#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zgw n LYS 2 N 0.00 0.25 -3.45 3.17 4.76 -1.26 -5.08 118.16 116.55 1zgw n LYS 2 Ca 0.00 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 55.16 1zgw n LYS 2 Cb 0.00 0.00 -0.11 0.00 -1.84 0.00 0.00 35.03 33.08 1zgw n LYS 2 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1zgw s LYS 3 N -2.71 0.72 0.00 1.97 3.01 -1.26 -5.04 119.74 116.43 1zgw s LYS 3 Ca 0.00 -1.65 0.00 0.00 -1.01 0.00 0.00 55.97 53.31 1zgw s LYS 3 Cb 0.00 -1.41 0.00 0.00 -1.01 0.00 0.00 37.83 35.41 1zgw s LYS 3 CO 0.00 -1.27 0.60 0.00 0.51 0.00 0.00 175.35 175.19 1zgw n ALA 4 N 3.58 0.12 -1.39 5.17 0.00 -1.26 -4.66 120.51 122.07 1zgw n ALA 4 Ca 0.18 -0.60 -0.42 0.00 0.00 0.00 0.00 53.44 52.60 1zgw n ALA 4 Cb 0.41 -0.12 -0.04 0.00 0.00 0.00 0.00 19.45 19.70 1zgw n ALA 4 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1zgw n THR 5 N 3.63 2.38 -0.44 0.00 -2.24 -1.26 -2.22 114.28 114.13 1zgw n THR 5 Ca 0.00 -2.10 0.00 0.00 -2.27 0.00 0.00 64.05 59.68 1zgw n THR 5 Cb 0.30 -2.41 0.00 0.00 -2.10 0.00 0.00 70.33 66.12 1zgw n THR 5 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1zgw n LEU 7 N 0.00 -1.85 -3.50 0.00 4.77 -0.94 -4.88 117.00 110.59 1zgw n LEU 7 Ca 0.00 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.58 1zgw n LEU 7 Cb 0.10 -0.93 -0.02 0.00 -2.33 0.00 0.00 43.42 40.25 1zgw n LEU 7 CO 0.00 0.00 3.04 0.41 -1.33 0.00 0.00 177.39 179.51 1zgw n THR 8 N -0.05 3.84 -0.54 -5.08 -1.04 -1.26 -4.72 114.28 105.43 1zgw n THR 8 Ca 0.00 -2.72 0.44 0.00 -2.04 0.00 0.00 64.05 59.73 1zgw n THR 8 Cb 0.00 -2.60 0.68 0.00 -1.82 0.00 0.00 70.33 66.59 1zgw n THR 8 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1zgw n ASP 9 N 4.80 0.00 -0.14 8.00 5.75 -1.26 0.14 116.55 133.83 1zgw n ASP 9 Ca 0.65 0.90 -0.03 0.00 -0.01 0.00 0.00 54.79 56.30 1zgw n ASP 9 Cb 0.30 -0.41 0.04 0.00 -1.03 0.00 0.00 41.12 40.02 1zgw n ASP 9 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 1zgw h ASP 10 N 0.00 -0.25 0.95 -1.12 5.19 -2.00 0.48 116.42 119.67 1zgw h ASP 10 Ca 0.78 0.12 -0.19 0.00 -0.62 0.00 0.00 57.03 57.11 1zgw h ASP 10 Cb 3.44 0.22 -0.03 0.00 0.18 0.00 0.00 39.33 43.13 1zgw h ASP 10 CO -0.01 -0.09 -0.91 -0.61 -3.12 0.00 0.00 179.24 174.50 1zgw h GLN 11 N 0.08 0.00 -0.91 3.56 5.75 0.75 -2.46 115.11 121.88 1zgw h GLN 11 Ca 0.23 0.00 0.18 0.00 -0.15 0.00 0.00 58.65 58.91 1zgw h GLN 11 Cb 0.34 0.00 -0.11 0.00 1.07 0.00 0.00 27.48 28.78 1zgw h GLN 11 CO -0.40 0.91 0.48 0.00 -2.65 0.00 0.00 178.83 177.17 1zgw h ARG 12 N 0.00 0.59 -0.80 1.69 -0.00 -0.30 2.11 114.38 117.67 1zgw h ARG 12 Ca -0.01 -0.04 -0.03 0.00 -0.50 0.00 0.00 59.98 59.41 1zgw h ARG 12 Cb 1.63 -0.13 -0.04 0.00 0.00 0.00 0.00 29.97 31.43 1zgw h ARG 12 CO 0.12 0.39 0.39 2.35 0.00 0.00 0.00 179.97 183.22 1zgw h TRP 13 N 0.61 1.14 0.00 3.04 -0.00 0.13 0.81 115.95 121.67 1zgw h TRP 13 Ca 0.52 -0.05 -0.01 0.00 -0.00 0.00 0.00 58.89 59.35 1zgw h TRP 13 Cb 0.84 -0.35 -0.00 0.00 -0.00 0.00 0.00 29.16 29.64 1zgw h TRP 13 CO -0.07 0.82 -0.05 0.37 -0.00 0.00 0.00 178.44 179.51 1zgw h GLN 14 N 1.12 0.00 -0.00 2.65 5.75 0.33 0.48 115.11 125.43 1zgw h GLN 14 Ca 0.27 0.00 -0.16 0.00 -0.15 0.00 0.00 58.65 58.61 1zgw h GLN 14 Cb 0.10 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.63 1zgw h GLN 14 CO -0.04 0.05 -0.75 0.77 -2.65 0.00 0.00 178.83 176.21 1zgw h SER 15 N 0.00 0.05 0.81 -0.69 0.02 0.54 0.49 113.55 114.77 1zgw h SER 15 Ca -0.00 -0.04 -0.15 0.00 -0.84 0.00 0.00 61.79 60.77 1zgw h SER 15 Cb 0.08 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 1zgw h SER 15 CO 0.01 0.78 -0.70 0.58 -1.14 0.00 0.00 176.83 176.36 1zgw h VAL 16 N 0.03 1.43 0.01 2.27 2.07 0.48 0.77 116.25 123.30 1zgw h VAL 16 Ca -0.01 -2.45 -0.33 0.00 0.82 0.00 0.00 66.70 64.73 1zgw h VAL 16 Cb 1.33 2.35 -0.05 0.00 -1.52 0.00 0.00 31.29 33.39 1zgw h VAL 16 CO 0.10 0.68 -1.99 0.18 0.02 0.00 0.00 177.57 176.56 1zgw n LEU 17 N -3.60 0.95 0.16 2.57 4.77 0.83 -3.87 117.00 118.81 1zgw n LEU 17 Ca -0.01 0.23 0.13 0.00 -0.03 0.00 0.00 56.01 56.34 1zgw n LEU 17 Cb 0.71 0.05 0.39 0.00 -2.33 0.00 0.00 43.42 42.24 1zgw n LEU 17 CO 0.43 0.51 0.87 0.00 -1.33 0.00 0.00 177.39 177.87 1zgw h ALA 18 N 0.83 1.00 -3.70 -1.18 0.00 -0.01 -3.47 119.26 112.73 1zgw h ALA 18 Ca -0.40 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.26 1zgw h ALA 18 Cb 2.08 0.00 0.07 0.00 0.00 0.00 0.00 17.79 19.94 1zgw h ALA 18 CO 0.06 0.00 -0.41 2.89 0.00 0.00 0.00 179.25 181.78 1zgw n ARG 19 N -2.60 -4.40 -2.11 0.00 1.85 0.12 -4.93 116.66 104.60 1zgw n ARG 19 Ca 0.04 0.54 -0.43 0.00 -1.00 0.00 0.00 57.85 56.99 1zgw n ARG 19 Cb 0.41 -4.65 -0.02 0.00 -1.05 0.00 0.00 32.46 27.14 1zgw n ARG 19 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1zgw s ASP 20 N -3.08 6.05 0.00 2.89 2.15 -0.36 -4.57 116.67 119.75 1zgw s ASP 20 Ca 0.31 1.18 0.03 0.00 0.43 0.00 0.00 52.55 54.51 1zgw s ASP 20 Cb -0.14 -2.53 0.19 0.00 -0.30 0.00 0.00 42.92 40.15 1zgw s ASP 20 CO 0.39 -1.60 0.54 -0.81 -0.17 0.00 0.00 175.17 173.51 1zgw n PRO 21 N 8.29 0.28 -0.00 4.34 -0.04 -1.26 -1.23 135.00 145.38 1zgw n PRO 21 Ca 0.21 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.77 1zgw n PRO 21 Cb 0.47 -1.18 -0.12 0.00 -0.04 0.00 0.00 33.50 32.63 1zgw n PRO 21 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1zgw n ASN 22 N -0.68 0.89 -0.34 3.54 5.15 -1.26 -3.98 115.26 118.58 1zgw n ASN 22 Ca 0.02 -0.89 0.10 0.00 -0.60 0.00 0.00 54.58 53.21 1zgw n ASN 22 Cb 0.01 1.11 -0.03 0.00 -0.53 0.00 0.00 39.78 40.34 1zgw n ASN 22 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1zgw n ALA 23 N -1.58 3.67 -2.70 5.20 0.00 -0.37 -4.66 120.51 120.08 1zgw n ALA 23 Ca 0.03 -0.59 -0.42 0.00 0.00 0.00 0.00 53.44 52.46 1zgw n ALA 23 Cb 0.35 -0.70 -0.03 0.00 0.00 0.00 0.00 19.45 19.08 1zgw n ALA 23 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1zgw s ASP 24 N -2.38 7.29 0.00 0.00 2.15 -1.24 -1.74 116.67 120.76 1zgw s ASP 24 Ca 0.14 1.58 0.00 0.00 0.43 0.00 0.00 52.55 54.70 1zgw s ASP 24 Cb 0.16 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.22 1zgw s ASP 24 CO 0.57 -0.37 0.00 0.61 -0.17 0.00 0.00 175.17 175.82 1zgw n GLY 25 N 3.02 3.07 0.19 2.66 0.00 -1.26 0.56 105.19 113.44 1zgw n GLY 25 Ca 0.07 -0.72 -0.14 0.00 0.00 0.00 0.00 46.02 45.23 1zgw n GLY 25 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1zgw h GLU 26 N 0.00 0.58 -2.74 1.61 4.22 -1.71 -3.43 114.58 113.11 1zgw h GLU 26 Ca 0.00 -0.50 0.11 0.00 0.08 0.00 0.00 59.36 59.05 1zgw h GLU 26 Cb 0.00 0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.30 1zgw h GLU 26 CO 0.00 1.13 0.34 -0.59 -2.18 0.00 0.00 179.01 177.70 1zgw s PHE 27 N -3.61 -0.14 0.38 0.92 -0.12 -0.71 -4.46 117.98 110.24 1zgw s PHE 27 Ca -0.08 -0.27 0.04 0.00 -0.05 0.00 0.00 56.93 56.57 1zgw s PHE 27 Cb 0.09 0.69 -0.03 0.00 -0.63 0.00 0.00 43.02 43.14 1zgw s PHE 27 CO 0.87 -1.10 0.11 0.14 -0.05 0.00 0.00 175.22 175.20 1zgw s VAL 28 N -3.55 0.75 -0.05 -2.49 -7.23 -0.39 -4.51 120.40 102.93 1zgw s VAL 28 Ca 0.12 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.27 1zgw s VAL 28 Cb -0.04 -2.46 0.03 0.00 0.56 0.00 0.00 36.38 34.46 1zgw s VAL 28 CO 0.05 0.00 0.03 0.72 -0.31 0.00 0.00 175.10 175.60 1zgw s PHE 29 N -3.25 0.33 -0.37 2.82 -0.12 -1.25 -1.62 117.98 114.52 1zgw s PHE 29 Ca 0.27 0.07 -0.15 0.00 -0.05 0.00 0.00 56.93 57.06 1zgw s PHE 29 Cb 0.04 -0.62 -0.00 0.00 -0.63 0.00 0.00 43.02 41.81 1zgw s PHE 29 CO 0.14 -0.25 0.35 0.00 -0.05 0.00 0.00 175.22 175.41 1zgw s ALA 30 N 2.08 3.48 -0.67 1.99 0.00 0.75 -3.91 121.76 125.49 1zgw s ALA 30 Ca 0.05 -1.35 -0.23 0.00 0.00 0.00 0.00 51.96 50.43 1zgw s ALA 30 Cb -0.12 -2.85 0.07 0.00 0.00 0.00 0.00 23.12 20.21 1zgw s ALA 30 CO -0.04 -1.20 1.00 0.08 0.00 0.00 0.00 175.76 175.60 1zgw s VAL 31 N 1.96 4.26 0.58 0.00 1.01 0.48 -1.22 120.40 127.47 1zgw s VAL 31 Ca 0.10 -0.27 0.43 0.00 0.00 0.00 0.00 61.98 62.25 1zgw s VAL 31 Cb -0.17 -4.71 0.44 0.00 0.00 0.00 0.00 36.38 31.94 1zgw s VAL 31 CO 0.12 -1.50 2.32 0.03 0.00 0.00 0.00 175.10 176.07 1zgw h ARG 32 N 9.62 0.00 -0.13 2.72 3.08 0.16 0.31 114.38 130.13 1zgw h ARG 32 Ca -0.29 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.72 1zgw h ARG 32 Cb 1.07 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.11 1zgw h ARG 32 CO 1.19 0.00 -0.13 0.00 -1.07 0.00 0.00 179.97 179.96 1zgw h THR 33 N 0.00 1.17 -0.01 2.04 1.03 -1.89 -2.95 112.91 112.31 1zgw h THR 33 Ca -0.00 -0.75 0.00 0.00 -0.01 0.00 0.00 66.41 65.65 1zgw h THR 33 Cb 0.08 1.22 0.00 0.00 -1.07 0.00 0.00 68.15 68.38 1zgw h THR 33 CO 0.00 0.23 0.00 1.07 -0.01 0.00 0.00 175.52 176.81 1zgw n THR 34 N -4.28 0.30 -3.08 0.00 5.66 -0.42 -4.99 114.28 107.47 1zgw n THR 34 Ca -0.01 -0.65 -0.22 0.00 -3.05 0.00 0.00 64.05 60.12 1zgw n THR 34 Cb 0.26 0.85 0.04 0.00 -1.55 0.00 0.00 70.33 69.94 1zgw n THR 34 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1zgw n GLY 35 N -0.12 -0.48 3.47 1.09 0.00 0.95 -4.86 105.19 105.23 1zgw n GLY 35 Ca 0.00 0.12 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 1zgw n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1zgw s ILE 36 N -3.19 1.80 -0.01 -0.61 1.01 -0.88 0.10 121.20 119.42 1zgw s ILE 36 Ca 0.33 -2.14 -0.09 0.00 0.00 0.00 0.00 60.65 58.76 1zgw s ILE 36 Cb -0.15 -2.53 0.01 0.00 0.01 0.00 0.00 42.46 39.80 1zgw s ILE 36 CO 0.41 -0.26 0.18 0.72 0.00 0.00 0.00 174.94 175.99 1zgw s PHE 37 N -2.90 -0.03 0.57 3.97 -0.12 -1.25 0.18 117.98 118.39 1zgw s PHE 37 Ca 0.31 0.02 0.10 0.00 -0.05 0.00 0.00 56.93 57.30 1zgw s PHE 37 Cb 0.04 -0.01 0.08 0.00 -0.63 0.00 0.00 43.02 42.50 1zgw s PHE 37 CO 0.13 -0.28 0.77 1.03 -0.05 0.00 0.00 175.22 176.82 1zgw s ARG 39 N -1.18 2.33 0.42 1.99 0.52 -1.26 -3.74 118.95 118.04 1zgw s ARG 39 Ca -0.13 -1.63 0.27 0.00 -0.52 0.00 0.00 55.73 53.72 1zgw s ARG 39 Cb -0.06 -2.64 0.79 0.00 0.52 0.00 0.00 34.95 33.55 1zgw s ARG 39 CO 0.02 -0.82 1.76 -1.00 0.02 0.00 0.00 175.30 175.28 1zgw h PRO 40 N 0.22 0.00 -0.28 3.54 0.13 -1.82 -3.23 132.00 130.55 1zgw h PRO 40 Ca -0.30 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.67 1zgw h PRO 40 Cb 1.29 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.32 1zgw h PRO 40 CO 0.41 0.00 -0.24 -1.13 -0.23 0.00 0.00 178.00 176.81 1zgw n SER 41 N -2.89 2.45 -4.57 1.44 3.41 -1.26 -2.79 113.62 109.41 1zgw n SER 41 Ca 0.03 -3.83 -0.46 0.00 -0.26 0.00 0.00 58.87 54.35 1zgw n SER 41 Cb 0.42 -0.59 -0.02 0.00 -0.26 0.00 0.00 64.21 63.75 1zgw n SER 41 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1zgw n ARG 43 N 1.02 2.53 -0.10 0.00 -4.01 -1.26 -4.59 116.66 110.25 1zgw n ARG 43 Ca 0.12 -2.34 -0.20 0.00 -1.04 0.00 0.00 57.85 54.38 1zgw n ARG 43 Cb 0.29 -1.51 -0.11 0.00 -3.04 0.00 0.00 32.46 28.10 1zgw n ARG 43 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 1zgw h ALA 44 N 4.25 0.24 0.00 2.89 0.00 -2.03 -3.51 119.26 121.11 1zgw h ALA 44 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 54.91 53.77 1zgw h ALA 44 Cb 0.96 0.71 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1zgw h ALA 44 CO 0.00 0.67 0.00 -2.13 0.00 0.00 0.00 179.25 177.79 1zgw n ARG 45 N -4.45 -1.90 -4.13 0.00 3.00 -1.26 -5.19 116.66 102.72 1zgw n ARG 45 Ca -0.30 0.00 -0.10 0.00 -0.00 0.00 0.00 57.85 57.45 1zgw n ARG 45 Cb 0.64 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 33.00 1zgw n ARG 45 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 1zgw s HIS 46 N -2.00 0.77 0.27 -0.14 3.76 -1.26 -4.97 115.29 111.72 1zgw s HIS 46 Ca 0.00 -0.88 0.12 0.00 -0.15 0.00 0.00 55.06 54.14 1zgw s HIS 46 Cb 0.00 -0.47 -0.05 0.00 1.11 0.00 0.00 32.58 33.17 1zgw s HIS 46 CO 0.00 -0.19 -0.20 0.00 -0.85 0.00 0.00 174.74 173.50 1zgw s ALA 47 N -3.35 2.70 0.89 -1.40 0.00 -1.26 -5.11 121.76 114.23 1zgw s ALA 47 Ca 0.07 -1.85 -0.13 0.00 0.00 0.00 0.00 51.96 50.06 1zgw s ALA 47 Cb 0.04 -0.26 0.04 0.00 0.00 0.00 0.00 23.12 22.93 1zgw s ALA 47 CO -0.05 0.29 0.61 1.28 0.00 0.00 0.00 175.76 177.89 1zgw n LEU 48 N -0.52 0.93 0.20 0.00 4.77 -1.26 -4.85 117.00 116.28 1zgw n LEU 48 Ca -0.06 0.42 0.05 0.00 -0.03 0.00 0.00 56.01 56.39 1zgw n LEU 48 Cb 0.60 -1.28 0.50 0.00 -2.33 0.00 0.00 43.42 40.91 1zgw n LEU 48 CO 0.37 -3.14 0.93 -0.09 -1.33 0.00 0.00 177.39 174.13 1zgw h ARG 49 N -1.30 0.06 -0.74 3.23 2.43 -2.00 -3.13 114.38 112.94 1zgw h ARG 49 Ca -0.44 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 58.78 1zgw h ARG 49 Cb 1.29 -0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 30.74 1zgw h ARG 49 CO 0.38 0.20 -0.45 1.49 -1.51 0.00 0.00 179.97 180.08 1zgw h GLU 50 N 0.06 -0.02 -0.67 0.20 4.22 -2.00 0.90 114.58 117.28 1zgw h GLU 50 Ca 0.01 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.45 1zgw h GLU 50 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1zgw h GLU 50 CO 0.02 -0.01 0.00 0.09 -2.18 0.00 0.00 179.01 176.93 1zgw n ASN 51 N -4.72 3.01 -4.26 1.04 3.02 -1.20 -4.81 115.26 107.34 1zgw n ASN 51 Ca 0.01 -2.34 -0.33 0.00 -0.03 0.00 0.00 54.58 51.89 1zgw n ASN 51 Cb 0.20 -0.50 -0.15 0.00 -0.61 0.00 0.00 39.78 38.72 1zgw n ASN 51 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1zgw s VAL 52 N -1.78 2.72 0.45 2.41 1.01 0.31 0.18 120.40 125.70 1zgw s VAL 52 Ca 0.27 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.54 1zgw s VAL 52 Cb 0.19 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 1zgw s VAL 52 CO 0.11 0.51 0.02 -0.94 0.00 0.00 0.00 175.10 174.79 1zgw s SER 53 N 0.93 3.76 0.13 3.32 1.04 -0.35 -4.82 113.70 117.70 1zgw s SER 53 Ca -0.03 -1.55 0.11 0.00 0.48 0.00 0.00 55.95 54.96 1zgw s SER 53 Cb -0.15 0.19 -0.04 0.00 0.10 0.00 0.00 66.02 66.12 1zgw s SER 53 CO -0.02 -0.72 -0.25 -0.36 0.98 0.00 0.00 173.24 172.87 1zgw s PHE 54 N -2.90 2.36 0.12 5.02 0.08 -1.26 -0.18 117.98 121.22 1zgw s PHE 54 Ca 0.19 -0.35 0.05 0.00 0.12 0.00 0.00 56.93 56.94 1zgw s PHE 54 Cb 0.05 -1.26 -0.04 0.00 -0.57 0.00 0.00 43.02 41.20 1zgw s PHE 54 CO 0.10 0.36 -0.13 0.71 -0.10 0.00 0.00 175.22 176.16 1zgw s TYR 55 N -1.12 1.31 0.15 0.36 1.51 -0.64 -4.90 117.35 114.03 1zgw s TYR 55 Ca 0.15 -0.58 -0.11 0.00 -1.01 0.00 0.00 57.07 55.53 1zgw s TYR 55 Cb -0.10 -0.69 -0.02 0.00 -0.11 0.00 0.00 41.96 41.03 1zgw s TYR 55 CO 0.07 0.11 1.50 0.00 -1.11 0.00 0.00 175.55 176.12 1zgw h ALA 56 N 3.53 0.61 -2.56 3.71 0.00 -1.90 -1.02 119.26 121.63 1zgw h ALA 56 Ca -0.39 -0.43 -0.22 0.00 0.00 0.00 0.00 54.91 53.87 1zgw h ALA 56 Cb 1.19 -0.14 -0.15 0.00 0.00 0.00 0.00 17.79 18.70 1zgw h ALA 56 CO 0.51 0.66 -0.61 0.54 0.00 0.00 0.00 179.25 180.36 1zgw s ASN 57 N -6.77 0.18 0.51 0.00 2.20 -1.26 -3.33 114.94 106.46 1zgw s ASN 57 Ca -0.11 -1.33 0.25 0.00 -0.94 0.00 0.00 52.86 50.74 1zgw s ASN 57 Cb 0.11 0.37 1.37 0.00 -2.00 0.00 0.00 41.25 41.11 1zgw s ASN 57 CO 0.88 -0.83 2.05 0.00 -2.94 0.00 0.00 177.10 176.26 1zgw h ALA 58 N 2.66 1.33 -0.26 3.54 0.00 -1.91 -2.24 119.26 122.38 1zgw h ALA 58 Ca -0.35 -0.12 -0.15 0.00 0.00 0.00 0.00 54.91 54.29 1zgw h ALA 58 Cb 1.24 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1zgw h ALA 58 CO 0.54 0.17 -0.44 1.03 0.00 0.00 0.00 179.25 180.54 1zgw h SER 59 N 0.00 0.70 -0.07 0.00 0.87 -1.96 0.78 113.55 113.86 1zgw h SER 59 Ca -0.00 -0.33 -0.00 0.00 -1.23 0.00 0.00 61.79 60.23 1zgw h SER 59 Cb 0.35 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 62.11 1zgw h SER 59 CO 0.02 1.04 0.04 -0.08 -0.53 0.00 0.00 176.83 177.32 1zgw h GLU 60 N 0.52 0.10 -0.61 2.24 4.57 -1.82 1.17 114.58 120.75 1zgw h GLU 60 Ca 0.04 -0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.23 1zgw h GLU 60 Cb 0.98 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.51 1zgw h GLU 60 CO 0.09 0.15 0.38 0.00 -1.18 0.00 0.00 179.01 178.44 1zgw h ALA 61 N 0.95 0.79 0.00 2.92 0.00 -1.22 0.31 119.26 123.01 1zgw h ALA 61 Ca 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1zgw h ALA 61 Cb 0.07 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1zgw h ALA 61 CO -0.00 0.12 -0.07 -0.07 0.00 0.00 0.00 179.25 179.23 1zgw h LEU 62 N 0.74 0.00 0.00 0.00 3.38 0.15 0.72 115.31 120.30 1zgw h LEU 62 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1zgw h LEU 62 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1zgw h LEU 62 CO -0.10 0.07 -0.01 0.00 0.09 0.00 0.00 178.44 178.49 1zgw h ALA 63 N 1.93 1.00 0.00 1.53 0.00 0.50 -3.12 119.26 121.10 1zgw h ALA 63 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1zgw h ALA 63 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1zgw h ALA 63 CO 0.01 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.26 1zgw n ALA 64 N -1.91 2.64 -1.98 0.00 0.00 0.24 -4.85 120.51 114.65 1zgw n ALA 64 Ca 0.05 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1zgw n ALA 64 Cb 0.47 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1zgw n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zgw n GLY 65 N 0.91 0.96 3.62 0.00 0.00 -1.18 -5.08 105.19 104.43 1zgw n GLY 65 Ca 0.23 -0.54 -0.23 0.00 0.00 0.00 0.00 46.02 45.47 1zgw n GLY 65 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1zgw s PHE 66 N -2.78 2.62 -0.35 1.61 0.40 -1.23 -4.99 117.98 113.26 1zgw s PHE 66 Ca 0.00 -0.26 -0.13 0.00 -0.60 0.00 0.00 56.93 55.93 1zgw s PHE 66 Cb 0.00 -1.20 -0.01 0.00 0.51 0.00 0.00 43.02 42.32 1zgw s PHE 66 CO 0.00 0.61 0.26 1.03 0.70 0.00 0.00 175.22 177.82 1zgw s ARG 67 N -3.66 3.42 0.35 0.44 0.52 0.11 -4.69 118.95 115.45 1zgw s ARG 67 Ca 0.32 -0.69 -0.29 0.00 -0.52 0.00 0.00 55.73 54.55 1zgw s ARG 67 Cb -0.06 -3.83 -0.11 0.00 0.52 0.00 0.00 34.95 31.47 1zgw s ARG 67 CO 0.19 -0.49 1.45 -1.25 0.02 0.00 0.00 175.30 175.21 1zgw s PRO 68 N 1.73 4.18 -0.02 3.54 0.04 -1.26 -3.82 135.00 139.40 1zgw s PRO 68 Ca 0.06 2.46 -0.32 0.00 0.04 0.00 0.00 61.00 63.25 1zgw s PRO 68 Cb -0.18 -3.01 -0.10 0.00 0.04 0.00 0.00 34.50 31.26 1zgw s PRO 68 CO 0.11 -0.45 1.95 0.00 0.04 0.00 0.00 177.00 178.65 1zgw n LYS 70 N 7.26 0.00 -0.06 0.00 4.81 -1.26 0.02 118.16 128.93 1zgw n LYS 70 Ca 0.21 0.17 -0.08 0.00 -0.87 0.00 0.00 58.31 57.74 1zgw n LYS 70 Cb 0.37 -1.66 -0.07 0.00 0.02 0.00 0.00 35.03 33.68 1zgw n LYS 70 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 1zgw n ARG 71 N -1.10 0.91 0.06 1.64 0.63 -1.26 -4.36 116.66 113.19 1zgw n ARG 71 Ca 0.00 0.05 0.12 0.00 -0.92 0.00 0.00 57.85 57.11 1zgw n ARG 71 Cb 0.16 -1.28 0.22 0.00 0.45 0.00 0.00 32.46 32.02 1zgw n ARG 71 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1zgw h GLN 73 N 0.00 0.23 -0.10 0.00 -0.00 -0.65 -3.40 115.11 111.20 1zgw h GLN 73 Ca 0.00 -0.39 -0.08 0.00 -0.00 0.00 0.00 58.65 58.18 1zgw h GLN 73 Cb 0.73 0.14 0.00 0.00 0.00 0.00 0.00 27.48 28.36 1zgw h GLN 73 CO 0.00 1.06 -0.25 -1.00 0.00 0.00 0.00 178.83 178.64 1zgw h PRO 74 N 0.06 0.34 -7.70 -2.39 0.13 -1.76 -3.46 132.00 117.22 1zgw h PRO 74 Ca -0.34 -0.24 -0.44 0.00 -0.87 0.00 0.00 66.00 64.12 1zgw h PRO 74 Cb 2.04 0.04 0.17 0.00 0.13 0.00 0.00 31.00 33.38 1zgw h PRO 74 CO 0.12 0.85 0.34 0.16 -0.23 0.00 0.00 178.00 179.23 1zgw s ASP 75 N -6.28 2.42 -0.10 1.44 1.47 -1.26 -5.06 116.67 109.30 1zgw s ASP 75 Ca -0.14 0.36 -0.05 0.00 1.18 0.00 0.00 52.55 53.90 1zgw s ASP 75 Cb 0.04 -0.45 -0.04 0.00 -0.34 0.00 0.00 42.92 42.13 1zgw s ASP 75 CO 0.76 -3.17 0.10 -0.54 0.68 0.00 0.00 175.17 173.01 1zgw s LYS 76 N -5.76 3.30 0.00 2.11 -0.14 -1.26 -4.99 119.74 113.01 1zgw s LYS 76 Ca 0.73 -0.23 0.00 0.00 -1.36 0.00 0.00 55.97 55.11 1zgw s LYS 76 Cb -0.05 -3.07 0.00 0.00 -1.68 0.00 0.00 37.83 33.03 1zgw s LYS 76 CO 0.54 0.75 0.00 0.00 -0.76 0.00 0.00 175.35 175.88 1zgw n ALA 77 N 1.93 0.00 0.17 5.17 0.00 -1.26 -3.35 120.51 123.17 1zgw n ALA 77 Ca -0.19 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.35 1zgw n ALA 77 Cb 0.54 0.00 0.63 0.00 0.00 0.00 0.00 19.45 20.62 1zgw n ALA 77 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1zgw h ASN 78 N 0.00 0.06 0.00 0.00 -0.26 1.47 1.88 115.58 118.73 1zgw h ASN 78 Ca 0.00 -0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1zgw h ASN 78 Cb 0.00 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.25 1zgw h ASN 78 CO 0.00 0.04 0.01 1.55 -1.06 0.00 0.00 177.43 177.97 1zgw h PRO 79 N 0.06 0.00 0.08 0.81 0.13 -1.83 -2.77 132.00 128.49 1zgw h PRO 79 Ca 0.07 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1zgw h PRO 79 Cb 0.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.34 1zgw h PRO 79 CO -0.01 0.00 -0.10 -0.09 -0.23 0.00 0.00 178.00 177.57 1zgw h ARG 80 N 0.00 -0.18 -1.05 0.86 2.43 0.30 -0.62 114.38 116.12 1zgw h ARG 80 Ca 0.00 0.01 0.28 0.00 -0.81 0.00 0.00 59.98 59.46 1zgw h ARG 80 Cb 0.02 0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 29.54 1zgw h ARG 80 CO 0.00 -0.12 0.70 1.96 -1.51 0.00 0.00 179.97 180.99 1zgw h GLN 81 N -0.19 0.28 -0.36 0.20 1.08 -1.62 0.40 115.11 114.90 1zgw h GLN 81 Ca -0.01 -0.02 -0.11 0.00 -1.45 0.00 0.00 58.65 57.06 1zgw h GLN 81 Cb 0.17 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.53 1zgw h GLN 81 CO -0.03 0.18 -0.22 1.25 -0.95 0.00 0.00 178.83 179.06 1zgw h HIS 82 N 0.28 0.91 0.00 2.96 2.76 -1.48 -1.09 115.15 119.49 1zgw h HIS 82 Ca 0.57 -0.24 -0.02 0.00 -2.20 0.00 0.00 60.37 58.48 1zgw h HIS 82 Cb 1.65 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 30.40 1zgw h HIS 82 CO -0.00 0.99 -0.09 -0.09 -1.30 0.00 0.00 177.93 177.44 1zgw h ARG 83 N 0.56 0.00 0.04 5.26 9.65 0.61 -1.61 114.38 128.89 1zgw h ARG 83 Ca 0.07 0.00 -0.22 0.00 -1.10 0.00 0.00 59.98 58.73 1zgw h ARG 83 Cb 0.78 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.35 1zgw h ARG 83 CO 0.06 0.09 -1.00 -0.07 2.80 0.00 0.00 179.97 181.85 1zgw h LEU 84 N 0.00 0.29 -1.16 3.80 -0.00 -0.52 -2.77 115.31 114.95 1zgw h LEU 84 Ca -0.00 -0.27 -0.01 0.00 -0.00 0.00 0.00 57.88 57.60 1zgw h LEU 84 Cb 0.45 -0.09 -0.04 0.00 -0.00 0.00 0.00 40.66 40.98 1zgw h LEU 84 CO 0.01 1.13 0.43 0.44 -0.00 0.00 0.00 178.44 180.45 1zgw h ASP 85 N 0.10 0.89 -0.14 -0.43 5.19 -0.24 -2.11 116.42 119.68 1zgw h ASP 85 Ca -0.07 -0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.29 1zgw h ASP 85 Cb 1.68 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 40.96 1zgw h ASP 85 CO 0.16 0.70 0.09 0.50 -3.12 0.00 0.00 179.24 177.57 1zgw h LYS 86 N 1.03 0.18 -0.91 3.56 3.11 -1.28 -2.58 116.57 119.68 1zgw h LYS 86 Ca 0.27 -0.01 0.07 0.00 -2.81 0.00 0.00 60.65 58.16 1zgw h LYS 86 Cb -0.02 -0.04 -0.06 0.00 -1.00 0.00 0.00 32.23 31.10 1zgw h LYS 86 CO -0.05 0.12 0.58 0.82 -2.81 0.00 0.00 179.45 178.11 1zgw h ILE 87 N 0.19 1.05 -0.53 2.00 2.04 -1.12 -0.43 117.51 120.71 1zgw h ILE 87 Ca 0.05 -0.36 0.10 0.00 1.00 0.00 0.00 64.86 65.65 1zgw h ILE 87 Cb -0.02 -0.08 -0.08 0.00 -0.74 0.00 0.00 36.82 35.90 1zgw h ILE 87 CO -0.01 0.19 0.06 0.74 0.00 0.00 0.00 178.15 179.13 1zgw h THR 88 N 1.04 0.64 -0.82 -0.27 2.02 -1.04 0.92 112.91 115.41 1zgw h THR 88 Ca 0.40 -0.06 0.11 0.00 0.77 0.00 0.00 66.41 67.63 1zgw h THR 88 Cb 0.19 0.44 -0.06 0.00 -1.74 0.00 0.00 68.15 66.98 1zgw h THR 88 CO -0.18 0.03 0.53 -0.74 0.37 0.00 0.00 175.52 175.54 1zgw h HIS 89 N 0.19 0.76 -0.93 3.16 6.17 -0.84 0.56 115.15 124.22 1zgw h HIS 89 Ca 0.27 0.02 0.12 0.00 0.71 0.00 0.00 60.37 61.49 1zgw h HIS 89 Cb 0.40 -0.24 -0.07 0.00 2.52 0.00 0.00 27.41 30.01 1zgw h HIS 89 CO -0.27 0.33 0.59 0.00 0.71 0.00 0.00 177.93 179.29 1zgw h ALA 90 N 1.60 1.68 -0.11 5.26 0.00 0.17 0.15 119.26 128.01 1zgw h ALA 90 Ca 0.39 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.31 1zgw h ALA 90 Cb 0.57 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1zgw h ALA 90 CO -0.16 0.09 0.06 0.00 0.00 0.00 0.00 179.25 179.25 1zgw h ARG 92 N 0.07 -0.26 -0.78 0.00 2.43 -0.35 0.15 114.38 115.65 1zgw h ARG 92 Ca 0.04 0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.32 1zgw h ARG 92 Cb 0.10 0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.66 1zgw h ARG 92 CO -0.01 -0.17 0.51 -0.07 -1.51 0.00 0.00 179.97 178.72 1zgw h LEU 93 N -0.27 0.63 -0.04 3.80 3.38 -1.05 1.58 115.31 123.34 1zgw h LEU 93 Ca 0.16 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1zgw h LEU 93 Cb 0.54 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1zgw h LEU 93 CO -0.53 0.37 0.00 0.18 0.09 0.00 0.00 178.44 178.56 1zgw n LEU 94 N -4.50 0.03 0.00 1.67 4.32 0.49 -2.89 117.00 116.12 1zgw n LEU 94 Ca 0.13 0.51 0.00 0.00 -0.02 0.00 0.00 56.01 56.63 1zgw n LEU 94 Cb 0.33 -0.51 0.00 0.00 -1.62 0.00 0.00 43.42 41.63 1zgw n LEU 94 CO 0.32 -0.30 -0.00 1.21 -1.22 0.00 0.00 177.39 177.40 1zgw n GLU 95 N -1.54 2.85 -0.04 3.23 0.00 0.17 -4.86 120.64 120.45 1zgw n GLU 95 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 57.16 56.97 1zgw n GLU 95 Cb 0.15 -0.21 -0.13 0.00 0.00 0.00 0.00 31.44 31.25 1zgw n GLU 95 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.13 178.07 1zgw n GLN 96 N -0.41 0.68 0.00 5.31 0.00 0.52 -4.97 117.38 118.51 1zgw n GLN 96 Ca 0.00 0.39 0.00 0.00 -0.00 0.00 0.00 57.00 57.39 1zgw n GLN 96 Cb 0.00 -1.72 0.00 0.00 0.00 0.00 0.00 30.24 28.52 1zgw n GLN 96 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.06 176.21 1zgw n GLU 97 N -3.88 2.43 -0.02 3.69 -0.00 -1.14 -5.05 120.64 116.67 1zgw n GLU 97 Ca -0.32 0.00 -0.03 0.00 -0.00 0.00 0.00 57.16 56.81 1zgw n GLU 97 Cb 0.90 0.00 -0.01 0.00 -0.00 0.00 0.00 31.44 32.33 1zgw n GLU 97 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 1zgw n THR 98 N 0.00 0.66 -2.07 3.84 -1.04 -1.26 -4.95 114.28 109.46 1zgw n THR 98 Ca 0.00 0.30 -0.41 0.00 -2.04 0.00 0.00 64.05 61.90 1zgw n THR 98 Cb 0.00 -1.73 -0.02 0.00 -1.82 0.00 0.00 70.33 66.76 1zgw n THR 98 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1zgw s PRO 99 N -1.77 4.27 0.49 -2.82 0.04 -1.26 -4.98 135.00 128.97 1zgw s PRO 99 Ca -0.10 2.25 -0.19 0.00 0.04 0.00 0.00 61.00 63.00 1zgw s PRO 99 Cb 0.01 -3.01 -0.08 0.00 0.04 0.00 0.00 34.50 31.46 1zgw s PRO 99 CO 0.15 -0.27 1.00 0.08 0.04 0.00 0.00 177.00 177.99 1zgw s VAL 100 N -1.16 4.16 -0.43 -0.36 1.01 -1.26 -4.90 120.40 117.47 1zgw s VAL 100 Ca 0.51 1.23 -0.04 0.00 0.00 0.00 0.00 61.98 63.68 1zgw s VAL 100 Cb -0.40 -3.55 0.11 0.00 0.00 0.00 0.00 36.38 32.54 1zgw s VAL 100 CO 0.54 -0.41 0.23 0.42 0.00 0.00 0.00 175.10 175.88 1zgw s THR 101 N -2.27 3.41 0.00 3.92 -4.23 -1.26 -4.70 115.64 110.51 1zgw s THR 101 Ca 0.63 -2.09 0.00 0.00 -1.18 0.00 0.00 61.69 59.05 1zgw s THR 101 Cb -0.12 -3.32 0.00 0.00 1.34 0.00 0.00 72.50 70.40 1zgw s THR 101 CO 0.23 -0.71 0.00 0.18 -0.54 0.00 0.00 174.62 173.77 1zgw n LEU 102 N 4.55 0.81 -0.34 4.79 4.77 -1.26 -4.71 117.00 125.61 1zgw n LEU 102 Ca -0.02 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.14 1zgw n LEU 102 Cb 0.41 0.00 0.36 0.00 -2.33 0.00 0.00 43.42 41.86 1zgw n LEU 102 CO 0.34 0.13 0.85 -0.08 -1.33 0.00 0.00 177.39 177.31 1zgw h GLU 103 N 0.00 0.00 -0.45 3.23 4.22 -1.98 0.52 114.58 120.13 1zgw h GLU 103 Ca 0.00 -0.00 -0.13 0.00 0.08 0.00 0.00 59.36 59.31 1zgw h GLU 103 Cb 0.42 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 1zgw h GLU 103 CO 0.00 0.00 -0.24 0.00 -2.18 0.00 0.00 179.01 176.60 1zgw h ALA 104 N 1.99 0.63 0.03 2.92 0.00 -1.97 -1.33 119.26 121.54 1zgw h ALA 104 Ca 0.66 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1zgw h ALA 104 Cb 1.46 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1zgw h ALA 104 CO -0.90 0.63 -0.01 -0.07 0.00 0.00 0.00 179.25 178.90 1zgw h LEU 105 N 0.79 -0.03 -0.94 0.00 3.38 -0.61 -1.67 115.31 116.23 1zgw h LEU 105 Ca 0.10 -0.56 0.10 0.00 0.09 0.00 0.00 57.88 57.60 1zgw h LEU 105 Cb 0.81 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.50 1zgw h LEU 105 CO 0.07 0.56 0.58 0.00 0.09 0.00 0.00 178.44 179.74 1zgw h ALA 106 N 0.29 1.37 -0.30 1.53 0.00 -0.24 -0.81 119.26 121.10 1zgw h ALA 106 Ca -0.00 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 1zgw h ALA 106 Cb 0.59 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1zgw h ALA 106 CO 0.01 0.23 -0.29 -0.44 0.00 0.00 0.00 179.25 178.75 1zgw h ASP 107 N 0.97 0.64 -0.43 0.00 5.19 -1.23 0.65 116.42 122.20 1zgw h ASP 107 Ca 0.45 -0.25 -0.14 0.00 -0.62 0.00 0.00 57.03 56.47 1zgw h ASP 107 Cb 0.37 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.69 1zgw h ASP 107 CO -0.24 0.90 -0.26 -0.61 -3.12 0.00 0.00 179.24 175.91 1zgw h GLN 108 N 0.54 0.96 0.00 3.56 -0.00 -0.19 -3.17 115.11 116.81 1zgw h GLN 108 Ca 0.07 -0.43 0.00 0.00 -0.00 0.00 0.00 58.65 58.28 1zgw h GLN 108 Cb 0.78 -0.02 0.00 0.00 0.00 0.00 0.00 27.48 28.24 1zgw h GLN 108 CO 0.06 1.10 -1.09 0.28 0.00 0.00 0.00 178.83 179.18 1zgw n VAL 109 N -4.09 0.31 -2.42 2.39 0.31 -0.58 -4.99 118.33 109.26 1zgw n VAL 109 Ca -0.01 -0.38 -0.00 0.00 -0.01 0.00 0.00 64.34 63.95 1zgw n VAL 109 Cb 0.48 -0.03 0.00 0.00 -0.91 0.00 0.00 33.84 33.38 1zgw n VAL 109 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1zgw n ALA 110 N -1.99 -0.00 -2.14 3.52 0.00 0.22 -5.08 120.51 115.03 1zgw n ALA 110 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.37 1zgw n ALA 110 Cb 0.49 -0.50 -0.10 0.00 0.00 0.00 0.00 19.45 19.34 1zgw n ALA 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1zgw s MET 111 N -4.84 0.74 1.22 0.00 0.23 -0.52 -5.01 119.30 111.12 1zgw s MET 111 Ca 0.00 -1.29 -0.14 0.00 -1.03 0.00 0.00 55.69 53.24 1zgw s MET 111 Cb -0.00 0.23 0.31 0.00 -1.53 0.00 0.00 34.83 33.84 1zgw s MET 111 CO 0.00 -0.18 1.01 -1.54 -2.03 0.00 0.00 175.02 172.28 1zgw s SER 112 N -2.96 0.52 0.27 -1.18 1.04 -1.26 -4.51 113.70 105.62 1zgw s SER 112 Ca 0.13 1.44 -0.04 0.00 0.48 0.00 0.00 55.95 57.97 1zgw s SER 112 Cb 0.08 -2.23 0.34 0.00 0.10 0.00 0.00 66.02 64.31 1zgw s SER 112 CO -0.06 -4.47 1.89 1.55 0.98 0.00 0.00 173.24 173.13 1zgw h PRO 113 N -2.81 1.09 -0.10 4.02 0.13 -1.97 0.20 132.00 132.56 1zgw h PRO 113 Ca -0.62 -0.13 -0.04 0.00 -0.87 0.00 0.00 66.00 64.34 1zgw h PRO 113 Cb 1.34 -0.21 -0.00 0.00 0.13 0.00 0.00 31.00 32.25 1zgw h PRO 113 CO 0.49 0.81 -0.09 0.74 -0.23 0.00 0.00 178.00 179.72 1zgw h PHE 114 N 1.10 0.29 0.00 1.56 -1.00 -2.00 -2.22 116.94 114.66 1zgw h PHE 114 Ca 0.28 -0.08 -0.03 0.00 2.81 0.00 0.00 57.97 60.94 1zgw h PHE 114 Cb 0.04 -0.06 -0.00 0.00 3.61 0.00 0.00 35.95 39.54 1zgw h PHE 114 CO 0.01 0.65 -0.16 1.25 -1.61 0.00 0.00 178.31 178.45 1zgw h HIS 115 N -0.16 0.00 -0.69 -0.55 2.76 -1.85 -1.89 115.15 112.77 1zgw h HIS 115 Ca 0.02 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.12 1zgw h HIS 115 Cb 0.59 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.53 1zgw h HIS 115 CO 0.08 0.16 0.15 1.25 -1.30 0.00 0.00 177.93 178.27 1zgw h LEU 116 N 0.00 1.07 -0.65 0.26 7.12 -0.43 0.51 115.31 123.20 1zgw h LEU 116 Ca -0.00 -0.24 -0.02 0.00 0.13 0.00 0.00 57.88 57.75 1zgw h LEU 116 Cb 0.65 -0.28 -0.03 0.00 -0.53 0.00 0.00 40.66 40.47 1zgw h LEU 116 CO 0.02 1.03 0.35 0.45 -0.13 0.00 0.00 178.44 180.16 1zgw h HIS 117 N 1.05 0.90 -0.66 1.25 3.86 -0.78 -0.23 115.15 120.55 1zgw h HIS 117 Ca 0.21 -0.03 0.05 0.00 -1.16 0.00 0.00 60.37 59.45 1zgw h HIS 117 Cb 0.40 -0.29 -0.04 0.00 1.06 0.00 0.00 27.41 28.54 1zgw h HIS 117 CO 0.03 0.65 0.43 0.00 0.86 0.00 0.00 177.93 179.90 1zgw h ARG 118 N 0.88 0.68 -0.21 2.45 3.08 -0.53 -1.44 114.38 119.30 1zgw h ARG 118 Ca 0.23 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 60.15 1zgw h ARG 118 Cb 0.06 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 29.95 1zgw h ARG 118 CO -0.03 0.45 -0.21 1.25 -1.07 0.00 0.00 179.97 180.36 1zgw h LEU 119 N 0.70 0.54 -0.99 3.04 7.12 0.24 -0.27 115.31 125.70 1zgw h LEU 119 Ca 0.28 -0.48 0.22 0.00 0.13 0.00 0.00 57.88 58.03 1zgw h LEU 119 Cb 0.20 -0.15 -0.12 0.00 -0.53 0.00 0.00 40.66 40.06 1zgw h LEU 119 CO -0.08 0.91 0.57 0.15 -0.13 0.00 0.00 178.44 179.86 1zgw h PHE 120 N 0.19 0.99 0.02 1.25 3.04 -0.05 0.21 116.94 122.58 1zgw h PHE 120 Ca 0.03 0.04 -0.22 0.00 3.98 0.00 0.00 57.97 61.80 1zgw h PHE 120 Cb 0.76 -0.28 0.02 0.00 2.56 0.00 0.00 35.95 39.00 1zgw h PHE 120 CO 0.08 0.12 -0.87 -0.22 -2.02 0.00 0.00 178.31 175.40 1zgw h LYS 121 N 0.63 0.55 0.36 1.11 3.64 -1.19 -1.64 116.57 120.02 1zgw h LYS 121 Ca 0.60 -0.62 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1zgw h LYS 121 Cb 1.06 0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 33.05 1zgw h LYS 121 CO -0.44 1.24 -0.34 0.00 -2.27 0.00 0.00 179.45 177.63 1zgw h ALA 122 N 0.33 -0.74 0.31 5.00 0.00 0.86 1.38 119.26 126.40 1zgw h ALA 122 Ca -0.11 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1zgw h ALA 122 Cb 1.56 0.48 0.00 0.00 0.00 0.00 0.00 17.79 19.83 1zgw h ALA 122 CO 0.17 -0.95 -0.15 1.15 0.00 0.00 0.00 179.25 179.47 1zgw h THR 123 N -0.72 0.59 -0.86 0.00 2.02 -0.81 -2.90 112.91 110.24 1zgw h THR 123 Ca -0.02 -0.75 0.22 0.00 0.77 0.00 0.00 66.41 66.62 1zgw h THR 123 Cb 0.64 0.92 -0.05 0.00 -1.74 0.00 0.00 68.15 67.92 1zgw h THR 123 CO -0.05 0.12 0.59 0.00 0.37 0.00 0.00 175.52 176.55 1zgw h THR 124 N -0.89 0.63 0.00 3.16 1.03 -1.32 -3.46 112.91 112.06 1zgw h THR 124 Ca -0.04 -0.06 0.00 0.00 -0.01 0.00 0.00 66.41 66.29 1zgw h THR 124 Cb 0.52 0.43 0.00 0.00 -1.07 0.00 0.00 68.15 68.02 1zgw h THR 124 CO 0.07 0.03 0.00 0.61 -0.01 0.00 0.00 175.52 176.22 1zgw n GLY 125 N -1.61 3.08 2.69 2.99 0.00 0.47 -4.94 105.19 107.87 1zgw n GLY 125 Ca 0.18 -1.03 -0.06 0.00 0.00 0.00 0.00 46.02 45.10 1zgw n GLY 125 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1zgw n MET 126 N 0.00 1.22 -2.83 1.61 0.00 -0.94 -4.68 117.12 111.51 1zgw n MET 126 Ca 0.00 -1.89 -0.00 0.00 0.00 0.00 0.00 57.70 55.81 1zgw n MET 126 Cb 0.00 -0.10 0.01 0.00 0.00 0.00 0.00 33.22 33.12 1zgw n MET 126 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 1zgw s THR 127 N -0.15 -0.43 0.00 2.03 2.01 -1.26 -5.00 115.64 112.83 1zgw s THR 127 Ca 0.21 -0.14 0.00 0.00 0.31 0.00 0.00 61.69 62.06 1zgw s THR 127 Cb 0.41 0.00 0.00 0.00 0.01 0.00 0.00 72.50 72.92 1zgw s THR 127 CO -0.08 0.00 0.00 -0.81 -0.69 0.00 0.00 174.62 173.04 1zgw n PRO 128 N 3.50 0.00 0.20 4.92 -0.04 -1.26 -3.20 135.00 139.12 1zgw n PRO 128 Ca 0.09 0.00 0.18 0.00 -0.04 0.00 0.00 63.50 63.73 1zgw n PRO 128 Cb 0.62 0.00 0.79 0.00 -0.04 0.00 0.00 33.50 34.86 1zgw n PRO 128 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1zgw h LYS 129 N 0.00 0.00 -0.39 0.54 3.11 -1.90 0.11 116.57 118.04 1zgw h LYS 129 Ca 0.00 0.00 -0.13 0.00 -2.81 0.00 0.00 60.65 57.71 1zgw h LYS 129 Cb 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.22 1zgw h LYS 129 CO 0.00 0.00 -0.27 0.00 -2.81 0.00 0.00 179.45 176.37 1zgw h ALA 130 N 1.47 0.80 -0.31 5.00 0.00 -1.93 -0.01 119.26 124.28 1zgw h ALA 130 Ca 0.11 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 1zgw h ALA 130 Cb 0.86 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1zgw h ALA 130 CO -0.00 0.65 -0.05 2.35 0.00 0.00 0.00 179.25 182.20 1zgw h TRP 131 N 0.69 0.52 -0.21 0.00 -0.00 -0.75 0.42 115.95 116.62 1zgw h TRP 131 Ca 0.09 -0.06 -0.04 0.00 -0.00 0.00 0.00 58.89 58.87 1zgw h TRP 131 Cb 0.80 -0.15 -0.01 0.00 -0.00 0.00 0.00 29.16 29.80 1zgw h TRP 131 CO 0.04 0.55 -0.04 0.37 -0.00 0.00 0.00 178.44 179.36 1zgw h GLN 132 N 0.47 0.40 -0.03 2.65 -0.00 -1.27 -2.07 115.11 115.26 1zgw h GLN 132 Ca 0.10 -0.15 -0.00 0.00 -0.00 0.00 0.00 58.65 58.60 1zgw h GLN 132 Cb 0.38 -0.03 -0.00 0.00 0.00 0.00 0.00 27.48 27.83 1zgw h GLN 132 CO 0.02 0.63 0.01 0.37 0.00 0.00 0.00 178.83 179.86 1zgw h GLN 133 N 0.14 0.05 0.81 1.69 4.15 -0.57 -2.08 115.11 119.30 1zgw h GLN 133 Ca 0.06 -0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.43 1zgw h GLN 133 Cb 0.48 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 28.16 1zgw h GLN 133 CO 0.02 0.20 -0.49 0.00 -1.93 0.00 0.00 178.83 176.62 1zgw h ALA 134 N 0.85 -1.28 -0.79 3.38 0.00 -0.94 -0.19 119.26 120.30 1zgw h ALA 134 Ca 0.01 -0.26 0.18 0.00 0.00 0.00 0.00 54.91 54.85 1zgw h ALA 134 Cb 0.17 0.61 -0.12 0.00 0.00 0.00 0.00 17.79 18.45 1zgw h ALA 134 CO -0.00 -1.24 0.21 -1.49 0.00 0.00 0.00 179.25 176.73 1zgw h TRP 135 N -1.22 0.33 0.00 0.00 -0.00 -1.43 0.55 115.95 114.18 1zgw h TRP 135 Ca -0.11 0.04 -0.02 0.00 -0.00 0.00 0.00 58.89 58.80 1zgw h TRP 135 Cb 0.98 -0.02 -0.00 0.00 -0.00 0.00 0.00 29.16 30.11 1zgw h TRP 135 CO -0.10 -0.10 -0.10 -0.09 -0.00 0.00 0.00 178.44 178.05 1zgw h ARG 136 N 0.28 0.00 0.00 0.49 2.43 -1.02 1.09 114.38 117.65 1zgw h ARG 136 Ca 0.46 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.52 1zgw h ARG 136 Cb 0.82 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.35 1zgw h ARG 136 CO -0.54 0.10 -0.79 0.00 -1.51 0.00 0.00 179.97 177.23 1zgw h ALA 137 N 1.90 0.67 0.00 2.80 0.00 0.19 -3.34 119.26 121.48 1zgw h ALA 137 Ca -0.00 -0.52 -0.31 0.00 0.00 0.00 0.00 54.91 54.08 1zgw h ALA 137 Cb 0.20 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 1zgw h ALA 137 CO 0.01 0.64 -2.29 -2.13 0.00 0.00 0.00 179.25 175.49 1zgw n ARG 138 N -3.08 0.79 0.00 0.00 0.63 -0.35 -5.10 116.66 109.55 1zgw n ARG 138 Ca -0.02 -0.03 0.00 0.00 -0.92 0.00 0.00 57.85 56.88 1zgw n ARG 138 Cb 0.74 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 32.15 1zgw n ARG 138 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99