#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 1.80 0.32 1.61 0.01 -1.26 -4.99 113.70 111.20 1wgp s SER 2 Ca 0.00 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 56.79 1wgp s SER 2 Cb 0.00 -0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.11 1wgp s SER 2 CO 0.00 0.06 0.00 -1.20 0.41 0.00 0.00 173.24 172.51 1wgp n SER 3 N 1.90 -2.92 0.00 2.44 7.64 -1.26 -5.15 113.62 116.27 1wgp n SER 3 Ca -0.18 0.75 0.00 0.00 1.01 0.00 0.00 58.87 60.45 1wgp n SER 3 Cb 0.54 2.85 0.00 0.00 -1.01 0.00 0.00 64.21 66.60 1wgp n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wgp n GLY 4 N -1.36 1.20 3.11 0.23 0.00 -1.26 -4.99 105.19 102.12 1wgp n GLY 4 Ca 0.00 -0.72 -0.18 0.00 0.00 0.00 0.00 46.02 45.12 1wgp n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wgp n SER 5 N 3.62 -7.06 -0.08 1.61 3.41 -1.24 -4.97 113.62 108.91 1wgp n SER 5 Ca 0.00 0.21 -0.11 0.00 -0.26 0.00 0.00 58.87 58.70 1wgp n SER 5 Cb 0.00 -4.08 -0.08 0.00 -0.26 0.00 0.00 64.21 59.79 1wgp n SER 5 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1wgp n SER 6 N -0.49 2.63 -2.56 4.04 7.64 -1.26 -4.38 113.62 119.25 1wgp n SER 6 Ca 0.03 -0.09 -0.29 0.00 1.01 0.00 0.00 58.87 59.53 1wgp n SER 6 Cb 0.54 -0.21 -0.04 0.00 -1.01 0.00 0.00 64.21 63.49 1wgp n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wgp n GLY 7 N 2.67 4.51 1.91 0.23 0.00 -1.25 -3.97 105.19 109.27 1wgp n GLY 7 Ca -0.30 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 43.76 1wgp n GLY 7 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1wgp n VAL 8 N 0.70 0.00 -1.50 1.61 0.31 -1.26 -4.91 118.33 113.27 1wgp n VAL 8 Ca 0.50 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 64.42 1wgp n VAL 8 Cb 0.51 -0.18 -0.09 0.00 -0.91 0.00 0.00 33.84 33.17 1wgp n VAL 8 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1wgp n ARG 9 N -2.45 0.52 -2.95 5.55 0.63 -1.25 0.10 116.66 116.80 1wgp n ARG 9 Ca 0.00 0.03 -0.11 0.00 -0.92 0.00 0.00 57.85 56.85 1wgp n ARG 9 Cb 0.00 -2.35 0.04 0.00 0.45 0.00 0.00 32.46 30.60 1wgp n ARG 9 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 1wgp n ARG 10 N 8.63 -3.60 -3.11 -0.14 3.00 -1.26 -5.01 116.66 115.17 1wgp n ARG 10 Ca 0.52 0.39 -0.39 0.00 -0.00 0.00 0.00 57.85 58.37 1wgp n ARG 10 Cb 0.25 -4.07 -0.06 0.00 0.00 0.00 0.00 32.46 28.58 1wgp n ARG 10 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1wgp s VAL 11 N -3.15 4.53 0.20 5.15 1.01 0.29 -4.97 120.40 123.46 1wgp s VAL 11 Ca 0.23 1.46 0.06 0.00 0.00 0.00 0.00 61.98 63.73 1wgp s VAL 11 Cb -0.10 -4.01 -0.11 0.00 0.00 0.00 0.00 36.38 32.16 1wgp s VAL 11 CO 0.34 0.49 1.46 1.55 0.00 0.00 0.00 175.10 178.94 1wgp h PRO 12 N 4.27 0.11 -0.91 2.72 0.13 -1.95 -3.26 132.00 133.11 1wgp h PRO 12 Ca -0.48 -0.11 0.17 0.00 -0.87 0.00 0.00 66.00 64.71 1wgp h PRO 12 Cb 1.21 0.03 -0.17 0.00 0.13 0.00 0.00 31.00 32.20 1wgp h PRO 12 CO 0.65 0.83 -0.26 -0.07 -0.23 0.00 0.00 178.00 178.92 1wgp h LEU 13 N 0.07 -0.96 -4.49 1.56 3.38 -1.96 0.53 115.31 113.43 1wgp h LEU 13 Ca -0.02 0.28 -0.45 0.00 0.09 0.00 0.00 57.88 57.78 1wgp h LEU 13 Cb 1.36 0.60 -0.15 0.00 0.09 0.00 0.00 40.66 42.57 1wgp h LEU 13 CO 0.11 -0.30 0.40 0.49 0.09 0.00 0.00 178.44 179.23 1wgp n PHE 14 N -5.56 1.33 -0.07 1.13 3.72 -1.23 -4.42 117.46 112.35 1wgp n PHE 14 Ca 0.13 -1.92 -0.12 0.00 -0.05 0.00 0.00 57.45 55.49 1wgp n PHE 14 Cb 0.45 -1.47 -0.08 0.00 -0.94 0.00 0.00 39.48 37.43 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 3.13 0.00 -0.64 -1.08 4.39 -0.13 -3.35 114.58 116.89 1wgp h GLU 15 Ca 0.38 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.08 1wgp h GLU 15 Cb 0.86 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 1wgp h GLU 15 CO 0.79 0.66 0.00 0.27 -1.16 0.00 0.00 179.01 179.57 1wgp n ASN 16 N -4.60 4.27 -4.82 1.42 6.94 -1.26 -4.90 115.26 112.31 1wgp n ASN 16 Ca -0.13 -2.41 -0.36 0.00 -0.02 0.00 0.00 54.58 51.65 1wgp n ASN 16 Cb 0.41 -0.55 -0.07 0.00 -2.36 0.00 0.00 39.78 37.21 1wgp n ASN 16 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 1wgp s MET 17 N -1.85 3.56 0.57 -3.83 -1.94 -1.26 -5.07 119.30 109.49 1wgp s MET 17 Ca 0.45 -0.19 -0.12 0.00 -1.71 0.00 0.00 55.69 54.12 1wgp s MET 17 Cb 0.29 -3.19 -0.05 0.00 2.01 0.00 0.00 34.83 33.89 1wgp s MET 17 CO 0.21 0.65 0.99 -0.51 -0.01 0.00 0.00 175.02 176.35 1wgp s ASP 18 N -0.68 6.36 0.16 3.03 1.11 -1.26 -4.95 116.67 120.44 1wgp s ASP 18 Ca 0.13 1.42 -0.16 0.00 0.18 0.00 0.00 52.55 54.12 1wgp s ASP 18 Cb -0.12 -2.46 0.07 0.00 1.07 0.00 0.00 42.92 41.48 1wgp s ASP 18 CO 0.02 -0.75 1.75 -0.33 1.18 0.00 0.00 175.17 177.05 1wgp h GLU 19 N 0.15 0.28 -0.58 8.23 5.08 -1.98 0.46 114.58 126.21 1wgp h GLU 19 Ca -0.45 -0.02 0.17 0.00 -1.00 0.00 0.00 59.36 58.06 1wgp h GLU 19 Cb 1.19 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.35 1wgp h GLU 19 CO 0.62 0.19 0.63 0.00 -1.00 0.00 0.00 179.01 179.45 1wgp h ARG 20 N 0.29 0.00 0.09 2.33 2.47 -2.00 1.31 114.38 118.86 1wgp h ARG 20 Ca 0.17 0.00 -0.25 0.00 -1.26 0.00 0.00 59.98 58.64 1wgp h ARG 20 Cb 0.15 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.47 1wgp h ARG 20 CO -0.17 0.00 -1.14 1.25 0.56 0.00 0.00 179.97 180.47 1wgp h LEU 21 N 0.00 0.42 0.21 3.04 5.85 -1.28 -1.76 115.31 121.79 1wgp h LEU 21 Ca 0.28 -0.41 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 1wgp h LEU 21 Cb 1.54 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.44 1wgp h LEU 21 CO -0.00 1.28 -0.13 -0.07 -0.34 0.00 0.00 178.44 179.18 1wgp h LEU 22 N 0.11 -0.32 0.31 2.25 -0.00 0.20 0.56 115.31 118.41 1wgp h LEU 22 Ca -0.11 0.02 -0.01 0.00 -0.00 0.00 0.00 57.88 57.77 1wgp h LEU 22 Cb 1.84 0.10 0.00 0.00 -0.00 0.00 0.00 40.66 42.60 1wgp h LEU 22 CO 0.19 -0.21 -0.15 -0.78 -0.00 0.00 0.00 178.44 177.49 1wgp h ASP 23 N -0.33 -0.35 -0.51 -0.43 3.58 -1.48 0.82 116.42 117.73 1wgp h ASP 23 Ca -0.02 -0.11 0.10 0.00 0.42 0.00 0.00 57.03 57.42 1wgp h ASP 23 Cb 0.28 0.09 -0.10 0.00 1.72 0.00 0.00 39.33 41.31 1wgp h ASP 23 CO 0.02 -0.08 -0.23 0.00 -2.88 0.00 0.00 179.24 176.07 1wgp h ALA 24 N 0.01 0.13 -0.02 -0.78 0.00 -1.21 1.67 119.26 119.07 1wgp h ALA 24 Ca -0.04 0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1wgp h ALA 24 Cb 0.44 0.57 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1wgp h ALA 24 CO 0.07 -0.56 -0.37 0.82 0.00 0.00 0.00 179.25 179.20 1wgp h ILE 25 N -0.11 1.28 0.21 0.00 2.04 0.25 -2.29 117.51 118.89 1wgp h ILE 25 Ca 0.24 -1.31 -0.01 0.00 1.00 0.00 0.00 64.86 64.77 1wgp h ILE 25 Cb 0.48 1.68 0.00 0.00 -0.74 0.00 0.00 36.82 38.25 1wgp h ILE 25 CO -0.58 0.38 -0.10 0.00 0.00 0.00 0.00 178.15 177.84 1wgp h GLU 27 N -0.41 0.00 -0.40 0.00 5.08 0.21 1.49 114.58 120.55 1wgp h GLU 27 Ca -0.03 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.23 1wgp h GLU 27 Cb 0.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1wgp h GLU 27 CO 0.05 0.00 -0.14 0.00 -1.00 0.00 0.00 179.01 177.92 1wgp h ARG 28 N 0.00 0.80 -5.84 2.33 2.47 -1.23 -3.44 114.38 109.47 1wgp h ARG 28 Ca 0.61 -0.32 -0.84 0.00 -1.26 0.00 0.00 59.98 58.17 1wgp h ARG 28 Cb 2.74 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 31.03 1wgp h ARG 28 CO -0.01 0.95 0.78 1.28 0.56 0.00 0.00 179.97 183.52 1wgp n LEU 29 N -4.29 1.10 -4.90 3.04 4.77 0.51 -4.89 117.00 112.33 1wgp n LEU 29 Ca -0.01 1.07 -0.30 0.00 -0.03 0.00 0.00 56.01 56.74 1wgp n LEU 29 Cb 0.39 -0.86 -0.04 0.00 -2.33 0.00 0.00 43.42 40.58 1wgp n LEU 29 CO 0.44 -0.81 0.10 -0.54 -1.33 0.00 0.00 177.39 175.25 1wgp s LYS 30 N 3.41 3.62 -0.44 3.23 1.02 -1.16 -4.91 119.74 124.52 1wgp s LYS 30 Ca 1.05 -0.07 -0.29 0.00 0.02 0.00 0.00 55.97 56.68 1wgp s LYS 30 Cb -1.46 -2.77 0.01 0.00 -0.52 0.00 0.00 37.83 33.09 1wgp s LYS 30 CO 0.77 0.37 1.43 -1.25 -0.92 0.00 0.00 175.35 175.74 1wgp s PRO 31 N -3.05 3.50 0.11 -1.68 0.04 -1.26 -3.17 135.00 129.49 1wgp s PRO 31 Ca 0.42 0.84 -0.03 0.00 0.04 0.00 0.00 61.00 62.27 1wgp s PRO 31 Cb -0.11 -4.05 -0.03 0.00 0.04 0.00 0.00 34.50 30.34 1wgp s PRO 31 CO 0.26 -1.66 0.07 0.00 0.04 0.00 0.00 177.00 175.71 1wgp s LEU 33 N -2.98 1.77 -0.08 0.00 2.96 -1.26 -3.79 118.68 115.31 1wgp s LEU 33 Ca 0.16 -0.28 0.03 0.00 -0.22 0.00 0.00 54.13 53.83 1wgp s LEU 33 Cb 0.07 0.47 -0.01 0.00 0.50 0.00 0.00 46.19 47.22 1wgp s LEU 33 CO -0.03 -0.33 -0.19 -0.36 -1.32 0.00 0.00 176.35 174.12 1wgp s PHE 34 N -1.32 2.63 0.00 5.38 0.08 -1.18 -4.99 117.98 118.57 1wgp s PHE 34 Ca -0.14 -0.59 0.00 0.00 0.12 0.00 0.00 56.93 56.32 1wgp s PHE 34 Cb -0.08 -1.69 0.00 0.00 -0.57 0.00 0.00 43.02 40.68 1wgp s PHE 34 CO 0.01 -0.13 0.00 0.25 -0.10 0.00 0.00 175.22 175.24 1wgp n THR 35 N 3.01 0.00 -2.01 0.64 -2.24 -1.26 -2.05 114.28 110.37 1wgp n THR 35 Ca -0.18 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.20 1wgp n THR 35 Cb 0.52 -0.22 -0.01 0.00 -2.10 0.00 0.00 70.33 68.52 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 -1.64 4.08 -0.79 -0.78 -1.05 -1.26 -2.71 118.70 114.54 1wgp s GLU 36 Ca 0.00 2.25 -0.04 0.00 -0.15 0.00 0.00 54.97 57.03 1wgp s GLU 36 Cb 0.00 -2.87 0.00 0.00 -0.44 0.00 0.00 34.13 30.83 1wgp s GLU 36 CO 0.00 -0.44 0.55 1.63 0.95 0.00 0.00 175.26 177.95 1wgp n LYS 37 N 0.34 -3.84 -4.01 -4.83 5.02 -0.91 -5.01 118.16 104.91 1wgp n LYS 37 Ca 0.02 0.48 -0.35 0.00 -2.02 0.00 0.00 58.31 56.44 1wgp n LYS 37 Cb 0.42 -4.43 -0.14 0.00 -0.02 0.00 0.00 35.03 30.86 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 -3.06 4.13 -0.29 4.39 0.01 -1.10 -4.98 113.70 112.80 1wgp s SER 38 Ca 0.27 -0.41 -0.12 0.00 1.31 0.00 0.00 55.95 57.00 1wgp s SER 38 Cb -0.12 -1.70 -0.04 0.00 0.21 0.00 0.00 66.02 64.37 1wgp s SER 38 CO 0.34 0.00 0.23 -0.31 0.41 0.00 0.00 173.24 173.91 1wgp s TYR 39 N 1.34 3.22 -0.12 2.43 2.02 -1.26 -1.49 117.35 123.51 1wgp s TYR 39 Ca 0.04 0.12 -0.05 0.00 -0.37 0.00 0.00 57.07 56.81 1wgp s TYR 39 Cb -0.14 -2.43 -0.03 0.00 -0.40 0.00 0.00 41.96 38.96 1wgp s TYR 39 CO -0.04 -0.20 0.01 -0.07 -1.57 0.00 0.00 175.55 173.68 1wgp h LEU 40 N 8.43 0.00 -8.53 -1.29 4.07 -1.94 -3.48 115.31 112.56 1wgp h LEU 40 Ca -0.34 -0.08 -0.32 0.00 0.08 0.00 0.00 57.88 57.22 1wgp h LEU 40 Cb 1.18 0.00 -0.17 0.00 1.08 0.00 0.00 40.66 42.76 1wgp h LEU 40 CO 0.58 0.62 -0.73 0.68 -1.08 0.00 0.00 178.44 178.51 1wgp s VAL 41 N -1.79 1.04 0.21 1.22 -7.23 -1.26 -4.99 120.40 107.60 1wgp s VAL 41 Ca -0.06 -1.81 0.07 0.00 -1.81 0.00 0.00 61.98 58.37 1wgp s VAL 41 Cb 0.00 -1.57 -0.05 0.00 0.56 0.00 0.00 36.38 35.33 1wgp s VAL 41 CO 0.12 -0.63 -0.12 -0.13 -0.31 0.00 0.00 175.10 174.02 1wgp s ARG 42 N -3.18 1.35 -0.30 4.82 3.00 -1.26 -3.00 118.95 120.37 1wgp s ARG 42 Ca 0.10 -1.61 -0.15 0.00 0.00 0.00 0.00 55.73 54.07 1wgp s ARG 42 Cb -0.01 -1.08 -0.03 0.00 0.00 0.00 0.00 34.95 33.84 1wgp s ARG 42 CO 0.00 0.15 0.38 -1.21 0.00 0.00 0.00 175.30 174.62 1wgp s GLU 43 N -3.67 3.86 0.00 3.54 0.41 -1.26 -4.04 118.70 117.54 1wgp s GLU 43 Ca 0.23 -0.10 0.00 0.00 -0.41 0.00 0.00 54.97 54.69 1wgp s GLU 43 Cb 0.00 -3.71 0.00 0.00 -1.78 0.00 0.00 34.13 28.64 1wgp s GLU 43 CO 0.07 -0.38 0.00 0.41 -0.49 0.00 0.00 175.26 174.87 1wgp n GLY 44 N 4.78 1.84 3.89 -1.39 0.00 -1.26 -5.04 105.19 108.01 1wgp n GLY 44 Ca -0.08 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.56 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 0.01 6.39 0.95 1.61 -4.77 -1.26 -5.00 116.67 114.59 1wgp s ASP 45 Ca 0.00 0.97 -0.13 0.00 -3.30 0.00 0.00 52.55 50.08 1wgp s ASP 45 Cb 0.00 -2.26 0.16 0.00 -1.09 0.00 0.00 42.92 39.73 1wgp s ASP 45 CO 0.00 -0.45 1.16 -2.16 0.70 0.00 0.00 175.17 174.41 1wgp s PRO 46 N -4.24 0.82 -0.29 2.11 0.04 -1.26 -3.80 135.00 128.39 1wgp s PRO 46 Ca 0.48 0.17 -0.04 0.00 0.04 0.00 0.00 61.00 61.65 1wgp s PRO 46 Cb -0.10 -1.81 0.03 0.00 0.04 0.00 0.00 34.50 32.65 1wgp s PRO 46 CO 0.37 -2.39 0.02 0.08 0.04 0.00 0.00 177.00 175.13 1wgp s VAL 47 N -3.32 3.38 -0.08 -0.36 1.01 0.36 -4.82 120.40 116.57 1wgp s VAL 47 Ca 0.66 -1.03 -0.17 0.00 0.00 0.00 0.00 61.98 61.44 1wgp s VAL 47 Cb -0.13 -2.81 -0.29 0.00 0.00 0.00 0.00 36.38 33.15 1wgp s VAL 47 CO 0.54 0.03 0.67 -1.13 0.00 0.00 0.00 175.10 175.20 1wgp h ASN 48 N 8.11 0.45 -4.62 3.32 -1.24 -1.95 -3.39 115.58 116.26 1wgp h ASN 48 Ca -0.28 -0.89 -0.18 0.00 0.71 0.00 0.00 56.30 55.67 1wgp h ASN 48 Cb 1.10 -0.15 -0.23 0.00 0.73 0.00 0.00 38.32 39.77 1wgp h ASN 48 CO 0.58 1.59 -0.63 -1.83 -1.29 0.00 0.00 177.43 175.85 1wgp s GLU 49 N -2.48 0.28 -0.00 6.67 1.03 -1.26 -2.77 118.70 120.17 1wgp s GLU 49 Ca -0.17 -0.35 -0.09 0.00 0.03 0.00 0.00 54.97 54.38 1wgp s GLU 49 Cb 0.04 0.11 -0.05 0.00 -0.80 0.00 0.00 34.13 33.43 1wgp s GLU 49 CO 0.80 -0.05 0.30 1.41 -1.33 0.00 0.00 175.26 176.39 1wgp s MET 50 N -1.00 3.67 -0.10 -4.83 1.75 0.55 -4.83 119.30 114.52 1wgp s MET 50 Ca -0.11 0.08 -0.01 0.00 -1.25 0.00 0.00 55.69 54.40 1wgp s MET 50 Cb -0.07 -3.12 -0.03 0.00 2.84 0.00 0.00 34.83 34.46 1wgp s MET 50 CO -0.00 0.67 -0.06 -0.51 -0.65 0.00 0.00 175.02 174.47 1wgp s LEU 51 N -1.49 3.18 -0.40 4.11 2.01 -1.25 -0.26 118.68 124.58 1wgp s LEU 51 Ca 0.25 -0.06 -0.03 0.00 0.01 0.00 0.00 54.13 54.30 1wgp s LEU 51 Cb -0.14 -1.72 0.10 0.00 0.01 0.00 0.00 46.19 44.45 1wgp s LEU 51 CO 0.14 0.30 0.20 -0.36 1.01 0.00 0.00 176.35 177.63 1wgp s PHE 52 N -0.43 3.55 -0.02 0.29 0.40 -1.09 -2.96 117.98 117.72 1wgp s PHE 52 Ca 0.06 -2.31 -0.35 0.00 -0.60 0.00 0.00 56.93 53.73 1wgp s PHE 52 Cb -0.12 -3.14 -0.14 0.00 0.51 0.00 0.00 43.02 40.13 1wgp s PHE 52 CO 0.02 -0.96 1.71 -0.89 0.70 0.00 0.00 175.22 175.80 1wgp n ILE 53 N 4.63 0.30 -0.13 0.64 2.08 -1.26 -3.72 119.36 121.89 1wgp n ILE 53 Ca -0.04 -0.05 -0.29 0.00 0.56 0.00 0.00 62.75 62.93 1wgp n ILE 53 Cb 0.42 -1.56 -0.10 0.00 -0.75 0.00 0.00 39.64 37.65 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 4.24 1.53 -3.64 1.39 2.08 -1.19 -4.23 119.36 119.54 1wgp n ILE 54 Ca 0.21 -0.36 -0.06 0.00 0.56 0.00 0.00 62.75 63.11 1wgp n ILE 54 Cb 0.26 -1.88 -0.07 0.00 -0.75 0.00 0.00 39.64 37.20 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 -2.49 0.35 0.00 0.38 0.52 -1.20 -3.67 118.95 112.84 1wgp s ARG 55 Ca -0.38 0.47 0.00 0.00 -0.52 0.00 0.00 55.73 55.30 1wgp s ARG 55 Cb 0.14 0.15 0.00 0.00 0.52 0.00 0.00 34.95 35.75 1wgp s ARG 55 CO 0.51 -0.05 0.00 0.41 0.02 0.00 0.00 175.30 176.19 1wgp n GLY 56 N 2.46 0.93 3.35 -3.53 0.00 -1.26 -3.28 105.19 103.86 1wgp n GLY 56 Ca -0.14 -1.93 -0.18 0.00 0.00 0.00 0.00 46.02 43.78 1wgp n GLY 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wgp s ARG 57 N -1.78 1.35 0.29 1.61 1.81 -1.26 -4.32 118.95 116.64 1wgp s ARG 57 Ca 0.00 -1.65 -0.18 0.00 -1.72 0.00 0.00 55.73 52.18 1wgp s ARG 57 Cb 0.00 -0.86 0.02 0.00 -0.45 0.00 0.00 34.95 33.66 1wgp s ARG 57 CO 0.00 0.02 0.66 -0.51 -0.68 0.00 0.00 175.30 174.79 1wgp s LEU 58 N -3.32 -0.04 -0.18 2.53 1.02 -1.25 -4.65 118.68 112.79 1wgp s LEU 58 Ca 0.26 -0.79 0.01 0.00 0.02 0.00 0.00 54.13 53.62 1wgp s LEU 58 Cb 0.03 2.46 0.01 0.00 0.02 0.00 0.00 46.19 48.72 1wgp s LEU 58 CO 0.08 -1.34 -0.18 -1.83 0.02 0.00 0.00 176.35 173.10 1wgp s GLU 59 N -3.71 3.06 -0.14 1.70 -1.05 -0.07 -3.05 118.70 115.44 1wgp s GLU 59 Ca 0.15 -0.80 -0.13 0.00 -0.15 0.00 0.00 54.97 54.04 1wgp s GLU 59 Cb -0.04 -2.61 -0.05 0.00 -0.44 0.00 0.00 34.13 30.99 1wgp s GLU 59 CO 0.09 -0.16 0.27 0.45 0.95 0.00 0.00 175.26 176.85 1wgp s SER 60 N 1.21 6.45 -0.04 0.83 0.15 0.15 -1.02 113.70 121.42 1wgp s SER 60 Ca 0.03 0.52 -0.06 0.00 0.70 0.00 0.00 55.95 57.14 1wgp s SER 60 Cb -0.14 -2.16 0.01 0.00 -1.71 0.00 0.00 66.02 62.02 1wgp s SER 60 CO -0.09 0.18 0.15 -0.69 1.20 0.00 0.00 173.24 173.99 1wgp s VAL 61 N 0.05 0.02 -0.04 4.45 1.01 0.82 0.19 120.40 126.90 1wgp s VAL 61 Ca 0.16 -0.16 -0.02 0.00 0.00 0.00 0.00 61.98 61.97 1wgp s VAL 61 Cb -0.13 -0.27 0.03 0.00 0.00 0.00 0.00 36.38 36.01 1wgp s VAL 61 CO 0.04 -0.09 0.09 0.28 0.00 0.00 0.00 175.10 175.42 1wgp s THR 62 N -0.24 -0.05 -0.21 3.92 -1.32 -1.22 0.12 115.64 116.64 1wgp s THR 62 Ca -0.03 0.18 -0.17 0.00 -1.21 0.00 0.00 61.69 60.46 1wgp s THR 62 Cb -0.03 -0.15 -0.08 0.00 -1.51 0.00 0.00 72.50 70.73 1wgp s THR 62 CO 0.00 0.07 -0.34 0.35 -2.21 0.00 0.00 174.62 172.50 1wgp n THR 63 N 4.06 1.51 -1.65 5.08 -2.24 -1.26 -1.54 114.28 118.23 1wgp n THR 63 Ca -0.25 -0.01 -0.61 0.00 -2.27 0.00 0.00 64.05 60.90 1wgp n THR 63 Cb 0.52 -2.22 -0.09 0.00 -2.10 0.00 0.00 70.33 66.44 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 -4.41 1.72 0.00 3.42 2.03 -1.26 -4.51 116.55 113.55 1wgp n ASP 64 Ca -0.25 1.02 0.00 0.00 0.52 0.00 0.00 54.79 56.08 1wgp n ASP 64 Cb 0.62 -1.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.00 1wgp n ASP 64 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wgp n GLY 65 N 4.71 -1.91 2.28 0.27 0.00 -1.26 -5.05 105.19 104.23 1wgp n GLY 65 Ca 0.33 0.53 -0.25 0.00 0.00 0.00 0.00 46.02 46.63 1wgp n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wgp n GLY 66 N -1.33 3.01 3.18 -0.02 0.00 -1.26 -5.01 105.19 103.76 1wgp n GLY 66 Ca 0.00 -1.71 -0.00 0.00 0.00 0.00 0.00 46.02 44.31 1wgp n GLY 66 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1wgp n ARG 67 N 1.62 -0.31 -1.41 1.61 0.63 -1.26 -4.65 116.66 112.90 1wgp n ARG 67 Ca 0.24 0.79 0.00 0.00 -0.92 0.00 0.00 57.85 57.96 1wgp n ARG 67 Cb 0.50 -1.01 -0.00 0.00 0.45 0.00 0.00 32.46 32.40 1wgp n ARG 67 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1wgp n SER 68 N 1.31 -7.59 0.00 6.15 7.64 -1.26 -5.09 113.62 114.78 1wgp n SER 68 Ca -0.00 1.68 0.00 0.00 1.01 0.00 0.00 58.87 61.56 1wgp n SER 68 Cb 0.48 -4.46 0.00 0.00 -1.01 0.00 0.00 64.21 59.22 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 -2.53 4.33 3.52 0.23 0.00 -1.26 -4.94 105.19 104.54 1wgp n GLY 69 Ca -0.00 -0.92 -0.42 0.00 0.00 0.00 0.00 46.02 44.68 1wgp n GLY 69 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1wgp n PHE 70 N -1.62 1.45 -1.35 1.61 3.72 -1.26 -4.87 117.46 115.15 1wgp n PHE 70 Ca 0.00 0.16 -0.38 0.00 -0.05 0.00 0.00 57.45 57.18 1wgp n PHE 70 Cb 0.00 -2.59 0.04 0.00 -0.94 0.00 0.00 39.48 35.99 1wgp n PHE 70 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 1wgp n TYR 71 N 12.61 -1.34 -2.92 1.38 0.18 -1.26 -4.87 117.16 120.94 1wgp n TYR 71 Ca 0.41 0.40 -0.43 0.00 1.88 0.00 0.00 57.90 60.16 1wgp n TYR 71 Cb 0.36 -1.87 -0.05 0.00 -0.38 0.00 0.00 39.34 37.40 1wgp n TYR 71 CO 0.00 0.00 0.00 1.21 -2.08 0.00 0.00 176.86 175.99 1wgp s ASN 72 N -1.21 6.38 0.39 9.48 2.47 -0.59 -4.84 114.94 127.02 1wgp s ASN 72 Ca 0.64 -0.24 -0.25 0.00 0.42 0.00 0.00 52.86 53.43 1wgp s ASN 72 Cb -0.42 -2.40 -0.09 0.00 -1.45 0.00 0.00 41.25 36.89 1wgp s ASN 72 CO 0.59 -1.03 1.12 -0.60 -3.72 0.00 0.00 177.10 173.46 1wgp s ARG 73 N 3.50 4.14 0.30 0.43 3.52 -1.26 -3.41 118.95 126.16 1wgp s ARG 73 Ca 0.29 1.73 -0.09 0.00 -0.13 0.00 0.00 55.73 57.53 1wgp s ARG 73 Cb -0.13 -2.67 0.00 0.00 -1.56 0.00 0.00 34.95 30.60 1wgp s ARG 73 CO 0.21 -0.22 0.51 -1.12 -0.81 0.00 0.00 175.30 173.87 1wgp s SER 74 N -1.26 0.29 0.07 -2.12 0.01 0.50 -4.97 113.70 106.22 1wgp s SER 74 Ca 0.56 -1.17 0.05 0.00 1.31 0.00 0.00 55.95 56.70 1wgp s SER 74 Cb -0.28 0.64 -0.03 0.00 0.21 0.00 0.00 66.02 66.56 1wgp s SER 74 CO 0.35 -1.26 -0.13 -0.22 0.41 0.00 0.00 173.24 172.39 1wgp s LEU 75 N -3.11 2.29 0.25 2.44 2.96 -1.26 0.31 118.68 122.56 1wgp s LEU 75 Ca 0.25 -0.63 0.11 0.00 -0.22 0.00 0.00 54.13 53.65 1wgp s LEU 75 Cb -0.01 -0.47 -0.05 0.00 0.50 0.00 0.00 46.19 46.16 1wgp s LEU 75 CO 0.13 -0.10 -0.18 -0.76 -1.32 0.00 0.00 176.35 174.12 1wgp s LEU 76 N -1.78 2.64 0.00 -0.68 1.43 -1.17 -4.82 118.68 114.29 1wgp s LEU 76 Ca -0.02 -0.92 0.01 0.00 -1.03 0.00 0.00 54.13 52.17 1wgp s LEU 76 Cb -0.09 -1.22 -0.00 0.00 0.03 0.00 0.00 46.19 44.90 1wgp s LEU 76 CO 0.02 0.06 0.03 2.29 0.23 0.00 0.00 176.35 178.99 1wgp n LYS 77 N -0.38 0.81 -1.97 1.70 2.85 -1.26 -3.93 118.16 115.99 1wgp n LYS 77 Ca -0.07 -0.77 -0.42 0.00 -1.05 0.00 0.00 58.31 55.99 1wgp n LYS 77 Cb 0.59 0.43 -0.03 0.00 -0.65 0.00 0.00 35.03 35.37 1wgp n LYS 77 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 1wgp s GLU 78 N -2.35 4.18 0.00 -1.58 2.02 -1.26 -2.49 118.70 117.23 1wgp s GLU 78 Ca 0.05 2.24 0.00 0.00 0.02 0.00 0.00 54.97 57.28 1wgp s GLU 78 Cb 0.00 -3.97 0.00 0.00 0.10 0.00 0.00 34.13 30.26 1wgp s GLU 78 CO 0.03 -0.85 0.00 0.41 0.02 0.00 0.00 175.26 174.88 1wgp n GLY 79 N 4.16 0.83 3.76 -1.39 0.00 -1.26 -4.76 105.19 106.52 1wgp n GLY 79 Ca 0.17 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.65 7.49 0.37 1.61 -1.08 -1.04 -3.92 116.67 119.44 1wgp s ASP 80 Ca 0.00 2.04 0.08 0.00 -0.52 0.00 0.00 52.55 54.15 1wgp s ASP 80 Cb 0.00 -2.61 -0.06 0.00 -1.46 0.00 0.00 42.92 38.79 1wgp s ASP 80 CO 0.00 0.03 0.02 0.72 0.52 0.00 0.00 175.17 176.46 1wgp s PHE 81 N -1.22 2.52 0.31 -5.34 -0.12 -1.26 -4.31 117.98 108.56 1wgp s PHE 81 Ca 0.43 -0.53 0.07 0.00 -0.05 0.00 0.00 56.93 56.85 1wgp s PHE 81 Cb -0.27 -1.62 -0.06 0.00 -0.63 0.00 0.00 43.02 40.44 1wgp s PHE 81 CO 0.34 0.44 -0.05 0.00 -0.05 0.00 0.00 175.22 175.90 1wgp n GLY 83 N -0.67 -0.48 0.24 0.00 0.00 -1.26 -3.90 105.19 99.11 1wgp n GLY 83 Ca -0.05 0.02 0.06 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.28 0.00 -0.91 1.61 2.03 -1.88 -1.58 116.42 115.40 1wgp h ASP 84 Ca -0.20 0.00 0.21 0.00 -0.73 0.00 0.00 57.03 56.31 1wgp h ASP 84 Cb 1.14 0.00 -0.07 0.00 -0.83 0.00 0.00 39.33 39.57 1wgp h ASP 84 CO 0.28 0.12 0.60 -0.33 -1.03 0.00 0.00 179.24 178.88 1wgp h GLU 85 N 0.00 0.37 0.51 4.15 3.07 -1.89 -0.48 114.58 120.31 1wgp h GLU 85 Ca -0.00 -0.02 -0.02 0.00 -0.50 0.00 0.00 59.36 58.81 1wgp h GLU 85 Cb 0.21 -0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.04 1wgp h GLU 85 CO 0.02 0.24 -0.28 1.25 -1.40 0.00 0.00 179.01 178.84 1wgp h LEU 86 N 0.38 -0.68 -0.83 1.33 5.85 -1.65 1.14 115.31 120.84 1wgp h LEU 86 Ca 0.47 0.03 0.18 0.00 0.84 0.00 0.00 57.88 59.41 1wgp h LEU 86 Cb 1.23 0.19 -0.15 0.00 0.37 0.00 0.00 40.66 42.30 1wgp h LEU 86 CO -0.17 -0.46 -0.12 0.25 -0.34 0.00 0.00 178.44 177.60 1wgp h LEU 87 N -0.74 -0.62 -0.20 2.25 5.85 -1.21 0.33 115.31 120.98 1wgp h LEU 87 Ca -0.06 0.24 -0.09 0.00 0.84 0.00 0.00 57.88 58.80 1wgp h LEU 87 Cb 0.59 0.47 -0.00 0.00 0.37 0.00 0.00 40.66 42.08 1wgp h LEU 87 CO 0.09 -0.26 -0.23 0.74 -0.34 0.00 0.00 178.44 178.44 1wgp h THR 88 N 0.03 1.33 -0.23 1.05 2.02 -1.15 -2.59 112.91 113.36 1wgp h THR 88 Ca 0.43 -1.41 0.02 0.00 0.77 0.00 0.00 66.41 66.22 1wgp h THR 88 Cb 0.73 1.79 -0.03 0.00 -1.74 0.00 0.00 68.15 68.90 1wgp h THR 88 CO -0.82 0.43 -0.19 -0.25 0.37 0.00 0.00 175.52 175.07 1wgp h TRP 89 N 0.18 -0.59 -0.63 3.16 7.01 0.51 1.64 115.95 127.23 1wgp h TRP 89 Ca 0.03 0.04 0.13 0.00 2.11 0.00 0.00 58.89 61.20 1wgp h TRP 89 Cb 0.79 0.29 -0.11 0.00 -2.10 0.00 0.00 29.16 28.03 1wgp h TRP 89 CO 0.08 -0.14 -0.02 0.00 -2.79 0.00 0.00 178.44 175.57 1wgp h ALA 90 N -0.69 0.60 -0.17 2.65 0.00 -1.13 1.39 119.26 121.91 1wgp h ALA 90 Ca 0.04 0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.20 1wgp h ALA 90 Cb 0.16 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1wgp h ALA 90 CO -0.25 -0.40 0.17 -0.07 0.00 0.00 0.00 179.25 178.69 1wgp h LEU 91 N 0.10 0.00 -8.90 0.00 4.07 -0.07 -3.38 115.31 107.12 1wgp h LEU 91 Ca 0.33 0.00 -0.61 0.00 0.08 0.00 0.00 57.88 57.68 1wgp h LEU 91 Cb 0.54 0.00 -0.11 0.00 1.08 0.00 0.00 40.66 42.17 1wgp h LEU 91 CO -0.56 0.00 0.28 -0.62 -1.08 0.00 0.00 178.44 176.46 1wgp s ASP 92 N -6.07 6.58 0.05 -0.43 2.15 0.52 -4.93 116.67 114.54 1wgp s ASP 92 Ca -0.05 0.54 -0.17 0.00 0.43 0.00 0.00 52.55 53.31 1wgp s ASP 92 Cb 0.16 -2.37 -0.21 0.00 -0.30 0.00 0.00 42.92 40.20 1wgp s ASP 92 CO 0.59 -0.55 1.18 1.55 -0.17 0.00 0.00 175.17 177.77 1wgp h PRO 93 N 8.16 0.58 -0.94 4.34 0.13 -1.76 -3.21 132.00 139.30 1wgp h PRO 93 Ca -0.25 -0.57 0.22 0.00 -0.87 0.00 0.00 66.00 64.52 1wgp h PRO 93 Cb 1.11 0.15 -0.12 0.00 0.13 0.00 0.00 31.00 32.26 1wgp h PRO 93 CO 0.85 1.19 0.50 0.87 -0.23 0.00 0.00 178.00 181.17 1wgp h LYS 94 N 0.19 0.52 -6.12 0.86 1.79 -1.91 -3.37 116.57 108.53 1wgp h LYS 94 Ca -0.08 -0.03 -0.57 0.00 -2.18 0.00 0.00 60.65 57.79 1wgp h LYS 94 Cb 1.41 -0.12 -0.05 0.00 -1.58 0.00 0.00 32.23 31.90 1wgp h LYS 94 CO 0.15 0.35 0.82 0.45 -1.08 0.00 0.00 179.45 180.14 1wgp s SER 95 N -5.25 7.05 -0.30 0.86 0.15 -1.21 -4.88 113.70 110.12 1wgp s SER 95 Ca -0.11 1.53 -0.06 0.00 0.70 0.00 0.00 55.95 58.00 1wgp s SER 95 Cb 0.25 -2.54 0.25 0.00 -1.71 0.00 0.00 66.02 62.28 1wgp s SER 95 CO 0.79 -0.69 1.24 0.61 1.20 0.00 0.00 173.24 176.39 1wgp n GLY 96 N 3.42 -1.99 0.50 9.45 0.00 -1.26 -4.88 105.19 110.42 1wgp n GLY 96 Ca 0.13 1.29 0.00 0.00 0.00 0.00 0.00 46.02 47.43 1wgp n GLY 96 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wgp n SER 97 N 1.95 0.00 -3.81 1.61 2.88 -1.26 -5.12 113.62 109.87 1wgp n SER 97 Ca 0.05 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.42 1wgp n SER 97 Cb 0.70 0.12 -0.16 0.00 -0.75 0.00 0.00 64.21 64.12 1wgp n SER 97 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 1wgp s ASN 98 N -1.43 0.32 0.88 -3.46 -0.87 -1.26 -5.14 114.94 103.98 1wgp s ASN 98 Ca 0.00 -0.01 -0.16 0.00 -1.57 0.00 0.00 52.86 51.12 1wgp s ASN 98 Cb 0.00 -0.17 -0.08 0.00 -0.02 0.00 0.00 41.25 40.98 1wgp s ASN 98 CO 0.00 -0.10 -0.14 0.18 -2.57 0.00 0.00 177.10 174.47 1wgp n LEU 99 N 4.07 -2.88 -4.76 0.60 4.77 -1.26 -4.95 117.00 112.59 1wgp n LEU 99 Ca -0.26 0.35 -0.30 0.00 -0.03 0.00 0.00 56.01 55.77 1wgp n LEU 99 Cb 0.51 -0.98 0.22 0.00 -2.33 0.00 0.00 43.42 40.84 1wgp n LEU 99 CO 0.23 -4.69 0.76 -2.16 -1.33 0.00 0.00 177.39 170.19 1wgp s PRO 100 N -2.49 -0.37 -0.01 3.23 0.04 -1.26 -4.69 135.00 129.45 1wgp s PRO 100 Ca 0.51 -0.28 0.08 0.00 0.04 0.00 0.00 61.00 61.35 1wgp s PRO 100 Cb -0.26 -1.72 -0.02 0.00 0.04 0.00 0.00 34.50 32.55 1wgp s PRO 100 CO 0.72 -3.11 -0.24 -1.12 0.04 0.00 0.00 177.00 173.29 1wgp s SER 101 N -4.43 2.86 0.96 6.66 0.01 -1.26 -0.49 113.70 118.01 1wgp s SER 101 Ca 0.73 -0.46 -0.11 0.00 1.31 0.00 0.00 55.95 57.42 1wgp s SER 101 Cb -0.06 -0.31 0.17 0.00 0.21 0.00 0.00 66.02 66.03 1wgp s SER 101 CO 0.55 0.29 1.10 -0.55 0.41 0.00 0.00 173.24 175.03 1wgp s SER 102 N -0.66 2.69 -0.14 2.44 0.15 -1.25 -4.86 113.70 112.07 1wgp s SER 102 Ca 0.09 1.83 0.09 0.00 0.70 0.00 0.00 55.95 58.66 1wgp s SER 102 Cb -0.09 -2.41 -0.23 0.00 -1.71 0.00 0.00 66.02 61.57 1wgp s SER 102 CO -0.01 -3.18 0.26 0.35 1.20 0.00 0.00 173.24 171.86 1wgp n THR 103 N -4.27 1.56 -3.65 6.45 -2.24 -1.26 -4.73 114.28 106.13 1wgp n THR 103 Ca 0.08 -0.75 -0.14 0.00 -2.27 0.00 0.00 64.05 60.98 1wgp n THR 103 Cb 0.53 -1.07 -0.07 0.00 -2.10 0.00 0.00 70.33 67.63 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 -2.54 0.90 -0.37 -0.78 3.03 -1.26 -4.96 118.95 112.97 1wgp s ARG 104 Ca -0.15 -0.22 -0.24 0.00 2.03 0.00 0.00 55.73 57.15 1wgp s ARG 104 Cb 0.07 0.41 0.01 0.00 -1.03 0.00 0.00 34.95 34.41 1wgp s ARG 104 CO 0.78 -0.30 0.84 0.99 -1.13 0.00 0.00 175.30 176.48 1wgp s THR 105 N -2.03 4.67 0.06 4.99 2.01 0.32 -4.59 115.64 121.08 1wgp s THR 105 Ca -0.08 0.99 0.03 0.00 0.31 0.00 0.00 61.69 62.95 1wgp s THR 105 Cb -0.02 -4.26 -0.04 0.00 0.01 0.00 0.00 72.50 68.19 1wgp s THR 105 CO 0.01 -0.48 0.03 -0.69 -0.69 0.00 0.00 174.62 172.80 1wgp s VAL 106 N 3.25 4.27 0.08 3.82 1.01 -1.16 -0.13 120.40 131.54 1wgp s VAL 106 Ca 0.34 -0.79 -0.00 0.00 0.00 0.00 0.00 61.98 61.52 1wgp s VAL 106 Cb -0.13 -3.01 -0.04 0.00 0.00 0.00 0.00 36.38 33.20 1wgp s VAL 106 CO 0.18 0.19 -0.02 -0.75 0.00 0.00 0.00 175.10 174.69 1wgp s LYS 107 N -2.15 0.72 -0.24 2.72 2.20 -0.19 -3.33 119.74 119.47 1wgp s LYS 107 Ca 0.26 -1.29 -0.07 0.00 -0.36 0.00 0.00 55.97 54.51 1wgp s LYS 107 Cb -0.12 0.12 -0.02 0.00 -1.51 0.00 0.00 37.83 36.30 1wgp s LYS 107 CO 0.18 -0.12 0.05 0.00 -0.36 0.00 0.00 175.35 175.10 1wgp s ALA 108 N -3.88 3.10 -0.14 3.13 0.00 -0.55 -0.90 121.76 122.52 1wgp s ALA 108 Ca 0.11 -1.13 0.16 0.00 0.00 0.00 0.00 51.96 51.10 1wgp s ALA 108 Cb 0.07 -2.01 -0.23 0.00 0.00 0.00 0.00 23.12 20.95 1wgp s ALA 108 CO -0.07 -0.47 0.14 1.28 0.00 0.00 0.00 175.76 176.64 1wgp n LEU 109 N 4.89 0.00 -4.25 0.00 4.32 -1.26 -2.15 117.00 118.55 1wgp n LEU 109 Ca -0.17 0.00 -0.17 0.00 -0.02 0.00 0.00 56.01 55.65 1wgp n LEU 109 Cb 0.51 0.34 -0.11 0.00 -1.62 0.00 0.00 43.42 42.54 1wgp n LEU 109 CO 0.31 0.34 -0.44 0.28 -1.22 0.00 0.00 177.39 176.65 1wgp s THR 110 N -2.61 1.35 0.09 -5.08 -1.32 -1.26 -4.74 115.64 102.06 1wgp s THR 110 Ca -0.08 -1.82 -0.35 0.00 -1.21 0.00 0.00 61.69 58.22 1wgp s THR 110 Cb 0.07 -1.63 -0.18 0.00 -1.51 0.00 0.00 72.50 69.24 1wgp s THR 110 CO 0.73 -0.49 1.01 1.21 -2.21 0.00 0.00 174.62 174.87 1wgp n GLU 111 N 0.32 0.39 -4.15 7.08 2.13 -1.26 -4.76 120.64 120.39 1wgp n GLU 111 Ca -0.14 0.14 -0.10 0.00 0.66 0.00 0.00 57.16 57.72 1wgp n GLU 111 Cb 0.58 -1.55 -0.10 0.00 0.27 0.00 0.00 31.44 30.64 1wgp n GLU 111 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 1wgp s VAL 112 N -0.20 0.09 -0.09 6.31 -7.23 -0.87 -4.56 120.40 113.85 1wgp s VAL 112 Ca 0.81 -1.91 -0.04 0.00 -1.81 0.00 0.00 61.98 59.02 1wgp s VAL 112 Cb -1.07 -2.09 0.05 0.00 0.56 0.00 0.00 36.38 33.83 1wgp s VAL 112 CO 0.55 -0.41 0.19 -0.70 -0.31 0.00 0.00 175.10 174.42 1wgp s GLU 113 N -4.06 0.10 0.34 4.82 -6.30 -1.20 -3.12 118.70 109.27 1wgp s GLU 113 Ca 0.26 0.54 -0.18 0.00 -2.50 0.00 0.00 54.97 53.09 1wgp s GLU 113 Cb 0.07 -0.17 0.04 0.00 0.00 0.00 0.00 34.13 34.07 1wgp s GLU 113 CO 0.03 -0.24 0.77 0.00 0.02 0.00 0.00 175.26 175.84 1wgp s ALA 114 N 1.82 -0.96 0.32 6.30 0.00 -1.25 -3.18 121.76 124.82 1wgp s ALA 114 Ca -0.03 -0.56 0.09 0.00 0.00 0.00 0.00 51.96 51.46 1wgp s ALA 114 Cb -0.12 0.74 -0.05 0.00 0.00 0.00 0.00 23.12 23.70 1wgp s ALA 114 CO -0.07 -1.01 0.08 -0.06 0.00 0.00 0.00 175.76 174.70 1wgp s PHE 115 N -2.95 2.66 0.26 0.00 0.40 -1.24 -3.70 117.98 113.41 1wgp s PHE 115 Ca 0.14 -0.36 0.07 0.00 -0.60 0.00 0.00 56.93 56.17 1wgp s PHE 115 Cb -0.05 -1.51 -0.03 0.00 0.51 0.00 0.00 43.02 41.94 1wgp s PHE 115 CO 0.09 0.44 0.22 0.00 0.70 0.00 0.00 175.22 176.67 1wgp s ALA 116 N -2.43 3.65 -0.18 5.36 0.00 -1.19 -2.67 121.76 124.30 1wgp s ALA 116 Ca 0.36 -1.42 -0.06 0.00 0.00 0.00 0.00 51.96 50.83 1wgp s ALA 116 Cb -0.03 -1.33 0.08 0.00 0.00 0.00 0.00 23.12 21.84 1wgp s ALA 116 CO 0.21 0.22 0.37 -1.17 0.00 0.00 0.00 175.76 175.39 1wgp s LEU 117 N -3.87 -0.53 0.29 0.00 1.98 0.65 -2.98 118.68 114.22 1wgp s LEU 117 Ca 0.34 0.85 -0.20 0.00 -2.89 0.00 0.00 54.13 52.22 1wgp s LEU 117 Cb -0.08 1.13 -0.09 0.00 0.66 0.00 0.00 46.19 47.81 1wgp s LEU 117 CO 0.26 -0.24 0.81 -0.51 -1.89 0.00 0.00 176.35 174.78 1wgp s ILE 118 N 2.55 4.48 -0.00 6.68 2.07 -1.26 0.21 121.20 135.92 1wgp s ILE 118 Ca -0.00 1.37 -0.25 0.00 -1.41 0.00 0.00 60.65 60.35 1wgp s ILE 118 Cb -0.12 -3.81 -0.18 0.00 0.13 0.00 0.00 42.46 38.48 1wgp s ILE 118 CO -0.11 0.04 1.26 0.00 -1.91 0.00 0.00 174.94 174.22 1wgp h ALA 119 N 2.91 -0.15 -0.29 1.50 0.00 -1.87 -2.64 119.26 118.73 1wgp h ALA 119 Ca -0.48 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.23 1wgp h ALA 119 Cb 1.19 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1wgp h ALA 119 CO 0.65 -0.38 0.00 -0.25 0.00 0.00 0.00 179.25 179.26 1wgp n ASP 120 N -4.97 0.00 -0.31 0.00 8.00 -1.26 0.19 116.55 118.20 1wgp n ASP 120 Ca -0.09 0.95 0.35 0.00 0.71 0.00 0.00 54.79 56.71 1wgp n ASP 120 Cb 0.23 -0.45 0.74 0.00 -0.02 0.00 0.00 41.12 41.63 1wgp n ASP 120 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1wgp h GLU 121 N 0.00 0.00 0.31 -1.24 4.39 -1.99 -0.52 114.58 115.53 1wgp h GLU 121 Ca 0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 1wgp h GLU 121 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1wgp h GLU 121 CO 0.00 0.00 -0.15 1.25 -1.16 0.00 0.00 179.01 178.95 1wgp h LEU 122 N 0.00 -0.35 -0.90 1.33 6.46 0.25 -1.71 115.31 120.39 1wgp h LEU 122 Ca 0.55 0.01 0.24 0.00 -0.12 0.00 0.00 57.88 58.57 1wgp h LEU 122 Cb 2.28 0.09 -0.15 0.00 -0.73 0.00 0.00 40.66 42.14 1wgp h LEU 122 CO -0.01 -0.18 0.16 0.11 -0.62 0.00 0.00 178.44 177.91 1wgp h LYS 123 N -0.56 0.13 0.09 1.25 1.79 0.14 0.87 116.57 120.28 1wgp h LYS 123 Ca -0.04 -0.01 -0.00 0.00 -2.18 0.00 0.00 60.65 58.42 1wgp h LYS 123 Cb 0.32 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.93 1wgp h LYS 123 CO 0.07 0.08 -0.13 0.35 -1.08 0.00 0.00 179.45 178.74 1wgp h PHE 124 N 0.13 -0.36 -0.42 -1.35 3.04 -1.15 1.50 116.94 118.32 1wgp h PHE 124 Ca 0.56 0.01 0.12 0.00 3.98 0.00 0.00 57.97 62.64 1wgp h PHE 124 Cb 1.14 0.15 -0.02 0.00 2.56 0.00 0.00 35.95 39.78 1wgp h PHE 124 CO -0.34 -0.16 0.32 -0.24 -2.02 0.00 0.00 178.31 175.87 1wgp h VAL 125 N -0.23 0.72 0.30 1.41 3.04 -0.27 0.18 116.25 121.40 1wgp h VAL 125 Ca -0.01 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.67 1wgp h VAL 125 Cb 0.21 0.77 0.00 0.00 -2.01 0.00 0.00 31.29 30.26 1wgp h VAL 125 CO -0.04 0.00 -0.14 0.00 -1.01 0.00 0.00 177.57 176.38 1wgp h ALA 126 N 1.76 -0.68 -0.87 3.17 0.00 0.17 -3.24 119.26 119.57 1wgp h ALA 126 Ca 0.20 -0.09 0.19 0.00 0.00 0.00 0.00 54.91 55.22 1wgp h ALA 126 Cb 0.84 0.15 -0.11 0.00 0.00 0.00 0.00 17.79 18.67 1wgp h ALA 126 CO -0.00 -0.65 0.40 1.03 0.00 0.00 0.00 179.25 180.02 1wgp h SER 127 N -0.61 0.38 -0.92 0.00 0.87 0.26 0.84 113.55 114.36 1wgp h SER 127 Ca -0.04 0.13 0.23 0.00 -1.23 0.00 0.00 61.79 60.88 1wgp h SER 127 Cb 0.31 0.09 -0.17 0.00 -0.44 0.00 0.00 62.40 62.19 1wgp h SER 127 CO 0.07 0.07 -0.06 0.00 -0.53 0.00 0.00 176.83 176.38 1wgp n GLN 128 N -4.99 -0.08 -0.13 2.24 1.13 0.58 0.12 117.38 116.25 1wgp n GLN 128 Ca 0.20 1.40 -0.27 0.00 -1.94 0.00 0.00 57.00 56.39 1wgp n GLN 128 Cb 0.57 -2.19 -0.10 0.00 0.11 0.00 0.00 30.24 28.63 1wgp n GLN 128 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1wgp n PHE 129 N -5.41 0.31 -0.36 1.08 -0.00 0.03 -4.48 117.46 108.62 1wgp n PHE 129 Ca 0.20 0.13 -0.00 0.00 -0.00 0.00 0.00 57.45 57.78 1wgp n PHE 129 Cb 0.63 -1.03 0.06 0.00 -0.00 0.00 0.00 39.48 39.14 1wgp n PHE 129 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1wgp h ARG 130 N -1.00 -0.02 -3.77 -4.13 2.47 0.10 -3.47 114.38 104.56 1wgp h ARG 130 Ca -0.60 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.12 1wgp h ARG 130 Cb 1.52 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.85 1wgp h ARG 130 CO -0.36 -0.01 -0.98 0.54 0.56 0.00 0.00 179.97 179.72 1wgp n ARG 131 N -5.50 -4.20 -3.26 0.04 1.74 0.12 -4.66 116.66 100.94 1wgp n ARG 131 Ca 0.11 3.25 -0.45 0.00 -0.77 0.00 0.00 57.85 59.99 1wgp n ARG 131 Cb 0.41 -4.04 -0.00 0.00 -1.02 0.00 0.00 32.46 27.81 1wgp n ARG 131 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1wgp s SER 132 N -5.29 7.19 0.00 0.55 0.01 -1.26 -4.99 113.70 109.90 1wgp s SER 132 Ca 0.00 -3.33 0.00 0.00 1.31 0.00 0.00 55.95 53.93 1wgp s SER 132 Cb 0.00 -2.25 0.00 0.00 0.21 0.00 0.00 66.02 63.98 1wgp s SER 132 CO 0.00 -0.42 0.00 0.61 0.41 0.00 0.00 173.24 173.84 1wgp n GLY 133 N 3.19 4.41 0.11 3.44 0.00 -1.26 -5.08 105.19 110.00 1wgp n GLY 133 Ca 0.24 -2.19 -0.10 0.00 0.00 0.00 0.00 46.02 43.97 1wgp n GLY 133 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wgp h PRO 134 N 0.00 -0.14 -0.58 1.61 0.13 -1.99 -3.47 132.00 127.56 1wgp h PRO 134 Ca 0.00 0.01 0.16 0.00 -0.87 0.00 0.00 66.00 65.30 1wgp h PRO 134 Cb 0.00 0.03 -0.20 0.00 0.13 0.00 0.00 31.00 30.96 1wgp h PRO 134 CO 0.00 0.33 -0.09 -1.12 -0.23 0.00 0.00 178.00 176.89 1wgp s SER 135 N -5.61 -0.87 -0.09 1.44 0.01 -1.26 -5.05 113.70 102.27 1wgp s SER 135 Ca -0.12 0.33 -0.01 0.00 1.31 0.00 0.00 55.95 57.45 1wgp s SER 135 Cb -0.00 1.64 0.00 0.00 0.21 0.00 0.00 66.02 67.87 1wgp s SER 135 CO 0.45 -0.16 0.02 -0.24 0.41 0.00 0.00 173.24 173.72 1wgp n SER 136 N 5.36 -6.90 -0.70 2.44 2.88 -1.26 -5.26 113.62 110.17 1wgp n SER 136 Ca 0.01 0.63 0.13 0.00 -1.33 0.00 0.00 58.87 58.31 1wgp n SER 136 Cb 0.54 -2.50 0.33 0.00 -0.75 0.00 0.00 64.21 61.83 1wgp n SER 136 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42