0.08 0.00 1.31 0.00 0.00 55.95 56.81 1wgp s SER 74 Cb -0.15 0.66 -0.04 0.00 0.21 0.00 0.00 66.02 66.70 1wgp s SER 74 CO 0.19 -1.27 -0.17 -0.22 0.41 0.00 0.00 173.24 172.17 1wgp s LEU 75 N -3.01 2.44 0.34 2.44 2.96 -1.26 -1.06 118.68 121.52 1wgp s LEU 75 Ca 0.19 -0.86 0.08 0.00 -0.22 0.00 0.00 54.13 53.32 1wgp s LEU 75 Cb -0.03 -0.77 -0.04 0.00 0.50 0.00 0.00 46.19 45.85 1wgp s LEU 75 CO 0.10 -0.06 0.16 -0.76 -1.32 0.00 0.00 176.35 174.46 1wgp s LEU 76 N -2.67 3.31 0.00 -0.68 1.43 -1.26 -4.91 118.68 113.90 1wgp s LEU 76 Ca 0.15 -0.73 0.07 0.00 -1.03 0.00 0.00 54.13 52.59 1wgp s LEU 76 Cb -0.05 -1.81 0.07 0.00 0.03 0.00 0.00 46.19 44.43 1wgp s LEU 76 CO 0.06 -0.30 0.55 2.29 0.23 0.00 0.00 176.35 179.18 1wgp n LYS 77 N -1.17 0.73 -2.52 1.70 2.85 -1.26 -4.79 118.16 113.69 1wgp n LYS 77 Ca -0.03 -2.27 -0.43 0.00 -1.05 0.00 0.00 58.31 54.53 1wgp n LYS 77 Cb 0.61 -0.13 -0.02 0.00 -0.65 0.00 0.00 35.03 34.83 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 -3.87 4.34 0.00 -1.58 -1.05 -1.26 -2.85 118.70 112.43 1wgp s GLU 78 Ca 0.42 1.58 0.00 0.00 -0.15 0.00 0.00 54.97 56.82 1wgp s GLU 78 Cb -0.03 -3.59 0.00 0.00 -0.44 0.00 0.00 34.13 30.06 1wgp s GLU 78 CO 0.27 -0.47 0.00 0.41 0.95 0.00 0.00 175.26 176.41 1wgp n GLY 79 N 3.34 0.94 3.68 -3.83 0.00 -1.23 -5.06 105.19 103.02 1wgp n GLY 79 Ca 0.11 -0.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 1wgp n GLY 79 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1wgp s ASP 80 N -2.04 2.42 0.03 1.61 1.47 -1.13 -4.73 116.67 114.30 1wgp s ASP 80 Ca 0.00 1.04 -0.10 0.00 1.18 0.00 0.00 52.55 54.67 1wgp s ASP 80 Cb 0.00 -1.62 0.01 0.00 -0.34 0.00 0.00 42.92 40.97 1wgp s ASP 80 CO 0.00 -3.24 0.21 0.72 0.68 0.00 0.00 175.17 173.54 1wgp s PHE 81 N -3.03 0.02 0.33 2.11 -0.12 -1.26 -2.61 117.98 113.42 1wgp s PHE 81 Ca 0.66 -0.20 0.07 0.00 -0.05 0.00 0.00 56.93 57.41 1wgp s PHE 81 Cb -0.17 -0.01 -0.07 0.00 -0.63 0.00 0.00 43.02 42.15 1wgp s PHE 81 CO 0.57 -0.42 -0.03 0.00 -0.05 0.00 0.00 175.22 175.28 1wgp n GLY 83 N -0.75 -0.17 0.09 0.00 0.00 -1.26 -4.66 105.19 98.45 1wgp n GLY 83 Ca -0.05 0.17 0.09 0.00 0.00 0.00 0.00 46.02 46.23 1wgp n GLY 83 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1wgp n ASP 84 N -2.39 0.39 0.19 1.61 5.68 -1.26 -1.80 116.55 118.96 1wgp n ASP 84 Ca -0.27 0.63 0.12 0.00 -0.50 0.00 0.00 54.79 54.78 1wgp n ASP 84 Cb 0.60 -0.70 0.65 0.00 -1.14 0.00 0.00 41.12 40.53 1wgp n ASP 84 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1wgp h GLU 85 N 0.00 0.00 0.19 0.11 4.39 -1.94 -1.65 114.58 115.68 1wgp h GLU 85 Ca 0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1wgp h GLU 85 Cb 0.17 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1wgp h GLU 85 CO 0.00 0.00 -0.09 1.25 -1.16 0.00 0.00 179.01 179.01 1wgp h LEU 86 N 0.00 -0.21 -0.16 1.33 5.85 -1.70 0.02 115.31 120.44 1wgp h LEU 86 Ca 0.00 -0.32 0.03 0.00 0.84 0.00 0.00 57.88 58.43 1wgp h LEU 86 Cb 0.06 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.10 1wgp h LEU 86 CO 0.00 0.28 -0.38 -0.07 -0.34 0.00 0.00 178.44 177.92 1wgp h LEU 87 N -0.78 -1.24 -0.50 2.25 -0.00 -1.52 0.13 115.31 113.65 1wgp h LEU 87 Ca -0.03 0.15 0.09 0.00 -0.00 0.00 0.00 57.88 58.09 1wgp h LEU 87 Cb 0.52 0.49 -0.07 0.00 -0.00 0.00 0.00 40.66 41.60 1wgp h LEU 87 CO 0.04 -0.32 0.09 0.74 -0.00 0.00 0.00 178.44 178.99 1wgp h THR 88 N -0.37 0.70 -0.65 0.22 2.02 -1.64 -0.20 112.91 112.99 1wgp h THR 88 Ca 0.03 -0.08 0.12 0.00 0.77 0.00 0.00 66.41 67.26 1wgp h THR 88 Cb 0.46 0.46 -0.12 0.00 -1.74 0.00 0.00 68.15 67.21 1wgp h THR 88 CO -0.34 0.04 -0.29 -0.25 0.37 0.00 0.00 175.52 175.05 1wgp h TRP 89 N 0.22 -0.76 0.38 3.16 7.01 0.27 1.46 115.95 127.68 1wgp h TRP 89 Ca 0.25 0.07 -0.01 0.00 2.11 0.00 0.00 58.89 61.32 1wgp h TRP 89 Cb 0.35 0.43 -0.01 0.00 -2.10 0.00 0.00 29.16 27.83 1wgp h TRP 89 CO -0.24 -0.36 -0.29 0.00 -2.79 0.00 0.00 178.44 174.76 1wgp h ALA 90 N 1.25 -0.66 -0.86 2.65 0.00 0.60 -0.94 119.26 121.29 1wgp h ALA 90 Ca 0.27 -0.12 0.22 0.00 0.00 0.00 0.00 54.91 55.28 1wgp h ALA 90 Cb 0.55 0.38 -0.05 0.00 0.00 0.00 0.00 17.79 18.66 1wgp h ALA 90 CO -0.72 -0.90 0.59 -0.07 0.00 0.00 0.00 179.25 178.16 1wgp h LEU 91 N -0.66 0.22 -8.89 0.00 -0.00 0.82 -3.37 115.31 103.43 1wgp h LEU 91 Ca -0.03 0.02 -0.57 0.00 -0.00 0.00 0.00 57.88 57.30 1wgp h LEU 91 Cb 0.57 -0.02 -0.06 0.00 -0.00 0.00 0.00 40.66 41.15 1wgp h LEU 91 CO 0.00 0.09 0.90 -1.81 -0.00 0.00 0.00 178.44 177.62 1wgp s ASP 92 N -5.70 6.79 0.35 -0.43 1.01 0.48 -4.88 116.67 114.28 1wgp s ASP 92 Ca -0.07 0.92 0.18 0.00 0.71 0.00 0.00 52.55 54.30 1wgp s ASP 92 Cb 0.22 -2.54 0.48 0.00 1.01 0.00 0.00 42.92 42.09 1wgp s ASP 92 CO 0.77 -1.03 1.64 1.55 0.21 0.00 0.00 175.17 178.31 1wgp h PRO 93 N 8.68 0.00 -0.27 8.23 0.13 -1.78 -3.09 132.00 143.90 1wgp h PRO 93 Ca -0.22 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.73 1wgp h PRO 93 Cb 1.07 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.20 1wgp h PRO 93 CO 1.06 0.41 -0.53 0.87 -0.23 0.00 0.00 178.00 179.58 1wgp h LYS 94 N 0.00 0.81 -3.22 0.86 1.79 -1.89 -3.49 116.57 111.42 1wgp h LYS 94 Ca -0.00 -0.50 0.32 0.00 -2.18 0.00 0.00 60.65 58.29 1wgp h LYS 94 Cb 1.07 0.05 -0.15 0.00 -1.58 0.00 0.00 32.23 31.62 1wgp h LYS 94 CO 0.05 1.13 -0.98 -1.13 -1.08 0.00 0.00 179.45 177.44 1wgp n SER 95 N -4.00 -7.45 -2.96 0.86 3.41 -1.17 -4.51 113.62 97.80 1wgp n SER 95 Ca -0.04 1.12 -0.36 0.00 -0.26 0.00 0.00 58.87 59.34 1wgp n SER 95 Cb 0.61 -4.53 0.02 0.00 -0.26 0.00 0.00 64.21 60.05 1wgp n SER 95 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wgp n GLY 96 N -4.15 5.78 5.00 5.00 0.00 -1.26 -4.93 105.19 110.63 1wgp n GLY 96 Ca -0.06 -2.61 0.00 0.00 0.00 0.00 0.00 46.02 43.35 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 -0.40 0.00 0.00 1.61 7.64 -1.26 -4.65 113.62 116.56 1wgp n SER 97 Ca 0.46 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.34 1wgp n SER 97 Cb 0.36 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.56 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 2.31 1.53 -4.77 6.43 5.15 -1.26 -5.13 115.26 119.52 1wgp n ASN 98 Ca 0.00 0.00 -0.32 0.00 -0.60 0.00 0.00 54.58 53.66 1wgp n ASN 98 Cb 0.00 0.00 0.08 0.00 -0.53 0.00 0.00 39.78 39.33 1wgp n ASN 98 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1wgp s LEU 99 N 0.00 3.14 0.89 1.20 1.43 -1.26 -5.03 118.68 119.05 1wgp s LEU 99 Ca 0.00 1.88 -0.12 0.00 -1.03 0.00 0.00 54.13 54.86 1wgp s LEU 99 Cb 0.00 -4.53 0.13 0.00 0.03 0.00 0.00 46.19 41.82 1wgp s LEU 99 CO 0.00 -1.92 1.13 -2.16 0.23 0.00 0.00 176.35 173.63 1wgp s PRO 100 N -4.66 1.29 -0.15 1.29 0.04 -1.26 -4.73 135.00 126.82 1wgp s PRO 100 Ca 0.63 0.34 0.01 0.00 0.04 0.00 0.00 61.00 62.02 1wgp s PRO 100 Cb -0.18 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.51 1wgp s PRO 100 CO 0.52 -2.10 -0.18 -1.12 0.04 0.00 0.00 177.00 174.16 1wgp s SER 101 N -4.02 3.49 0.68 6.66 0.01 -1.26 -0.66 113.70 118.61 1wgp s SER 101 Ca 0.63 -0.50 -0.17 0.00 1.31 0.00 0.00 55.95 57.22 1wgp s SER 101 Cb -0.15 -1.52 0.01 0.00 0.21 0.00 0.00 66.02 64.57 1wgp s SER 101 CO 0.53 0.09 1.27 -0.94 0.41 0.00 0.00 173.24 174.60 1wgp s SER 102 N 0.75 4.40 -0.06 2.44 1.04 -1.25 -4.93 113.70 116.10 1wgp s SER 102 Ca -0.07 2.54 0.10 0.00 0.48 0.00 0.00 55.95 59.00 1wgp s SER 102 Cb -0.16 -2.61 0.25 0.00 0.10 0.00 0.00 66.02 63.61 1wgp s SER 102 CO 0.00 -2.13 1.19 1.07 0.98 0.00 0.00 173.24 174.35 1wgp n THR 103 N -2.22 1.40 -3.55 2.02 5.66 -1.26 -4.37 114.28 111.95 1wgp n THR 103 Ca 0.15 -1.38 -0.16 0.00 -3.05 0.00 0.00 64.05 59.62 1wgp n THR 103 Cb 0.49 0.23 -0.06 0.00 -1.55 0.00 0.00 70.33 69.44 1wgp n THR 103 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1wgp s ARG 104 N -1.66 1.03 0.09 1.09 1.04 -1.26 -4.93 118.95 114.34 1wgp s ARG 104 Ca 0.21 -0.01 0.06 0.00 -1.04 0.00 0.00 55.73 54.95 1wgp s ARG 104 Cb 0.15 0.48 -0.04 0.00 -2.04 0.00 0.00 34.95 33.50 1wgp s ARG 104 CO 0.08 -0.35 -0.04 0.99 -0.04 0.00 0.00 175.30 175.94 1wgp s THR 105 N -1.83 3.76 0.07 4.99 2.01 -0.15 -4.22 115.64 120.26 1wgp s THR 105 Ca -0.08 -1.09 -0.04 0.00 0.31 0.00 0.00 61.69 60.79 1wgp s THR 105 Cb -0.01 -2.78 -0.02 0.00 0.01 0.00 0.00 72.50 69.70 1wgp s THR 105 CO 0.04 0.12 0.06 -0.69 -0.69 0.00 0.00 174.62 173.46 1wgp s VAL 106 N -1.27 0.19 -0.06 3.82 1.01 -0.97 -0.90 120.40 122.23 1wgp s VAL 106 Ca 0.24 -1.56 -0.17 0.00 0.00 0.00 0.00 61.98 60.48 1wgp s VAL 106 Cb -0.11 -1.46 0.04 0.00 0.00 0.00 0.00 36.38 34.84 1wgp s VAL 106 CO 0.16 -0.86 0.40 -0.75 0.00 0.00 0.00 175.10 174.06 1wgp s LYS 107 N -3.90 0.69 -0.32 2.72 2.20 -1.06 -3.82 119.74 116.25 1wgp s LYS 107 Ca 0.06 0.08 -0.20 0.00 -0.36 0.00 0.00 55.97 55.56 1wgp s LYS 107 Cb 0.07 0.32 -0.01 0.00 -1.51 0.00 0.00 37.83 36.70 1wgp s LYS 107 CO -0.10 -0.18 0.61 0.00 -0.36 0.00 0.00 175.35 175.32 1wgp s ALA 108 N -0.91 3.50 -0.11 3.13 0.00 0.37 -2.14 121.76 125.61 1wgp s ALA 108 Ca -0.10 -0.76 0.22 0.00 0.00 0.00 0.00 51.96 51.33 1wgp s ALA 108 Cb -0.04 -3.09 -0.21 0.00 0.00 0.00 0.00 23.12 19.78 1wgp s ALA 108 CO 0.04 -1.15 0.69 1.28 0.00 0.00 0.00 175.76 176.62 1wgp n LEU 109 N 5.89 0.32 -4.20 0.00 4.32 -1.26 -2.28 117.00 119.78 1wgp n LEU 109 Ca -0.02 0.12 -0.14 0.00 -0.02 0.00 0.00 56.01 55.95 1wgp n LEU 109 Cb 0.49 -0.02 -0.09 0.00 -1.62 0.00 0.00 43.42 42.18 1wgp n LEU 109 CO 0.46 -0.07 -0.14 0.28 -1.22 0.00 0.00 177.39 176.70 1wgp s THR 110 N -3.46 0.00 0.02 -5.08 -1.32 -1.26 -4.87 115.64 99.67 1wgp s THR 110 Ca -0.05 -1.92 -0.30 0.00 -1.21 0.00 0.00 61.69 58.21 1wgp s THR 110 Cb 0.12 -2.49 -0.09 0.00 -1.51 0.00 0.00 72.50 68.54 1wgp s THR 110 CO 0.87 0.00 1.97 -0.70 -2.21 0.00 0.00 174.62 174.55 1wgp s GLU 111 N -3.85 4.08 -0.10 7.08 2.12 -1.26 -4.78 118.70 121.99 1wgp s GLU 111 Ca 0.38 2.56 0.03 0.00 0.36 0.00 0.00 54.97 58.30 1wgp s GLU 111 Cb 0.04 -4.17 0.01 0.00 0.26 0.00 0.00 34.13 30.27 1wgp s GLU 111 CO 0.17 -1.02 -0.20 0.08 -0.54 0.00 0.00 175.26 173.75 1wgp s VAL 112 N 4.67 1.82 -0.27 3.70 1.01 -1.18 -4.60 120.40 125.54 1wgp s VAL 112 Ca 0.89 -0.86 -0.05 0.00 0.00 0.00 0.00 61.98 61.95 1wgp s VAL 112 Cb -0.42 -1.60 0.01 0.00 0.00 0.00 0.00 36.38 34.37 1wgp s VAL 112 CO 0.41 0.51 0.03 -1.61 0.00 0.00 0.00 175.10 174.44 1wgp s GLU 113 N 0.60 3.09 0.34 2.72 8.01 -1.11 -2.92 118.70 129.44 1wgp s GLU 113 Ca -0.14 -0.84 -0.18 0.00 0.01 0.00 0.00 54.97 53.82 1wgp s GLU 113 Cb -0.17 -3.24 0.04 0.00 -4.31 0.00 0.00 34.13 26.45 1wgp s GLU 113 CO 0.04 -0.39 0.75 0.00 0.01 0.00 0.00 175.26 175.67 1wgp s ALA 114 N 1.46 -0.93 0.37 5.21 0.00 -1.26 -2.68 121.76 123.93 1wgp s ALA 114 Ca 0.03 -0.57 0.08 0.00 0.00 0.00 0.00 51.96 51.50 1wgp s ALA 114 Cb -0.17 0.76 -0.04 0.00 0.00 0.00 0.00 23.12 23.68 1wgp s ALA 114 CO 0.00 -1.01 0.24 -0.06 0.00 0.00 0.00 175.76 174.94 1wgp s PHE 115 N -3.04 2.73 0.16 0.00 0.40 -1.20 -4.14 117.98 112.87 1wgp s PHE 115 Ca 0.14 -0.44 0.09 0.00 -0.60 0.00 0.00 56.93 56.12 1wgp s PHE 115 Cb -0.05 -1.88 -0.04 0.00 0.51 0.00 0.00 43.02 41.56 1wgp s PHE 115 CO 0.10 0.16 -0.15 0.00 0.70 0.00 0.00 175.22 176.02 1wgp s ALA 116 N -2.45 2.77 -0.10 5.36 0.00 -1.20 -1.83 121.76 124.31 1wgp s ALA 116 Ca 0.42 -1.45 -0.01 0.00 0.00 0.00 0.00 51.96 50.92 1wgp s ALA 116 Cb -0.02 -0.63 0.03 0.00 0.00 0.00 0.00 23.12 22.49 1wgp s ALA 116 CO 0.25 0.51 -0.04 -1.17 0.00 0.00 0.00 175.76 175.31 1wgp s LEU 117 N -2.52 0.92 0.24 0.00 1.98 0.47 -2.84 118.68 116.94 1wgp s LEU 117 Ca 0.21 -0.21 -0.24 0.00 -2.89 0.00 0.00 54.13 51.00 1wgp s LEU 117 Cb -0.09 -0.66 -0.09 0.00 0.66 0.00 0.00 46.19 46.01 1wgp s LEU 117 CO 0.12 -0.15 0.83 -0.51 -1.89 0.00 0.00 176.35 174.75 1wgp s ILE 118 N 1.83 4.34 0.09 6.68 2.07 -1.26 0.21 121.20 135.16 1wgp s ILE 118 Ca 0.05 1.66 -0.27 0.00 -1.41 0.00 0.00 60.65 60.68 1wgp s ILE 118 Cb -0.12 -4.03 -0.14 0.00 0.13 0.00 0.00 42.46 38.30 1wgp s ILE 118 CO -0.07 0.30 1.68 0.00 -1.91 0.00 0.00 174.94 174.94 1wgp h ALA 119 N 3.64 -0.36 -0.13 1.50 0.00 -1.87 -0.32 119.26 121.72 1wgp h ALA 119 Ca -0.47 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.39 1wgp h ALA 119 Cb 1.20 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 1wgp h ALA 119 CO 0.66 -0.71 -0.08 -3.47 0.00 0.00 0.00 179.25 175.64 1wgp n ASP 120 N -5.28 -0.14 -0.31 0.00 2.03 -1.26 0.18 116.55 111.77 1wgp n ASP 120 Ca -0.09 1.06 0.15 0.00 0.52 0.00 0.00 54.79 56.43 1wgp n ASP 120 Cb 0.20 -0.44 0.39 0.00 -0.72 0.00 0.00 41.12 40.54 1wgp n ASP 120 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1wgp h GLU 121 N 0.00 0.64 0.01 -0.67 4.39 -1.96 0.63 114.58 117.62 1wgp h GLU 121 Ca 0.02 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.68 1wgp h GLU 121 Cb 0.05 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.56 1wgp h GLU 121 CO -0.12 0.42 -0.01 1.25 -1.16 0.00 0.00 179.01 179.39 1wgp h LEU 122 N 0.65 -0.01 -0.88 1.33 6.46 0.26 0.96 115.31 124.07 1wgp h LEU 122 Ca 0.53 0.00 0.22 0.00 -0.12 0.00 0.00 57.88 58.51 1wgp h LEU 122 Cb 0.97 0.00 -0.13 0.00 -0.73 0.00 0.00 40.66 40.78 1wgp h LEU 122 CO -0.29 -0.01 0.36 0.50 -0.62 0.00 0.00 178.44 178.37 1wgp h LYS 123 N -0.02 0.35 0.22 1.25 3.64 0.24 0.97 116.57 123.22 1wgp h LYS 123 Ca -0.00 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1wgp h LYS 123 Cb 0.01 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 1wgp h LYS 123 CO 0.00 0.23 -0.29 0.35 -2.27 0.00 0.00 179.45 177.47 1wgp h PHE 124 N 0.36 -0.82 -0.70 1.91 3.57 0.35 1.50 116.94 123.11 1wgp h PHE 124 Ca 0.55 0.01 0.03 0.00 3.53 0.00 0.00 57.97 62.09 1wgp h PHE 124 Cb 1.06 0.33 -0.04 0.00 2.79 0.00 0.00 35.95 40.09 1wgp h PHE 124 CO -0.16 -0.37 0.46 -0.24 -2.23 0.00 0.00 178.31 175.77 1wgp h VAL 125 N -0.53 1.12 0.40 1.41 3.04 0.22 0.35 116.25 122.25 1wgp h VAL 125 Ca -0.03 -0.30 -0.02 0.00 -1.01 0.00 0.00 66.70 65.35 1wgp h VAL 125 Cb 0.48 0.18 0.00 0.00 -2.01 0.00 0.00 31.29 29.94 1wgp h VAL 125 CO -0.07 0.16 -0.19 0.00 -1.01 0.00 0.00 177.57 176.46 1wgp h ALA 126 N 1.59 -1.07 -0.41 3.17 0.00 0.15 -2.51 119.26 120.18 1wgp h ALA 126 Ca 0.27 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.15 1wgp h ALA 126 Cb 0.02 0.21 -0.08 0.00 0.00 0.00 0.00 17.79 17.93 1wgp h ALA 126 CO -0.07 -1.03 -0.14 1.03 0.00 0.00 0.00 179.25 179.04 1wgp h SER 127 N -0.56 -0.50 -0.99 0.00 0.87 0.23 1.00 113.55 113.60 1wgp h SER 127 Ca -0.05 0.14 0.31 0.00 -1.23 0.00 0.00 61.79 60.95 1wgp h SER 127 Cb 0.41 0.30 -0.18 0.00 -0.44 0.00 0.00 62.40 62.49 1wgp h SER 127 CO 0.09 -0.18 0.16 1.56 -0.53 0.00 0.00 176.83 177.94 1wgp h GLN 128 N -0.05 0.01 0.00 2.24 1.08 -0.28 -1.84 115.11 116.27 1wgp h GLN 128 Ca 0.20 -0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.34 1wgp h GLN 128 Cb 0.36 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.77 1wgp h GLN 128 CO -0.45 0.01 -0.49 0.35 -0.95 0.00 0.00 178.83 177.29 1wgp h PHE 129 N 0.01 0.00 -1.00 2.96 3.57 -0.54 -3.46 116.94 118.48 1wgp h PHE 129 Ca 0.66 0.00 -0.84 0.00 3.53 0.00 0.00 57.97 61.32 1wgp h PHE 129 Cb 1.48 0.00 0.03 0.00 2.79 0.00 0.00 35.95 40.25 1wgp h PHE 129 CO -0.37 0.60 0.41 0.54 -2.23 0.00 0.00 178.31 177.26 1wgp n ARG 130 N -4.60 0.00 -2.89 1.11 5.12 0.33 -4.89 116.66 110.84 1wgp n ARG 130 Ca -0.13 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.80 1wgp n ARG 130 Cb 0.36 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.16 1wgp n ARG 130 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 1wgp s ARG 131 N 1.66 0.45 0.21 5.56 3.52 -1.26 -4.81 118.95 124.27 1wgp s ARG 131 Ca 0.99 -0.22 0.00 0.00 -0.13 0.00 0.00 55.73 56.37 1wgp s ARG 131 Cb -1.40 0.04 0.00 0.00 -1.56 0.00 0.00 34.95 32.03 1wgp s ARG 131 CO 0.71 -0.62 0.00 0.45 -0.81 0.00 0.00 175.30 175.02 1wgp n SER 132 N 3.72 -1.87 0.00 -2.12 2.88 -1.26 -5.17 113.62 109.80 1wgp n SER 132 Ca 0.09 0.58 0.00 0.00 -1.33 0.00 0.00 58.87 58.21 1wgp n SER 132 Cb 0.61 1.96 0.00 0.00 -0.75 0.00 0.00 64.21 66.03 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 -1.32 3.62 3.58 0.46 0.00 -1.26 -5.03 105.19 105.24 1wgp n GLY 133 Ca 0.00 -0.81 -0.36 0.00 0.00 0.00 0.00 46.02 44.85 1wgp n GLY 133 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wgp s PRO 134 N -2.30 3.25 0.55 1.61 0.04 -1.26 -4.75 135.00 132.14 1wgp s PRO 134 Ca 0.00 -1.55 0.00 0.00 0.04 0.00 0.00 61.00 59.49 1wgp s PRO 134 Cb 0.00 -5.39 0.00 0.00 0.04 0.00 0.00 34.50 29.15 1wgp s PRO 134 CO 0.00 -3.09 0.00 0.45 0.04 0.00 0.00 177.00 174.40 1wgp n SER 135 N 11.34 -8.32 -0.05 6.66 2.88 -1.26 -4.88 113.62 119.98 1wgp n SER 135 Ca 0.46 1.60 -0.02 0.00 -1.33 0.00 0.00 58.87 59.58 1wgp n SER 135 Cb 0.46 -4.84 -0.01 0.00 -0.75 0.00 0.00 64.21 59.07 1wgp n SER 135 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1wgp h SER 136 N 0.72 0.00 0.00 -3.46 0.87 -2.00 -3.54 113.55 106.14 1wgp h SER 136 Ca 0.00 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 1wgp h SER 136 Cb 0.58 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.54 1wgp h SER 136 CO 0.00 0.58 0.00 0.61 -0.53 0.00 0.00 176.83 177.49