#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wgp h SER 2 N 0.00 -0.40 0.00 1.61 0.02 -2.13 -3.48 113.55 109.17 1wgp h SER 2 Ca 0.00 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 1wgp h SER 2 Cb 0.00 0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.64 1wgp h SER 2 CO 0.00 0.03 0.00 -0.24 -1.14 0.00 0.00 176.83 175.48 1wgp n SER 3 N -5.12 -0.22 0.00 3.07 2.88 -1.26 -5.17 113.62 107.80 1wgp n SER 3 Ca -0.09 0.16 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 1wgp n SER 3 Cb 0.27 0.38 0.00 0.00 -0.75 0.00 0.00 64.21 64.11 1wgp n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wgp n GLY 4 N -1.09 -0.05 3.75 0.46 0.00 -1.26 -4.94 105.19 102.06 1wgp n GLY 4 Ca 0.00 -1.95 -0.41 0.00 0.00 0.00 0.00 46.02 43.66 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 -0.64 6.90 -0.11 1.61 1.04 -1.26 -5.02 113.70 116.22 1wgp s SER 5 Ca 0.00 2.47 0.00 0.00 0.48 0.00 0.00 55.95 58.90 1wgp s SER 5 Cb 0.00 -2.62 -0.02 0.00 0.10 0.00 0.00 66.02 63.48 1wgp s SER 5 CO 0.00 -0.50 -0.11 -0.94 0.98 0.00 0.00 173.24 172.67 1wgp s SER 6 N 0.02 4.18 -1.12 7.02 1.04 -1.26 -5.05 113.70 118.52 1wgp s SER 6 Ca 0.54 -0.25 -0.09 0.00 0.48 0.00 0.00 55.95 56.63 1wgp s SER 6 Cb -0.37 -1.46 0.27 0.00 0.10 0.00 0.00 66.02 64.57 1wgp s SER 6 CO 0.42 0.22 1.22 0.61 0.98 0.00 0.00 173.24 176.69 1wgp n GLY 7 N 3.19 4.32 0.99 7.32 0.00 -1.26 -4.26 105.19 115.48 1wgp n GLY 7 Ca -0.18 -2.54 0.00 0.00 0.00 0.00 0.00 46.02 43.30 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 2.62 0.00 0.00 1.61 3.14 -1.26 -5.05 118.33 119.39 1wgp n VAL 8 Ca 0.26 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.64 1wgp n VAL 8 Cb 0.38 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.16 1wgp n VAL 8 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1wgp n ARG 9 N -2.00 0.00 -2.36 1.45 1.74 -1.26 -0.71 116.66 113.52 1wgp n ARG 9 Ca 0.00 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.06 1wgp n ARG 9 Cb 0.00 0.00 0.05 0.00 -1.02 0.00 0.00 32.46 31.49 1wgp n ARG 9 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1wgp n ARG 10 N 0.00 1.62 -2.64 5.56 0.63 -1.26 -5.09 116.66 115.48 1wgp n ARG 10 Ca 0.00 -3.28 -0.40 0.00 -0.92 0.00 0.00 57.85 53.25 1wgp n ARG 10 Cb 0.00 -1.37 -0.05 0.00 0.45 0.00 0.00 32.46 31.49 1wgp n ARG 10 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1wgp s VAL 11 N -3.10 3.83 0.21 5.15 1.01 0.11 -4.95 120.40 122.66 1wgp s VAL 11 Ca 0.32 1.83 0.08 0.00 0.00 0.00 0.00 61.98 64.22 1wgp s VAL 11 Cb 0.35 -4.16 -0.10 0.00 0.00 0.00 0.00 36.38 32.47 1wgp s VAL 11 CO -0.06 0.43 1.48 1.55 0.00 0.00 0.00 175.10 178.51 1wgp h PRO 12 N 3.98 0.04 -0.81 2.72 0.13 -1.99 -3.28 132.00 132.80 1wgp h PRO 12 Ca -0.46 -0.03 0.13 0.00 -0.87 0.00 0.00 66.00 64.77 1wgp h PRO 12 Cb 1.20 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 32.21 1wgp h PRO 12 CO 0.67 0.78 -0.38 -0.07 -0.23 0.00 0.00 178.00 178.78 1wgp h LEU 13 N 0.02 -1.35 -4.62 1.56 3.38 -1.98 0.14 115.31 112.45 1wgp h LEU 13 Ca -0.01 0.27 -0.47 0.00 0.09 0.00 0.00 57.88 57.76 1wgp h LEU 13 Cb 1.34 0.69 -0.05 0.00 0.09 0.00 0.00 40.66 42.73 1wgp h LEU 13 CO 0.10 -0.30 1.57 0.49 0.09 0.00 0.00 178.44 180.39 1wgp n PHE 14 N -5.45 1.38 -0.09 1.13 3.72 -1.24 -4.36 117.46 112.56 1wgp n PHE 14 Ca 0.07 -2.29 -0.15 0.00 -0.05 0.00 0.00 57.45 55.03 1wgp n PHE 14 Cb 0.38 -1.92 -0.09 0.00 -0.94 0.00 0.00 39.48 36.90 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 3.91 0.00 -0.54 -1.08 5.08 -0.94 -3.37 114.58 117.64 1wgp h GLU 15 Ca 0.52 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.88 1wgp h GLU 15 Cb 0.83 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.08 1wgp h GLU 15 CO 1.02 0.75 0.00 0.27 -1.00 0.00 0.00 179.01 180.05 1wgp n ASN 16 N -4.53 4.13 -4.59 1.42 6.94 -1.26 -4.91 115.26 112.46 1wgp n ASN 16 Ca -0.20 -2.37 -0.40 0.00 -0.02 0.00 0.00 54.58 51.59 1wgp n ASN 16 Cb 0.51 -0.48 -0.08 0.00 -2.36 0.00 0.00 39.78 37.36 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 -1.69 3.89 0.82 -3.83 -1.94 -1.26 -4.59 119.30 110.70 1wgp s MET 17 Ca 0.43 0.03 -0.12 0.00 -1.71 0.00 0.00 55.69 54.33 1wgp s MET 17 Cb 0.28 -3.71 0.09 0.00 2.01 0.00 0.00 34.83 33.50 1wgp s MET 17 CO 0.22 -0.42 1.16 -0.51 -0.01 0.00 0.00 175.02 175.46 1wgp s ASP 18 N 1.65 3.70 0.16 3.03 1.01 -1.26 -4.84 116.67 120.12 1wgp s ASP 18 Ca 0.18 2.20 -0.15 0.00 0.71 0.00 0.00 52.55 55.48 1wgp s ASP 18 Cb -0.16 -2.57 0.08 0.00 1.01 0.00 0.00 42.92 41.29 1wgp s ASP 18 CO 0.11 -2.58 1.76 -0.33 0.21 0.00 0.00 175.17 174.33 1wgp h GLU 19 N -1.10 0.31 -1.01 8.23 5.08 -1.98 -0.02 114.58 124.09 1wgp h GLU 19 Ca -0.45 -0.02 0.29 0.00 -1.00 0.00 0.00 59.36 58.19 1wgp h GLU 19 Cb 1.27 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.41 1wgp h GLU 19 CO 0.46 0.21 0.74 0.00 -1.00 0.00 0.00 179.01 179.42 1wgp h ARG 20 N 0.32 0.00 -0.09 2.33 2.47 -2.00 1.11 114.38 118.53 1wgp h ARG 20 Ca 0.18 0.00 -0.19 0.00 -1.26 0.00 0.00 59.98 58.71 1wgp h ARG 20 Cb 0.15 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.46 1wgp h ARG 20 CO -0.17 0.00 -0.75 1.25 0.56 0.00 0.00 179.97 180.86 1wgp h LEU 21 N 0.00 0.59 0.71 3.04 5.85 -1.34 -1.53 115.31 122.62 1wgp h LEU 21 Ca 0.48 -0.39 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 1wgp h LEU 21 Cb 1.95 -0.17 0.01 0.00 0.37 0.00 0.00 40.66 42.82 1wgp h LEU 21 CO -0.01 1.14 -0.34 -0.07 -0.34 0.00 0.00 178.44 178.83 1wgp h LEU 22 N 0.33 -0.81 -0.69 2.25 -0.00 0.15 0.38 115.31 116.93 1wgp h LEU 22 Ca -0.04 0.03 0.13 0.00 -0.00 0.00 0.00 57.88 58.00 1wgp h LEU 22 Cb 1.33 0.21 -0.09 0.00 -0.00 0.00 0.00 40.66 42.11 1wgp h LEU 22 CO 0.13 -0.52 0.23 -0.78 -0.00 0.00 0.00 178.44 177.51 1wgp h ASP 23 N -1.07 0.17 0.42 -0.43 3.58 -1.36 1.33 116.42 119.06 1wgp h ASP 23 Ca -0.10 0.11 -0.01 0.00 0.42 0.00 0.00 57.03 57.45 1wgp h ASP 23 Cb 0.73 0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.87 1wgp h ASP 23 CO 0.16 0.07 -0.36 0.00 -2.88 0.00 0.00 179.24 176.23 1wgp h ALA 24 N 1.52 -0.81 0.00 -0.78 0.00 -1.16 1.39 119.26 119.42 1wgp h ALA 24 Ca 0.37 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1wgp h ALA 24 Cb 0.56 0.49 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1wgp h ALA 24 CO -0.40 -0.98 -0.04 0.82 0.00 0.00 0.00 179.25 178.64 1wgp h ILE 25 N -0.78 0.33 0.20 0.00 2.04 0.90 -1.23 117.51 118.96 1wgp h ILE 25 Ca -0.04 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.58 1wgp h ILE 25 Cb 0.68 1.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.93 1wgp h ILE 25 CO -0.02 0.04 -0.10 0.00 0.00 0.00 0.00 178.15 178.07 1wgp h GLU 27 N -1.04 0.00 -0.25 0.00 4.39 0.22 0.52 114.58 118.41 1wgp h GLU 27 Ca -0.03 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.49 1wgp h GLU 27 Cb 0.30 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.95 1wgp h GLU 27 CO 0.04 0.00 -0.57 0.00 -1.16 0.00 0.00 179.01 177.32 1wgp h ARG 28 N 0.00 0.79 -5.35 2.33 2.47 -1.23 -3.45 114.38 109.95 1wgp h ARG 28 Ca 0.25 -0.52 -0.76 0.00 -1.26 0.00 0.00 59.98 57.69 1wgp h ARG 28 Cb 1.29 0.07 0.02 0.00 -1.65 0.00 0.00 29.97 29.70 1wgp h ARG 28 CO -0.00 1.14 0.43 1.28 0.56 0.00 0.00 179.97 183.38 1wgp n LEU 29 N -3.98 0.72 -4.82 3.04 4.77 0.18 -4.91 117.00 112.00 1wgp n LEU 29 Ca -0.04 1.05 -0.31 0.00 -0.03 0.00 0.00 56.01 56.68 1wgp n LEU 29 Cb 0.64 -0.80 -0.06 0.00 -2.33 0.00 0.00 43.42 40.87 1wgp n LEU 29 CO 0.50 -1.07 -0.23 -0.54 -1.33 0.00 0.00 177.39 174.73 1wgp s LYS 30 N 1.78 3.09 -0.34 3.23 1.02 -1.07 -4.91 119.74 122.54 1wgp s LYS 30 Ca 0.89 -0.57 -0.29 0.00 0.02 0.00 0.00 55.97 56.02 1wgp s LYS 30 Cb -1.27 -2.85 0.00 0.00 -0.52 0.00 0.00 37.83 33.19 1wgp s LYS 30 CO 0.66 0.60 1.37 -1.25 -0.92 0.00 0.00 175.35 175.80 1wgp s PRO 31 N -2.29 3.76 0.22 -1.68 0.04 -1.26 -2.62 135.00 131.17 1wgp s PRO 31 Ca 0.30 1.13 -0.10 0.00 0.04 0.00 0.00 61.00 62.37 1wgp s PRO 31 Cb -0.12 -3.95 -0.01 0.00 0.04 0.00 0.00 34.50 30.45 1wgp s PRO 31 CO 0.22 -1.33 0.37 0.00 0.04 0.00 0.00 177.00 176.31 1wgp s LEU 33 N -3.03 1.65 -0.21 0.00 2.96 -1.26 -4.29 118.68 114.50 1wgp s LEU 33 Ca 0.24 -1.04 0.01 0.00 -0.22 0.00 0.00 54.13 53.12 1wgp s LEU 33 Cb 0.02 0.57 0.05 0.00 0.50 0.00 0.00 46.19 47.33 1wgp s LEU 33 CO 0.07 -0.75 -0.08 -0.36 -1.32 0.00 0.00 176.35 173.91 1wgp s PHE 34 N -3.99 2.41 0.00 5.38 0.08 -1.24 -5.06 117.98 115.55 1wgp s PHE 34 Ca 0.18 -1.66 0.00 0.00 0.12 0.00 0.00 56.93 55.57 1wgp s PHE 34 Cb 0.06 -1.61 0.00 0.00 -0.57 0.00 0.00 43.02 40.90 1wgp s PHE 34 CO -0.02 -0.75 0.00 0.25 -0.10 0.00 0.00 175.22 174.60 1wgp n THR 35 N 4.68 0.00 -2.36 0.64 -2.24 -1.26 -3.63 114.28 110.11 1wgp n THR 35 Ca -0.13 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.27 1wgp n THR 35 Cb 0.45 -1.91 -0.02 0.00 -2.10 0.00 0.00 70.33 66.75 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 -2.52 4.05 -1.05 -0.78 -1.05 -1.26 -2.96 118.70 113.14 1wgp s GLU 36 Ca 0.00 1.73 0.00 0.00 -0.15 0.00 0.00 54.97 56.55 1wgp s GLU 36 Cb 0.00 -2.61 0.00 0.00 -0.44 0.00 0.00 34.13 31.08 1wgp s GLU 36 CO 0.00 -0.29 0.00 1.63 0.95 0.00 0.00 175.26 177.55 1wgp n LYS 37 N -0.03 -0.97 -3.39 -4.83 5.02 -1.16 -4.98 118.16 107.82 1wgp n LYS 37 Ca 0.05 0.60 -0.40 0.00 -2.02 0.00 0.00 58.31 56.54 1wgp n LYS 37 Cb 0.48 -4.77 -0.09 0.00 -0.02 0.00 0.00 35.03 30.62 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 -2.46 6.21 -0.49 4.39 0.01 -1.15 -4.91 113.70 115.30 1wgp s SER 38 Ca 0.00 0.01 -0.16 0.00 1.31 0.00 0.00 55.95 57.11 1wgp s SER 38 Cb 0.00 -2.20 0.08 0.00 0.21 0.00 0.00 66.02 64.10 1wgp s SER 38 CO 0.00 -0.27 0.45 -0.31 0.41 0.00 0.00 173.24 173.52 1wgp s TYR 39 N 2.06 3.21 0.05 2.43 1.51 -1.26 -0.30 117.35 125.06 1wgp s TYR 39 Ca 0.13 -0.92 -0.29 0.00 -1.01 0.00 0.00 57.07 54.99 1wgp s TYR 39 Cb -0.16 -3.33 -0.17 0.00 -0.11 0.00 0.00 41.96 38.18 1wgp s TYR 39 CO 0.11 -0.88 1.50 -0.07 -1.11 0.00 0.00 175.55 175.10 1wgp h LEU 40 N 8.95 -0.53 -8.27 -1.29 4.07 -1.92 -3.45 115.31 112.86 1wgp h LEU 40 Ca -0.29 -0.04 -0.24 0.00 0.08 0.00 0.00 57.88 57.39 1wgp h LEU 40 Cb 1.11 0.14 -0.18 0.00 1.08 0.00 0.00 40.66 42.80 1wgp h LEU 40 CO 0.92 -0.29 -0.71 0.68 -1.08 0.00 0.00 178.44 177.95 1wgp s VAL 41 N -5.58 0.57 0.26 1.22 -7.23 -1.26 -4.98 120.40 103.40 1wgp s VAL 41 Ca -0.16 -1.45 0.05 0.00 -1.81 0.00 0.00 61.98 58.61 1wgp s VAL 41 Cb 0.03 -1.07 -0.06 0.00 0.56 0.00 0.00 36.38 35.84 1wgp s VAL 41 CO 0.59 -0.62 -0.03 -0.60 -0.31 0.00 0.00 175.10 174.13 1wgp s ARG 42 N -2.60 1.45 -0.59 4.82 3.00 -1.25 -2.14 118.95 121.64 1wgp s ARG 42 Ca -0.01 -1.74 -0.19 0.00 -1.00 0.00 0.00 55.73 52.80 1wgp s ARG 42 Cb -0.03 -0.92 0.10 0.00 0.00 0.00 0.00 34.95 34.11 1wgp s ARG 42 CO -0.02 -0.02 0.70 -1.21 0.00 0.00 0.00 175.30 174.74 1wgp s GLU 43 N -3.79 3.04 0.00 5.12 2.02 -1.26 -3.95 118.70 119.89 1wgp s GLU 43 Ca 0.29 -1.33 0.00 0.00 0.02 0.00 0.00 54.97 53.95 1wgp s GLU 43 Cb 0.05 -4.27 0.00 0.00 0.10 0.00 0.00 34.13 30.01 1wgp s GLU 43 CO 0.10 -1.53 0.00 0.41 0.02 0.00 0.00 175.26 174.26 1wgp n GLY 44 N 5.28 0.57 3.85 -1.39 0.00 -1.24 -5.03 105.19 107.24 1wgp n GLY 44 Ca -0.10 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.88 6.54 0.97 1.61 -4.77 -1.25 -4.94 116.67 113.95 1wgp s ASP 45 Ca 0.00 1.44 -0.14 0.00 -3.30 0.00 0.00 52.55 50.54 1wgp s ASP 45 Cb 0.00 -2.46 0.18 0.00 -1.09 0.00 0.00 42.92 39.55 1wgp s ASP 45 CO 0.00 -0.58 1.17 -2.16 0.70 0.00 0.00 175.17 174.30 1wgp s PRO 46 N -4.18 0.62 -0.33 2.11 0.04 -1.26 -3.47 135.00 128.53 1wgp s PRO 46 Ca 0.56 0.09 0.04 0.00 0.04 0.00 0.00 61.00 61.73 1wgp s PRO 46 Cb -0.10 -1.80 0.09 0.00 0.04 0.00 0.00 34.50 32.74 1wgp s PRO 46 CO 0.34 -2.51 0.02 0.08 0.04 0.00 0.00 177.00 174.98 1wgp s VAL 47 N -3.35 2.26 -0.01 -0.36 1.01 0.50 -4.81 120.40 115.65 1wgp s VAL 47 Ca 0.67 -2.23 -0.23 0.00 0.00 0.00 0.00 61.98 60.20 1wgp s VAL 47 Cb -0.12 -2.62 -0.20 0.00 0.00 0.00 0.00 36.38 33.44 1wgp s VAL 47 CO 0.54 -0.50 1.15 -1.13 0.00 0.00 0.00 175.10 175.16 1wgp h ASN 48 N 7.64 0.30 -4.85 3.32 -0.73 -1.96 -3.39 115.58 115.92 1wgp h ASN 48 Ca -0.07 -0.67 -0.22 0.00 1.87 0.00 0.00 56.30 57.22 1wgp h ASN 48 Cb 1.02 -0.09 -0.19 0.00 0.27 0.00 0.00 38.32 39.33 1wgp h ASN 48 CO 0.51 0.92 -0.71 -1.83 -0.37 0.00 0.00 177.43 175.95 1wgp s GLU 49 N -3.57 0.54 0.03 6.67 1.03 -1.26 -3.04 118.70 119.10 1wgp s GLU 49 Ca -0.15 -0.88 -0.05 0.00 0.03 0.00 0.00 54.97 53.91 1wgp s GLU 49 Cb 0.03 -0.11 -0.05 0.00 -0.80 0.00 0.00 34.13 33.19 1wgp s GLU 49 CO 0.75 -0.01 0.27 1.41 -1.33 0.00 0.00 175.26 176.35 1wgp s MET 50 N -2.25 3.56 -0.14 -4.83 1.75 0.57 -4.83 119.30 113.12 1wgp s MET 50 Ca -0.05 -0.13 -0.02 0.00 -1.25 0.00 0.00 55.69 54.24 1wgp s MET 50 Cb -0.05 -3.05 -0.02 0.00 2.84 0.00 0.00 34.83 34.55 1wgp s MET 50 CO -0.02 0.63 -0.09 -0.51 -0.65 0.00 0.00 175.02 174.37 1wgp s LEU 51 N -1.94 2.93 -0.41 4.11 2.01 -1.26 0.47 118.68 124.59 1wgp s LEU 51 Ca 0.30 -0.24 -0.04 0.00 0.01 0.00 0.00 54.13 54.15 1wgp s LEU 51 Cb -0.13 -1.68 0.10 0.00 0.01 0.00 0.00 46.19 44.49 1wgp s LEU 51 CO 0.18 0.17 0.21 -0.36 1.01 0.00 0.00 176.35 177.57 1wgp s PHE 52 N 0.33 3.51 0.04 0.29 0.40 -0.99 -3.31 117.98 118.25 1wgp s PHE 52 Ca -0.08 -2.18 -0.34 0.00 -0.60 0.00 0.00 56.93 53.73 1wgp s PHE 52 Cb -0.15 -3.14 -0.13 0.00 0.51 0.00 0.00 43.02 40.11 1wgp s PHE 52 CO 0.05 -0.95 1.73 -0.89 0.70 0.00 0.00 175.22 175.86 1wgp n ILE 53 N 4.68 0.30 -0.13 0.64 2.08 -1.26 -3.56 119.36 122.11 1wgp n ILE 53 Ca -0.05 -0.05 -0.23 0.00 0.56 0.00 0.00 62.75 62.98 1wgp n ILE 53 Cb 0.42 -1.72 -0.11 0.00 -0.75 0.00 0.00 39.64 37.48 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 4.30 1.45 -3.07 1.39 2.08 -1.14 -4.59 119.36 119.78 1wgp n ILE 54 Ca 0.20 -0.47 0.05 0.00 0.56 0.00 0.00 62.75 63.09 1wgp n ILE 54 Cb 0.29 -1.61 0.00 0.00 -0.75 0.00 0.00 39.64 37.57 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 -2.50 0.09 0.00 0.38 3.52 -1.11 -4.84 118.95 114.48 1wgp s ARG 55 Ca -0.35 0.06 0.00 0.00 -0.13 0.00 0.00 55.73 55.30 1wgp s ARG 55 Cb 0.11 0.03 0.00 0.00 -1.56 0.00 0.00 34.95 33.54 1wgp s ARG 55 CO 0.53 -0.16 0.00 0.41 -0.81 0.00 0.00 175.30 175.27 1wgp n GLY 56 N 4.79 1.93 3.26 8.12 0.00 -1.26 -4.00 105.19 118.02 1wgp n GLY 56 Ca 0.09 -0.30 -0.10 0.00 0.00 0.00 0.00 46.02 45.71 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 2.28 0.93 0.26 1.61 1.81 -1.26 -4.17 118.95 120.40 1wgp s ARG 57 Ca 0.00 -0.80 -0.21 0.00 -1.72 0.00 0.00 55.73 53.00 1wgp s ARG 57 Cb 0.00 0.39 0.04 0.00 -0.45 0.00 0.00 34.95 34.93 1wgp s ARG 57 CO 0.00 -0.33 0.82 -0.51 -0.68 0.00 0.00 175.30 174.60 1wgp s LEU 58 N -2.73 -0.18 -0.13 2.53 1.02 -1.24 -4.55 118.68 113.41 1wgp s LEU 58 Ca 0.03 -0.65 0.02 0.00 0.02 0.00 0.00 54.13 53.56 1wgp s LEU 58 Cb 0.03 2.55 0.00 0.00 0.02 0.00 0.00 46.19 48.79 1wgp s LEU 58 CO -0.10 -1.26 -0.21 -1.83 0.02 0.00 0.00 176.35 172.97 1wgp s GLU 59 N -3.37 3.08 -0.22 1.70 -1.05 -1.15 -1.98 118.70 115.71 1wgp s GLU 59 Ca 0.13 -0.84 -0.09 0.00 -0.15 0.00 0.00 54.97 54.02 1wgp s GLU 59 Cb -0.04 -2.44 -0.05 0.00 -0.44 0.00 0.00 34.13 31.16 1wgp s GLU 59 CO 0.06 0.06 0.12 0.45 0.95 0.00 0.00 175.26 176.90 1wgp s SER 60 N 0.65 5.92 0.08 0.83 0.15 0.19 -3.10 113.70 118.43 1wgp s SER 60 Ca -0.10 0.10 0.04 0.00 0.70 0.00 0.00 55.95 56.68 1wgp s SER 60 Cb -0.16 -2.05 -0.03 0.00 -1.71 0.00 0.00 66.02 62.07 1wgp s SER 60 CO 0.02 0.11 -0.10 -0.69 1.20 0.00 0.00 173.24 173.78 1wgp s VAL 61 N 0.76 0.87 0.05 4.45 1.01 -0.93 1.00 120.40 127.61 1wgp s VAL 61 Ca 0.06 -1.48 0.03 0.00 0.00 0.00 0.00 61.98 60.59 1wgp s VAL 61 Cb -0.13 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.06 1wgp s VAL 61 CO 0.02 -0.48 -0.09 0.28 0.00 0.00 0.00 175.10 174.83 1wgp s THR 62 N -2.07 0.67 -0.01 3.92 -1.32 -1.24 -2.05 115.64 113.54 1wgp s THR 62 Ca 0.01 -1.16 0.00 0.00 -1.21 0.00 0.00 61.69 59.34 1wgp s THR 62 Cb -0.05 -0.74 -0.01 0.00 -1.51 0.00 0.00 72.50 70.19 1wgp s THR 62 CO 0.00 -0.36 -0.01 0.35 -2.21 0.00 0.00 174.62 172.39 1wgp n THR 63 N 1.38 0.06 -2.62 5.08 -2.24 -1.26 -3.80 114.28 110.87 1wgp n THR 63 Ca -0.22 -0.02 -0.43 0.00 -2.27 0.00 0.00 64.05 61.10 1wgp n THR 63 Cb 0.55 -0.57 -0.02 0.00 -2.10 0.00 0.00 70.33 68.19 1wgp n THR 63 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1wgp s ASP 64 N -4.03 6.91 0.00 3.42 1.11 -1.26 -4.77 116.67 118.05 1wgp s ASP 64 Ca -0.01 1.05 0.00 0.00 0.18 0.00 0.00 52.55 53.76 1wgp s ASP 64 Cb 0.00 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.45 1wgp s ASP 64 CO 0.03 -0.90 0.00 0.61 1.18 0.00 0.00 175.17 176.08 1wgp n GLY 65 N 3.92 -0.07 0.00 0.21 0.00 -1.26 -5.10 105.19 102.89 1wgp n GLY 65 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 2.34 1.52 1.48 -0.02 0.00 -1.26 -5.14 105.19 104.11 1wgp n GLY 66 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1wgp n GLY 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wgp n ARG 67 N 0.00 -4.24 -1.51 1.61 1.74 -1.26 -5.00 116.66 107.99 1wgp n ARG 67 Ca 0.00 3.14 0.00 0.00 -0.77 0.00 0.00 57.85 60.22 1wgp n ARG 67 Cb 0.00 -3.52 0.00 0.00 -1.02 0.00 0.00 32.46 27.92 1wgp n ARG 67 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1wgp n SER 68 N -0.63 -7.76 -4.67 0.55 2.88 -1.26 -4.84 113.62 97.89 1wgp n SER 68 Ca 0.00 1.06 -0.43 0.00 -1.33 0.00 0.00 58.87 58.17 1wgp n SER 68 Cb 0.00 -3.83 -0.02 0.00 -0.75 0.00 0.00 64.21 59.61 1wgp n SER 68 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1wgp s GLY 69 N -1.50 1.79 -0.28 0.46 0.00 -1.26 -4.93 107.32 101.61 1wgp s GLY 69 Ca 0.00 0.41 -0.02 0.00 0.00 0.00 0.00 44.72 45.11 1wgp s GLY 69 CO 0.00 2.33 0.51 -0.12 0.00 0.00 0.00 173.10 175.82 1wgp s PHE 70 N 3.08 -1.30 -0.51 1.90 5.36 -1.26 -5.12 117.98 120.13 1wgp s PHE 70 Ca 0.52 1.36 -0.20 0.00 -0.96 0.00 0.00 56.93 57.64 1wgp s PHE 70 Cb -0.20 0.35 0.05 0.00 -0.34 0.00 0.00 43.02 42.88 1wgp s PHE 70 CO 0.14 -0.82 0.70 0.71 -1.46 0.00 0.00 175.22 174.50 1wgp s TYR 71 N 2.73 2.99 -0.75 10.12 1.51 -1.26 -4.81 117.35 127.88 1wgp s TYR 71 Ca 0.18 -0.37 -0.26 0.00 -1.01 0.00 0.00 57.07 55.60 1wgp s TYR 71 Cb -0.15 -3.65 0.04 0.00 -0.11 0.00 0.00 41.96 38.08 1wgp s TYR 71 CO -0.19 -1.10 1.26 1.21 -1.11 0.00 0.00 175.55 175.63 1wgp s ASN 72 N 2.67 6.19 0.59 2.29 2.47 -1.25 -4.88 114.94 123.01 1wgp s ASN 72 Ca 0.19 -0.57 -0.16 0.00 0.42 0.00 0.00 52.86 52.75 1wgp s ASN 72 Cb -0.17 -2.55 -0.04 0.00 -1.45 0.00 0.00 41.25 37.04 1wgp s ASN 72 CO 0.14 -1.78 1.05 -0.13 -3.72 0.00 0.00 177.10 172.66 1wgp s ARG 73 N 5.53 3.39 0.25 0.43 3.00 -1.26 -3.66 118.95 126.63 1wgp s ARG 73 Ca 0.35 1.16 -0.22 0.00 0.00 0.00 0.00 55.73 57.02 1wgp s ARG 73 Cb -0.08 -2.04 0.03 0.00 0.00 0.00 0.00 34.95 32.85 1wgp s ARG 73 CO 0.13 -0.75 0.77 -1.54 0.00 0.00 0.00 175.30 173.91 1wgp s SER 74 N -2.86 -0.25 0.15 0.23 1.04 0.28 -4.97 113.70 107.32 1wgp s SER 74 Ca 0.63 -0.56 0.08 0.00 0.48 0.00 0.00 55.95 56.57 1wgp s SER 74 Cb -0.15 0.68 -0.04 0.00 0.10 0.00 0.00 66.02 66.61 1wgp s SER 74 CO 0.37 -1.25 -0.17 -0.22 0.98 0.00 0.00 173.24 172.94 1wgp s LEU 75 N -2.92 2.42 0.22 2.42 2.96 -1.26 0.56 118.68 123.07 1wgp s LEU 75 Ca 0.11 -0.83 0.11 0.00 -0.22 0.00 0.00 54.13 53.29 1wgp s LEU 75 Cb -0.05 -0.74 -0.05 0.00 0.50 0.00 0.00 46.19 45.85 1wgp s LEU 75 CO 0.06 -0.06 -0.21 -0.76 -1.32 0.00 0.00 176.35 174.06 1wgp s LEU 76 N -2.54 2.49 0.00 -0.68 1.43 -0.84 -4.80 118.68 113.75 1wgp s LEU 76 Ca 0.13 -0.93 0.06 0.00 -1.03 0.00 0.00 54.13 52.36 1wgp s LEU 76 Cb -0.06 -1.03 -0.02 0.00 0.03 0.00 0.00 46.19 45.10 1wgp s LEU 76 CO 0.05 0.04 0.23 2.29 0.23 0.00 0.00 176.35 179.19 1wgp n LYS 77 N -0.06 0.45 -1.67 1.70 2.85 -1.26 -3.66 118.16 116.50 1wgp n LYS 77 Ca -0.10 -3.21 -0.48 0.00 -1.05 0.00 0.00 58.31 53.47 1wgp n LYS 77 Cb 0.58 2.34 -0.05 0.00 -0.65 0.00 0.00 35.03 37.25 1wgp n LYS 77 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 1wgp n GLU 78 N -0.69 2.05 0.00 -1.58 0.28 -1.26 -1.74 120.64 117.69 1wgp n GLU 78 Ca 0.03 0.74 0.00 0.00 -0.16 0.00 0.00 57.16 57.78 1wgp n GLU 78 Cb 0.58 -2.53 0.00 0.00 1.43 0.00 0.00 31.44 30.91 1wgp n GLU 78 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1wgp n GLY 79 N 3.83 0.56 3.77 -1.84 0.00 -1.26 -5.09 105.19 105.16 1wgp n GLY 79 Ca 0.20 -0.05 -0.38 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 -0.93 7.43 0.47 1.61 -1.08 -0.71 -5.03 116.67 118.43 1wgp s ASP 80 Ca 0.00 1.83 0.05 0.00 -0.52 0.00 0.00 52.55 53.91 1wgp s ASP 80 Cb 0.00 -2.57 -0.03 0.00 -1.46 0.00 0.00 42.92 38.86 1wgp s ASP 80 CO 0.00 0.04 0.14 0.72 0.52 0.00 0.00 175.17 176.59 1wgp s PHE 81 N -1.43 2.16 0.14 -5.34 -0.71 -1.26 -4.23 117.98 107.31 1wgp s PHE 81 Ca 0.45 -0.77 0.02 0.00 -1.04 0.00 0.00 56.93 55.60 1wgp s PHE 81 Cb -0.21 -1.81 -0.04 0.00 -1.21 0.00 0.00 43.02 39.74 1wgp s PHE 81 CO 0.27 0.11 -0.04 0.00 -1.34 0.00 0.00 175.22 174.21 1wgp n GLY 83 N -0.16 -0.58 0.07 0.00 0.00 -1.26 -4.07 105.19 99.20 1wgp n GLY 83 Ca -0.09 0.27 -0.06 0.00 0.00 0.00 0.00 46.02 46.14 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 -2.26 0.00 -0.88 1.61 2.03 -1.93 -3.20 116.42 111.79 1wgp h ASP 84 Ca -0.68 0.00 0.25 0.00 -0.73 0.00 0.00 57.03 55.87 1wgp h ASP 84 Cb 1.37 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 39.83 1wgp h ASP 84 CO 0.57 0.92 0.91 -0.33 -1.03 0.00 0.00 179.24 180.27 1wgp h GLU 85 N 0.00 0.00 0.34 4.15 4.39 -1.93 0.50 114.58 122.03 1wgp h GLU 85 Ca -0.01 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 1wgp h GLU 85 Cb 1.65 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.31 1wgp h GLU 85 CO 0.12 0.00 -0.16 1.25 -1.16 0.00 0.00 179.01 179.06 1wgp h LEU 86 N 0.00 -0.39 -0.80 1.33 5.85 -1.93 0.30 115.31 119.67 1wgp h LEU 86 Ca 0.42 -0.14 0.13 0.00 0.84 0.00 0.00 57.88 59.13 1wgp h LEU 86 Cb 2.22 0.10 -0.14 0.00 0.37 0.00 0.00 40.66 43.22 1wgp h LEU 86 CO -0.00 -0.07 -0.38 0.25 -0.34 0.00 0.00 178.44 177.90 1wgp h LEU 87 N -0.74 -1.36 -0.44 2.25 5.85 -0.20 0.43 115.31 121.09 1wgp h LEU 87 Ca -0.05 0.27 -0.04 0.00 0.84 0.00 0.00 57.88 58.91 1wgp h LEU 87 Cb 0.50 0.69 -0.02 0.00 0.37 0.00 0.00 40.66 42.20 1wgp h LEU 87 CO 0.08 -0.30 0.13 0.74 -0.34 0.00 0.00 178.44 178.75 1wgp h THR 88 N -0.09 1.23 -0.17 1.05 2.02 -1.47 -0.05 112.91 115.43 1wgp h THR 88 Ca 0.28 -0.76 0.03 0.00 0.77 0.00 0.00 66.41 66.73 1wgp h THR 88 Cb 0.57 0.88 -0.05 0.00 -1.74 0.00 0.00 68.15 67.80 1wgp h THR 88 CO -0.84 0.27 -0.42 -0.25 0.37 0.00 0.00 175.52 174.66 1wgp h TRP 89 N 0.58 -1.25 -0.44 3.16 7.01 0.35 0.94 115.95 126.31 1wgp h TRP 89 Ca 0.14 0.05 0.07 0.00 2.11 0.00 0.00 58.89 61.26 1wgp h TRP 89 Cb 0.28 0.57 -0.06 0.00 -2.10 0.00 0.00 29.16 27.85 1wgp h TRP 89 CO 0.01 -0.40 0.09 0.00 -2.79 0.00 0.00 178.44 175.35 1wgp h ALA 90 N -0.50 0.48 -0.45 2.65 0.00 -0.38 0.38 119.26 121.44 1wgp h ALA 90 Ca 0.03 0.09 0.13 0.00 0.00 0.00 0.00 54.91 55.16 1wgp h ALA 90 Cb 0.49 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1wgp h ALA 90 CO -0.37 -0.31 0.40 -0.07 0.00 0.00 0.00 179.25 178.89 1wgp h LEU 91 N 0.22 0.00 -8.63 0.00 4.07 0.74 -3.35 115.31 108.36 1wgp h LEU 91 Ca 0.21 0.00 -0.69 0.00 0.08 0.00 0.00 57.88 57.49 1wgp h LEU 91 Cb 0.27 0.00 -0.19 0.00 1.08 0.00 0.00 40.66 41.82 1wgp h LEU 91 CO -0.28 0.00 -0.31 -1.81 -1.08 0.00 0.00 178.44 174.96 1wgp s ASP 92 N -5.73 6.16 0.23 -0.43 1.11 0.31 -4.93 116.67 113.39 1wgp s ASP 92 Ca -0.05 -0.52 0.10 0.00 0.18 0.00 0.00 52.55 52.26 1wgp s ASP 92 Cb 0.17 -2.19 0.18 0.00 1.07 0.00 0.00 42.92 42.16 1wgp s ASP 92 CO 0.63 -0.42 1.51 1.55 1.18 0.00 0.00 175.17 179.62 1wgp h PRO 93 N 8.58 0.00 -0.62 8.23 0.13 -1.75 -3.15 132.00 143.42 1wgp h PRO 93 Ca -0.28 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.82 1wgp h PRO 93 Cb 1.13 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.23 1wgp h PRO 93 CO 0.72 0.73 0.30 0.87 -0.23 0.00 0.00 178.00 180.39 1wgp h LYS 94 N 0.00 0.90 0.00 0.86 1.79 -1.91 -3.48 116.57 114.73 1wgp h LYS 94 Ca -0.01 -0.13 0.13 0.00 -2.18 0.00 0.00 60.65 58.46 1wgp h LYS 94 Cb 1.31 -0.16 -0.03 0.00 -1.58 0.00 0.00 32.23 31.76 1wgp h LYS 94 CO 0.09 0.72 -0.17 0.43 -1.08 0.00 0.00 179.45 179.44 1wgp n SER 95 N -4.50 -3.58 -0.06 0.86 7.64 -1.19 -4.80 113.62 107.98 1wgp n SER 95 Ca 0.04 0.52 -0.07 0.00 1.01 0.00 0.00 58.87 60.36 1wgp n SER 95 Cb 0.13 -1.65 -0.02 0.00 -1.01 0.00 0.00 64.21 61.65 1wgp n SER 95 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wgp n GLY 96 N -1.60 -0.45 0.17 0.23 0.00 -1.26 -5.06 105.19 97.21 1wgp n GLY 96 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 -4.26 -0.05 -4.71 1.61 2.88 -1.26 -5.15 113.62 102.68 1wgp n SER 97 Ca -0.11 0.07 -0.31 0.00 -1.33 0.00 0.00 58.87 57.19 1wgp n SER 97 Cb 0.42 0.14 -0.09 0.00 -0.75 0.00 0.00 64.21 63.93 1wgp n SER 97 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1wgp s ASN 98 N -2.00 4.04 0.86 -3.46 3.84 -1.26 -5.11 114.94 111.84 1wgp s ASN 98 Ca 0.00 -1.55 -0.15 0.00 0.21 0.00 0.00 52.86 51.37 1wgp s ASN 98 Cb 0.00 0.18 -0.04 0.00 -0.55 0.00 0.00 41.25 40.84 1wgp s ASN 98 CO 0.00 -0.70 0.13 0.18 -2.79 0.00 0.00 177.10 173.91 1wgp n LEU 99 N -1.15 -1.48 -4.82 3.21 4.77 -1.26 -4.93 117.00 111.34 1wgp n LEU 99 Ca -0.14 0.40 -0.31 0.00 -0.03 0.00 0.00 56.01 55.93 1wgp n LEU 99 Cb 0.67 -1.08 0.04 0.00 -2.33 0.00 0.00 43.42 40.72 1wgp n LEU 99 CO 0.42 -4.11 0.71 -2.16 -1.33 0.00 0.00 177.39 170.92 1wgp s PRO 100 N -2.80 3.02 -0.13 3.23 0.04 -1.26 -4.65 135.00 132.45 1wgp s PRO 100 Ca 0.56 0.99 0.03 0.00 0.04 0.00 0.00 61.00 62.61 1wgp s PRO 100 Cb -0.27 -2.00 0.01 0.00 0.04 0.00 0.00 34.50 32.28 1wgp s PRO 100 CO 0.68 -1.04 -0.22 -1.54 0.04 0.00 0.00 177.00 174.93 1wgp s SER 101 N -3.64 3.03 0.65 6.66 1.04 -1.26 0.19 113.70 120.36 1wgp s SER 101 Ca 0.59 -0.58 -0.16 0.00 0.48 0.00 0.00 55.95 56.28 1wgp s SER 101 Cb -0.14 -1.40 -0.01 0.00 0.10 0.00 0.00 66.02 64.57 1wgp s SER 101 CO 0.52 0.08 1.15 -0.94 0.98 0.00 0.00 173.24 175.03 1wgp s SER 102 N 0.77 5.01 -0.28 7.02 1.04 -1.23 -4.92 113.70 121.12 1wgp s SER 102 Ca -0.09 2.17 0.11 0.00 0.48 0.00 0.00 55.95 58.63 1wgp s SER 102 Cb -0.16 -2.57 0.61 0.00 0.10 0.00 0.00 66.02 64.00 1wgp s SER 102 CO -0.00 -1.70 1.60 0.35 0.98 0.00 0.00 173.24 174.47 1wgp n THR 103 N -2.17 2.65 -3.52 2.02 -2.24 -1.26 -3.63 114.28 106.13 1wgp n THR 103 Ca 0.12 -2.03 -0.14 0.00 -2.27 0.00 0.00 64.05 59.73 1wgp n THR 103 Cb 0.51 -0.32 -0.05 0.00 -2.10 0.00 0.00 70.33 68.37 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 -3.03 0.94 0.17 -0.78 1.70 -1.26 -4.96 118.95 111.74 1wgp s ARG 104 Ca 0.48 0.03 0.07 0.00 -0.47 0.00 0.00 55.73 55.84 1wgp s ARG 104 Cb 0.40 0.44 -0.04 0.00 -0.57 0.00 0.00 34.95 35.18 1wgp s ARG 104 CO 0.08 -0.34 0.05 0.99 -1.08 0.00 0.00 175.30 175.01 1wgp s THR 105 N -1.88 3.99 -0.10 4.99 2.01 -0.87 -3.90 115.64 119.88 1wgp s THR 105 Ca -0.04 -1.32 -0.19 0.00 0.31 0.00 0.00 61.69 60.45 1wgp s THR 105 Cb -0.00 -3.03 0.04 0.00 0.01 0.00 0.00 72.50 69.52 1wgp s THR 105 CO 0.01 -0.12 0.46 -0.69 -0.69 0.00 0.00 174.62 173.59 1wgp s VAL 106 N -1.76 0.02 0.02 3.82 1.01 -0.91 -2.19 120.40 120.41 1wgp s VAL 106 Ca 0.29 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.12 1wgp s VAL 106 Cb -0.09 -0.71 -0.02 0.00 0.00 0.00 0.00 36.38 35.56 1wgp s VAL 106 CO 0.20 -0.09 -0.05 -0.75 0.00 0.00 0.00 175.10 174.42 1wgp s LYS 107 N -0.56 0.38 -0.44 2.72 2.36 -1.18 -2.92 119.74 120.09 1wgp s LYS 107 Ca -0.07 -0.51 -0.25 0.00 -2.55 0.00 0.00 55.97 52.59 1wgp s LYS 107 Cb -0.03 -0.16 0.02 0.00 -1.05 0.00 0.00 37.83 36.61 1wgp s LYS 107 CO 0.04 0.03 0.91 0.00 1.55 0.00 0.00 175.35 177.87 1wgp s ALA 108 N -0.98 3.28 -0.12 3.13 0.00 0.59 -2.96 121.76 124.71 1wgp s ALA 108 Ca -0.08 -0.74 0.17 0.00 0.00 0.00 0.00 51.96 51.31 1wgp s ALA 108 Cb -0.07 -3.60 -0.21 0.00 0.00 0.00 0.00 23.12 19.24 1wgp s ALA 108 CO -0.00 -1.94 0.52 1.28 0.00 0.00 0.00 175.76 175.62 1wgp n LEU 109 N 7.03 0.49 -4.15 0.00 4.32 -1.26 -2.99 117.00 120.43 1wgp n LEU 109 Ca 0.06 0.22 -0.13 0.00 -0.02 0.00 0.00 56.01 56.14 1wgp n LEU 109 Cb 0.48 0.21 -0.11 0.00 -1.62 0.00 0.00 43.42 42.39 1wgp n LEU 109 CO 0.62 0.27 -0.40 0.28 -1.22 0.00 0.00 177.39 176.94 1wgp s THR 110 N -2.82 0.75 -0.50 -5.08 -1.32 -1.26 -4.97 115.64 100.44 1wgp s THR 110 Ca -0.06 -1.62 -0.45 0.00 -1.21 0.00 0.00 61.69 58.35 1wgp s THR 110 Cb 0.08 -1.31 -0.19 0.00 -1.51 0.00 0.00 72.50 69.58 1wgp s THR 110 CO 0.83 -0.64 1.99 1.21 -2.21 0.00 0.00 174.62 175.80 1wgp n GLU 111 N 0.54 0.03 -4.12 7.08 2.13 -1.26 -4.73 120.64 120.29 1wgp n GLU 111 Ca -0.16 0.01 -0.35 0.00 0.66 0.00 0.00 57.16 57.32 1wgp n GLU 111 Cb 0.58 -1.52 -0.07 0.00 0.27 0.00 0.00 31.44 30.70 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 5.20 4.82 -0.24 6.31 1.01 -1.24 -4.63 120.40 131.62 1wgp s VAL 112 Ca 1.16 -0.20 -0.00 0.00 0.00 0.00 0.00 61.98 62.94 1wgp s VAL 112 Cb -1.49 -3.13 0.07 0.00 0.00 0.00 0.00 36.38 31.84 1wgp s VAL 112 CO 0.70 0.49 0.00 -1.61 0.00 0.00 0.00 175.10 174.68 1wgp s GLU 113 N -1.31 1.22 0.33 2.72 2.02 -1.26 -3.73 118.70 118.70 1wgp s GLU 113 Ca 0.18 -0.93 -0.18 0.00 0.02 0.00 0.00 54.97 54.06 1wgp s GLU 113 Cb -0.12 -2.42 0.04 0.00 0.10 0.00 0.00 34.13 31.74 1wgp s GLU 113 CO 0.08 -0.70 0.77 0.00 0.02 0.00 0.00 175.26 175.43 1wgp s ALA 114 N 1.51 -0.99 0.28 5.21 0.00 -1.26 -2.77 121.76 123.74 1wgp s ALA 114 Ca -0.01 -0.53 0.09 0.00 0.00 0.00 0.00 51.96 51.51 1wgp s ALA 114 Cb -0.18 0.75 -0.04 0.00 0.00 0.00 0.00 23.12 23.65 1wgp s ALA 114 CO -0.10 -1.01 0.08 -0.06 0.00 0.00 0.00 175.76 174.66 1wgp s PHE 115 N -3.02 2.78 0.24 0.00 0.40 -1.23 -4.05 117.98 113.10 1wgp s PHE 115 Ca 0.14 -0.24 0.05 0.00 -0.60 0.00 0.00 56.93 56.28 1wgp s PHE 115 Cb -0.05 -1.35 -0.03 0.00 0.51 0.00 0.00 43.02 42.09 1wgp s PHE 115 CO 0.09 0.53 0.34 0.00 0.70 0.00 0.00 175.22 176.87 1wgp s ALA 116 N -2.31 3.88 -0.09 5.36 0.00 -1.08 -2.35 121.76 125.17 1wgp s ALA 116 Ca 0.33 -1.26 -0.04 0.00 0.00 0.00 0.00 51.96 51.00 1wgp s ALA 116 Cb -0.06 -1.67 0.05 0.00 0.00 0.00 0.00 23.12 21.44 1wgp s ALA 116 CO 0.22 0.24 0.17 -1.17 0.00 0.00 0.00 175.76 175.22 1wgp s LEU 117 N -3.96 -0.10 0.26 0.00 1.98 0.18 -2.59 118.68 114.44 1wgp s LEU 117 Ca 0.34 0.35 -0.25 0.00 -2.89 0.00 0.00 54.13 51.68 1wgp s LEU 117 Cb -0.09 0.32 -0.09 0.00 0.66 0.00 0.00 46.19 46.99 1wgp s LEU 117 CO 0.28 -0.25 0.86 -0.51 -1.89 0.00 0.00 176.35 174.85 1wgp s ILE 118 N 2.31 4.30 0.10 6.68 2.07 -1.26 0.21 121.20 135.61 1wgp s ILE 118 Ca 0.03 1.72 -0.18 0.00 -1.41 0.00 0.00 60.65 60.81 1wgp s ILE 118 Cb -0.12 -4.05 -0.06 0.00 0.13 0.00 0.00 42.46 38.36 1wgp s ILE 118 CO -0.06 0.28 1.58 0.00 -1.91 0.00 0.00 174.94 174.84 1wgp h ALA 119 N 3.60 0.37 -0.04 1.50 0.00 -1.89 -1.88 119.26 120.93 1wgp h ALA 119 Ca -0.47 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1wgp h ALA 119 Cb 1.20 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1wgp h ALA 119 CO 0.66 0.04 -0.03 0.22 0.00 0.00 0.00 179.25 180.13 1wgp h ASP 120 N 0.28 -0.12 -0.96 0.00 1.82 -1.93 1.22 116.42 116.73 1wgp h ASP 120 Ca 0.09 0.02 0.24 0.00 -0.39 0.00 0.00 57.03 56.98 1wgp h ASP 120 Cb 0.31 0.05 -0.07 0.00 0.68 0.00 0.00 39.33 40.30 1wgp h ASP 120 CO 0.00 -0.02 0.64 -0.33 -1.61 0.00 0.00 179.24 177.92 1wgp h GLU 121 N -0.02 0.32 0.07 0.28 4.39 -1.98 -0.44 114.58 117.20 1wgp h GLU 121 Ca 0.01 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.68 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 -0.04 0.21 -0.03 1.25 -1.16 0.00 0.00 179.01 179.23 1wgp h LEU 122 N 0.33 -0.08 -0.97 1.33 6.46 0.59 -1.12 115.31 121.84 1wgp h LEU 122 Ca 0.51 0.00 0.24 0.00 -0.12 0.00 0.00 57.88 58.51 1wgp h LEU 122 Cb 1.41 0.02 -0.18 0.00 -0.73 0.00 0.00 40.66 41.18 1wgp h LEU 122 CO -0.18 -0.05 -0.05 0.50 -0.62 0.00 0.00 178.44 178.04 1wgp h LYS 123 N -0.11 0.01 0.06 1.25 3.64 0.18 1.37 116.57 122.97 1wgp h LYS 123 Ca -0.01 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1wgp h LYS 123 Cb 0.07 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1wgp h LYS 123 CO 0.02 0.01 -0.13 0.35 -2.27 0.00 0.00 179.45 177.43 1wgp h PHE 124 N 0.01 -0.37 -0.54 1.91 3.04 -1.04 1.18 116.94 121.14 1wgp h PHE 124 Ca 0.55 0.01 0.10 0.00 3.98 0.00 0.00 57.97 62.61 1wgp h PHE 124 Cb 1.05 0.15 -0.03 0.00 2.56 0.00 0.00 35.95 39.68 1wgp h PHE 124 CO -0.57 -0.15 0.37 -0.24 -2.02 0.00 0.00 178.31 175.69 1wgp h VAL 125 N -0.20 0.87 0.00 1.41 3.04 0.27 0.89 116.25 122.52 1wgp h VAL 125 Ca -0.01 -0.10 -0.04 0.00 -1.01 0.00 0.00 66.70 65.54 1wgp h VAL 125 Cb 0.19 0.55 -0.01 0.00 -2.01 0.00 0.00 31.29 30.02 1wgp h VAL 125 CO -0.05 0.05 -0.20 0.00 -1.01 0.00 0.00 177.57 176.37 1wgp h ALA 126 N 1.73 1.06 0.12 3.17 0.00 0.27 -3.02 119.26 122.58 1wgp h ALA 126 Ca 0.25 -0.18 -0.36 0.00 0.00 0.00 0.00 54.91 54.63 1wgp h ALA 126 Cb 0.59 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1wgp h ALA 126 CO -0.06 0.24 -1.94 0.45 0.00 0.00 0.00 179.25 177.94 1wgp n SER 127 N -3.41 2.11 -0.08 0.00 2.88 0.40 -2.24 113.62 113.28 1wgp n SER 127 Ca -0.00 0.23 -0.08 0.00 -1.33 0.00 0.00 58.87 57.69 1wgp n SER 127 Cb 0.39 -0.88 -0.06 0.00 -0.75 0.00 0.00 64.21 62.91 1wgp n SER 127 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 1wgp h GLN 128 N -0.00 -0.22 0.00 -1.46 1.08 0.52 -3.30 115.11 111.73 1wgp h GLN 128 Ca -0.42 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 56.80 1wgp h GLN 128 Cb 1.99 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 29.47 1wgp h GLN 128 CO 0.07 -0.15 -0.12 0.74 -0.95 0.00 0.00 178.83 178.42 1wgp h PHE 129 N -0.23 0.00 -4.25 2.96 -1.00 -1.74 -3.46 116.94 109.22 1wgp h PHE 129 Ca 0.04 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.78 1wgp h PHE 129 Cb 0.35 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.90 1wgp h PHE 129 CO -0.68 0.00 -0.05 2.89 -1.61 0.00 0.00 178.31 178.86 1wgp n ARG 130 N -4.58 -2.52 -2.43 1.51 1.85 -0.95 -4.80 116.66 104.74 1wgp n ARG 130 Ca -0.02 0.11 -0.43 0.00 -1.00 0.00 0.00 57.85 56.52 1wgp n ARG 130 Cb 0.06 -4.54 -0.02 0.00 -1.05 0.00 0.00 32.46 26.91 1wgp n ARG 130 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 1wgp s ARG 131 N -4.48 4.02 0.49 2.89 3.52 -1.26 -4.74 118.95 119.39 1wgp s ARG 131 Ca 0.00 1.36 0.00 0.00 -0.13 0.00 0.00 55.73 56.96 1wgp s ARG 131 Cb 0.00 -3.84 0.00 0.00 -1.56 0.00 0.00 34.95 29.55 1wgp s ARG 131 CO 0.00 -0.99 0.00 0.43 -0.81 0.00 0.00 175.30 173.93 1wgp n SER 132 N 7.29 -7.23 -4.49 -2.12 7.64 -1.26 -4.67 113.62 108.77 1wgp n SER 132 Ca 0.14 1.45 -0.23 0.00 1.01 0.00 0.00 58.87 61.24 1wgp n SER 132 Cb 0.46 -4.09 -0.11 0.00 -1.01 0.00 0.00 64.21 59.47 1wgp n SER 132 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wgp s GLY 133 N -4.55 2.08 -0.01 0.23 0.00 -1.26 -4.81 107.32 99.00 1wgp s GLY 133 Ca 0.00 -2.05 -0.22 0.00 0.00 0.00 0.00 44.72 42.46 1wgp s GLY 133 CO 0.00 -1.92 1.10 -0.56 0.00 0.00 0.00 173.10 171.72 1wgp h PRO 134 N 2.10 0.32 -6.02 2.90 0.13 -1.96 -3.44 132.00 126.03 1wgp h PRO 134 Ca -0.41 -0.31 -0.71 0.00 -0.87 0.00 0.00 66.00 63.70 1wgp h PRO 134 Cb 1.24 0.08 -0.02 0.00 0.13 0.00 0.00 31.00 32.43 1wgp h PRO 134 CO 0.71 0.99 1.31 0.43 -0.23 0.00 0.00 178.00 181.21 1wgp n SER 135 N -4.37 1.87 -3.65 1.44 7.64 -1.26 -4.86 113.62 110.43 1wgp n SER 135 Ca -0.10 0.59 -0.02 0.00 1.01 0.00 0.00 58.87 60.35 1wgp n SER 135 Cb 0.57 -1.16 -0.07 0.00 -1.01 0.00 0.00 64.21 62.55 1wgp n SER 135 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wgp s SER 136 N 6.35 -0.36 0.00 6.43 0.15 -1.26 -5.21 113.70 119.80 1wgp s SER 136 Ca 1.10 0.60 0.00 0.00 0.70 0.00 0.00 55.95 58.35 1wgp s SER 136 Cb -1.04 1.01 0.00 0.00 -1.71 0.00 0.00 66.02 64.28 1wgp s SER 136 CO 0.56 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.51