#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 0.00 -1.31 0.03 4.81 -1.26 -5.17 118.16 115.27 1zgw n LYS 2 Ca 0.00 0.00 0.15 0.00 -0.87 0.00 0.00 58.31 57.59 1zgw n LYS 2 Cb 0.00 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 34.98 1zgw n LYS 2 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1zgw n LYS 3 N -3.28 -2.72 0.00 1.64 5.02 -1.26 -4.99 118.16 112.57 1zgw n LYS 3 Ca 0.00 2.11 0.00 0.00 -2.02 0.00 0.00 58.31 58.40 1zgw n LYS 3 Cb 0.00 -3.31 0.00 0.00 -0.02 0.00 0.00 35.03 31.70 1zgw n LYS 3 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1zgw n ALA 4 N -3.50 0.00 -0.31 7.82 0.00 -1.26 -4.90 120.51 118.36 1zgw n ALA 4 Ca -0.05 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.36 1zgw n ALA 4 Cb 0.63 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.03 1zgw n ALA 4 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1zgw n THR 5 N 0.00 0.96 -2.52 0.00 -1.04 -1.26 -4.11 114.28 106.31 1zgw n THR 5 Ca 0.00 -0.45 -0.01 0.00 -2.04 0.00 0.00 64.05 61.55 1zgw n THR 5 Cb 0.00 -1.58 0.00 0.00 -1.82 0.00 0.00 70.33 66.93 1zgw n THR 5 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1zgw n LEU 7 N -0.62 0.00 -3.46 0.00 4.77 -1.26 -5.03 117.00 111.40 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 0.50 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.57 1zgw n LEU 7 CO 0.02 0.00 3.16 0.41 -1.33 0.00 0.00 177.39 179.64 1zgw n THR 8 N 0.00 4.02 -0.45 -5.08 -1.04 -1.26 -4.63 114.28 105.83 1zgw n THR 8 Ca 0.00 -2.74 0.41 0.00 -2.04 0.00 0.00 64.05 59.68 1zgw n THR 8 Cb 0.00 -2.62 0.76 0.00 -1.82 0.00 0.00 70.33 66.66 1zgw n THR 8 CO 0.00 0.00 0.00 -2.24 -0.64 0.00 0.00 175.07 172.19 1zgw h ASP 9 N 5.35 0.03 -0.28 8.00 3.04 -1.97 1.19 116.42 131.79 1zgw h ASP 9 Ca 0.77 0.01 0.03 0.00 -3.24 0.00 0.00 57.03 54.60 1zgw h ASP 9 Cb 0.41 0.01 -0.03 0.00 -1.04 0.00 0.00 39.33 38.68 1zgw h ASP 9 CO 1.82 -0.01 0.10 0.44 -2.04 0.00 0.00 179.24 179.56 1zgw h ASP 10 N 0.02 0.11 1.19 4.15 5.19 -2.00 0.30 116.42 125.38 1zgw h ASP 10 Ca 0.70 0.03 -0.16 0.00 -0.62 0.00 0.00 57.03 56.98 1zgw h ASP 10 Cb 2.73 0.02 -0.02 0.00 0.18 0.00 0.00 39.33 42.24 1zgw h ASP 10 CO -0.04 0.10 -0.77 -0.61 -3.12 0.00 0.00 179.24 174.80 1zgw h GLN 11 N 0.23 0.00 -0.80 3.56 5.75 0.87 -2.32 115.11 122.40 1zgw h GLN 11 Ca 0.12 0.00 0.12 0.00 -0.15 0.00 0.00 58.65 58.74 1zgw h GLN 11 Cb 0.09 0.00 -0.08 0.00 1.07 0.00 0.00 27.48 28.56 1zgw h GLN 11 CO -0.13 0.77 0.41 0.00 -2.65 0.00 0.00 178.83 177.24 1zgw h ARG 12 N 0.00 0.62 -0.88 1.69 2.47 0.44 1.41 114.38 120.14 1zgw h ARG 12 Ca -0.01 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.67 1zgw h ARG 12 Cb 1.57 -0.14 -0.04 0.00 -1.65 0.00 0.00 29.97 29.71 1zgw h ARG 12 CO 0.10 0.41 0.52 2.35 0.56 0.00 0.00 179.97 183.91 1zgw h TRP 13 N 0.64 1.17 -0.30 3.04 -0.00 -0.20 0.63 115.95 120.93 1zgw h TRP 13 Ca 0.41 -0.01 0.00 0.00 -0.00 0.00 0.00 58.89 59.30 1zgw h TRP 13 Cb 0.51 -0.38 -0.02 0.00 -0.00 0.00 0.00 29.16 29.27 1zgw h TRP 13 CO -0.09 0.79 0.19 0.37 -0.00 0.00 0.00 178.44 179.69 1zgw h GLN 14 N 1.21 0.40 -0.13 2.65 4.15 0.20 0.38 115.11 123.97 1zgw h GLN 14 Ca 0.31 -0.03 -0.14 0.00 0.77 0.00 0.00 58.65 59.57 1zgw h GLN 14 Cb -0.03 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.56 1zgw h GLN 14 CO -0.06 0.28 -0.52 0.77 -1.93 0.00 0.00 178.83 177.37 1zgw h SER 15 N 0.41 0.39 0.10 -0.69 0.02 0.46 0.85 113.55 115.10 1zgw h SER 15 Ca 0.11 -0.20 -0.16 0.00 -0.84 0.00 0.00 61.79 60.71 1zgw h SER 15 Cb -0.03 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 1zgw h SER 15 CO -0.02 0.84 -0.56 0.58 -1.14 0.00 0.00 176.83 176.53 1zgw h VAL 16 N 0.28 1.33 0.02 2.27 2.07 0.37 0.79 116.25 123.37 1zgw h VAL 16 Ca 0.01 -1.83 -0.29 0.00 0.82 0.00 0.00 66.70 65.41 1zgw h VAL 16 Cb 1.01 1.82 -0.04 0.00 -1.52 0.00 0.00 31.29 32.55 1zgw h VAL 16 CO 0.09 0.56 -1.66 -0.07 0.02 0.00 0.00 177.57 176.50 1zgw h LEU 17 N 0.37 0.06 -0.04 2.57 3.38 -0.34 -3.30 115.31 118.01 1zgw h LEU 17 Ca 0.00 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1zgw h LEU 17 Cb 1.09 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1zgw h LEU 17 CO 0.10 1.11 0.00 0.00 0.09 0.00 0.00 178.44 179.74 1zgw n ALA 18 N -2.58 2.24 -3.19 1.53 0.00 0.30 -4.91 120.51 113.89 1zgw n ALA 18 Ca -0.17 -0.05 -0.17 0.00 0.00 0.00 0.00 53.44 53.05 1zgw n ALA 18 Cb 1.04 -1.45 0.05 0.00 0.00 0.00 0.00 19.45 19.09 1zgw n ALA 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1zgw n ARG 19 N -1.90 -5.31 -2.11 0.00 1.74 0.13 -4.90 116.66 104.31 1zgw n ARG 19 Ca 0.06 0.61 -0.43 0.00 -0.77 0.00 0.00 57.85 57.31 1zgw n ARG 19 Cb 0.37 -4.94 -0.02 0.00 -1.02 0.00 0.00 32.46 26.85 1zgw n ARG 19 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1zgw s ASP 20 N -3.15 6.04 0.00 0.55 2.15 -0.36 -4.71 116.67 117.19 1zgw s ASP 20 Ca 0.38 1.17 0.06 0.00 0.43 0.00 0.00 52.55 54.59 1zgw s ASP 20 Cb -0.17 -2.53 0.37 0.00 -0.30 0.00 0.00 42.92 40.29 1zgw s ASP 20 CO 0.47 -1.61 0.87 -0.81 -0.17 0.00 0.00 175.17 173.92 1zgw n PRO 21 N 8.31 0.55 -0.00 4.34 -0.04 -1.26 -1.76 135.00 145.14 1zgw n PRO 21 Ca 0.21 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.76 1zgw n PRO 21 Cb 0.47 -1.17 -0.11 0.00 -0.04 0.00 0.00 33.50 32.64 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 -0.67 0.84 -0.21 3.54 5.15 -1.26 -4.05 115.26 118.60 1zgw n ASN 22 Ca 0.05 -0.81 0.06 0.00 -0.60 0.00 0.00 54.58 53.28 1zgw n ASN 22 Cb 0.02 1.14 -0.02 0.00 -0.53 0.00 0.00 39.78 40.39 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 -1.56 3.06 -2.69 5.20 0.00 -0.72 -4.76 120.51 119.03 1zgw n ALA 23 Ca 0.03 -0.44 -0.42 0.00 0.00 0.00 0.00 53.44 52.61 1zgw n ALA 23 Cb 0.33 -0.42 -0.03 0.00 0.00 0.00 0.00 19.45 19.33 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 -1.64 7.30 0.00 0.00 2.15 -1.15 -2.09 116.67 121.23 1zgw s ASP 24 Ca 0.09 1.60 0.00 0.00 0.43 0.00 0.00 52.55 54.66 1zgw s ASP 24 Cb 0.09 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.15 1zgw s ASP 24 CO 0.34 -0.37 0.00 0.61 -0.17 0.00 0.00 175.17 175.58 1zgw n GLY 25 N 3.01 3.19 0.13 2.66 0.00 -1.26 0.46 105.19 113.38 1zgw n GLY 25 Ca 0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.88 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 1.56 0.19 -3.78 1.61 4.57 -1.67 -3.45 114.58 113.61 1zgw h GLU 26 Ca 0.00 -0.33 -0.09 0.00 -1.18 0.00 0.00 59.36 57.76 1zgw h GLU 26 Cb 0.00 0.12 -0.10 0.00 -0.16 0.00 0.00 28.75 28.61 1zgw h GLU 26 CO 0.00 1.16 -0.18 -0.59 -1.18 0.00 0.00 179.01 178.22 1zgw s PHE 27 N -2.50 0.49 0.39 0.92 -0.12 -0.89 -4.33 117.98 111.94 1zgw s PHE 27 Ca -0.24 -0.83 0.04 0.00 -0.05 0.00 0.00 56.93 55.84 1zgw s PHE 27 Cb 0.06 0.09 -0.04 0.00 -0.63 0.00 0.00 43.02 42.51 1zgw s PHE 27 CO 0.72 -0.96 0.10 0.14 -0.05 0.00 0.00 175.22 175.17 1zgw s VAL 28 N -3.97 0.81 -0.05 -2.49 -7.23 -0.31 -4.31 120.40 102.84 1zgw s VAL 28 Ca 0.25 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.40 1zgw s VAL 28 Cb 0.00 -2.47 0.03 0.00 0.56 0.00 0.00 36.38 34.50 1zgw s VAL 28 CO 0.10 0.00 0.03 0.72 -0.31 0.00 0.00 175.10 175.64 1zgw s PHE 29 N -3.23 0.31 -0.36 2.82 -0.12 -1.25 -1.58 117.98 114.58 1zgw s PHE 29 Ca 0.26 0.08 -0.14 0.00 -0.05 0.00 0.00 56.93 57.09 1zgw s PHE 29 Cb 0.04 -0.60 -0.01 0.00 -0.63 0.00 0.00 43.02 41.83 1zgw s PHE 29 CO 0.14 -0.24 0.27 0.00 -0.05 0.00 0.00 175.22 175.34 1zgw s ALA 30 N 2.02 3.50 -0.56 1.99 0.00 0.65 -3.88 121.76 125.48 1zgw s ALA 30 Ca 0.04 -1.43 -0.24 0.00 0.00 0.00 0.00 51.96 50.33 1zgw s ALA 30 Cb -0.12 -2.74 0.05 0.00 0.00 0.00 0.00 23.12 20.31 1zgw s ALA 30 CO -0.04 -1.09 0.93 0.08 0.00 0.00 0.00 175.76 175.64 1zgw s VAL 31 N 1.75 4.41 0.39 0.00 1.01 0.44 -1.08 120.40 127.32 1zgw s VAL 31 Ca 0.07 0.14 0.39 0.00 0.00 0.00 0.00 61.98 62.58 1zgw s VAL 31 Cb -0.18 -4.55 0.42 0.00 0.00 0.00 0.00 36.38 32.08 1zgw s VAL 31 CO 0.11 -1.15 2.18 0.03 0.00 0.00 0.00 175.10 176.27 1zgw h ARG 32 N 9.33 0.00 -0.02 2.72 3.08 0.14 0.40 114.38 130.03 1zgw h ARG 32 Ca -0.27 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.73 1zgw h ARG 32 Cb 1.07 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.12 1zgw h ARG 32 CO 1.09 0.00 -0.25 0.00 -1.07 0.00 0.00 179.97 179.75 1zgw h THR 33 N 0.00 1.19 -0.00 2.04 1.03 -1.90 -3.10 112.91 112.17 1zgw h THR 33 Ca -0.00 -0.90 0.00 0.00 -0.01 0.00 0.00 66.41 65.50 1zgw h THR 33 Cb 0.26 1.45 0.00 0.00 -1.07 0.00 0.00 68.15 68.79 1zgw h THR 33 CO 0.00 0.26 -0.02 1.07 -0.01 0.00 0.00 175.52 176.83 1zgw n THR 34 N -4.23 0.00 -2.39 0.00 5.66 -0.78 -5.00 114.28 107.54 1zgw n THR 34 Ca -0.02 -0.49 -0.12 0.00 -3.05 0.00 0.00 64.05 60.37 1zgw n THR 34 Cb 0.31 1.01 0.00 0.00 -1.55 0.00 0.00 70.33 70.10 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 0.56 -0.06 3.55 1.09 0.00 0.13 -4.88 105.19 105.58 1zgw n GLY 35 Ca 0.00 -0.35 -0.26 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.70 2.20 0.01 -0.61 1.01 -0.86 0.03 121.20 120.30 1zgw s ILE 36 Ca 0.06 -2.18 -0.13 0.00 0.00 0.00 0.00 60.65 58.40 1zgw s ILE 36 Cb -0.03 -2.68 0.02 0.00 0.01 0.00 0.00 42.46 39.78 1zgw s ILE 36 CO 0.08 -0.18 0.26 0.72 0.00 0.00 0.00 174.94 175.82 1zgw s PHE 37 N -2.63 -0.09 0.42 3.97 -0.12 -1.25 0.17 117.98 118.45 1zgw s PHE 37 Ca 0.33 0.05 0.08 0.00 -0.05 0.00 0.00 56.93 57.34 1zgw s PHE 37 Cb 0.03 0.05 -0.00 0.00 -0.63 0.00 0.00 43.02 42.47 1zgw s PHE 37 CO 0.17 -0.41 0.48 1.03 -0.05 0.00 0.00 175.22 176.44 1zgw s ARG 39 N -1.81 2.69 0.14 1.99 0.52 -1.26 -3.78 118.95 117.44 1zgw s ARG 39 Ca -0.10 -1.38 0.18 0.00 -0.52 0.00 0.00 55.73 53.90 1zgw s ARG 39 Cb -0.04 -2.58 0.77 0.00 0.52 0.00 0.00 34.95 33.61 1zgw s ARG 39 CO 0.01 -0.24 1.54 -0.35 0.02 0.00 0.00 175.30 176.28 1zgw n PRO 40 N -1.72 0.10 -0.82 3.54 -0.04 -1.26 -2.79 135.00 132.02 1zgw n PRO 40 Ca 0.06 0.39 -0.03 0.00 -0.04 0.00 0.00 63.50 63.88 1zgw n PRO 40 Cb 0.60 -1.70 0.19 0.00 -0.04 0.00 0.00 33.50 32.55 1zgw n PRO 40 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1zgw n SER 41 N -1.89 2.40 -4.67 3.54 3.41 -1.26 -2.95 113.62 112.20 1zgw n SER 41 Ca 0.02 -3.84 -0.45 0.00 -0.26 0.00 0.00 58.87 54.34 1zgw n SER 41 Cb 0.16 -0.59 -0.03 0.00 -0.26 0.00 0.00 64.21 63.49 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 2.25 2.61 -0.10 0.00 -4.01 -1.26 -4.61 116.66 111.55 1zgw n ARG 43 Ca 0.13 -2.44 -0.19 0.00 -1.04 0.00 0.00 57.85 54.30 1zgw n ARG 43 Cb 0.31 -1.52 -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 4.13 0.20 0.00 2.89 0.00 -2.01 -3.51 119.26 120.96 1zgw h ALA 44 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 54.91 53.88 1zgw h ALA 44 Cb 0.96 0.59 0.00 0.00 0.00 0.00 0.00 17.79 19.34 1zgw h ALA 44 CO 0.00 0.56 0.00 -2.13 0.00 0.00 0.00 179.25 177.68 1zgw n ARG 45 N -4.48 -1.71 -4.08 0.00 3.00 -1.26 -5.19 116.66 102.94 1zgw n ARG 45 Ca -0.26 0.00 -0.07 0.00 -0.00 0.00 0.00 57.85 57.52 1zgw n ARG 45 Cb 0.61 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.97 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 0.50 0.25 -0.14 3.76 -1.26 -4.99 115.29 111.41 1zgw s HIS 46 Ca 0.00 -1.03 0.12 0.00 -0.15 0.00 0.00 55.06 53.99 1zgw s HIS 46 Cb 0.00 -0.37 -0.05 0.00 1.11 0.00 0.00 32.58 33.27 1zgw s HIS 46 CO 0.00 -0.38 -0.21 0.00 -0.85 0.00 0.00 174.74 173.30 1zgw s ALA 47 N -3.82 2.65 0.81 -1.40 0.00 -1.26 -5.11 121.76 113.63 1zgw s ALA 47 Ca 0.06 -1.79 -0.15 0.00 0.00 0.00 0.00 51.96 50.08 1zgw s ALA 47 Cb 0.07 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 1zgw s ALA 47 CO -0.10 0.32 0.48 1.28 0.00 0.00 0.00 175.76 177.75 1zgw n LEU 48 N -0.30 0.47 0.23 0.00 4.77 -1.26 -4.83 117.00 116.08 1zgw n LEU 48 Ca -0.08 0.49 0.07 0.00 -0.03 0.00 0.00 56.01 56.46 1zgw n LEU 48 Cb 0.59 -1.21 0.58 0.00 -2.33 0.00 0.00 43.42 41.04 1zgw n LEU 48 CO 0.35 -3.29 1.01 -0.09 -1.33 0.00 0.00 177.39 174.04 1zgw h ARG 49 N -0.80 0.04 -0.77 3.23 1.12 -2.00 -3.11 114.38 112.09 1zgw h ARG 49 Ca -0.45 -0.00 0.07 0.00 -1.11 0.00 0.00 59.98 58.49 1zgw h ARG 49 Cb 1.32 -0.01 -0.09 0.00 -0.01 0.00 0.00 29.97 31.18 1zgw h ARG 49 CO 0.39 0.09 -0.46 -1.91 -3.11 0.00 0.00 179.97 174.98 1zgw n GLU 50 N -4.46 -0.34 -0.40 0.20 0.00 -1.26 0.12 120.64 114.50 1zgw n GLU 50 Ca -0.02 1.38 0.04 0.00 0.00 0.00 0.00 57.16 58.56 1zgw n GLU 50 Cb 0.15 -2.03 0.20 0.00 0.00 0.00 0.00 31.44 29.76 1zgw n GLU 50 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1zgw n ASN 51 N -4.75 3.13 -4.36 4.31 3.02 -1.18 -4.82 115.26 110.60 1zgw n ASN 51 Ca 0.02 -2.36 -0.34 0.00 -0.03 0.00 0.00 54.58 51.87 1zgw n ASN 51 Cb 0.20 -0.51 -0.14 0.00 -0.61 0.00 0.00 39.78 38.73 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 -1.81 3.27 0.46 2.41 1.01 0.32 0.16 120.40 126.23 1zgw s VAL 52 Ca 0.28 -0.56 0.03 0.00 0.00 0.00 0.00 61.98 61.74 1zgw s VAL 52 Cb 0.20 -2.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 1zgw s VAL 52 CO 0.11 0.49 0.02 -0.94 0.00 0.00 0.00 175.10 174.77 1zgw s SER 53 N 0.76 3.85 0.13 3.32 1.04 -0.24 -4.84 113.70 117.72 1zgw s SER 53 Ca -0.04 -1.55 0.10 0.00 0.48 0.00 0.00 55.95 54.95 1zgw s SER 53 Cb -0.15 0.20 -0.04 0.00 0.10 0.00 0.00 66.02 66.13 1zgw s SER 53 CO 0.02 -0.72 -0.25 -0.36 0.98 0.00 0.00 173.24 172.90 1zgw s PHE 54 N -2.87 2.18 0.10 5.02 0.08 -1.26 -0.25 117.98 120.98 1zgw s PHE 54 Ca 0.18 -0.39 0.04 0.00 0.12 0.00 0.00 56.93 56.89 1zgw s PHE 54 Cb 0.05 -1.18 -0.04 0.00 -0.57 0.00 0.00 43.02 41.29 1zgw s PHE 54 CO 0.09 0.32 -0.11 0.71 -0.10 0.00 0.00 175.22 176.13 1zgw s TYR 55 N -1.14 1.17 0.14 0.36 1.51 -0.61 -4.90 117.35 113.89 1zgw s TYR 55 Ca 0.13 -0.62 -0.11 0.00 -1.01 0.00 0.00 57.07 55.46 1zgw s TYR 55 Cb -0.10 -0.63 -0.04 0.00 -0.11 0.00 0.00 41.96 41.09 1zgw s TYR 55 CO 0.06 0.05 1.49 0.00 -1.11 0.00 0.00 175.55 176.03 1zgw h ALA 56 N 3.57 0.59 -2.42 3.71 0.00 -1.90 -0.81 119.26 121.99 1zgw h ALA 56 Ca -0.38 -0.45 -0.20 0.00 0.00 0.00 0.00 54.91 53.88 1zgw h ALA 56 Cb 1.19 -0.13 -0.15 0.00 0.00 0.00 0.00 17.79 18.70 1zgw h ALA 56 CO 0.52 0.68 -0.65 0.54 0.00 0.00 0.00 179.25 180.34 1zgw s ASN 57 N -6.83 0.38 0.55 0.00 2.20 -1.26 -3.48 114.94 106.50 1zgw s ASN 57 Ca -0.11 -1.22 0.29 0.00 -0.94 0.00 0.00 52.86 50.88 1zgw s ASN 57 Cb 0.11 0.29 1.60 0.00 -2.00 0.00 0.00 41.25 41.25 1zgw s ASN 57 CO 0.88 -0.72 2.14 0.00 -2.94 0.00 0.00 177.10 176.45 1zgw h ALA 58 N 2.83 1.32 -0.17 3.54 0.00 -1.92 -1.99 119.26 122.88 1zgw h ALA 58 Ca -0.35 -0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.33 1zgw h ALA 58 Cb 1.20 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1zgw h ALA 58 CO 0.59 0.10 -0.56 1.03 0.00 0.00 0.00 179.25 180.40 1zgw h SER 59 N 0.00 0.59 -0.12 0.00 0.87 -1.96 0.66 113.55 113.59 1zgw h SER 59 Ca -0.00 -0.32 -0.00 0.00 -1.23 0.00 0.00 61.79 60.24 1zgw h SER 59 Cb 0.23 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 1zgw h SER 59 CO 0.01 1.03 0.06 -0.08 -0.53 0.00 0.00 176.83 177.31 1zgw h GLU 60 N 0.40 0.17 -0.53 2.24 4.57 -1.78 1.16 114.58 120.81 1zgw h GLU 60 Ca 0.00 -0.02 0.02 0.00 -1.18 0.00 0.00 59.36 58.18 1zgw h GLU 60 Cb 1.11 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.63 1zgw h GLU 60 CO 0.10 0.23 0.33 0.00 -1.18 0.00 0.00 179.01 178.49 1zgw h ALA 61 N 0.93 0.68 -0.02 2.92 0.00 -1.27 0.32 119.26 122.82 1zgw h ALA 61 Ca 0.04 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1zgw h ALA 61 Cb 0.12 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1zgw h ALA 61 CO -0.01 0.05 0.02 -0.07 0.00 0.00 0.00 179.25 179.24 1zgw h LEU 62 N 0.66 0.00 -0.23 0.00 3.38 0.12 0.23 115.31 119.46 1zgw h LEU 62 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1zgw h LEU 62 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1zgw h LEU 62 CO -0.08 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.45 1zgw h ALA 63 N 1.99 1.00 0.00 1.53 0.00 0.51 -3.03 119.26 121.26 1zgw h ALA 63 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1zgw h ALA 63 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1zgw h ALA 63 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1zgw n ALA 64 N -2.00 2.58 -1.92 0.00 0.00 0.79 -4.84 120.51 115.12 1zgw n ALA 64 Ca 0.04 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1zgw n ALA 64 Cb 0.46 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.45 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 0.80 0.87 3.72 0.00 0.00 -1.15 -5.07 105.19 104.36 1zgw n GLY 65 Ca 0.21 -0.62 -0.23 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.55 2.83 -0.33 1.61 0.08 -1.23 -5.00 117.98 113.39 1zgw s PHE 66 Ca 0.00 -0.21 -0.13 0.00 0.12 0.00 0.00 56.93 56.71 1zgw s PHE 66 Cb 0.00 -1.34 -0.02 0.00 -0.57 0.00 0.00 43.02 41.09 1zgw s PHE 66 CO 0.00 0.54 0.24 0.50 -0.10 0.00 0.00 175.22 176.39 1zgw s ARG 67 N -3.76 3.56 0.30 0.44 3.52 0.10 -4.68 118.95 118.44 1zgw s ARG 67 Ca 0.33 -0.60 -0.29 0.00 -0.13 0.00 0.00 55.73 55.04 1zgw s ARG 67 Cb -0.06 -3.79 -0.11 0.00 -1.56 0.00 0.00 34.95 29.43 1zgw s ARG 67 CO 0.22 -0.41 1.50 -1.25 -0.81 0.00 0.00 175.30 174.56 1zgw s PRO 68 N 1.73 4.18 -0.01 5.12 0.04 -1.26 -3.80 135.00 141.01 1zgw s PRO 68 Ca 0.06 2.47 -0.32 0.00 0.04 0.00 0.00 61.00 63.25 1zgw s PRO 68 Cb -0.17 -3.04 -0.11 0.00 0.04 0.00 0.00 34.50 31.22 1zgw s PRO 68 CO 0.11 -0.51 1.90 0.00 0.04 0.00 0.00 177.00 178.53 1zgw n LYS 70 N 6.70 0.00 -0.06 0.00 4.81 -1.26 -0.37 118.16 127.98 1zgw n LYS 70 Ca 0.21 0.06 -0.07 0.00 -0.87 0.00 0.00 58.31 57.64 1zgw n LYS 70 Cb 0.34 -1.52 -0.07 0.00 0.02 0.00 0.00 35.03 33.80 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 -0.95 1.23 0.09 1.64 3.00 -1.26 -4.45 116.66 115.96 1zgw n ARG 71 Ca 0.00 0.04 0.09 0.00 -0.00 0.00 0.00 57.85 57.98 1zgw n ARG 71 Cb 0.02 -1.26 -0.02 0.00 0.00 0.00 0.00 32.46 31.21 1zgw n ARG 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1zgw h GLN 73 N 0.00 0.45 0.11 0.00 5.75 -0.96 -3.37 115.11 117.09 1zgw h GLN 73 Ca -0.03 -0.76 -0.26 0.00 -0.15 0.00 0.00 58.65 57.45 1zgw h GLN 73 Cb 1.12 0.28 0.03 0.00 1.07 0.00 0.00 27.48 29.98 1zgw h GLN 73 CO 0.01 1.36 -1.07 -1.00 -2.65 0.00 0.00 178.83 175.48 1zgw h PRO 74 N 0.13 0.54 -7.61 -2.39 0.13 -1.78 -3.46 132.00 117.55 1zgw h PRO 74 Ca -0.21 -0.72 -0.43 0.00 -0.87 0.00 0.00 66.00 63.77 1zgw h PRO 74 Cb 2.09 0.24 0.18 0.00 0.13 0.00 0.00 31.00 33.64 1zgw h PRO 74 CO 0.25 1.31 0.28 0.16 -0.23 0.00 0.00 178.00 179.77 1zgw s ASP 75 N -7.24 1.97 -0.08 1.44 1.47 -1.25 -5.05 116.67 107.93 1zgw s ASP 75 Ca -0.11 0.44 -0.01 0.00 1.18 0.00 0.00 52.55 54.04 1zgw s ASP 75 Cb 0.04 -0.57 -0.03 0.00 -0.34 0.00 0.00 42.92 42.02 1zgw s ASP 75 CO 0.90 -3.46 -0.01 -0.54 0.68 0.00 0.00 175.17 172.75 1zgw s LYS 76 N -5.66 2.95 0.00 2.11 -0.14 -1.26 -4.97 119.74 112.78 1zgw s LYS 76 Ca 0.73 -0.43 0.00 0.00 -1.36 0.00 0.00 55.97 54.91 1zgw s LYS 76 Cb -0.07 -2.77 0.00 0.00 -1.68 0.00 0.00 37.83 33.32 1zgw s LYS 76 CO 0.55 0.70 0.00 0.00 -0.76 0.00 0.00 175.35 175.83 1zgw n ALA 77 N 2.13 0.00 0.19 5.17 0.00 -1.26 -3.70 120.51 123.05 1zgw n ALA 77 Ca -0.18 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.34 1zgw n ALA 77 Cb 0.54 0.00 0.61 0.00 0.00 0.00 0.00 19.45 20.60 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 0.07 0.05 0.00 -0.26 0.99 1.31 115.58 117.74 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 -0.02 0.00 0.00 -1.06 0.00 0.00 38.32 37.24 1zgw h ASN 78 CO 0.00 0.05 0.00 -0.81 -1.06 0.00 0.00 177.43 175.61 1zgw n PRO 79 N -4.52 0.15 0.02 0.81 -0.04 -1.26 -2.55 135.00 127.61 1zgw n PRO 79 Ca -0.01 0.63 -0.09 0.00 -0.04 0.00 0.00 63.50 63.99 1zgw n PRO 79 Cb 0.14 -1.97 -0.05 0.00 -0.04 0.00 0.00 33.50 31.58 1zgw n PRO 79 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1zgw h ARG 80 N 0.00 -0.35 -1.00 0.54 9.65 0.17 -0.22 114.38 123.17 1zgw h ARG 80 Ca 0.00 0.02 0.26 0.00 -1.10 0.00 0.00 59.98 59.16 1zgw h ARG 80 Cb 0.03 0.08 -0.07 0.00 -1.39 0.00 0.00 29.97 28.61 1zgw h ARG 80 CO 0.00 -0.23 0.67 1.96 2.80 0.00 0.00 179.97 185.16 1zgw h GLN 81 N -0.36 0.30 -0.34 0.20 4.20 -1.66 0.10 115.11 117.56 1zgw h GLN 81 Ca 0.01 -0.02 -0.12 0.00 0.06 0.00 0.00 58.65 58.58 1zgw h GLN 81 Cb 0.40 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 1zgw h GLN 81 CO -0.20 0.20 -0.25 0.45 -0.67 0.00 0.00 178.83 178.36 1zgw h HIS 82 N 0.31 0.89 0.00 2.96 3.86 -1.28 -0.85 115.15 121.05 1zgw h HIS 82 Ca 0.54 -0.25 -0.03 0.00 -1.16 0.00 0.00 60.37 59.47 1zgw h HIS 82 Cb 1.52 -0.20 -0.00 0.00 1.06 0.00 0.00 27.41 29.79 1zgw h HIS 82 CO -0.00 1.00 -0.15 -0.09 0.86 0.00 0.00 177.93 179.55 1zgw h ARG 83 N 0.53 0.00 0.03 2.45 9.65 0.62 -1.63 114.38 126.03 1zgw h ARG 83 Ca 0.06 0.00 -0.22 0.00 -1.10 0.00 0.00 59.98 58.73 1zgw h ARG 83 Cb 0.81 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.38 1zgw h ARG 83 CO 0.07 0.15 -0.98 1.25 2.80 0.00 0.00 179.97 183.25 1zgw h LEU 84 N 0.00 0.26 -1.10 3.80 7.12 -0.69 -2.79 115.31 121.90 1zgw h LEU 84 Ca -0.00 -0.23 -0.02 0.00 0.13 0.00 0.00 57.88 57.75 1zgw h LEU 84 Cb 0.50 -0.08 -0.03 0.00 -0.53 0.00 0.00 40.66 40.52 1zgw h LEU 84 CO 0.02 1.09 0.32 0.44 -0.13 0.00 0.00 178.44 180.18 1zgw h ASP 85 N 0.08 0.86 -0.17 1.25 3.32 -0.22 -2.21 116.42 119.33 1zgw h ASP 85 Ca -0.06 -0.09 0.01 0.00 0.02 0.00 0.00 57.03 56.91 1zgw h ASP 85 Cb 1.66 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.97 1zgw h ASP 85 CO 0.15 0.73 0.07 0.50 -1.72 0.00 0.00 179.24 178.97 1zgw h LYS 86 N 0.95 0.16 -0.79 3.56 1.63 -1.22 -2.47 116.57 118.38 1zgw h LYS 86 Ca 0.23 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 60.02 1zgw h LYS 86 Cb 0.10 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.66 1zgw h LYS 86 CO -0.03 0.11 0.48 0.82 -3.45 0.00 0.00 179.45 177.38 1zgw h ILE 87 N 0.17 1.22 -0.74 2.00 2.04 -1.16 -0.84 117.51 120.19 1zgw h ILE 87 Ca 0.07 -0.47 0.11 0.00 1.00 0.00 0.00 64.86 65.57 1zgw h ILE 87 Cb 0.02 0.10 -0.08 0.00 -0.74 0.00 0.00 36.82 36.12 1zgw h ILE 87 CO -0.05 0.23 0.36 0.74 0.00 0.00 0.00 178.15 179.43 1zgw h THR 88 N 1.09 0.80 -0.92 -0.27 2.02 -0.98 0.97 112.91 115.62 1zgw h THR 88 Ca 0.29 -0.20 0.09 0.00 0.77 0.00 0.00 66.41 67.35 1zgw h THR 88 Cb -0.05 0.16 -0.07 0.00 -1.74 0.00 0.00 68.15 66.45 1zgw h THR 88 CO -0.05 0.11 0.59 -0.74 0.37 0.00 0.00 175.52 175.80 1zgw h HIS 89 N 0.59 1.02 -0.74 3.16 6.17 -0.81 0.79 115.15 125.34 1zgw h HIS 89 Ca 0.38 0.03 0.13 0.00 0.71 0.00 0.00 60.37 61.62 1zgw h HIS 89 Cb 0.45 -0.33 -0.05 0.00 2.52 0.00 0.00 27.41 30.00 1zgw h HIS 89 CO -0.11 0.48 0.49 0.00 0.71 0.00 0.00 177.93 179.50 1zgw h ALA 90 N 1.53 2.03 0.02 5.26 0.00 0.15 0.11 119.26 128.37 1zgw h ALA 90 Ca 0.42 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.33 1zgw h ALA 90 Cb 0.36 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1zgw h ALA 90 CO -0.18 -0.22 -0.01 0.00 0.00 0.00 0.00 179.25 178.84 1zgw h ARG 92 N -0.13 -0.13 -0.81 0.00 9.65 -0.36 0.18 114.38 122.77 1zgw h ARG 92 Ca -0.00 0.01 0.09 0.00 -1.10 0.00 0.00 59.98 58.98 1zgw h ARG 92 Cb 0.12 0.03 -0.06 0.00 -1.39 0.00 0.00 29.97 28.68 1zgw h ARG 92 CO 0.00 -0.09 0.53 -0.07 2.80 0.00 0.00 179.97 183.14 1zgw h LEU 93 N -0.14 0.69 -0.06 3.80 -0.00 -1.06 1.19 115.31 119.73 1zgw h LEU 93 Ca 0.22 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 58.11 1zgw h LEU 93 Cb 0.48 -0.13 0.00 0.00 -0.00 0.00 0.00 40.66 41.01 1zgw h LEU 93 CO -0.56 0.42 0.00 0.18 -0.00 0.00 0.00 178.44 178.48 1zgw n LEU 94 N -4.51 0.05 0.00 1.67 4.32 0.58 -2.49 117.00 116.63 1zgw n LEU 94 Ca 0.13 0.51 0.00 0.00 -0.02 0.00 0.00 56.01 56.64 1zgw n LEU 94 Cb 0.31 -0.51 0.00 0.00 -1.62 0.00 0.00 43.42 41.60 1zgw n LEU 94 CO 0.32 -0.29 0.09 1.21 -1.22 0.00 0.00 177.39 177.50 1zgw n GLU 95 N -1.56 0.70 -0.07 3.23 0.00 -0.12 -4.82 120.64 118.00 1zgw n GLU 95 Ca 0.03 -0.19 -0.07 0.00 0.00 0.00 0.00 57.16 56.94 1zgw n GLU 95 Cb 0.16 -0.62 -0.04 0.00 0.00 0.00 0.00 31.44 30.95 1zgw n GLU 95 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.13 177.50 1zgw h GLN 96 N 0.00 0.00 0.00 5.31 5.75 0.17 -3.48 115.11 122.86 1zgw h GLN 96 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1zgw h GLN 96 Cb 0.17 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.72 1zgw h GLN 96 CO 0.00 0.28 0.00 -0.85 -2.65 0.00 0.00 178.83 175.61 1zgw n GLU 97 N -4.65 2.47 -0.05 1.69 0.28 -1.14 -5.06 120.64 114.18 1zgw n GLU 97 Ca -0.09 0.00 -0.06 0.00 -0.16 0.00 0.00 57.16 56.85 1zgw n GLU 97 Cb 0.26 0.00 -0.02 0.00 1.43 0.00 0.00 31.44 33.11 1zgw n GLU 97 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 1zgw n THR 98 N 0.00 1.31 -2.04 3.84 -1.04 -1.26 -4.95 114.28 110.15 1zgw n THR 98 Ca 0.00 0.22 -0.40 0.00 -2.04 0.00 0.00 64.05 61.83 1zgw n THR 98 Cb 0.00 -2.09 -0.01 0.00 -1.82 0.00 0.00 70.33 66.41 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 -2.54 4.04 0.49 -2.82 0.04 -1.26 -4.97 135.00 127.98 1zgw s PRO 99 Ca -0.20 2.21 -0.19 0.00 0.04 0.00 0.00 61.00 62.86 1zgw s PRO 99 Cb 0.03 -2.83 -0.08 0.00 0.04 0.00 0.00 34.50 31.65 1zgw s PRO 99 CO 0.29 -0.45 1.01 0.08 0.04 0.00 0.00 177.00 177.98 1zgw s VAL 100 N -1.22 4.04 -0.46 -0.36 1.01 -1.26 -4.90 120.40 117.24 1zgw s VAL 100 Ca 0.55 1.19 -0.06 0.00 0.00 0.00 0.00 61.98 63.66 1zgw s VAL 100 Cb -0.39 -3.51 0.12 0.00 0.00 0.00 0.00 36.38 32.60 1zgw s VAL 100 CO 0.51 -0.35 0.30 0.42 0.00 0.00 0.00 175.10 175.98 1zgw s THR 101 N -2.18 3.84 0.00 3.92 -4.23 -1.26 -4.64 115.64 111.09 1zgw s THR 101 Ca 0.64 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 59.17 1zgw s THR 101 Cb -0.14 -3.56 0.00 0.00 1.34 0.00 0.00 72.50 70.14 1zgw s THR 101 CO 0.22 -0.76 0.00 0.18 -0.54 0.00 0.00 174.62 173.72 1zgw n LEU 102 N 4.67 0.00 -0.32 4.79 4.32 -1.26 -4.81 117.00 124.39 1zgw n LEU 102 Ca -0.04 0.00 0.17 0.00 -0.02 0.00 0.00 56.01 56.12 1zgw n LEU 102 Cb 0.41 0.00 0.34 0.00 -1.62 0.00 0.00 43.42 42.54 1zgw n LEU 102 CO 0.38 0.00 0.80 1.21 -1.22 0.00 0.00 177.39 178.56 1zgw n GLU 103 N -0.90 -0.07 -0.13 3.23 0.00 -1.26 0.46 120.64 121.97 1zgw n GLU 103 Ca 0.00 1.37 -0.11 0.00 0.00 0.00 0.00 57.16 58.41 1zgw n GLU 103 Cb 0.11 -2.23 -0.02 0.00 0.00 0.00 0.00 31.44 29.29 1zgw n GLU 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1zgw h ALA 104 N 1.86 0.52 0.18 4.31 0.00 -1.98 -1.13 119.26 123.01 1zgw h ALA 104 Ca 0.62 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1zgw h ALA 104 Cb 1.37 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1zgw h ALA 104 CO -0.84 0.41 -0.09 1.25 0.00 0.00 0.00 179.25 179.98 1zgw h LEU 105 N 0.54 -0.20 -0.90 0.00 7.12 -0.34 -1.91 115.31 119.63 1zgw h LEU 105 Ca 0.09 -0.31 0.15 0.00 0.13 0.00 0.00 57.88 57.94 1zgw h LEU 105 Cb 0.65 0.05 -0.09 0.00 -0.53 0.00 0.00 40.66 40.74 1zgw h LEU 105 CO 0.04 0.25 0.50 0.00 -0.13 0.00 0.00 178.44 179.11 1zgw h ALA 106 N -0.06 1.38 -0.36 1.25 0.00 -0.06 -0.11 119.26 121.30 1zgw h ALA 106 Ca -0.02 0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 1zgw h ALA 106 Cb 0.50 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1zgw h ALA 106 CO 0.04 -0.02 -0.25 -0.44 0.00 0.00 0.00 179.25 178.59 1zgw h ASP 107 N 0.72 0.75 0.21 0.00 5.19 -1.19 0.43 116.42 122.53 1zgw h ASP 107 Ca 0.49 -0.27 -0.15 0.00 -0.62 0.00 0.00 57.03 56.47 1zgw h ASP 107 Cb 0.65 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.95 1zgw h ASP 107 CO -0.34 0.96 -0.57 -0.61 -3.12 0.00 0.00 179.24 175.57 1zgw h GLN 108 N 0.64 0.37 0.00 3.56 4.15 -0.25 -3.22 115.11 120.36 1zgw h GLN 108 Ca 0.09 -0.24 0.00 0.00 0.77 0.00 0.00 58.65 59.27 1zgw h GLN 108 Cb 0.75 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.47 1zgw h GLN 108 CO 0.06 0.83 -1.27 0.28 -1.93 0.00 0.00 178.83 176.80 1zgw n VAL 109 N -3.92 0.21 -2.12 2.39 0.31 -0.22 -4.97 118.33 110.00 1zgw n VAL 109 Ca -0.03 -0.36 -0.00 0.00 -0.01 0.00 0.00 64.34 63.94 1zgw n VAL 109 Cb 0.60 0.08 0.00 0.00 -0.91 0.00 0.00 33.84 33.61 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 -0.01 -2.23 3.52 0.00 0.14 -5.06 120.51 114.87 1zgw n ALA 110 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1zgw n ALA 110 Cb 0.49 -0.55 -0.10 0.00 0.00 0.00 0.00 19.45 19.29 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 -4.25 1.22 0.96 0.00 0.23 -0.48 -5.02 119.30 111.96 1zgw s MET 111 Ca 0.00 -1.64 -0.13 0.00 -1.03 0.00 0.00 55.69 52.90 1zgw s MET 111 Cb -0.00 0.06 0.17 0.00 -1.53 0.00 0.00 34.83 33.53 1zgw s MET 111 CO 0.00 -0.32 1.13 -1.12 -2.03 0.00 0.00 175.02 172.68 1zgw s SER 112 N -3.19 3.00 0.44 -1.18 0.01 -1.26 -4.31 113.70 107.20 1zgw s SER 112 Ca 0.35 0.98 0.13 0.00 1.31 0.00 0.00 55.95 58.72 1zgw s SER 112 Cb 0.07 -1.54 0.97 0.00 0.21 0.00 0.00 66.02 65.73 1zgw s SER 112 CO 0.10 -2.87 1.99 1.55 0.41 0.00 0.00 173.24 174.42 1zgw h PRO 113 N -1.72 0.07 -0.24 12.44 0.13 -1.96 -1.59 132.00 139.13 1zgw h PRO 113 Ca -0.51 -0.01 -0.13 0.00 -0.87 0.00 0.00 66.00 64.47 1zgw h PRO 113 Cb 1.33 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.44 1zgw h PRO 113 CO 0.58 0.21 -0.40 0.74 -0.23 0.00 0.00 178.00 178.90 1zgw h PHE 114 N 0.07 0.68 -0.04 1.56 -1.00 -2.00 -2.29 116.94 113.92 1zgw h PHE 114 Ca 0.01 -0.20 -0.11 0.00 2.81 0.00 0.00 57.97 60.48 1zgw h PHE 114 Cb 0.29 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 39.69 1zgw h PHE 114 CO 0.00 0.89 -0.51 1.25 -1.61 0.00 0.00 178.31 178.33 1zgw h HIS 115 N 0.47 0.11 -0.71 -0.55 2.76 -1.66 -1.92 115.15 113.65 1zgw h HIS 115 Ca 0.04 -0.04 0.03 0.00 -2.20 0.00 0.00 60.37 58.20 1zgw h HIS 115 Cb 0.91 -0.02 -0.04 0.00 1.55 0.00 0.00 27.41 29.80 1zgw h HIS 115 CO 0.04 0.58 0.45 1.25 -1.30 0.00 0.00 177.93 178.95 1zgw h LEU 116 N 0.07 0.74 -0.63 0.26 5.85 -0.91 0.18 115.31 120.87 1zgw h LEU 116 Ca -0.00 -0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.75 1zgw h LEU 116 Cb 0.93 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.76 1zgw h LEU 116 CO 0.07 0.51 0.39 0.45 -0.34 0.00 0.00 178.44 179.52 1zgw h HIS 117 N 0.88 0.73 -0.65 1.25 3.86 -0.94 0.61 115.15 120.88 1zgw h HIS 117 Ca 0.28 0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.56 1zgw h HIS 117 Cb 0.01 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.20 1zgw h HIS 117 CO -0.04 0.41 0.43 -0.09 0.86 0.00 0.00 177.93 179.50 1zgw h ARG 118 N 0.76 0.69 -0.11 2.45 9.65 -0.19 -1.53 114.38 126.10 1zgw h ARG 118 Ca 0.25 -0.04 -0.05 0.00 -1.10 0.00 0.00 59.98 59.04 1zgw h ARG 118 Cb 0.02 -0.16 -0.00 0.00 -1.39 0.00 0.00 29.97 28.44 1zgw h ARG 118 CO -0.10 0.46 -0.13 1.25 2.80 0.00 0.00 179.97 184.24 1zgw h LEU 119 N 0.71 0.31 -1.00 3.80 7.12 0.91 -0.91 115.31 126.26 1zgw h LEU 119 Ca 0.27 -0.50 0.21 0.00 0.13 0.00 0.00 57.88 58.00 1zgw h LEU 119 Cb 0.18 -0.09 -0.12 0.00 -0.53 0.00 0.00 40.66 40.10 1zgw h LEU 119 CO -0.08 0.75 0.59 0.15 -0.13 0.00 0.00 178.44 179.72 1zgw h PHE 120 N -0.12 1.02 -0.10 1.25 3.04 -0.19 0.20 116.94 122.04 1zgw h PHE 120 Ca 0.02 0.04 -0.05 0.00 3.98 0.00 0.00 57.97 61.95 1zgw h PHE 120 Cb 0.67 -0.30 -0.00 0.00 2.56 0.00 0.00 35.95 38.88 1zgw h PHE 120 CO 0.09 0.15 -0.13 -0.22 -2.02 0.00 0.00 178.31 176.18 1zgw h LYS 121 N 0.67 0.26 0.21 1.11 1.63 -1.16 -0.01 116.57 119.28 1zgw h LYS 121 Ca 0.60 -0.15 0.01 0.00 -0.85 0.00 0.00 60.65 60.26 1zgw h LYS 121 Cb 1.04 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 32.66 1zgw h LYS 121 CO -0.43 0.71 -0.23 0.00 -3.45 0.00 0.00 179.45 176.05 1zgw h ALA 122 N 0.55 -0.45 0.53 5.00 0.00 0.47 0.91 119.26 126.27 1zgw h ALA 122 Ca 0.01 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1zgw h ALA 122 Cb 0.68 0.33 0.01 0.00 0.00 0.00 0.00 17.79 18.80 1zgw h ALA 122 CO 0.03 -0.79 -0.25 1.15 0.00 0.00 0.00 179.25 179.39 1zgw h THR 123 N -0.48 0.00 -1.03 0.00 2.02 -0.79 -3.00 112.91 109.63 1zgw h THR 123 Ca 0.00 -0.43 0.28 0.00 0.77 0.00 0.00 66.41 67.03 1zgw h THR 123 Cb 0.45 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 66.80 1zgw h THR 123 CO -0.06 0.00 0.71 0.00 0.37 0.00 0.00 175.52 176.53 1zgw h THR 124 N -1.14 0.51 0.00 3.16 1.03 -1.04 -3.46 112.91 111.98 1zgw h THR 124 Ca -0.07 -0.06 0.00 0.00 -0.01 0.00 0.00 66.41 66.27 1zgw h THR 124 Cb 0.54 0.32 0.00 0.00 -1.07 0.00 0.00 68.15 67.94 1zgw h THR 124 CO 0.12 0.03 0.00 0.61 -0.01 0.00 0.00 175.52 176.27 1zgw n GLY 125 N -1.63 3.09 2.69 2.99 0.00 0.31 -4.90 105.19 107.74 1zgw n GLY 125 Ca 0.23 -1.02 -0.06 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.92 1.61 0.00 -1.06 -4.71 117.12 111.26 1zgw n MET 126 Ca 0.00 -1.69 0.02 0.00 0.00 0.00 0.00 57.70 56.03 1zgw n MET 126 Cb 0.00 0.05 0.00 0.00 0.00 0.00 0.00 33.22 33.27 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 0.19 -0.42 0.00 2.03 2.01 -1.26 -5.00 115.64 113.18 1zgw s THR 127 Ca 0.19 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.19 1zgw s THR 127 Cb 0.41 -0.05 0.00 0.00 0.01 0.00 0.00 72.50 72.86 1zgw s THR 127 CO -0.10 0.00 0.00 -0.81 -0.69 0.00 0.00 174.62 173.02 1zgw n PRO 128 N 4.05 0.00 0.31 4.92 -0.04 -1.26 -2.86 135.00 140.11 1zgw n PRO 128 Ca 0.07 0.00 0.19 0.00 -0.04 0.00 0.00 63.50 63.72 1zgw n PRO 128 Cb 0.61 0.00 1.03 0.00 -0.04 0.00 0.00 33.50 35.10 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 -0.23 0.54 3.64 -1.93 0.37 116.57 118.96 1zgw h LYS 129 Ca 0.00 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.27 1zgw h LYS 129 Cb 0.00 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1zgw h LYS 129 CO 0.00 0.00 -0.32 0.00 -2.27 0.00 0.00 179.45 176.86 1zgw h ALA 130 N 1.82 1.03 -0.67 5.00 0.00 -1.95 -1.04 119.26 123.44 1zgw h ALA 130 Ca 0.02 -0.38 -0.06 0.00 0.00 0.00 0.00 54.91 54.48 1zgw h ALA 130 Cb 0.23 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1zgw h ALA 130 CO -0.00 0.59 0.18 2.35 0.00 0.00 0.00 179.25 182.37 1zgw h TRP 131 N 0.41 1.12 -0.92 0.00 -0.00 -0.77 -0.24 115.95 115.54 1zgw h TRP 131 Ca 0.05 -0.13 0.03 0.00 -0.00 0.00 0.00 58.89 58.84 1zgw h TRP 131 Cb 0.76 -0.32 -0.05 0.00 -0.00 0.00 0.00 29.16 29.55 1zgw h TRP 131 CO 0.02 0.91 0.61 0.37 -0.00 0.00 0.00 178.44 180.36 1zgw h GLN 132 N 1.00 1.15 -0.28 2.65 -0.00 -1.29 -0.19 115.11 118.15 1zgw h GLN 132 Ca 0.21 -0.07 -0.04 0.00 -0.00 0.00 0.00 58.65 58.75 1zgw h GLN 132 Cb 0.35 -0.26 -0.01 0.00 0.00 0.00 0.00 27.48 27.56 1zgw h GLN 132 CO -0.00 0.76 0.02 0.37 0.00 0.00 0.00 178.83 179.98 1zgw h GLN 133 N 1.18 0.49 0.77 1.69 -0.00 -0.21 -1.86 115.11 117.17 1zgw h GLN 133 Ca 0.36 -0.15 -0.04 0.00 -0.00 0.00 0.00 58.65 58.83 1zgw h GLN 133 Cb -0.02 -0.05 0.01 0.00 0.00 0.00 0.00 27.48 27.41 1zgw h GLN 133 CO -0.10 0.63 -0.37 0.00 0.00 0.00 0.00 178.83 178.98 1zgw h ALA 134 N 0.85 -1.03 -0.78 3.38 0.00 -0.43 -0.18 119.26 121.07 1zgw h ALA 134 Ca 0.08 -0.23 0.17 0.00 0.00 0.00 0.00 54.91 54.93 1zgw h ALA 134 Cb 0.39 0.40 -0.14 0.00 0.00 0.00 0.00 17.79 18.44 1zgw h ALA 134 CO 0.01 -1.05 -0.10 -1.49 0.00 0.00 0.00 179.25 176.62 1zgw h TRP 135 N -1.10 -0.25 -0.45 0.00 -0.00 -1.08 0.80 115.95 113.86 1zgw h TRP 135 Ca -0.11 0.06 0.00 0.00 -0.00 0.00 0.00 58.89 58.85 1zgw h TRP 135 Cb 0.80 0.23 -0.02 0.00 -0.00 0.00 0.00 29.16 30.18 1zgw h TRP 135 CO -0.01 -0.31 0.28 -0.09 -0.00 0.00 0.00 178.44 178.32 1zgw h ARG 136 N 0.04 0.60 -0.15 0.49 2.43 -1.08 0.95 114.38 117.66 1zgw h ARG 136 Ca 0.40 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.39 1zgw h ARG 136 Cb 0.67 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 1zgw h ARG 136 CO -0.75 0.42 -0.52 0.00 -1.51 0.00 0.00 179.97 177.60 1zgw h ALA 137 N 1.69 0.83 -0.03 2.80 0.00 0.24 -3.03 119.26 121.77 1zgw h ALA 137 Ca 0.16 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1zgw h ALA 137 Cb -0.04 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1zgw h ALA 137 CO -0.03 0.68 -0.02 -2.13 0.00 0.00 0.00 179.25 177.74 1zgw n ARG 138 N -3.96 2.19 0.00 0.00 0.63 -0.38 -5.10 116.66 110.04 1zgw n ARG 138 Ca -0.02 -1.84 0.00 0.00 -0.92 0.00 0.00 57.85 55.06 1zgw n ARG 138 Cb 0.57 -1.45 0.00 0.00 0.45 0.00 0.00 32.46 32.03 1zgw n ARG 138 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99