#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 -2.72 -2.71 2.12 5.02 -1.26 -5.02 118.16 113.59 1zgw n LYS 2 Ca 0.00 2.27 -0.06 0.00 -2.02 0.00 0.00 58.31 58.50 1zgw n LYS 2 Cb 0.00 -3.56 0.06 0.00 -0.02 0.00 0.00 35.03 31.50 1zgw n LYS 2 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1zgw n LYS 3 N 1.41 0.50 0.00 1.97 4.81 -1.26 -4.98 118.16 120.61 1zgw n LYS 3 Ca -0.11 -1.30 0.00 0.00 -0.87 0.00 0.00 58.31 56.02 1zgw n LYS 3 Cb 0.29 -0.94 0.00 0.00 0.02 0.00 0.00 35.03 34.40 1zgw n LYS 3 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1zgw n ALA 4 N 1.65 0.00 -0.14 3.14 0.00 -1.26 -4.74 120.51 119.17 1zgw n ALA 4 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1zgw n ALA 4 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.11 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 -0.03 0.98 -1.55 0.00 -1.04 -1.26 -4.51 114.28 106.87 1zgw n THR 5 Ca 0.00 -0.22 -0.00 0.00 -2.04 0.00 0.00 64.05 61.78 1zgw n THR 5 Cb 0.00 -1.18 0.00 0.00 -1.82 0.00 0.00 70.33 67.33 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 -1.45 -0.71 -3.49 0.00 -0.00 -1.26 -4.81 117.00 105.28 1zgw n LEU 7 Ca -0.00 -1.89 -0.40 0.00 -0.00 0.00 0.00 56.01 53.71 1zgw n LEU 7 Cb 0.50 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.91 1zgw n LEU 7 CO 0.02 1.35 3.10 0.41 -0.00 0.00 0.00 177.39 182.26 1zgw n THR 8 N 0.05 3.94 -0.61 1.96 -1.04 -1.26 -4.68 114.28 112.63 1zgw n THR 8 Ca -0.22 -2.76 0.48 0.00 -2.04 0.00 0.00 64.05 59.50 1zgw n THR 8 Cb 0.72 -2.61 0.76 0.00 -1.82 0.00 0.00 70.33 67.37 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 4.68 0.08 0.18 8.00 5.75 -1.26 0.95 116.55 134.94 1zgw n ASP 9 Ca 0.67 1.14 -0.14 0.00 -0.01 0.00 0.00 54.79 56.45 1zgw n ASP 9 Cb 0.30 -0.57 -0.08 0.00 -1.03 0.00 0.00 41.12 39.75 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 -0.38 0.98 -1.12 5.19 -2.00 -0.35 116.42 118.74 1zgw h ASP 10 Ca 0.91 0.02 -0.19 0.00 -0.62 0.00 0.00 57.03 57.15 1zgw h ASP 10 Cb 3.36 0.11 -0.03 0.00 0.18 0.00 0.00 39.33 42.95 1zgw h ASP 10 CO -0.19 -0.25 -1.08 -0.61 -3.12 0.00 0.00 179.24 173.98 1zgw h GLN 11 N -0.41 0.00 -0.83 3.56 4.15 0.19 -2.72 115.11 119.05 1zgw h GLN 11 Ca -0.03 0.00 0.15 0.00 0.77 0.00 0.00 58.65 59.54 1zgw h GLN 11 Cb 0.33 0.00 -0.10 0.00 0.21 0.00 0.00 27.48 27.92 1zgw h GLN 11 CO 0.04 0.60 0.41 0.00 -1.93 0.00 0.00 178.83 177.95 1zgw h ARG 12 N 0.00 0.56 -0.59 1.69 2.47 0.20 1.53 114.38 120.23 1zgw h ARG 12 Ca -0.09 -0.03 -0.09 0.00 -1.26 0.00 0.00 59.98 58.51 1zgw h ARG 12 Cb 1.66 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 29.83 1zgw h ARG 12 CO 0.08 0.37 0.04 2.35 0.56 0.00 0.00 179.97 183.37 1zgw h TRP 13 N 0.57 1.10 0.00 3.04 -0.00 -1.02 0.80 115.95 120.45 1zgw h TRP 13 Ca 0.46 -0.18 -0.01 0.00 -0.00 0.00 0.00 58.89 59.16 1zgw h TRP 13 Cb 0.68 -0.29 -0.00 0.00 -0.00 0.00 0.00 29.16 29.54 1zgw h TRP 13 CO -0.11 0.97 -0.05 0.37 -0.00 0.00 0.00 178.44 179.62 1zgw h GLN 14 N 0.92 0.00 0.03 2.65 4.15 0.13 0.23 115.11 123.21 1zgw h GLN 14 Ca 0.17 0.00 -0.22 0.00 0.77 0.00 0.00 58.65 59.38 1zgw h GLN 14 Cb 0.51 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.18 1zgw h GLN 14 CO 0.02 0.05 -0.98 0.77 -1.93 0.00 0.00 178.83 176.76 1zgw h SER 15 N 0.00 0.22 0.69 -0.69 0.02 0.33 0.39 113.55 114.52 1zgw h SER 15 Ca -0.00 -0.21 -0.08 0.00 -0.84 0.00 0.00 61.79 60.66 1zgw h SER 15 Cb 0.09 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1zgw h SER 15 CO 0.01 1.08 -0.40 0.58 -1.14 0.00 0.00 176.83 176.95 1zgw h VAL 16 N 0.07 1.01 0.01 2.27 2.07 0.34 0.16 116.25 122.18 1zgw h VAL 16 Ca -0.05 -1.51 -0.34 0.00 0.82 0.00 0.00 66.70 65.62 1zgw h VAL 16 Cb 1.67 1.88 -0.06 0.00 -1.52 0.00 0.00 31.29 33.26 1zgw h VAL 16 CO 0.15 0.39 -2.07 0.18 0.02 0.00 0.00 177.57 176.24 1zgw n LEU 17 N -3.67 0.74 0.04 2.57 4.77 0.51 -3.89 117.00 118.07 1zgw n LEU 17 Ca -0.01 0.19 0.12 0.00 -0.03 0.00 0.00 56.01 56.28 1zgw n LEU 17 Cb 0.49 0.16 0.50 0.00 -2.33 0.00 0.00 43.42 42.24 1zgw n LEU 17 CO 0.37 0.50 0.90 0.00 -1.33 0.00 0.00 177.39 177.83 1zgw n ALA 18 N -2.71 2.15 -3.50 -1.18 0.00 0.14 -4.90 120.51 110.51 1zgw n ALA 18 Ca -0.27 -0.06 -0.21 0.00 0.00 0.00 0.00 53.44 52.91 1zgw n ALA 18 Cb 1.09 -1.43 0.08 0.00 0.00 0.00 0.00 19.45 19.20 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 -1.77 -7.29 -2.11 0.00 1.74 0.48 -4.88 116.66 102.84 1zgw n ARG 19 Ca 0.06 0.80 -0.43 0.00 -0.77 0.00 0.00 57.85 57.51 1zgw n ARG 19 Cb 0.33 -5.76 -0.02 0.00 -1.02 0.00 0.00 32.46 25.99 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 -3.62 6.05 0.00 0.55 2.15 -0.74 -4.69 116.67 116.38 1zgw s ASP 20 Ca 0.39 1.19 0.07 0.00 0.43 0.00 0.00 52.55 54.63 1zgw s ASP 20 Cb -0.17 -2.53 0.44 0.00 -0.30 0.00 0.00 42.92 40.36 1zgw s ASP 20 CO 0.70 -1.60 0.95 -0.81 -0.17 0.00 0.00 175.17 174.24 1zgw n PRO 21 N 8.29 0.59 -0.00 4.34 -0.04 -1.26 -1.83 135.00 145.08 1zgw n PRO 21 Ca 0.21 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.73 1zgw n PRO 21 Cb 0.47 -1.20 -0.08 0.00 -0.04 0.00 0.00 33.50 32.65 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 -0.70 0.83 -0.19 3.54 5.15 -1.26 -4.21 115.26 118.42 1zgw n ASN 22 Ca 0.06 -0.69 0.05 0.00 -0.60 0.00 0.00 54.58 53.40 1zgw n ASN 22 Cb 0.03 1.11 -0.01 0.00 -0.53 0.00 0.00 39.78 40.37 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 -1.43 2.98 -2.38 5.20 0.00 -0.76 -4.74 120.51 119.38 1zgw n ALA 23 Ca 0.02 -0.41 -0.42 0.00 0.00 0.00 0.00 53.44 52.62 1zgw n ALA 23 Cb 0.24 -0.38 -0.03 0.00 0.00 0.00 0.00 19.45 19.29 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 -1.55 6.96 0.00 0.00 -1.08 -0.99 -1.80 116.67 118.20 1zgw s ASP 24 Ca 0.08 1.86 0.00 0.00 -0.52 0.00 0.00 52.55 53.96 1zgw s ASP 24 Cb 0.08 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.99 1zgw s ASP 24 CO 0.31 -0.69 0.00 0.61 0.52 0.00 0.00 175.17 175.92 1zgw n GLY 25 N 3.54 2.98 0.09 2.66 0.00 -1.26 0.69 105.19 113.88 1zgw n GLY 25 Ca 0.13 -0.30 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 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 0.16 -4.43 1.61 4.22 -1.62 -3.45 114.58 111.06 1zgw h GLU 26 Ca 0.00 -0.10 -0.22 0.00 0.08 0.00 0.00 59.36 59.12 1zgw h GLU 26 Cb 0.00 0.01 -0.14 0.00 0.50 0.00 0.00 28.75 29.12 1zgw h GLU 26 CO 0.00 0.68 -0.52 -0.59 -2.18 0.00 0.00 179.01 176.40 1zgw s PHE 27 N -4.00 1.05 0.41 0.92 -0.71 -1.02 -4.33 117.98 110.30 1zgw s PHE 27 Ca -0.15 -1.28 0.03 0.00 -1.04 0.00 0.00 56.93 54.49 1zgw s PHE 27 Cb 0.03 -0.43 -0.03 0.00 -1.21 0.00 0.00 43.02 41.37 1zgw s PHE 27 CO 0.72 -0.72 0.08 0.14 -1.34 0.00 0.00 175.22 174.09 1zgw s VAL 28 N -4.08 0.94 -0.05 -2.49 -7.23 -0.18 -4.35 120.40 102.95 1zgw s VAL 28 Ca 0.36 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.51 1zgw s VAL 28 Cb 0.05 -2.45 0.03 0.00 0.56 0.00 0.00 36.38 34.58 1zgw s VAL 28 CO 0.12 0.00 0.08 0.72 -0.31 0.00 0.00 175.10 175.71 1zgw s PHE 29 N -3.13 0.02 -0.37 2.82 -0.12 -1.25 -1.46 117.98 114.49 1zgw s PHE 29 Ca 0.23 0.31 -0.15 0.00 -0.05 0.00 0.00 56.93 57.27 1zgw s PHE 29 Cb 0.04 -0.45 0.00 0.00 -0.63 0.00 0.00 43.02 41.99 1zgw s PHE 29 CO 0.12 -0.22 0.33 0.00 -0.05 0.00 0.00 175.22 175.41 1zgw s ALA 30 N 2.19 3.48 -0.40 1.99 0.00 0.10 -3.84 121.76 125.29 1zgw s ALA 30 Ca 0.05 -1.43 -0.23 0.00 0.00 0.00 0.00 51.96 50.35 1zgw s ALA 30 Cb -0.12 -2.84 0.02 0.00 0.00 0.00 0.00 23.12 20.17 1zgw s ALA 30 CO -0.04 -1.23 0.76 0.08 0.00 0.00 0.00 175.76 175.33 1zgw s VAL 31 N 1.88 4.73 0.11 0.00 1.01 0.35 -1.26 120.40 127.22 1zgw s VAL 31 Ca 0.09 0.62 0.34 0.00 0.00 0.00 0.00 61.98 63.03 1zgw s VAL 31 Cb -0.17 -4.23 0.39 0.00 0.00 0.00 0.00 36.38 32.36 1zgw s VAL 31 CO 0.11 -0.54 1.99 0.03 0.00 0.00 0.00 175.10 176.69 1zgw h ARG 32 N 8.69 0.00 -0.15 2.72 3.08 0.11 0.45 114.38 129.29 1zgw h ARG 32 Ca -0.25 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.71 1zgw h ARG 32 Cb 1.09 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 1zgw h ARG 32 CO 0.92 0.00 -0.31 0.00 -1.07 0.00 0.00 179.97 179.52 1zgw h THR 33 N 0.00 1.27 -0.00 2.04 1.03 -1.91 -3.14 112.91 112.20 1zgw h THR 33 Ca -0.00 -1.28 0.00 0.00 -0.01 0.00 0.00 66.41 65.12 1zgw h THR 33 Cb 0.51 1.50 0.00 0.00 -1.07 0.00 0.00 68.15 69.09 1zgw h THR 33 CO 0.00 0.39 -0.11 1.07 -0.01 0.00 0.00 175.52 176.86 1zgw n THR 34 N -4.11 0.00 -2.76 0.00 5.66 -1.04 -5.00 114.28 107.04 1zgw n THR 34 Ca -0.01 -0.44 -0.16 0.00 -3.05 0.00 0.00 64.05 60.39 1zgw n THR 34 Cb 0.41 1.06 0.02 0.00 -1.55 0.00 0.00 70.33 70.27 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 0.71 -0.18 3.47 1.09 0.00 0.15 -4.89 105.19 105.54 1zgw n GLY 35 Ca 0.02 -0.14 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.98 1.61 -0.01 -0.61 1.01 -0.82 0.02 121.20 119.42 1zgw s ILE 36 Ca 0.20 -2.08 -0.09 0.00 0.00 0.00 0.00 60.65 58.69 1zgw s ILE 36 Cb -0.09 -2.64 0.01 0.00 0.01 0.00 0.00 42.46 39.75 1zgw s ILE 36 CO 0.25 -0.17 0.18 0.72 0.00 0.00 0.00 174.94 175.92 1zgw s PHE 37 N -3.02 -0.03 0.51 3.97 -0.12 -1.24 0.13 117.98 118.18 1zgw s PHE 37 Ca 0.32 0.02 0.05 0.00 -0.05 0.00 0.00 56.93 57.28 1zgw s PHE 37 Cb 0.06 -0.01 0.02 0.00 -0.63 0.00 0.00 43.02 42.46 1zgw s PHE 37 CO 0.14 -0.29 0.33 1.03 -0.05 0.00 0.00 175.22 176.39 1zgw s ARG 39 N -1.20 2.27 0.59 1.99 3.00 -1.26 -3.80 118.95 120.54 1zgw s ARG 39 Ca -0.13 -2.00 0.35 0.00 0.00 0.00 0.00 55.73 53.96 1zgw s ARG 39 Cb -0.06 -2.05 1.81 0.00 0.00 0.00 0.00 34.95 34.64 1zgw s ARG 39 CO 0.02 -0.49 2.17 -1.00 0.00 0.00 0.00 175.30 176.00 1zgw h PRO 40 N 0.92 0.00 -0.30 3.54 0.13 -1.82 -3.05 132.00 131.42 1zgw h PRO 40 Ca -0.39 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.57 1zgw h PRO 40 Cb 1.29 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.32 1zgw h PRO 40 CO 0.61 0.04 -0.23 -1.13 -0.23 0.00 0.00 178.00 177.05 1zgw n SER 41 N -3.31 2.54 -4.47 1.44 3.41 -1.26 -2.93 113.62 109.03 1zgw n SER 41 Ca -0.02 -3.83 -0.48 0.00 -0.26 0.00 0.00 58.87 54.28 1zgw n SER 41 Cb 0.19 -0.60 -0.03 0.00 -0.26 0.00 0.00 64.21 63.51 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 1.03 2.41 -0.10 0.00 1.85 -1.26 -4.55 116.66 116.04 1zgw n ARG 43 Ca 0.16 -2.17 -0.21 0.00 -1.00 0.00 0.00 57.85 54.63 1zgw n ARG 43 Cb 0.25 -1.49 -0.11 0.00 -1.05 0.00 0.00 32.46 30.07 1zgw n ARG 43 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1zgw n ALA 44 N 1.42 0.76 0.00 2.89 0.00 -1.26 -5.10 120.51 119.23 1zgw n ALA 44 Ca 0.17 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1zgw n ALA 44 Cb 0.59 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 19.55 1zgw n ALA 44 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1zgw n ARG 45 N -4.44 -1.51 -4.05 0.00 3.00 -1.26 -5.18 116.66 103.21 1zgw n ARG 45 Ca -0.31 0.00 -0.08 0.00 -0.00 0.00 0.00 57.85 57.47 1zgw n ARG 45 Cb 0.65 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 33.01 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 -3.00 0.44 0.36 -0.14 3.76 -1.26 -4.91 115.29 110.53 1zgw s HIS 46 Ca 0.00 -0.93 0.08 0.00 -0.15 0.00 0.00 55.06 54.06 1zgw s HIS 46 Cb 0.00 -0.32 -0.05 0.00 1.11 0.00 0.00 32.58 33.32 1zgw s HIS 46 CO 0.00 -0.37 0.10 0.00 -0.85 0.00 0.00 174.74 173.62 1zgw s ALA 47 N -3.53 3.40 0.98 -1.40 0.00 -1.26 -5.11 121.76 114.83 1zgw s ALA 47 Ca 0.03 -1.95 -0.12 0.00 0.00 0.00 0.00 51.96 49.92 1zgw s ALA 47 Cb 0.05 -0.50 0.11 0.00 0.00 0.00 0.00 23.12 22.78 1zgw s ALA 47 CO -0.09 0.00 0.71 1.28 0.00 0.00 0.00 175.76 177.67 1zgw n LEU 48 N -1.09 0.79 0.09 0.00 4.77 -1.26 -4.90 117.00 115.40 1zgw n LEU 48 Ca -0.03 0.27 -0.05 0.00 -0.03 0.00 0.00 56.01 56.16 1zgw n LEU 48 Cb 0.62 -1.29 -0.01 0.00 -2.33 0.00 0.00 43.42 40.42 1zgw n LEU 48 CO 0.44 -2.99 0.27 -0.09 -1.33 0.00 0.00 177.39 173.69 1zgw h ARG 49 N -1.87 0.03 -0.71 3.23 2.43 -1.99 -3.31 114.38 112.18 1zgw h ARG 49 Ca -0.46 -0.03 0.07 0.00 -0.81 0.00 0.00 59.98 58.74 1zgw h ARG 49 Cb 1.29 0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 30.76 1zgw h ARG 49 CO 0.39 0.87 -0.51 1.49 -1.51 0.00 0.00 179.97 180.70 1zgw h GLU 50 N 0.01 -0.11 -0.67 0.20 4.22 -2.00 0.73 114.58 116.97 1zgw h GLU 50 Ca -0.02 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.43 1zgw h GLU 50 Cb 1.51 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.78 1zgw h GLU 50 CO 0.11 -0.07 0.00 0.09 -2.18 0.00 0.00 179.01 176.96 1zgw n ASN 51 N -4.99 2.30 -4.50 1.04 3.02 -1.26 -4.83 115.26 106.04 1zgw n ASN 51 Ca 0.00 -2.23 -0.35 0.00 -0.03 0.00 0.00 54.58 51.97 1zgw n ASN 51 Cb 0.25 -0.45 -0.12 0.00 -0.61 0.00 0.00 39.78 38.85 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 -1.63 4.23 0.45 2.41 1.01 0.26 0.15 120.40 127.26 1zgw s VAL 52 Ca 0.19 -0.22 0.03 0.00 0.00 0.00 0.00 61.98 61.98 1zgw s VAL 52 Cb 0.13 -2.92 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 1zgw s VAL 52 CO 0.08 0.43 0.03 -0.94 0.00 0.00 0.00 175.10 174.69 1zgw s SER 53 N 0.88 3.65 0.11 3.32 1.04 -0.39 -4.85 113.70 117.46 1zgw s SER 53 Ca 0.02 -1.56 0.08 0.00 0.48 0.00 0.00 55.95 54.97 1zgw s SER 53 Cb -0.14 0.23 -0.04 0.00 0.10 0.00 0.00 66.02 66.17 1zgw s SER 53 CO 0.02 -0.74 -0.21 -0.36 0.98 0.00 0.00 173.24 172.93 1zgw s PHE 54 N -2.94 1.83 0.11 5.02 0.08 -1.26 0.03 117.98 120.86 1zgw s PHE 54 Ca 0.19 -0.42 0.05 0.00 0.12 0.00 0.00 56.93 56.88 1zgw s PHE 54 Cb 0.05 -1.00 -0.04 0.00 -0.57 0.00 0.00 43.02 41.46 1zgw s PHE 54 CO 0.10 0.22 -0.13 0.71 -0.10 0.00 0.00 175.22 176.02 1zgw s TYR 55 N -1.18 1.28 0.13 0.36 1.51 -0.53 -4.90 117.35 114.02 1zgw s TYR 55 Ca 0.07 -0.59 -0.11 0.00 -1.01 0.00 0.00 57.07 55.43 1zgw s TYR 55 Cb -0.10 -0.68 -0.08 0.00 -0.11 0.00 0.00 41.96 40.99 1zgw s TYR 55 CO 0.04 0.10 1.42 0.00 -1.11 0.00 0.00 175.55 176.00 1zgw h ALA 56 N 3.54 0.48 -2.28 3.71 0.00 -1.88 -0.44 119.26 122.39 1zgw h ALA 56 Ca -0.39 -0.51 -0.20 0.00 0.00 0.00 0.00 54.91 53.81 1zgw h ALA 56 Cb 1.19 -0.08 -0.15 0.00 0.00 0.00 0.00 17.79 18.75 1zgw h ALA 56 CO 0.51 0.68 -0.68 0.54 0.00 0.00 0.00 179.25 180.31 1zgw s ASN 57 N -6.94 0.83 0.60 0.00 2.20 -1.26 -3.77 114.94 106.60 1zgw s ASN 57 Ca -0.11 -1.08 0.34 0.00 -0.94 0.00 0.00 52.86 51.07 1zgw s ASN 57 Cb 0.10 0.17 1.92 0.00 -2.00 0.00 0.00 41.25 41.44 1zgw s ASN 57 CO 0.89 -0.57 2.24 0.00 -2.94 0.00 0.00 177.10 176.72 1zgw h ALA 58 N 2.93 1.28 -0.17 3.54 0.00 -1.90 -1.43 119.26 123.51 1zgw h ALA 58 Ca -0.35 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.37 1zgw h ALA 58 Cb 1.17 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1zgw h ALA 58 CO 0.63 0.03 -0.58 1.03 0.00 0.00 0.00 179.25 180.37 1zgw h SER 59 N 0.00 0.61 0.04 0.00 0.87 -1.96 0.82 113.55 113.93 1zgw h SER 59 Ca -0.00 -0.34 -0.00 0.00 -1.23 0.00 0.00 61.79 60.22 1zgw h SER 59 Cb 0.09 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 61.88 1zgw h SER 59 CO 0.00 1.05 -0.02 -0.08 -0.53 0.00 0.00 176.83 177.26 1zgw h GLU 60 N 0.41 -0.05 -0.78 2.24 4.57 -1.68 1.04 114.58 120.34 1zgw h GLU 60 Ca 0.00 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.21 1zgw h GLU 60 Cb 1.12 0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.68 1zgw h GLU 60 CO 0.11 0.08 0.50 0.00 -1.18 0.00 0.00 179.01 178.52 1zgw h ALA 61 N 0.80 1.02 0.00 2.92 0.00 -1.28 0.26 119.26 122.97 1zgw h ALA 61 Ca -0.01 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1zgw h ALA 61 Cb 0.15 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1zgw h ALA 61 CO 0.01 0.33 -0.12 -0.07 0.00 0.00 0.00 179.25 179.39 1zgw h LEU 62 N 0.99 0.00 -0.05 0.00 3.38 0.15 0.01 115.31 119.79 1zgw h LEU 62 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1zgw h LEU 62 Cb -0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1zgw h LEU 62 CO -0.10 0.12 0.00 0.00 0.09 0.00 0.00 178.44 178.55 1zgw h ALA 63 N 1.88 1.00 0.00 1.53 0.00 0.45 -3.10 119.26 121.02 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 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1zgw h ALA 63 CO 0.02 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.27 1zgw n ALA 64 N -1.91 2.64 -1.73 0.00 0.00 -0.01 -4.86 120.51 114.64 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 0.46 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.42 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 0.92 0.72 3.51 0.00 0.00 -1.17 -5.09 105.19 104.08 1zgw n GLY 65 Ca 0.23 -0.45 -0.25 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.65 2.35 -0.35 1.61 0.40 -1.23 -4.98 117.98 113.13 1zgw s PHE 66 Ca 0.00 -0.43 -0.13 0.00 -0.60 0.00 0.00 56.93 55.77 1zgw s PHE 66 Cb 0.00 -1.21 -0.01 0.00 0.51 0.00 0.00 43.02 42.31 1zgw s PHE 66 CO 0.00 0.64 0.25 0.50 0.70 0.00 0.00 175.22 177.31 1zgw s ARG 67 N -3.57 3.45 0.32 0.44 3.52 0.10 -4.71 118.95 118.51 1zgw s ARG 67 Ca 0.31 -0.67 -0.29 0.00 -0.13 0.00 0.00 55.73 54.95 1zgw s ARG 67 Cb -0.01 -3.82 -0.11 0.00 -1.56 0.00 0.00 34.95 29.45 1zgw s ARG 67 CO 0.16 -0.47 1.43 -1.25 -0.81 0.00 0.00 175.30 174.36 1zgw s PRO 68 N 1.73 4.22 -0.40 5.12 0.04 -1.26 -3.67 135.00 140.78 1zgw s PRO 68 Ca 0.06 2.40 -0.29 0.00 0.04 0.00 0.00 61.00 63.22 1zgw s PRO 68 Cb -0.18 -3.04 0.00 0.00 0.04 0.00 0.00 34.50 31.33 1zgw s PRO 68 CO 0.11 -0.41 1.53 0.00 0.04 0.00 0.00 177.00 178.26 1zgw n LYS 70 N 8.23 0.00 -0.03 0.00 4.81 -1.26 0.83 118.16 130.74 1zgw n LYS 70 Ca 0.18 0.09 -0.14 0.00 -0.87 0.00 0.00 58.31 57.57 1zgw n LYS 70 Cb 0.48 -1.53 -0.14 0.00 0.02 0.00 0.00 35.03 33.86 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 -1.00 0.69 0.00 1.64 3.00 -1.26 -3.95 116.66 115.77 1zgw n ARG 71 Ca 0.00 0.24 0.11 0.00 -0.00 0.00 0.00 57.85 58.19 1zgw n ARG 71 Cb 0.03 -1.71 0.07 0.00 0.00 0.00 0.00 32.46 30.85 1zgw n ARG 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1zgw n GLN 73 N 0.97 0.56 0.00 0.00 7.27 0.93 -4.54 117.38 122.57 1zgw n GLN 73 Ca 0.12 0.35 0.12 0.00 0.07 0.00 0.00 57.00 57.66 1zgw n GLN 73 Cb 0.52 -1.56 0.22 0.00 2.41 0.00 0.00 30.24 31.83 1zgw n GLN 73 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 1zgw n PRO 74 N -4.37 0.48 -1.50 3.69 -0.04 -1.25 -4.96 135.00 127.04 1zgw n PRO 74 Ca -0.37 -0.32 -0.30 0.00 -0.04 0.00 0.00 63.50 62.47 1zgw n PRO 74 Cb 0.71 -1.49 0.22 0.00 -0.04 0.00 0.00 33.50 32.90 1zgw n PRO 74 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1zgw s ASP 75 N -2.74 1.88 0.09 3.54 -4.77 -1.24 -5.03 116.67 108.39 1zgw s ASP 75 Ca 0.17 0.40 -0.20 0.00 -3.30 0.00 0.00 52.55 49.62 1zgw s ASP 75 Cb 0.18 -0.51 -0.07 0.00 -1.09 0.00 0.00 42.92 41.44 1zgw s ASP 75 CO 0.64 -3.51 0.59 -0.54 0.70 0.00 0.00 175.17 173.05 1zgw s LYS 76 N -5.68 4.24 0.00 2.11 -0.14 -1.26 -4.87 119.74 114.13 1zgw s LYS 76 Ca 0.73 0.78 0.00 0.00 -1.36 0.00 0.00 55.97 56.12 1zgw s LYS 76 Cb -0.06 -3.23 0.00 0.00 -1.68 0.00 0.00 37.83 32.86 1zgw s LYS 76 CO 0.55 0.62 0.00 0.00 -0.76 0.00 0.00 175.35 175.76 1zgw n ALA 77 N 1.66 0.00 0.17 5.17 0.00 -1.26 -4.75 120.51 121.49 1zgw n ALA 77 Ca -0.10 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.38 1zgw n ALA 77 Cb 0.51 0.00 0.42 0.00 0.00 0.00 0.00 19.45 20.37 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 0.10 0.45 0.00 -0.26 2.22 0.84 115.58 118.93 1zgw h ASN 78 Ca 0.00 -0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.70 1zgw h ASN 78 Cb 0.00 -0.03 -0.00 0.00 -1.06 0.00 0.00 38.32 37.23 1zgw h ASN 78 CO 0.00 0.32 -0.06 1.55 -1.06 0.00 0.00 177.43 178.18 1zgw h PRO 79 N 0.10 0.00 0.24 0.81 0.13 -1.91 -2.99 132.00 128.38 1zgw h PRO 79 Ca 0.02 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1zgw h PRO 79 Cb 0.42 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.53 1zgw h PRO 79 CO 0.03 0.06 -0.35 -0.09 -0.23 0.00 0.00 178.00 177.42 1zgw h ARG 80 N 0.00 -0.59 -0.94 0.86 1.12 0.43 -0.06 114.38 115.19 1zgw h ARG 80 Ca -0.00 0.04 0.23 0.00 -1.11 0.00 0.00 59.98 59.14 1zgw h ARG 80 Cb 0.29 0.13 -0.07 0.00 -0.01 0.00 0.00 29.97 30.32 1zgw h ARG 80 CO 0.01 -0.40 0.63 1.96 -3.11 0.00 0.00 179.97 179.06 1zgw h GLN 81 N -0.62 0.35 -0.32 0.20 4.20 -1.53 -0.32 115.11 117.08 1zgw h GLN 81 Ca -0.03 -0.02 -0.12 0.00 0.06 0.00 0.00 58.65 58.54 1zgw h GLN 81 Cb 0.56 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 1zgw h GLN 81 CO -0.10 0.23 -0.28 0.45 -0.67 0.00 0.00 178.83 178.46 1zgw h HIS 82 N 0.36 0.89 0.00 2.96 3.86 -1.36 -0.74 115.15 121.12 1zgw h HIS 82 Ca 0.50 -0.26 -0.05 0.00 -1.16 0.00 0.00 60.37 59.40 1zgw h HIS 82 Cb 1.33 -0.19 -0.01 0.00 1.06 0.00 0.00 27.41 29.60 1zgw h HIS 82 CO -0.00 1.02 -0.25 -0.09 0.86 0.00 0.00 177.93 179.47 1zgw h ARG 83 N 0.52 0.00 0.02 2.45 2.43 0.57 -1.64 114.38 118.72 1zgw h ARG 83 Ca 0.06 0.00 -0.20 0.00 -0.81 0.00 0.00 59.98 59.02 1zgw h ARG 83 Cb 0.85 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.38 1zgw h ARG 83 CO 0.07 0.25 -0.94 1.25 -1.51 0.00 0.00 179.97 179.09 1zgw h LEU 84 N 0.00 0.14 -1.23 3.80 5.85 -0.84 -2.86 115.31 120.17 1zgw h LEU 84 Ca -0.00 -0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.60 1zgw h LEU 84 Cb 0.57 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 1zgw h LEU 84 CO 0.03 1.00 0.53 0.44 -0.34 0.00 0.00 178.44 180.10 1zgw h ASP 85 N 0.05 0.90 0.17 1.25 3.32 -0.19 -1.89 116.42 120.03 1zgw h ASP 85 Ca -0.04 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1zgw h ASP 85 Cb 1.62 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.93 1zgw h ASP 85 CO 0.13 0.65 -0.14 0.50 -1.72 0.00 0.00 179.24 178.66 1zgw h LYS 86 N 1.07 -0.32 -0.69 3.56 3.64 -1.24 -2.57 116.57 120.03 1zgw h LYS 86 Ca 0.29 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.81 1zgw h LYS 86 Cb -0.11 0.07 -0.09 0.00 -0.41 0.00 0.00 32.23 31.69 1zgw h LYS 86 CO -0.06 -0.21 0.26 0.82 -2.27 0.00 0.00 179.45 177.98 1zgw h ILE 87 N -0.33 0.70 -0.72 2.00 1.08 -1.19 0.80 117.51 119.85 1zgw h ILE 87 Ca -0.00 -0.14 0.13 0.00 -0.39 0.00 0.00 64.86 64.46 1zgw h ILE 87 Cb 0.30 0.25 -0.09 0.00 -3.07 0.00 0.00 36.82 34.21 1zgw h ILE 87 CO -0.02 0.08 0.28 0.74 -0.69 0.00 0.00 178.15 178.54 1zgw h THR 88 N 0.42 0.68 -0.94 -0.27 2.02 -1.00 1.21 112.91 115.02 1zgw h THR 88 Ca 0.36 -0.15 0.11 0.00 0.77 0.00 0.00 66.41 67.51 1zgw h THR 88 Cb 0.51 0.21 -0.07 0.00 -1.74 0.00 0.00 68.15 67.05 1zgw h THR 88 CO -0.37 0.08 0.60 -0.74 0.37 0.00 0.00 175.52 175.47 1zgw h HIS 89 N 0.43 1.02 -1.00 3.16 6.17 -0.49 0.61 115.15 125.05 1zgw h HIS 89 Ca 0.39 0.03 0.11 0.00 0.71 0.00 0.00 60.37 61.61 1zgw h HIS 89 Cb 0.57 -0.32 -0.08 0.00 2.52 0.00 0.00 27.41 30.10 1zgw h HIS 89 CO -0.17 0.43 0.63 0.00 0.71 0.00 0.00 177.93 179.53 1zgw h ALA 90 N 1.55 1.50 -0.16 5.26 0.00 0.21 0.21 119.26 127.83 1zgw h ALA 90 Ca 0.46 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.38 1zgw h ALA 90 Cb 0.49 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1zgw h ALA 90 CO -0.22 0.25 0.07 0.00 0.00 0.00 0.00 179.25 179.35 1zgw h ARG 92 N 0.13 -0.34 -0.90 0.00 9.65 -0.10 0.15 114.38 122.97 1zgw h ARG 92 Ca 0.05 0.02 0.20 0.00 -1.10 0.00 0.00 59.98 59.15 1zgw h ARG 92 Cb 0.13 0.08 -0.07 0.00 -1.39 0.00 0.00 29.97 28.72 1zgw h ARG 92 CO -0.01 -0.23 0.59 1.37 2.80 0.00 0.00 179.97 184.50 1zgw h LEU 93 N -0.35 0.44 -0.12 3.80 8.10 -1.30 2.17 115.31 128.05 1zgw h LEU 93 Ca 0.02 0.04 0.00 0.00 0.11 0.00 0.00 57.88 58.06 1zgw h LEU 93 Cb 0.42 -0.04 0.00 0.00 -0.44 0.00 0.00 40.66 40.60 1zgw h LEU 93 CO -0.28 0.18 0.00 0.18 -4.11 0.00 0.00 178.44 174.41 1zgw n LEU 94 N -4.52 0.09 0.00 0.17 4.32 -0.01 -2.66 117.00 114.38 1zgw n LEU 94 Ca 0.19 0.53 0.00 0.00 -0.02 0.00 0.00 56.01 56.71 1zgw n LEU 94 Cb 0.67 -0.52 0.00 0.00 -1.62 0.00 0.00 43.42 41.95 1zgw n LEU 94 CO 0.30 -0.34 0.02 1.21 -1.22 0.00 0.00 177.39 177.36 1zgw n GLU 95 N -1.61 2.32 0.01 3.23 4.07 0.12 -4.77 120.64 124.01 1zgw n GLU 95 Ca 0.03 -0.05 -0.20 0.00 -0.06 0.00 0.00 57.16 56.88 1zgw n GLU 95 Cb 0.15 -0.33 -0.14 0.00 -0.06 0.00 0.00 31.44 31.06 1zgw n GLU 95 CO 0.00 0.00 0.00 0.37 -0.06 0.00 0.00 177.13 177.44 1zgw h GLN 96 N 0.00 0.22 0.00 5.31 4.15 0.36 -3.46 115.11 121.68 1zgw h GLN 96 Ca 0.00 -0.38 0.00 0.00 0.77 0.00 0.00 58.65 59.04 1zgw h GLN 96 Cb 0.06 0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.89 1zgw h GLN 96 CO 0.00 1.18 0.00 -0.85 -1.93 0.00 0.00 178.83 177.23 1zgw n GLU 97 N -4.15 1.82 -0.01 1.69 -0.00 -1.14 -5.04 120.64 113.81 1zgw n GLU 97 Ca -0.18 0.00 -0.02 0.00 -0.00 0.00 0.00 57.16 56.96 1zgw n GLU 97 Cb 0.79 0.00 -0.01 0.00 -0.00 0.00 0.00 31.44 32.22 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 -0.02 0.39 -2.13 3.84 -1.04 -1.26 -4.97 114.28 109.09 1zgw n THR 98 Ca 0.00 0.32 -0.40 0.00 -2.04 0.00 0.00 64.05 61.93 1zgw n THR 98 Cb 0.00 -1.58 -0.02 0.00 -1.82 0.00 0.00 70.33 66.91 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 -1.46 4.24 0.54 -2.82 0.04 -1.26 -5.01 135.00 129.27 1zgw s PRO 99 Ca -0.06 2.15 -0.17 0.00 0.04 0.00 0.00 61.00 62.96 1zgw s PRO 99 Cb 0.01 -2.96 -0.07 0.00 0.04 0.00 0.00 34.50 31.52 1zgw s PRO 99 CO 0.09 -0.26 1.01 0.08 0.04 0.00 0.00 177.00 177.96 1zgw s VAL 100 N -1.20 4.29 -0.09 -0.36 1.01 -1.26 -4.98 120.40 117.81 1zgw s VAL 100 Ca 0.51 1.11 -0.01 0.00 0.00 0.00 0.00 61.98 63.60 1zgw s VAL 100 Cb -0.38 -3.61 0.03 0.00 0.00 0.00 0.00 36.38 32.42 1zgw s VAL 100 CO 0.50 -0.61 -0.04 0.42 0.00 0.00 0.00 175.10 175.37 1zgw s THR 101 N -2.55 0.68 0.00 3.92 -4.23 -1.26 -4.95 115.64 107.26 1zgw s THR 101 Ca 0.61 -0.09 0.00 0.00 -1.18 0.00 0.00 61.69 61.03 1zgw s THR 101 Cb -0.12 -0.77 0.00 0.00 1.34 0.00 0.00 72.50 72.96 1zgw s THR 101 CO 0.32 0.31 0.00 0.18 -0.54 0.00 0.00 174.62 174.89 1zgw n LEU 102 N 4.93 1.13 -0.34 4.79 4.77 -1.26 -4.79 117.00 126.23 1zgw n LEU 102 Ca -0.11 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.04 1zgw n LEU 102 Cb 0.50 0.00 0.34 0.00 -2.33 0.00 0.00 43.42 41.93 1zgw n LEU 102 CO 0.15 0.15 0.85 -0.08 -1.33 0.00 0.00 177.39 177.12 1zgw h GLU 103 N 0.00 0.02 -0.53 3.23 4.81 -1.97 0.65 114.58 120.79 1zgw h GLU 103 Ca 0.00 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1zgw h GLU 103 Cb 0.44 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.80 1zgw h GLU 103 CO 0.00 0.01 0.25 0.00 -0.73 0.00 0.00 179.01 178.54 1zgw h ALA 104 N 1.97 0.68 -0.38 2.92 0.00 -1.99 0.14 119.26 122.61 1zgw h ALA 104 Ca 0.63 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 55.26 1zgw h ALA 104 Cb 1.38 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1zgw h ALA 104 CO -0.88 0.26 -0.36 1.25 0.00 0.00 0.00 179.25 179.51 1zgw h LEU 105 N 0.71 0.94 -0.46 0.00 6.46 -0.24 -1.51 115.31 121.22 1zgw h LEU 105 Ca 0.18 -0.42 -0.05 0.00 -0.12 0.00 0.00 57.88 57.47 1zgw h LEU 105 Cb 0.14 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 39.78 1zgw h LEU 105 CO -0.02 1.20 0.09 0.00 -0.62 0.00 0.00 178.44 179.08 1zgw h ALA 106 N 0.85 0.60 -0.11 1.25 0.00 -0.07 -1.87 119.26 119.92 1zgw h ALA 106 Ca 0.07 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 1zgw h ALA 106 Cb 0.94 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1zgw h ALA 106 CO 0.09 0.32 -0.40 -0.44 0.00 0.00 0.00 179.25 178.82 1zgw h ASP 107 N 0.62 0.24 -0.28 0.00 3.32 -0.66 0.21 116.42 119.86 1zgw h ASP 107 Ca 0.14 -0.10 -0.16 0.00 0.02 0.00 0.00 57.03 56.94 1zgw h ASP 107 Cb 0.36 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.85 1zgw h ASP 107 CO 0.01 0.62 -0.44 -0.61 -1.72 0.00 0.00 179.24 177.10 1zgw h GLN 108 N 0.20 0.79 0.00 3.56 4.15 -1.01 -3.16 115.11 119.63 1zgw h GLN 108 Ca 0.02 -0.47 0.00 0.00 0.77 0.00 0.00 58.65 58.96 1zgw h GLN 108 Cb 0.79 0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.53 1zgw h GLN 108 CO 0.06 1.10 -0.50 0.28 -1.93 0.00 0.00 178.83 177.84 1zgw n VAL 109 N -4.13 0.13 -2.02 2.39 0.31 -0.73 -4.94 118.33 109.35 1zgw n VAL 109 Ca -0.04 -0.10 -0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1zgw n VAL 109 Cb 0.56 0.04 -0.00 0.00 -0.91 0.00 0.00 33.84 33.53 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 -1.62 -0.01 -2.16 3.52 0.00 0.48 -5.05 120.51 115.66 1zgw n ALA 110 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.39 1zgw n ALA 110 Cb 0.37 -0.53 -0.10 0.00 0.00 0.00 0.00 19.45 19.19 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 -4.04 0.95 0.96 0.00 0.23 0.20 -5.01 119.30 112.60 1zgw s MET 111 Ca 0.00 -1.45 -0.13 0.00 -1.03 0.00 0.00 55.69 53.08 1zgw s MET 111 Cb -0.00 0.25 0.17 0.00 -1.53 0.00 0.00 34.83 33.71 1zgw s MET 111 CO 0.00 -0.27 1.13 -1.54 -2.03 0.00 0.00 175.02 172.31 1zgw s SER 112 N -3.05 3.01 0.37 -1.18 1.04 -1.26 -4.17 113.70 108.45 1zgw s SER 112 Ca 0.25 0.98 0.08 0.00 0.48 0.00 0.00 55.95 57.74 1zgw s SER 112 Cb 0.07 -1.55 0.73 0.00 0.10 0.00 0.00 66.02 65.37 1zgw s SER 112 CO 0.02 -2.87 1.91 1.55 0.98 0.00 0.00 173.24 174.84 1zgw h PRO 113 N -1.71 0.36 -0.34 4.02 0.13 -1.94 -1.40 132.00 131.11 1zgw h PRO 113 Ca -0.51 -0.07 -0.15 0.00 -0.87 0.00 0.00 66.00 64.39 1zgw h PRO 113 Cb 1.33 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 1zgw h PRO 113 CO 0.58 0.43 -0.39 0.74 -0.23 0.00 0.00 178.00 179.13 1zgw h PHE 114 N 0.34 0.97 0.00 1.56 -1.00 -2.00 -2.22 116.94 114.59 1zgw h PHE 114 Ca 0.07 -0.29 -0.07 0.00 2.81 0.00 0.00 57.97 60.50 1zgw h PHE 114 Cb 0.32 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 39.67 1zgw h PHE 114 CO 0.01 1.07 -0.32 1.25 -1.61 0.00 0.00 178.31 178.71 1zgw h HIS 115 N 0.67 0.00 -0.55 -0.55 2.76 -1.73 -1.38 115.15 114.36 1zgw h HIS 115 Ca 0.06 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.20 1zgw h HIS 115 Cb 0.95 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.89 1zgw h HIS 115 CO 0.05 0.32 0.24 1.25 -1.30 0.00 0.00 177.93 178.49 1zgw h LEU 116 N 0.00 0.74 -0.25 0.26 5.85 -0.88 0.21 115.31 121.23 1zgw h LEU 116 Ca -0.00 -0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.58 1zgw h LEU 116 Cb 0.78 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 1zgw h LEU 116 CO 0.04 0.70 0.12 0.45 -0.34 0.00 0.00 178.44 179.40 1zgw h HIS 117 N 0.75 0.22 -0.84 1.25 3.86 -0.92 0.39 115.15 119.85 1zgw h HIS 117 Ca 0.19 0.01 0.13 0.00 -1.16 0.00 0.00 60.37 59.53 1zgw h HIS 117 Cb 0.17 -0.06 -0.06 0.00 1.06 0.00 0.00 27.41 28.52 1zgw h HIS 117 CO 0.00 0.12 0.55 -0.09 0.86 0.00 0.00 177.93 179.37 1zgw h ARG 118 N 0.25 0.66 -0.04 2.45 9.65 -0.28 -1.34 114.38 125.73 1zgw h ARG 118 Ca 0.11 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 58.93 1zgw h ARG 118 Cb 0.04 -0.15 -0.00 0.00 -1.39 0.00 0.00 29.97 28.47 1zgw h ARG 118 CO -0.08 0.43 -0.03 1.25 2.80 0.00 0.00 179.97 184.34 1zgw h LEU 119 N 0.68 0.09 -1.26 3.80 7.12 0.62 -0.53 115.31 125.82 1zgw h LEU 119 Ca 0.41 -0.48 0.23 0.00 0.13 0.00 0.00 57.88 58.17 1zgw h LEU 119 Cb 0.63 -0.03 -0.09 0.00 -0.53 0.00 0.00 40.66 40.64 1zgw h LEU 119 CO -0.17 0.55 0.63 0.15 -0.13 0.00 0.00 178.44 179.47 1zgw h PHE 120 N -0.37 0.78 0.05 1.25 3.04 -0.03 0.19 116.94 121.85 1zgw h PHE 120 Ca 0.01 0.03 -0.25 0.00 3.98 0.00 0.00 57.97 61.73 1zgw h PHE 120 Cb 0.52 -0.23 0.01 0.00 2.56 0.00 0.00 35.95 38.81 1zgw h PHE 120 CO 0.09 0.13 -1.07 -0.22 -2.02 0.00 0.00 178.31 175.22 1zgw h LYS 121 N 0.52 0.44 0.42 1.11 3.64 -1.13 -1.19 116.57 120.38 1zgw h LYS 121 Ca 0.57 -0.54 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 1zgw h LYS 121 Cb 1.24 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 33.23 1zgw h LYS 121 CO -0.31 1.20 -0.20 0.00 -2.27 0.00 0.00 179.45 177.86 1zgw h ALA 122 N 0.60 -0.57 0.57 5.00 0.00 0.95 1.47 119.26 127.28 1zgw h ALA 122 Ca -0.12 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 1zgw h ALA 122 Cb 1.73 0.22 0.01 0.00 0.00 0.00 0.00 17.79 19.75 1zgw h ALA 122 CO 0.19 -0.79 -0.27 1.15 0.00 0.00 0.00 179.25 179.52 1zgw h THR 123 N -0.61 0.00 -0.87 0.00 2.02 -1.05 -2.96 112.91 109.43 1zgw h THR 123 Ca -0.06 -0.43 0.22 0.00 0.77 0.00 0.00 66.41 66.92 1zgw h THR 123 Cb 0.46 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 66.82 1zgw h THR 123 CO 0.09 0.00 0.60 0.00 0.37 0.00 0.00 175.52 176.58 1zgw h THR 124 N -1.19 0.62 0.00 3.16 1.03 -1.28 -3.46 112.91 111.79 1zgw h THR 124 Ca -0.08 -0.07 0.00 0.00 -0.01 0.00 0.00 66.41 66.26 1zgw h THR 124 Cb 0.58 0.42 0.00 0.00 -1.07 0.00 0.00 68.15 68.08 1zgw h THR 124 CO 0.13 0.04 0.00 0.61 -0.01 0.00 0.00 175.52 176.28 1zgw n GLY 125 N -1.61 3.08 2.70 2.99 0.00 0.50 -4.92 105.19 107.92 1zgw n GLY 125 Ca 0.18 -1.03 -0.07 0.00 0.00 0.00 0.00 46.02 45.11 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 1.21 -2.98 1.61 0.00 -0.79 -4.64 117.12 111.54 1zgw n MET 126 Ca 0.00 -1.76 0.03 0.00 0.00 0.00 0.00 57.70 55.96 1zgw n MET 126 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 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 -0.46 0.00 2.03 2.01 -1.26 -5.00 115.64 113.15 1zgw s THR 127 Ca 0.21 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.21 1zgw s THR 127 Cb 0.40 -0.13 0.00 0.00 0.01 0.00 0.00 72.50 72.78 1zgw s THR 127 CO -0.09 0.00 0.00 -0.81 -0.69 0.00 0.00 174.62 173.03 1zgw n PRO 128 N 4.28 0.00 0.31 4.92 -0.04 -1.26 -2.76 135.00 140.46 1zgw n PRO 128 Ca 0.08 0.00 0.18 0.00 -0.04 0.00 0.00 63.50 63.72 1zgw n PRO 128 Cb 0.60 0.00 1.04 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 -0.43 0.54 1.63 -1.93 -1.57 116.57 114.81 1zgw h LYS 129 Ca 0.00 0.00 -0.14 0.00 -0.85 0.00 0.00 60.65 59.66 1zgw h LYS 129 Cb 0.00 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.62 1zgw h LYS 129 CO 0.00 0.00 -0.30 0.00 -3.45 0.00 0.00 179.45 175.70 1zgw h ALA 130 N 2.00 0.66 -0.53 5.00 0.00 -1.95 -1.15 119.26 123.29 1zgw h ALA 130 Ca -0.00 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.42 1zgw h ALA 130 Cb 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1zgw h ALA 130 CO 0.00 0.67 0.05 2.35 0.00 0.00 0.00 179.25 182.33 1zgw h TRP 131 N 0.80 0.91 -0.35 0.00 -0.00 -1.10 0.79 115.95 117.00 1zgw h TRP 131 Ca 0.09 -0.12 -0.01 0.00 -0.00 0.00 0.00 58.89 58.85 1zgw h TRP 131 Cb 0.88 -0.25 -0.02 0.00 -0.00 0.00 0.00 29.16 29.77 1zgw h TRP 131 CO 0.06 0.81 0.17 0.37 -0.00 0.00 0.00 178.44 179.85 1zgw h GLN 132 N 0.81 0.51 -0.28 2.65 4.15 -1.30 -1.07 115.11 120.58 1zgw h GLN 132 Ca 0.16 -0.07 -0.03 0.00 0.77 0.00 0.00 58.65 59.48 1zgw h GLN 132 Cb 0.41 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 1zgw h GLN 132 CO 0.01 0.45 0.05 0.37 -1.93 0.00 0.00 178.83 177.79 1zgw h GLN 133 N 0.44 0.46 0.75 1.69 -0.00 -0.80 -2.14 115.11 115.51 1zgw h GLN 133 Ca 0.12 -0.12 -0.03 0.00 -0.00 0.00 0.00 58.65 58.62 1zgw h GLN 133 Cb 0.11 -0.06 -0.00 0.00 0.00 0.00 0.00 27.48 27.53 1zgw h GLN 133 CO -0.02 0.56 -0.45 0.00 0.00 0.00 0.00 178.83 178.93 1zgw h ALA 134 N 0.88 -1.16 -0.69 3.38 0.00 -0.68 0.13 119.26 121.12 1zgw h ALA 134 Ca 0.09 -0.23 0.15 0.00 0.00 0.00 0.00 54.91 54.91 1zgw h ALA 134 Cb 0.32 0.55 -0.13 0.00 0.00 0.00 0.00 17.79 18.54 1zgw h ALA 134 CO 0.00 -1.17 -0.10 -1.49 0.00 0.00 0.00 179.25 176.50 1zgw h TRP 135 N -1.13 -0.23 -0.38 0.00 -0.00 -1.22 0.58 115.95 113.57 1zgw h TRP 135 Ca -0.10 0.06 -0.00 0.00 -0.00 0.00 0.00 58.89 58.85 1zgw h TRP 135 Cb 0.90 0.21 -0.02 0.00 -0.00 0.00 0.00 29.16 30.25 1zgw h TRP 135 CO -0.09 -0.26 0.22 -0.09 -0.00 0.00 0.00 178.44 178.21 1zgw h ARG 136 N 0.04 0.51 0.00 0.49 2.43 -1.00 0.01 114.38 116.86 1zgw h ARG 136 Ca 0.35 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.37 1zgw h ARG 136 Cb 0.57 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.99 1zgw h ARG 136 CO -0.67 0.36 -0.51 0.00 -1.51 0.00 0.00 179.97 177.64 1zgw h ALA 137 N 1.73 0.97 0.00 2.80 0.00 0.29 -2.73 119.26 122.31 1zgw h ALA 137 Ca 0.14 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1zgw h ALA 137 Cb -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1zgw h ALA 137 CO -0.03 0.64 -0.61 -0.09 0.00 0.00 0.00 179.25 179.17 1zgw h ARG 138 N 0.00 0.00 -0.00 0.00 2.43 -0.26 -3.51 114.38 113.04 1zgw h ARG 138 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1zgw h ARG 138 Cb 1.02 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.57 1zgw h ARG 138 CO 0.07 0.00 0.00 -2.13 -1.51 0.00 0.00 179.97 176.40