#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zgq h VAL 7 N 0.00 0.92 -3.55 2.41 3.04 -1.99 -3.43 116.25 113.65 1zgq h VAL 7 Ca 0.00 -2.62 -0.71 0.00 -1.01 0.00 0.00 66.70 62.36 1zgq h VAL 7 Cb 0.00 2.62 -0.20 0.00 -2.01 0.00 0.00 31.29 31.70 1zgq h VAL 7 CO 0.00 0.78 -0.44 -0.63 -1.01 0.00 0.00 177.57 176.28 1zgq s ILE 8 N -2.59 5.26 0.93 3.17 1.01 -1.26 -5.03 121.20 122.69 1zgq s ILE 8 Ca -0.13 -0.54 -0.14 0.00 0.00 0.00 0.00 60.65 59.84 1zgq s ILE 8 Cb 0.07 -3.88 0.16 0.00 0.01 0.00 0.00 42.46 38.82 1zgq s ILE 8 CO 0.82 -0.24 1.21 -0.54 0.00 0.00 0.00 174.94 176.20 1zgq s LYS 9 N 1.70 0.96 0.44 2.79 1.02 -1.26 -4.97 119.74 120.41 1zgq s LYS 9 Ca 0.05 -0.05 0.16 0.00 0.02 0.00 0.00 55.97 56.15 1zgq s LYS 9 Cb -0.19 -1.85 0.98 0.00 -0.52 0.00 0.00 37.83 36.26 1zgq s LYS 9 CO 0.10 -2.25 1.95 1.49 -0.92 0.00 0.00 175.35 175.72 1zgq h GLU 10 N -1.53 0.00 -4.48 1.68 4.57 -1.98 -3.41 114.58 109.44 1zgq h GLU 10 Ca -0.46 0.00 -0.53 0.00 -1.18 0.00 0.00 59.36 57.19 1zgq h GLU 10 Cb 1.29 0.00 -0.35 0.00 -0.16 0.00 0.00 28.75 29.54 1zgq h GLU 10 CO 0.52 0.23 -0.81 0.12 -1.18 0.00 0.00 179.01 177.88 1zgq s PHE 11 N -4.42 1.55 0.01 0.92 5.36 -1.26 -4.08 117.98 116.06 1zgq s PHE 11 Ca -0.03 -0.67 0.02 0.00 -0.96 0.00 0.00 56.93 55.29 1zgq s PHE 11 Cb 0.15 -1.18 -0.01 0.00 -0.34 0.00 0.00 43.02 41.64 1zgq s PHE 11 CO 0.69 -0.39 -0.07 -1.64 -1.46 0.00 0.00 175.22 172.35 1zgq s MET 12 N 1.05 0.55 0.24 10.12 -1.94 -0.75 -5.03 119.30 123.55 1zgq s MET 12 Ca -0.07 -0.35 0.07 0.00 -1.71 0.00 0.00 55.69 53.64 1zgq s MET 12 Cb -0.15 -0.50 -0.04 0.00 2.01 0.00 0.00 34.83 36.15 1zgq s MET 12 CO -0.01 0.13 0.13 1.03 -0.01 0.00 0.00 175.02 176.29 1zgq s ARG 13 N -0.43 2.75 0.03 2.03 0.52 -1.26 -1.76 118.95 120.83 1zgq s ARG 13 Ca 0.01 -1.11 -0.06 0.00 -0.52 0.00 0.00 55.73 54.05 1zgq s ARG 13 Cb -0.04 -2.47 -0.01 0.00 0.52 0.00 0.00 34.95 32.95 1zgq s ARG 13 CO -0.00 0.41 0.10 -0.59 0.02 0.00 0.00 175.30 175.24 1zgq s PHE 14 N -2.09 0.18 -0.05 -0.53 -0.12 0.68 -1.61 117.98 114.44 1zgq s PHE 14 Ca 0.32 -0.46 0.05 0.00 -0.05 0.00 0.00 56.93 56.79 1zgq s PHE 14 Cb -0.08 -0.13 -0.01 0.00 -0.63 0.00 0.00 43.02 42.18 1zgq s PHE 14 CO 0.23 -0.36 -0.21 0.15 -0.05 0.00 0.00 175.22 174.98 1zgq s LYS 15 N -2.49 2.13 0.01 1.99 1.02 -0.30 0.07 119.74 122.18 1zgq s LYS 15 Ca -0.06 -0.76 0.03 0.00 0.02 0.00 0.00 55.97 55.20 1zgq s LYS 15 Cb -0.02 -1.84 -0.01 0.00 -0.52 0.00 0.00 37.83 35.44 1zgq s LYS 15 CO -0.04 0.32 -0.09 0.54 -0.92 0.00 0.00 175.35 175.16 1zgq s VAL 16 N -0.09 0.69 -0.03 3.17 0.11 -0.14 -0.65 120.40 123.46 1zgq s VAL 16 Ca -0.03 -0.53 0.01 0.00 -2.93 0.00 0.00 61.98 58.50 1zgq s VAL 16 Cb -0.12 -0.61 0.02 0.00 -1.53 0.00 0.00 36.38 34.14 1zgq s VAL 16 CO 0.03 0.09 -0.02 -0.60 -3.33 0.00 0.00 175.10 171.26 1zgq s ARG 17 N -0.50 0.48 -0.06 1.54 3.52 -0.70 0.03 118.95 123.27 1zgq s ARG 17 Ca 0.01 -0.01 0.05 0.00 -0.13 0.00 0.00 55.73 55.66 1zgq s ARG 17 Cb -0.05 -0.58 -0.01 0.00 -1.56 0.00 0.00 34.95 32.75 1zgq s ARG 17 CO 0.00 -0.09 -0.22 1.41 -0.81 0.00 0.00 175.30 175.59 1zgq s MET 18 N 0.87 2.38 -0.23 5.12 -2.45 0.49 -0.52 119.30 124.95 1zgq s MET 18 Ca -0.10 -0.80 0.01 0.00 -1.25 0.00 0.00 55.69 53.55 1zgq s MET 18 Cb -0.13 -1.98 0.04 0.00 1.25 0.00 0.00 34.83 34.00 1zgq s MET 18 CO -0.01 0.30 -0.12 -1.21 1.05 0.00 0.00 175.02 175.03 1zgq s GLU 19 N 0.01 2.68 0.27 4.11 2.02 -0.54 -0.77 118.70 126.48 1zgq s GLU 19 Ca -0.07 -1.06 0.02 0.00 0.02 0.00 0.00 54.97 53.89 1zgq s GLU 19 Cb -0.14 -2.84 -0.04 0.00 0.10 0.00 0.00 34.13 31.21 1zgq s GLU 19 CO 0.04 -0.40 0.15 0.20 0.02 0.00 0.00 175.26 175.27 1zgq s GLY 20 N 1.24 1.86 -0.15 -1.39 0.00 -0.10 -1.92 107.32 106.86 1zgq s GLY 20 Ca -0.01 -1.79 -0.07 0.00 0.00 0.00 0.00 44.72 42.85 1zgq s GLY 20 CO -0.07 -1.52 0.33 -1.59 0.00 0.00 0.00 173.10 170.24 1zgq s THR 21 N -3.77 -0.22 -0.10 0.90 2.01 -0.51 -1.18 115.64 112.77 1zgq s THR 21 Ca 0.37 0.16 -0.01 0.00 0.31 0.00 0.00 61.69 62.53 1zgq s THR 21 Cb 0.06 -0.51 0.03 0.00 0.01 0.00 0.00 72.50 72.08 1zgq s THR 21 CO 0.16 0.07 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.42 1zgq s VAL 22 N 1.78 0.83 -1.29 3.82 1.01 -0.86 0.38 120.40 126.07 1zgq s VAL 22 Ca -0.06 -0.17 -0.07 0.00 0.00 0.00 0.00 61.98 61.68 1zgq s VAL 22 Cb -0.10 -0.88 0.05 0.00 0.00 0.00 0.00 36.38 35.44 1zgq s VAL 22 CO -0.11 0.33 0.44 0.59 0.00 0.00 0.00 175.10 176.36 1zgq n ASN 23 N 4.94 -4.10 0.00 3.32 4.13 -0.57 -1.08 115.26 121.91 1zgq n ASN 23 Ca -0.12 -0.29 0.00 0.00 1.68 0.00 0.00 54.58 55.86 1zgq n ASN 23 Cb 0.50 -3.38 0.00 0.00 -1.54 0.00 0.00 39.78 35.36 1zgq n ASN 23 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1zgq n GLY 24 N -1.17 1.53 3.62 7.41 0.00 -1.26 -5.04 105.19 110.27 1zgq n GLY 24 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 1zgq n GLY 24 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1zgq s HIS 25 N -2.38 3.16 0.03 1.61 5.04 -0.24 -5.04 115.29 117.48 1zgq s HIS 25 Ca 0.00 0.88 -0.22 0.00 -1.54 0.00 0.00 55.06 54.18 1zgq s HIS 25 Cb 0.00 -3.42 -0.06 0.00 0.04 0.00 0.00 32.58 29.14 1zgq s HIS 25 CO 0.00 -0.67 0.65 -1.21 -2.34 0.00 0.00 174.74 171.17 1zgq s GLU 26 N 3.23 4.37 0.11 2.88 2.02 -1.26 -2.04 118.70 128.01 1zgq s GLU 26 Ca 0.36 0.85 -0.10 0.00 0.02 0.00 0.00 54.97 56.11 1zgq s GLU 26 Cb -0.13 -3.33 0.00 0.00 0.10 0.00 0.00 34.13 30.77 1zgq s GLU 26 CO 0.15 0.39 0.25 -0.59 0.02 0.00 0.00 175.26 175.47 1zgq s PHE 27 N -0.32 0.13 -0.02 1.61 -0.12 -0.33 -4.28 117.98 114.65 1zgq s PHE 27 Ca 0.33 -0.53 0.01 0.00 -0.05 0.00 0.00 56.93 56.70 1zgq s PHE 27 Cb -0.19 0.00 0.01 0.00 -0.63 0.00 0.00 43.02 42.21 1zgq s PHE 27 CO 0.20 -0.60 -0.03 -1.21 -0.05 0.00 0.00 175.22 173.52 1zgq s GLU 28 N -3.87 0.39 -0.02 1.99 2.02 -0.62 -0.92 118.70 117.67 1zgq s GLU 28 Ca 0.07 -0.07 0.04 0.00 0.02 0.00 0.00 54.97 55.03 1zgq s GLU 28 Cb 0.04 -0.44 -0.01 0.00 0.10 0.00 0.00 34.13 33.82 1zgq s GLU 28 CO -0.09 -0.01 -0.14 0.42 0.02 0.00 0.00 175.26 175.46 1zgq s ILE 29 N 0.39 1.14 -0.02 -1.63 1.01 0.05 -1.38 121.20 120.76 1zgq s ILE 29 Ca -0.04 -0.60 0.05 0.00 0.00 0.00 0.00 60.65 60.06 1zgq s ILE 29 Cb -0.07 -0.96 -0.01 0.00 0.01 0.00 0.00 42.46 41.42 1zgq s ILE 29 CO -0.01 0.33 -0.18 -1.61 0.00 0.00 0.00 174.94 173.47 1zgq s GLU 30 N -0.22 1.57 0.18 2.79 2.02 -0.30 -0.38 118.70 124.37 1zgq s GLU 30 Ca 0.03 -0.64 -0.11 0.00 0.02 0.00 0.00 54.97 54.27 1zgq s GLU 30 Cb -0.07 -1.47 -0.00 0.00 0.10 0.00 0.00 34.13 32.69 1zgq s GLU 30 CO -0.00 0.35 0.36 0.20 0.02 0.00 0.00 175.26 176.19 1zgq s GLY 31 N -0.30 0.37 -0.02 -1.39 0.00 0.11 -0.70 107.32 105.38 1zgq s GLY 31 Ca 0.04 -0.75 0.01 0.00 0.00 0.00 0.00 44.72 44.02 1zgq s GLY 31 CO 0.00 -0.69 -0.02 1.85 0.00 0.00 0.00 173.10 174.24 1zgq s GLU 32 N -3.96 0.44 0.29 2.90 2.12 -0.73 -0.97 118.70 118.78 1zgq s GLU 32 Ca 0.16 -0.04 0.03 0.00 0.36 0.00 0.00 54.97 55.48 1zgq s GLU 32 Cb 0.02 -0.52 -0.04 0.00 0.26 0.00 0.00 34.13 33.85 1zgq s GLU 32 CO 0.01 -0.05 0.17 0.20 -0.54 0.00 0.00 175.26 175.04 1zgq s GLY 33 N 0.64 1.97 0.17 -1.50 0.00 0.11 -1.36 107.32 107.36 1zgq s GLY 33 Ca -0.07 -1.80 -0.22 0.00 0.00 0.00 0.00 44.72 42.64 1zgq s GLY 33 CO -0.01 -1.53 0.59 -1.83 0.00 0.00 0.00 173.10 170.31 1zgq s GLU 34 N -3.84 1.33 0.00 2.90 -1.05 -0.57 -0.23 118.70 117.24 1zgq s GLU 34 Ca 0.37 -0.59 0.00 0.00 -0.15 0.00 0.00 54.97 54.60 1zgq s GLU 34 Cb 0.05 0.57 0.00 0.00 -0.44 0.00 0.00 34.13 34.31 1zgq s GLU 34 CO 0.18 -0.58 0.00 0.41 0.95 0.00 0.00 175.26 176.22 1zgq n GLY 35 N -0.37 -1.59 3.10 -3.83 0.00 -0.72 -0.13 105.19 101.64 1zgq n GLY 35 Ca -0.15 -1.06 -0.35 0.00 0.00 0.00 0.00 46.02 44.46 1zgq n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1zgq s ARG 36 N -1.47 1.92 0.40 1.61 0.52 -0.50 -1.80 118.95 119.62 1zgq s ARG 36 Ca 0.00 -1.78 0.17 0.00 -0.52 0.00 0.00 55.73 53.60 1zgq s ARG 36 Cb 0.00 -3.46 1.07 0.00 0.52 0.00 0.00 34.95 33.08 1zgq s ARG 36 CO 0.00 -1.00 1.81 -1.35 0.02 0.00 0.00 175.30 174.78 1zgq h PRO 37 N 7.94 0.42 -0.00 3.54 0.11 -1.82 -1.63 132.00 140.56 1zgq h PRO 37 Ca -0.12 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.97 1zgq h PRO 37 Cb 1.04 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1zgq h PRO 37 CO 0.64 0.28 -0.42 0.66 -0.21 0.00 0.00 178.00 178.95 1zgq n TYR 38 N -4.57 0.00 0.77 0.65 4.02 -1.26 -4.03 117.16 112.73 1zgq n TYR 38 Ca 0.22 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 58.19 1zgq n TYR 38 Cb 0.77 -0.19 -0.08 0.00 -0.02 0.00 0.00 39.34 39.82 1zgq n TYR 38 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1zgq n GLU 39 N -1.14 1.64 -2.47 -0.72 1.02 -0.65 -4.77 120.64 113.55 1zgq n GLU 39 Ca 0.08 -0.11 -0.05 0.00 -0.02 0.00 0.00 57.16 57.07 1zgq n GLU 39 Cb 0.34 -1.27 0.01 0.00 -0.02 0.00 0.00 31.44 30.50 1zgq n GLU 39 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1zgq n GLY 40 N 1.36 0.44 3.30 0.62 0.00 -1.00 -4.81 105.19 105.11 1zgq n GLY 40 Ca 0.04 -0.57 -0.13 0.00 0.00 0.00 0.00 46.02 45.36 1zgq n GLY 40 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1zgq s HIS 41 N -2.72 -0.43 0.09 1.61 -3.43 -1.23 -0.68 115.29 108.50 1zgq s HIS 41 Ca 0.08 1.02 -0.11 0.00 -0.80 0.00 0.00 55.06 55.25 1zgq s HIS 41 Cb -0.03 0.15 0.01 0.00 -1.43 0.00 0.00 32.58 31.28 1zgq s HIS 41 CO 0.09 -0.24 0.25 0.54 -2.00 0.00 0.00 174.74 173.38 1zgq s ASN 42 N 0.03 0.02 0.19 7.38 6.03 -0.77 -1.41 114.94 126.40 1zgq s ASN 42 Ca -0.02 -0.53 0.08 0.00 -1.03 0.00 0.00 52.86 51.36 1zgq s ASN 42 Cb -0.03 0.37 -0.04 0.00 -3.03 0.00 0.00 41.25 38.52 1zgq s ASN 42 CO 0.01 -0.75 -0.15 0.42 -2.03 0.00 0.00 177.10 174.60 1zgq s THR 43 N -3.73 1.70 -0.20 0.54 -4.23 0.81 -1.59 115.64 108.94 1zgq s THR 43 Ca 0.04 -2.09 -0.16 0.00 -1.18 0.00 0.00 61.69 58.29 1zgq s THR 43 Cb 0.04 -1.94 0.06 0.00 1.34 0.00 0.00 72.50 71.99 1zgq s THR 43 CO -0.11 -0.52 0.52 0.54 -0.54 0.00 0.00 174.62 174.52 1zgq s VAL 44 N -2.68 -0.01 -0.19 2.29 0.11 -0.65 -1.52 120.40 117.76 1zgq s VAL 44 Ca 0.19 0.02 -0.03 0.00 -2.93 0.00 0.00 61.98 59.23 1zgq s VAL 44 Cb -0.02 -0.74 -0.01 0.00 -1.53 0.00 0.00 36.38 34.07 1zgq s VAL 44 CO 0.06 0.01 -0.06 -0.75 -3.33 0.00 0.00 175.10 171.03 1zgq s LYS 45 N 0.66 3.43 0.06 1.54 2.20 -0.46 -0.74 119.74 126.42 1zgq s LYS 45 Ca -0.03 -0.62 0.07 0.00 -0.36 0.00 0.00 55.97 55.03 1zgq s LYS 45 Cb -0.05 -2.91 -0.04 0.00 -1.51 0.00 0.00 37.83 33.33 1zgq s LYS 45 CO -0.04 -0.02 -0.14 -0.51 -0.36 0.00 0.00 175.35 174.27 1zgq s LEU 46 N 1.02 2.81 -0.06 5.43 2.01 0.14 -1.78 118.68 128.24 1zgq s LEU 46 Ca 0.00 -0.39 0.01 0.00 0.01 0.00 0.00 54.13 53.76 1zgq s LEU 46 Cb -0.15 -1.64 0.02 0.00 0.01 0.00 0.00 46.19 44.44 1zgq s LEU 46 CO -0.00 0.23 -0.06 -0.54 1.01 0.00 0.00 176.35 176.99 1zgq s LYS 47 N -1.72 1.14 -0.54 1.70 1.02 0.12 -1.12 119.74 120.35 1zgq s LYS 47 Ca 0.17 -0.18 -0.27 0.00 0.02 0.00 0.00 55.97 55.70 1zgq s LYS 47 Cb -0.11 -1.13 0.03 0.00 -0.52 0.00 0.00 37.83 36.10 1zgq s LYS 47 CO 0.08 -0.11 1.11 0.08 -0.92 0.00 0.00 175.35 175.59 1zgq s VAL 48 N 1.12 4.17 -0.24 3.17 1.01 0.08 -1.15 120.40 128.56 1zgq s VAL 48 Ca -0.07 0.86 0.20 0.00 0.00 0.00 0.00 61.98 62.96 1zgq s VAL 48 Cb -0.14 -4.64 0.06 0.00 0.00 0.00 0.00 36.38 31.66 1zgq s VAL 48 CO -0.01 -1.18 1.21 0.71 0.00 0.00 0.00 175.10 175.83 1zgq h THR 49 N 6.15 0.31 -2.81 3.92 1.35 -1.55 -3.44 112.91 116.83 1zgq h THR 49 Ca -0.25 -1.51 -0.12 0.00 -0.55 0.00 0.00 66.41 63.98 1zgq h THR 49 Cb 1.06 1.95 -0.23 0.00 -1.73 0.00 0.00 68.15 69.21 1zgq h THR 49 CO 1.14 0.18 -0.23 -0.75 -0.25 0.00 0.00 175.52 175.61 1zgq s LYS 50 N -3.13 0.56 0.00 4.72 2.20 -1.08 -4.90 119.74 118.10 1zgq s LYS 50 Ca 0.02 0.31 0.00 0.00 -0.36 0.00 0.00 55.97 55.93 1zgq s LYS 50 Cb 0.08 0.26 0.00 0.00 -1.51 0.00 0.00 37.83 36.66 1zgq s LYS 50 CO 0.76 -0.11 0.00 0.41 -0.36 0.00 0.00 175.35 176.05 1zgq n GLY 51 N 2.27 0.47 3.84 5.54 0.00 -1.26 -1.58 105.19 114.47 1zgq n GLY 51 Ca -0.16 -0.52 -0.36 0.00 0.00 0.00 0.00 46.02 44.98 1zgq n GLY 51 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1zgq s GLY 52 N -2.48 2.49 0.35 -0.02 0.00 -1.26 -3.97 107.32 102.43 1zgq s GLY 52 Ca 0.00 -0.08 -0.20 0.00 0.00 0.00 0.00 44.72 44.45 1zgq s GLY 52 CO 0.00 0.22 0.85 2.56 0.00 0.00 0.00 173.10 176.73 1zgq s PRO 53 N -1.90 4.21 0.13 2.90 0.04 -1.26 -5.13 135.00 134.00 1zgq s PRO 53 Ca 0.38 0.97 -0.31 0.00 0.04 0.00 0.00 61.00 62.08 1zgq s PRO 53 Cb -0.16 -2.46 -0.08 0.00 0.04 0.00 0.00 34.50 31.85 1zgq s PRO 53 CO 0.19 0.14 1.39 -0.51 0.04 0.00 0.00 177.00 178.26 1zgq s LEU 54 N -2.77 4.38 -0.05 -3.56 1.43 -1.25 -4.93 118.68 111.92 1zgq s LEU 54 Ca 0.55 2.37 0.04 0.00 -1.03 0.00 0.00 54.13 56.06 1zgq s LEU 54 Cb -0.12 -3.59 0.21 0.00 0.03 0.00 0.00 46.19 42.72 1zgq s LEU 54 CO 0.17 -0.65 0.89 -0.81 0.23 0.00 0.00 176.35 176.18 1zgq n PRO 55 N 3.75 1.92 -4.17 1.29 -0.04 -1.26 -4.87 135.00 131.61 1zgq n PRO 55 Ca 0.11 -0.81 -0.11 0.00 -0.04 0.00 0.00 63.50 62.65 1zgq n PRO 55 Cb 0.42 -1.60 -0.10 0.00 -0.04 0.00 0.00 33.50 32.19 1zgq n PRO 55 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1zgq s PHE 56 N -1.52 1.03 0.09 0.54 -0.12 -1.26 -4.67 117.98 112.06 1zgq s PHE 56 Ca 0.14 -1.29 -0.31 0.00 -0.05 0.00 0.00 56.93 55.42 1zgq s PHE 56 Cb 0.10 -0.49 -0.09 0.00 -0.63 0.00 0.00 43.02 41.91 1zgq s PHE 56 CO 0.05 -0.63 1.73 0.00 -0.05 0.00 0.00 175.22 176.33 1zgq s ALA 57 N -4.12 3.71 0.34 1.99 0.00 0.01 -4.90 121.76 118.79 1zgq s ALA 57 Ca 0.34 1.30 0.03 0.00 0.00 0.00 0.00 51.96 53.62 1zgq s ALA 57 Cb 0.07 -3.73 0.63 0.00 0.00 0.00 0.00 23.12 20.09 1zgq s ALA 57 CO 0.09 -1.18 1.98 2.35 0.00 0.00 0.00 175.76 179.00 1zgq h TRP 58 N 8.55 0.85 -1.27 0.00 2.91 -1.95 -3.16 115.95 121.88 1zgq h TRP 58 Ca -0.44 0.02 0.37 0.00 1.13 0.00 0.00 58.89 59.97 1zgq h TRP 58 Cb 1.21 -0.28 -0.08 0.00 -0.51 0.00 0.00 29.16 29.50 1zgq h TRP 58 CO 0.79 0.50 0.88 -0.44 -1.03 0.00 0.00 178.44 179.14 1zgq h ASP 59 N 0.88 0.15 1.11 2.65 3.32 -1.94 0.30 116.42 122.89 1zgq h ASP 59 Ca 0.29 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.38 1zgq h ASP 59 Cb 0.04 0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.62 1zgq h ASP 59 CO -0.08 -0.01 0.00 0.16 -1.72 0.00 0.00 179.24 177.59 1zgq h ILE 60 N 0.11 0.00 0.00 0.35 3.07 -1.96 -2.98 117.51 116.10 1zgq h ILE 60 Ca 0.66 -0.55 -0.21 0.00 1.55 0.00 0.00 64.86 66.31 1zgq h ILE 60 Cb 2.32 1.55 -0.04 0.00 -0.27 0.00 0.00 36.82 40.38 1zgq h ILE 60 CO -0.14 0.00 -1.68 0.18 -1.05 0.00 0.00 178.15 175.46 1zgq n LEU 61 N -3.08 0.64 -0.31 0.16 4.77 0.08 -4.52 117.00 114.74 1zgq n LEU 61 Ca 0.01 0.28 0.10 0.00 -0.03 0.00 0.00 56.01 56.38 1zgq n LEU 61 Cb 0.32 0.15 0.27 0.00 -2.33 0.00 0.00 43.42 41.84 1zgq n LEU 61 CO 0.28 0.23 1.09 0.77 -1.33 0.00 0.00 177.39 178.43 1zgq h SER 62 N 0.00 0.49 -0.11 -1.43 4.64 -1.35 -1.79 113.55 114.01 1zgq h SER 62 Ca -0.23 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 1zgq h SER 62 Cb 1.71 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.85 1zgq h SER 62 CO 0.04 0.14 0.00 -2.65 -0.87 0.00 0.00 176.83 173.50 1zgq n PRO 63 N -4.92 1.56 0.00 4.77 -0.02 -1.26 -3.30 135.00 131.83 1zgq n PRO 63 Ca 0.20 -0.51 0.08 0.00 -2.02 0.00 0.00 63.50 61.24 1zgq n PRO 63 Cb 0.54 -1.49 0.01 0.00 -0.02 0.00 0.00 33.50 32.54 1zgq n PRO 63 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1zgq n GLN 64 N 0.04 1.64 -2.38 -0.52 1.13 -0.67 -4.90 117.38 111.73 1zgq n GLN 64 Ca 0.05 -0.88 -0.40 0.00 -1.94 0.00 0.00 57.00 53.82 1zgq n GLN 64 Cb 0.33 -1.28 0.03 0.00 0.11 0.00 0.00 30.24 29.43 1zgq n GLN 64 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 1zgq n PHE 65 N -0.00 2.86 0.00 1.08 3.01 -1.21 -4.98 117.46 118.23 1zgq n PHE 65 Ca 0.07 -2.49 0.00 0.00 1.01 0.00 0.00 57.45 56.04 1zgq n PHE 65 Cb 0.34 -1.18 0.00 0.00 -0.01 0.00 0.00 39.48 38.63 1zgq n PHE 65 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1zgq n SER 69 N -0.24 0.00 0.00 4.37 2.88 -1.26 -5.06 113.62 114.31 1zgq n SER 69 Ca 0.49 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 58.12 1zgq n SER 69 Cb 0.25 0.00 0.49 0.00 -0.75 0.00 0.00 64.21 64.20 1zgq n SER 69 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1zgq n LYS 70 N 0.00 0.57 0.14 -1.46 4.76 -1.26 -2.03 118.16 118.88 1zgq n LYS 70 Ca 0.00 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.57 1zgq n LYS 70 Cb 0.00 -1.45 0.40 0.00 -1.84 0.00 0.00 35.03 32.14 1zgq n LYS 70 CO 0.00 0.00 0.00 -0.24 -1.37 0.00 0.00 177.40 175.79 1zgq h VAL 71 N 0.00 0.00 -0.13 -0.18 3.04 -1.97 -2.93 116.25 114.08 1zgq h VAL 71 Ca 0.00 -0.52 0.00 0.00 -1.01 0.00 0.00 66.70 65.17 1zgq h VAL 71 Cb 0.00 1.47 0.00 0.00 -2.01 0.00 0.00 31.29 30.75 1zgq h VAL 71 CO 0.00 0.00 0.00 -1.22 -1.01 0.00 0.00 177.57 175.34 1zgq n TYR 72 N -2.44 0.17 -2.56 3.17 4.02 -0.86 -4.78 117.16 113.88 1zgq n TYR 72 Ca 0.04 -0.08 -0.43 0.00 -0.01 0.00 0.00 57.90 57.43 1zgq n TYR 72 Cb 0.40 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.70 1zgq n TYR 72 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1zgq s VAL 73 N -1.83 4.49 -0.07 -0.72 1.01 -1.11 -3.41 120.40 118.75 1zgq s VAL 73 Ca 0.28 1.79 -0.30 0.00 0.00 0.00 0.00 61.98 63.75 1zgq s VAL 73 Cb 0.14 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 1zgq s VAL 73 CO 0.22 -0.04 1.34 -0.75 0.00 0.00 0.00 175.10 175.88 1zgq s LYS 74 N 2.41 4.27 -0.04 2.72 2.20 -1.07 -4.83 119.74 125.40 1zgq s LYS 74 Ca 0.52 1.83 0.05 0.00 -0.36 0.00 0.00 55.97 58.01 1zgq s LYS 74 Cb -0.21 -3.68 -0.02 0.00 -1.51 0.00 0.00 37.83 32.41 1zgq s LYS 74 CO 0.18 -0.62 -0.20 -1.01 -0.36 0.00 0.00 175.35 173.33 1zgq s HIS 75 N 2.91 2.52 0.92 4.03 3.76 -1.26 0.10 115.29 128.28 1zgq s HIS 75 Ca 0.60 -0.38 -0.12 0.00 -0.15 0.00 0.00 55.06 55.01 1zgq s HIS 75 Cb -0.27 -1.59 0.14 0.00 1.11 0.00 0.00 32.58 31.98 1zgq s HIS 75 CO 0.22 0.01 1.10 -2.14 -0.85 0.00 0.00 174.74 173.08 1zgq s PRO 76 N -0.54 1.05 0.41 8.40 0.02 -1.26 -4.94 135.00 138.15 1zgq s PRO 76 Ca 0.07 0.68 0.08 0.00 0.02 0.00 0.00 61.00 61.85 1zgq s PRO 76 Cb -0.11 -1.80 0.87 0.00 0.02 0.00 0.00 34.50 33.48 1zgq s PRO 76 CO 0.01 -2.34 2.03 0.00 -0.33 0.00 0.00 177.00 176.36 1zgq h ALA 77 N -1.62 1.68 -0.00 -1.55 0.00 -2.00 -2.84 119.26 112.93 1zgq h ALA 77 Ca -0.51 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1zgq h ALA 77 Cb 1.30 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1zgq h ALA 77 CO 0.56 0.27 -0.06 -0.40 0.00 0.00 0.00 179.25 179.63 1zgq n ASP 78 N -4.44 0.23 -4.20 0.00 5.75 -1.26 -4.64 116.55 108.00 1zgq n ASP 78 Ca 0.02 -0.41 -0.36 0.00 -0.01 0.00 0.00 54.79 54.03 1zgq n ASP 78 Cb 0.11 -0.16 -0.13 0.00 -1.03 0.00 0.00 41.12 39.90 1zgq n ASP 78 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1zgq s ILE 79 N -2.49 3.17 0.06 2.12 1.01 -1.07 -5.02 121.20 118.98 1zgq s ILE 79 Ca 0.30 -1.29 -0.34 0.00 0.00 0.00 0.00 60.65 59.32 1zgq s ILE 79 Cb 0.20 -2.80 -0.13 0.00 0.01 0.00 0.00 42.46 39.75 1zgq s ILE 79 CO 0.46 -0.10 1.74 -2.65 0.00 0.00 0.00 174.94 174.39 1zgq n PRO 80 N 4.67 2.26 -2.81 2.79 -0.02 -1.26 -4.54 135.00 136.09 1zgq n PRO 80 Ca -0.13 0.82 -0.44 0.00 -2.02 0.00 0.00 63.50 61.73 1zgq n PRO 80 Cb 0.44 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 1zgq n PRO 80 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1zgq n ASP 81 N 5.04 5.19 -0.28 2.55 -0.08 -1.26 -4.41 116.55 123.31 1zgq n ASP 81 Ca 0.19 -3.01 0.09 0.00 -1.51 0.00 0.00 54.79 50.55 1zgq n ASP 81 Cb 0.30 -1.55 0.22 0.00 2.34 0.00 0.00 41.12 42.42 1zgq n ASP 81 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 1zgq h TYR 82 N 6.83 0.14 -0.29 -0.67 3.20 -1.91 -1.11 116.97 123.16 1zgq h TYR 82 Ca 0.34 0.05 -0.09 0.00 3.14 0.00 0.00 58.73 62.17 1zgq h TYR 82 Cb 0.82 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 39.14 1zgq h TYR 82 CO 1.14 -0.22 -0.20 0.87 -1.64 0.00 0.00 178.16 178.12 1zgq h LYS 83 N 0.16 0.54 0.03 1.82 1.57 -1.91 -2.17 116.57 116.60 1zgq h LYS 83 Ca 0.47 -0.19 -0.26 0.00 -1.87 0.00 0.00 60.65 58.80 1zgq h LYS 83 Cb 0.89 -0.04 0.02 0.00 0.08 0.00 0.00 32.23 33.17 1zgq h LYS 83 CO -0.65 0.71 -1.06 0.87 -0.57 0.00 0.00 179.45 178.75 1zgq h LYS 84 N 0.49 0.60 0.00 3.15 1.57 -1.66 -3.22 116.57 117.49 1zgq h LYS 84 Ca 0.08 -0.68 -0.01 0.00 -1.87 0.00 0.00 60.65 58.17 1zgq h LYS 84 Cb 0.61 0.20 -0.00 0.00 0.08 0.00 0.00 32.23 33.12 1zgq h LYS 84 CO 0.04 1.28 -0.06 -0.07 -0.57 0.00 0.00 179.45 180.07 1zgq h LEU 85 N 0.32 0.00 -1.13 2.94 3.38 -1.11 -2.79 115.31 116.93 1zgq h LEU 85 Ca -0.13 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 1zgq h LEU 85 Cb 1.71 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.46 1zgq h LEU 85 CO 0.20 0.06 -0.02 0.77 0.09 0.00 0.00 178.44 179.54 1zgq h SER 86 N 0.00 0.00 -4.23 -0.43 4.64 -1.40 -3.46 113.55 108.68 1zgq h SER 86 Ca -0.00 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.84 1zgq h SER 86 Cb 0.35 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.47 1zgq h SER 86 CO 0.01 0.02 0.38 -0.36 -0.87 0.00 0.00 176.83 176.01 1zgq s PHE 87 N -3.57 3.50 0.55 4.77 0.40 -1.06 -0.92 117.98 121.66 1zgq s PHE 87 Ca 0.02 1.41 0.35 0.00 -0.60 0.00 0.00 56.93 58.11 1zgq s PHE 87 Cb 0.08 -2.77 1.93 0.00 0.51 0.00 0.00 43.02 42.77 1zgq s PHE 87 CO 0.58 -0.45 2.24 -1.00 0.70 0.00 0.00 175.22 177.29 1zgq h PRO 88 N 0.59 0.00 -0.23 0.24 0.13 -1.88 -3.45 132.00 127.40 1zgq h PRO 88 Ca -0.46 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1zgq h PRO 88 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 1zgq h PRO 88 CO 0.62 0.03 0.14 0.93 -0.23 0.00 0.00 178.00 179.48 1zgq h GLU 89 N 0.00 0.32 0.00 0.86 3.07 -1.92 -3.33 114.58 113.58 1zgq h GLU 89 Ca -0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 1zgq h GLU 89 Cb 0.10 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 1zgq h GLU 89 CO 0.00 0.26 0.00 0.41 -1.40 0.00 0.00 179.01 178.29 1zgq n GLY 90 N -1.01 -1.75 3.24 -3.84 0.00 -0.10 -4.57 105.19 97.15 1zgq n GLY 90 Ca -0.03 -2.01 -0.10 0.00 0.00 0.00 0.00 46.02 43.89 1zgq n GLY 90 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1zgq s PHE 91 N 0.00 0.76 0.02 1.61 -0.12 -0.85 -1.73 117.98 117.66 1zgq s PHE 91 Ca 0.00 -1.10 0.08 0.00 -0.05 0.00 0.00 56.93 55.86 1zgq s PHE 91 Cb 0.00 -0.34 -0.03 0.00 -0.63 0.00 0.00 43.02 42.03 1zgq s PHE 91 CO 0.00 -0.62 -0.25 0.15 -0.05 0.00 0.00 175.22 174.45 1zgq s LYS 92 N -4.04 1.97 0.04 1.99 1.02 0.83 -0.11 119.74 121.43 1zgq s LYS 92 Ca 0.25 -1.02 0.05 0.00 0.02 0.00 0.00 55.97 55.27 1zgq s LYS 92 Cb 0.06 -2.04 -0.02 0.00 -0.52 0.00 0.00 37.83 35.31 1zgq s LYS 92 CO 0.03 0.54 -0.15 1.67 -0.92 0.00 0.00 175.35 176.52 1zgq s TRP 93 N -0.75 1.32 0.14 3.18 1.48 -0.52 -0.08 118.94 123.71 1zgq s TRP 93 Ca 0.11 -0.35 0.07 0.00 -1.06 0.00 0.00 56.10 54.88 1zgq s TRP 93 Cb -0.10 -0.79 -0.04 0.00 -1.16 0.00 0.00 33.47 31.38 1zgq s TRP 93 CO 0.01 0.04 -0.15 -1.21 -4.06 0.00 0.00 176.95 171.58 1zgq s GLU 94 N -1.07 1.11 -0.06 3.25 2.02 -0.01 -0.29 118.70 123.64 1zgq s GLU 94 Ca 0.03 -1.30 -0.20 0.00 0.02 0.00 0.00 54.97 53.52 1zgq s GLU 94 Cb -0.08 -1.04 0.04 0.00 0.10 0.00 0.00 34.13 33.16 1zgq s GLU 94 CO 0.01 0.20 0.46 0.50 0.02 0.00 0.00 175.26 176.45 1zgq s ARG 95 N -2.74 0.76 -0.08 1.61 3.52 -0.20 -0.62 118.95 121.21 1zgq s ARG 95 Ca 0.11 0.14 0.04 0.00 -0.13 0.00 0.00 55.73 55.89 1zgq s ARG 95 Cb -0.05 0.35 0.00 0.00 -1.56 0.00 0.00 34.95 33.70 1zgq s ARG 95 CO 0.04 -0.20 -0.20 0.08 -0.81 0.00 0.00 175.30 174.21 1zgq s VAL 96 N -0.93 1.72 -0.22 7.11 1.01 0.15 -0.71 120.40 128.53 1zgq s VAL 96 Ca -0.10 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.07 1zgq s VAL 96 Cb -0.03 -1.49 0.04 0.00 0.00 0.00 0.00 36.38 34.90 1zgq s VAL 96 CO 0.05 0.48 -0.15 -0.04 0.00 0.00 0.00 175.10 175.45 1zgq s MET 97 N 0.33 2.61 -0.40 2.72 -1.94 0.49 -0.98 119.30 122.12 1zgq s MET 97 Ca -0.14 -1.09 -0.11 0.00 -1.71 0.00 0.00 55.69 52.64 1zgq s MET 97 Cb -0.16 -2.75 0.05 0.00 2.01 0.00 0.00 34.83 33.98 1zgq s MET 97 CO 0.06 -0.40 0.25 -0.80 -0.01 0.00 0.00 175.02 174.12 1zgq s ASN 98 N 1.20 5.74 0.23 3.03 0.01 0.29 -1.59 114.94 123.84 1zgq s ASN 98 Ca -0.02 -1.24 -0.19 0.00 -0.71 0.00 0.00 52.86 50.70 1zgq s ASN 98 Cb -0.17 -2.02 -0.08 0.00 0.41 0.00 0.00 41.25 39.39 1zgq s ASN 98 CO -0.09 -0.48 0.72 -0.36 -1.51 0.00 0.00 177.10 175.39 1zgq s PHE 99 N 1.51 3.62 0.58 2.20 0.40 -0.37 -0.59 117.98 125.33 1zgq s PHE 99 Ca 0.02 1.37 0.42 0.00 -0.60 0.00 0.00 56.93 58.14 1zgq s PHE 99 Cb -0.21 -2.61 2.23 0.00 0.51 0.00 0.00 43.02 42.95 1zgq s PHE 99 CO 0.05 0.32 2.31 1.05 0.70 0.00 0.00 175.22 179.64 1zgq h GLU 100 N 3.32 0.00 -0.68 0.44 4.11 -1.51 -2.46 114.58 117.79 1zgq h GLU 100 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 1zgq h GLU 100 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1zgq h GLU 100 CO 0.65 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.34 1zgq n ASP 101 N -3.14 4.10 0.00 3.06 3.85 -1.26 -4.94 116.55 118.22 1zgq n ASP 101 Ca -0.02 -2.18 0.00 0.00 -0.71 0.00 0.00 54.79 51.87 1zgq n ASP 101 Cb 0.11 -0.51 0.00 0.00 -1.35 0.00 0.00 41.12 39.37 1zgq n ASP 101 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1zgq n GLY 102 N 1.40 2.84 3.76 6.12 0.00 -0.92 -4.72 105.19 113.66 1zgq n GLY 102 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 1zgq n GLY 102 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1zgq s GLY 103 N -2.59 2.43 -0.01 -0.02 0.00 -1.10 -4.75 107.32 101.28 1zgq s GLY 103 Ca 0.00 1.48 0.02 0.00 0.00 0.00 0.00 44.72 46.22 1zgq s GLY 103 CO 0.00 2.36 -0.08 0.14 0.00 0.00 0.00 173.10 175.52 1zgq s VAL 104 N -0.35 0.62 -0.03 1.40 1.01 -0.23 -1.24 120.40 121.59 1zgq s VAL 104 Ca 0.59 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 62.28 1zgq s VAL 104 Cb -0.45 -0.53 0.00 0.00 0.00 0.00 0.00 36.38 35.40 1zgq s VAL 104 CO 0.50 0.18 -0.10 -0.69 0.00 0.00 0.00 175.10 175.00 1zgq s VAL 105 N -0.05 0.88 -0.05 2.92 1.01 -0.62 -0.47 120.40 124.02 1zgq s VAL 105 Ca 0.01 -0.40 0.06 0.00 0.00 0.00 0.00 61.98 61.65 1zgq s VAL 105 Cb -0.05 -0.79 -0.01 0.00 0.00 0.00 0.00 36.38 35.53 1zgq s VAL 105 CO -0.00 0.27 -0.24 0.42 0.00 0.00 0.00 175.10 175.55 1zgq s THR 106 N 0.24 2.17 0.03 3.92 -4.23 -0.82 -0.38 115.64 116.57 1zgq s THR 106 Ca -0.04 -1.04 0.06 0.00 -1.18 0.00 0.00 61.69 59.49 1zgq s THR 106 Cb -0.10 -1.78 -0.02 0.00 1.34 0.00 0.00 72.50 71.94 1zgq s THR 106 CO 0.01 0.57 -0.18 -0.69 -0.54 0.00 0.00 174.62 173.79 1zgq s VAL 107 N -0.33 1.43 -0.02 2.29 1.01 0.11 -2.15 120.40 122.75 1zgq s VAL 107 Ca 0.02 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 60.99 1zgq s VAL 107 Cb -0.12 -1.24 0.01 0.00 0.00 0.00 0.00 36.38 35.02 1zgq s VAL 107 CO 0.02 0.20 -0.03 0.28 0.00 0.00 0.00 175.10 175.57 1zgq s THR 108 N -0.70 0.35 0.03 3.92 -1.32 -0.63 -1.03 115.64 116.25 1zgq s THR 108 Ca 0.06 -0.10 -0.06 0.00 -1.21 0.00 0.00 61.69 60.38 1zgq s THR 108 Cb -0.08 -0.35 -0.01 0.00 -1.51 0.00 0.00 72.50 70.55 1zgq s THR 108 CO 0.01 0.14 0.10 -1.58 -2.21 0.00 0.00 174.62 171.08 1zgq s GLN 109 N 0.40 0.57 -0.08 7.08 -0.44 0.60 -1.02 119.66 126.76 1zgq s GLN 109 Ca -0.04 -0.70 0.03 0.00 -2.50 0.00 0.00 55.36 52.15 1zgq s GLN 109 Cb -0.08 0.22 0.01 0.00 -1.64 0.00 0.00 33.01 31.53 1zgq s GLN 109 CO -0.00 -0.14 -0.16 0.34 0.50 0.00 0.00 175.29 175.82 1zgq s ASP 110 N -2.00 2.29 -0.19 6.67 2.15 -0.80 -1.44 116.67 123.35 1zgq s ASP 110 Ca -0.07 -0.40 -0.00 0.00 0.43 0.00 0.00 52.55 52.51 1zgq s ASP 110 Cb -0.02 -1.05 0.01 0.00 -0.30 0.00 0.00 42.92 41.55 1zgq s ASP 110 CO -0.04 0.07 -0.15 -0.44 -0.17 0.00 0.00 175.17 174.45 1zgq s SER 111 N 0.60 3.51 0.38 -0.34 0.01 0.85 -1.97 113.70 116.74 1zgq s SER 111 Ca -0.15 -0.56 0.04 0.00 1.31 0.00 0.00 55.95 56.59 1zgq s SER 111 Cb -0.16 -1.56 -0.03 0.00 0.21 0.00 0.00 66.02 64.47 1zgq s SER 111 CO 0.05 0.01 0.12 -0.94 0.41 0.00 0.00 173.24 172.88 1zgq s SER 112 N 1.28 2.53 -0.17 2.44 1.04 -0.46 -2.01 113.70 118.35 1zgq s SER 112 Ca 0.04 -1.59 -0.01 0.00 0.48 0.00 0.00 55.95 54.87 1zgq s SER 112 Cb -0.14 0.36 0.04 0.00 0.10 0.00 0.00 66.02 66.39 1zgq s SER 112 CO -0.09 -0.85 -0.04 -0.22 0.98 0.00 0.00 173.24 173.03 1zgq s LEU 113 N -3.55 1.57 -0.19 2.42 2.96 -1.25 -0.80 118.68 119.84 1zgq s LEU 113 Ca 0.28 -0.70 0.00 0.00 -0.22 0.00 0.00 54.13 53.50 1zgq s LEU 113 Cb 0.04 -0.86 0.04 0.00 0.50 0.00 0.00 46.19 45.91 1zgq s LEU 113 CO 0.15 -0.21 -0.08 -1.10 -1.32 0.00 0.00 176.35 173.79 1zgq s GLN 114 N 1.67 1.74 -1.38 1.98 -0.21 -0.33 -4.85 119.66 118.27 1zgq s GLN 114 Ca 0.00 -0.70 -0.03 0.00 0.02 0.00 0.00 55.36 54.65 1zgq s GLN 114 Cb -0.16 -2.24 0.02 0.00 1.00 0.00 0.00 33.01 31.63 1zgq s GLN 114 CO -0.07 -0.44 0.70 -0.25 -2.12 0.00 0.00 175.29 173.10 1zgq n ASP 115 N 4.77 -1.72 0.00 5.90 8.00 -1.26 -2.19 116.55 130.06 1zgq n ASP 115 Ca -0.13 -0.86 0.00 0.00 0.71 0.00 0.00 54.79 54.51 1zgq n ASP 115 Cb 0.47 -3.78 0.00 0.00 -0.02 0.00 0.00 41.12 37.78 1zgq n ASP 115 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1zgq n GLY 116 N -1.68 1.19 3.29 0.44 0.00 -1.26 -5.02 105.19 102.15 1zgq n GLY 116 Ca -0.23 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.47 1zgq n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zgq s PHE 118 N -0.15 3.61 -0.19 0.00 2.99 -0.63 -1.19 117.98 122.42 1zgq s PHE 118 Ca -0.04 1.60 -0.01 0.00 0.00 0.00 0.00 56.93 58.48 1zgq s PHE 118 Cb -0.14 -3.26 0.00 0.00 0.00 0.00 0.00 43.02 39.62 1zgq s PHE 118 CO 0.04 -0.56 -0.12 0.42 -0.00 0.00 0.00 175.22 175.00 1zgq s ILE 119 N -0.07 2.82 -0.17 0.64 -1.09 0.02 -1.15 121.20 122.21 1zgq s ILE 119 Ca 0.50 -0.69 -0.01 0.00 -2.23 0.00 0.00 60.65 58.22 1zgq s ILE 119 Cb -0.28 -2.23 -0.00 0.00 -1.58 0.00 0.00 42.46 38.36 1zgq s ILE 119 CO 0.34 0.48 -0.12 -0.31 -1.23 0.00 0.00 174.94 174.10 1zgq s TYR 120 N 1.18 2.84 -0.24 3.97 2.02 0.18 -1.36 117.35 125.94 1zgq s TYR 120 Ca 0.02 -0.96 0.02 0.00 -0.37 0.00 0.00 57.07 55.77 1zgq s TYR 120 Cb -0.14 -1.93 0.05 0.00 -0.40 0.00 0.00 41.96 39.53 1zgq s TYR 120 CO -0.04 -0.45 -0.13 0.21 -1.57 0.00 0.00 175.55 173.56 1zgq s LYS 121 N 0.90 2.50 -0.09 -0.62 2.20 -0.83 -1.72 119.74 122.08 1zgq s LYS 121 Ca -0.03 -1.17 0.02 0.00 -0.36 0.00 0.00 55.97 54.43 1zgq s LYS 121 Cb -0.15 -2.81 -0.02 0.00 -1.51 0.00 0.00 37.83 33.34 1zgq s LYS 121 CO -0.01 -0.46 -0.13 0.08 -0.36 0.00 0.00 175.35 174.47 1zgq s VAL 122 N 1.17 3.09 -0.11 4.02 1.01 0.33 -1.91 120.40 127.99 1zgq s VAL 122 Ca -0.04 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.28 1zgq s VAL 122 Cb -0.18 -2.25 0.01 0.00 0.00 0.00 0.00 36.38 33.96 1zgq s VAL 122 CO -0.07 0.56 -0.20 -0.54 0.00 0.00 0.00 175.10 174.85 1zgq s LYS 123 N -0.27 2.72 -0.06 2.72 1.02 -0.19 -1.47 119.74 124.22 1zgq s LYS 123 Ca 0.02 -0.76 0.03 0.00 0.02 0.00 0.00 55.97 55.29 1zgq s LYS 123 Cb -0.13 -2.16 0.01 0.00 -0.52 0.00 0.00 37.83 35.02 1zgq s LYS 123 CO 0.03 0.05 -0.15 0.12 -0.92 0.00 0.00 175.35 174.47 1zgq s PHE 124 N 0.67 1.68 -0.13 3.18 5.36 -0.81 -1.61 117.98 126.32 1zgq s PHE 124 Ca -0.12 -0.58 -0.01 0.00 -0.96 0.00 0.00 56.93 55.26 1zgq s PHE 124 Cb -0.16 -1.17 0.04 0.00 -0.34 0.00 0.00 43.02 41.38 1zgq s PHE 124 CO 0.03 -0.25 -0.01 0.42 -1.46 0.00 0.00 175.22 173.94 1zgq s ILE 125 N 0.38 0.67 -0.15 3.12 1.01 -0.91 -1.42 121.20 123.89 1zgq s ILE 125 Ca -0.11 -0.26 0.00 0.00 0.00 0.00 0.00 60.65 60.28 1zgq s ILE 125 Cb -0.14 -0.89 -0.00 0.00 0.01 0.00 0.00 42.46 41.43 1zgq s ILE 125 CO 0.04 0.14 -0.15 -0.83 0.00 0.00 0.00 174.94 174.14 1zgq s GLY 126 N 1.83 1.48 0.25 6.18 0.00 0.16 -1.95 107.32 115.28 1zgq s GLY 126 Ca 0.03 -1.03 0.03 0.00 0.00 0.00 0.00 44.72 43.75 1zgq s GLY 126 CO -0.07 -0.00 0.04 -1.34 0.00 0.00 0.00 173.10 171.73 1zgq s VAL 127 N 0.76 0.91 -1.58 1.40 -7.23 0.38 -1.51 120.40 113.54 1zgq s VAL 127 Ca -0.06 -2.01 -0.03 0.00 -1.81 0.00 0.00 61.98 58.06 1zgq s VAL 127 Cb -0.15 -2.50 0.01 0.00 0.56 0.00 0.00 36.38 34.29 1zgq s VAL 127 CO 0.01 -0.18 0.39 -3.20 -0.31 0.00 0.00 175.10 171.81 1zgq n ASN 128 N -0.47 -5.79 -4.67 4.85 5.15 -1.26 -1.06 115.26 112.00 1zgq n ASN 128 Ca -0.03 -0.19 -0.40 0.00 -0.60 0.00 0.00 54.58 53.36 1zgq n ASN 128 Cb 0.65 -4.73 -0.06 0.00 -0.53 0.00 0.00 39.78 35.11 1zgq n ASN 128 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1zgq s PHE 129 N -3.09 3.42 0.30 1.20 0.40 -1.26 -2.72 117.98 116.22 1zgq s PHE 129 Ca 0.21 0.98 -0.30 0.00 -0.60 0.00 0.00 56.93 57.23 1zgq s PHE 129 Cb -0.09 -2.79 -0.11 0.00 0.51 0.00 0.00 43.02 40.54 1zgq s PHE 129 CO 0.26 -0.11 1.53 -2.14 0.70 0.00 0.00 175.22 175.46 1zgq s PRO 130 N 1.65 4.16 0.58 0.24 0.02 -1.26 -4.88 135.00 135.50 1zgq s PRO 130 Ca 0.30 2.51 0.27 0.00 0.02 0.00 0.00 61.00 64.10 1zgq s PRO 130 Cb -0.16 -3.03 1.67 0.00 0.02 0.00 0.00 34.50 32.99 1zgq s PRO 130 CO 0.11 -0.56 2.18 0.66 -0.33 0.00 0.00 177.00 179.07 1zgq h SER 131 N 4.55 0.00 -0.68 2.53 4.64 -1.97 -0.65 113.55 121.96 1zgq h SER 131 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1zgq h SER 131 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1zgq h SER 131 CO 0.76 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.82 1zgq n ASP 132 N -3.96 3.84 -4.90 4.97 5.75 -1.26 -4.42 116.55 116.57 1zgq n ASP 132 Ca -0.01 -2.00 -0.28 0.00 -0.01 0.00 0.00 54.79 52.49 1zgq n ASP 132 Cb 0.19 -0.45 0.05 0.00 -1.03 0.00 0.00 41.12 39.88 1zgq n ASP 132 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1zgq s GLY 133 N -1.08 1.62 0.63 6.12 0.00 -0.25 -4.86 107.32 109.50 1zgq s GLY 133 Ca 0.47 -0.55 0.38 0.00 0.00 0.00 0.00 44.72 45.03 1zgq s GLY 133 CO 0.33 -0.19 2.32 -0.56 0.00 0.00 0.00 173.10 175.00 1zgq h PRO 134 N -0.53 0.00 0.08 2.90 0.13 -1.94 -0.91 132.00 131.74 1zgq h PRO 134 Ca -0.45 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1zgq h PRO 134 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1zgq h PRO 134 CO 0.63 0.00 -0.04 0.28 -0.23 0.00 0.00 178.00 178.64 1zgq h VAL 135 N 0.00 0.85 0.00 1.56 2.07 -1.94 0.11 116.25 118.90 1zgq h VAL 135 Ca -0.00 -1.42 0.00 0.00 0.82 0.00 0.00 66.70 66.10 1zgq h VAL 135 Cb 0.00 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1zgq h VAL 135 CO 0.00 0.26 0.00 0.24 0.02 0.00 0.00 177.57 178.09 1zgq h MET 136 N -0.95 0.00 -0.21 1.57 2.86 -1.75 0.13 114.93 116.58 1zgq h MET 136 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1zgq h MET 136 Cb 0.51 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.17 1zgq h MET 136 CO 0.02 0.00 0.00 1.04 1.06 0.00 0.00 176.91 179.03 1zgq n GLN 137 N -2.73 2.41 -3.79 1.72 1.13 -0.36 -4.71 117.38 111.06 1zgq n GLN 137 Ca 0.02 -2.11 -0.23 0.00 -1.94 0.00 0.00 57.00 52.75 1zgq n GLN 137 Cb 0.34 -1.49 0.01 0.00 0.11 0.00 0.00 30.24 29.21 1zgq n GLN 137 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1zgq n LYS 138 N 1.42 -4.36 -0.44 -1.09 5.02 -0.99 -4.92 118.16 112.80 1zgq n LYS 138 Ca 0.17 0.55 0.10 0.00 -2.02 0.00 0.00 58.31 57.10 1zgq n LYS 138 Cb 0.60 -4.96 0.31 0.00 -0.02 0.00 0.00 35.03 30.97 1zgq n LYS 138 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1zgq n LYS 139 N -4.32 3.12 -3.35 1.97 5.02 -0.01 -4.98 118.16 115.61 1zgq n LYS 139 Ca -0.30 -2.67 -0.35 0.00 -2.02 0.00 0.00 58.31 52.97 1zgq n LYS 139 Cb 0.68 -1.65 -0.06 0.00 -0.02 0.00 0.00 35.03 33.98 1zgq n LYS 139 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1zgq s THR 140 N -1.36 4.85 -0.40 -0.18 -4.23 -1.25 -2.23 115.64 110.84 1zgq s THR 140 Ca 0.46 0.79 0.09 0.00 -1.18 0.00 0.00 61.69 61.86 1zgq s THR 140 Cb 0.27 -3.72 0.43 0.00 1.34 0.00 0.00 72.50 70.82 1zgq s THR 140 CO 0.27 0.18 1.05 0.23 -0.54 0.00 0.00 174.62 175.81 1zgq n MET 141 N 0.63 2.63 0.00 3.99 2.81 0.18 -4.87 117.12 122.48 1zgq n MET 141 Ca -0.04 -4.08 0.00 0.00 -1.81 0.00 0.00 57.70 51.77 1zgq n MET 141 Cb 0.52 -1.91 0.00 0.00 -0.71 0.00 0.00 33.22 31.12 1zgq n MET 141 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1zgq n GLY 142 N -0.32 -1.65 3.86 3.03 0.00 -1.26 -4.53 105.19 104.31 1zgq n GLY 142 Ca 0.29 -1.55 -0.32 0.00 0.00 0.00 0.00 46.02 44.44 1zgq n GLY 142 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1zgq s TRP 143 N -2.67 3.40 0.55 1.61 0.52 -1.26 -1.24 118.94 119.85 1zgq s TRP 143 Ca 0.00 1.06 -0.09 0.00 0.02 0.00 0.00 56.10 57.10 1zgq s TRP 143 Cb 0.00 -2.42 -0.04 0.00 -1.15 0.00 0.00 33.47 29.86 1zgq s TRP 143 CO 0.00 0.13 0.91 -1.21 0.02 0.00 0.00 176.95 176.80 1zgq s GLU 144 N -3.06 3.60 0.54 4.98 0.41 -0.78 -4.82 118.70 119.56 1zgq s GLU 144 Ca 0.51 0.51 -0.21 0.00 -0.41 0.00 0.00 54.97 55.37 1zgq s GLU 144 Cb -0.11 -2.22 -0.05 0.00 -1.78 0.00 0.00 34.13 29.97 1zgq s GLU 144 CO 0.21 -0.38 1.28 0.00 -0.49 0.00 0.00 175.26 175.89 1zgq s ALA 145 N -2.93 2.80 0.32 5.21 0.00 -1.26 -4.79 121.76 121.11 1zgq s ALA 145 Ca 0.52 1.18 0.03 0.00 0.00 0.00 0.00 51.96 53.69 1zgq s ALA 145 Cb -0.11 -3.50 -0.06 0.00 0.00 0.00 0.00 23.12 19.45 1zgq s ALA 145 CO 0.48 -1.17 0.07 -1.54 0.00 0.00 0.00 175.76 173.60 1zgq s SER 146 N -1.17 2.27 -0.16 0.00 1.04 0.46 -4.98 113.70 111.16 1zgq s SER 146 Ca 0.71 -1.40 -0.03 0.00 0.48 0.00 0.00 55.95 55.71 1zgq s SER 146 Cb -0.36 -0.01 0.05 0.00 0.10 0.00 0.00 66.02 65.80 1zgq s SER 146 CO 0.42 -0.64 0.05 -0.89 0.98 0.00 0.00 173.24 173.16 1zgq s THR 147 N -3.34 0.27 0.07 2.02 2.01 -1.26 -0.75 115.64 114.66 1zgq s THR 147 Ca 0.36 -0.30 -0.20 0.00 0.31 0.00 0.00 61.69 61.85 1zgq s THR 147 Cb 0.08 -0.78 -0.07 0.00 0.01 0.00 0.00 72.50 71.75 1zgq s THR 147 CO 0.15 -0.16 0.60 -0.70 -0.69 0.00 0.00 174.62 173.82 1zgq s GLU 148 N 1.98 4.27 -0.27 4.92 2.12 0.68 -4.54 118.70 127.86 1zgq s GLU 148 Ca 0.01 0.79 -0.08 0.00 0.36 0.00 0.00 54.97 56.05 1zgq s GLU 148 Cb -0.16 -3.26 -0.02 0.00 0.26 0.00 0.00 34.13 30.95 1zgq s GLU 148 CO -0.08 0.58 0.10 0.50 -0.54 0.00 0.00 175.26 175.83 1zgq s ARG 149 N -0.95 3.55 0.22 4.30 3.00 -0.30 -1.43 118.95 127.34 1zgq s ARG 149 Ca 0.30 -0.56 0.11 0.00 -1.00 0.00 0.00 55.73 54.58 1zgq s ARG 149 Cb -0.20 -3.41 -0.04 0.00 0.00 0.00 0.00 34.95 31.29 1zgq s ARG 149 CO 0.20 -0.27 -0.16 -0.51 0.00 0.00 0.00 175.30 174.56 1zgq s LEU 150 N 1.62 2.73 -0.04 -0.88 1.02 0.35 -1.16 118.68 122.32 1zgq s LEU 150 Ca 0.06 -0.79 -0.29 0.00 0.02 0.00 0.00 54.13 53.13 1zgq s LEU 150 Cb -0.16 -1.37 0.10 0.00 0.02 0.00 0.00 46.19 44.78 1zgq s LEU 150 CO 0.05 0.08 0.89 -0.72 0.02 0.00 0.00 176.35 176.67 1zgq s TYR 151 N -1.95 -0.38 0.25 0.29 -0.85 -0.80 -1.67 117.35 112.25 1zgq s TYR 151 Ca 0.25 0.38 -0.21 0.00 -0.52 0.00 0.00 57.07 56.97 1zgq s TYR 151 Cb -0.07 0.51 -0.09 0.00 0.38 0.00 0.00 41.96 42.69 1zgq s TYR 151 CO 0.14 -0.51 0.77 -1.25 -1.52 0.00 0.00 175.55 173.18 1zgq s PRO 152 N -2.55 4.31 -0.28 -3.49 0.04 -1.26 -2.01 135.00 129.77 1zgq s PRO 152 Ca 0.02 0.96 -0.22 0.00 0.04 0.00 0.00 61.00 61.81 1zgq s PRO 152 Cb -0.01 -2.84 0.08 0.00 0.04 0.00 0.00 34.50 31.77 1zgq s PRO 152 CO -0.05 0.36 0.77 0.50 0.04 0.00 0.00 177.00 178.61 1zgq s ARG 153 N -2.03 0.73 -1.39 4.56 6.06 -0.07 -4.93 118.95 121.87 1zgq s ARG 153 Ca 0.45 1.00 -0.09 0.00 -2.50 0.00 0.00 55.73 54.58 1zgq s ARG 153 Cb -0.17 0.29 0.06 0.00 0.06 0.00 0.00 34.95 35.19 1zgq s ARG 153 CO 0.21 -0.11 0.60 -3.47 -2.50 0.00 0.00 175.30 170.03 1zgq n ASP 154 N 3.18 -4.42 0.00 -2.12 2.03 -1.26 -1.03 116.55 112.94 1zgq n ASP 154 Ca -0.16 -0.44 0.00 0.00 0.52 0.00 0.00 54.79 54.71 1zgq n ASP 154 Cb 0.56 -3.61 0.00 0.00 -0.72 0.00 0.00 41.12 37.36 1zgq n ASP 154 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1zgq n GLY 155 N -1.34 0.72 3.55 0.27 0.00 -1.26 -4.99 105.19 102.14 1zgq n GLY 155 Ca -0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.72 1zgq n GLY 155 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1zgq s VAL 156 N -3.04 0.53 -0.17 1.61 -7.23 -0.20 -4.96 120.40 106.94 1zgq s VAL 156 Ca 0.00 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.10 1zgq s VAL 156 Cb 0.00 -2.25 -0.04 0.00 0.56 0.00 0.00 36.38 34.65 1zgq s VAL 156 CO 0.00 0.00 0.06 -0.22 -0.31 0.00 0.00 175.10 174.63 1zgq s LEU 157 N -3.66 3.86 0.18 1.32 2.96 -0.79 -0.89 118.68 121.66 1zgq s LEU 157 Ca 0.20 0.13 0.08 0.00 -0.22 0.00 0.00 54.13 54.32 1zgq s LEU 157 Cb 0.01 -1.96 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 1zgq s LEU 157 CO 0.14 0.22 -0.16 -0.54 -1.32 0.00 0.00 176.35 174.68 1zgq s LYS 158 N 0.11 1.30 -0.23 1.98 1.02 -0.85 0.38 119.74 123.45 1zgq s LYS 158 Ca 0.05 -1.49 -0.24 0.00 0.02 0.00 0.00 55.97 54.32 1zgq s LYS 158 Cb -0.12 -1.24 0.06 0.00 -0.52 0.00 0.00 37.83 36.02 1zgq s LYS 158 CO 0.01 0.23 0.66 0.20 -0.92 0.00 0.00 175.35 175.53 1zgq s GLY 159 N -2.95 -0.50 0.04 -3.33 0.00 -0.32 -1.91 107.32 98.34 1zgq s GLY 159 Ca 0.19 1.81 0.06 0.00 0.00 0.00 0.00 44.72 46.78 1zgq s GLY 159 CO 0.07 1.54 -0.18 -0.54 0.00 0.00 0.00 173.10 173.99 1zgq s GLU 160 N 0.19 1.23 0.00 2.90 8.01 -0.31 0.24 118.70 130.97 1zgq s GLU 160 Ca -0.01 -0.84 0.01 0.00 0.01 0.00 0.00 54.97 54.13 1zgq s GLU 160 Cb -0.04 -1.29 -0.00 0.00 -4.31 0.00 0.00 34.13 28.48 1zgq s GLU 160 CO 0.02 0.33 -0.04 0.42 0.01 0.00 0.00 175.26 176.00 1zgq s ILE 161 N -0.78 0.27 -0.63 -1.63 1.01 -0.42 -1.14 121.20 117.88 1zgq s ILE 161 Ca 0.05 -0.24 -0.15 0.00 0.00 0.00 0.00 60.65 60.32 1zgq s ILE 161 Cb -0.08 -0.25 0.16 0.00 0.01 0.00 0.00 42.46 42.30 1zgq s ILE 161 CO 0.01 0.02 0.57 -1.00 0.00 0.00 0.00 174.94 174.54 1zgq s HIS 162 N -0.22 3.42 0.38 3.97 3.76 -1.26 -0.38 115.29 124.96 1zgq s HIS 162 Ca -0.00 -1.56 0.07 0.00 -0.15 0.00 0.00 55.06 53.42 1zgq s HIS 162 Cb -0.02 -3.78 -0.00 0.00 1.11 0.00 0.00 32.58 29.88 1zgq s HIS 162 CO -0.00 -1.01 0.50 0.15 -0.85 0.00 0.00 174.74 173.53 1zgq s LYS 163 N 1.12 2.91 -0.19 1.40 1.02 0.18 -4.82 119.74 121.36 1zgq s LYS 163 Ca 0.08 -1.18 -0.16 0.00 0.02 0.00 0.00 55.97 54.73 1zgq s LYS 163 Cb -0.24 -2.74 0.05 0.00 -0.52 0.00 0.00 37.83 34.39 1zgq s LYS 163 CO -0.01 -0.11 0.49 0.00 -0.92 0.00 0.00 175.35 174.80 1zgq s ALA 164 N -2.29 -1.23 -0.17 5.17 0.00 -1.26 -1.67 121.76 120.31 1zgq s ALA 164 Ca 0.50 1.44 -0.09 0.00 0.00 0.00 0.00 51.96 53.81 1zgq s ALA 164 Cb -0.09 -0.84 -0.05 0.00 0.00 0.00 0.00 23.12 22.14 1zgq s ALA 164 CO 0.31 -0.24 0.15 -0.51 0.00 0.00 0.00 175.76 175.47 1zgq s LEU 165 N 0.43 4.27 0.27 0.00 1.43 0.37 -1.87 118.68 123.58 1zgq s LEU 165 Ca -0.01 0.33 -0.29 0.00 -1.03 0.00 0.00 54.13 53.12 1zgq s LEU 165 Cb -0.04 -2.11 -0.09 0.00 0.03 0.00 0.00 46.19 43.98 1zgq s LEU 165 CO -0.01 0.24 1.01 -0.54 0.23 0.00 0.00 176.35 177.28 1zgq s LYS 166 N -0.06 4.70 -0.04 1.70 1.02 -0.37 -0.50 119.74 126.19 1zgq s LYS 166 Ca 0.11 1.59 -0.01 0.00 0.02 0.00 0.00 55.97 57.68 1zgq s LYS 166 Cb -0.11 -3.14 -0.04 0.00 -0.52 0.00 0.00 37.83 34.02 1zgq s LYS 166 CO 0.00 0.34 0.04 -0.51 -0.92 0.00 0.00 175.35 174.30 1zgq s LEU 167 N -1.47 3.73 0.53 3.17 1.43 -0.85 0.47 118.68 125.70 1zgq s LEU 167 Ca 0.44 0.13 0.31 0.00 -1.03 0.00 0.00 54.13 53.99 1zgq s LEU 167 Cb -0.27 -2.04 1.41 0.00 0.03 0.00 0.00 46.19 45.32 1zgq s LEU 167 CO 0.34 0.32 2.01 0.07 0.23 0.00 0.00 176.35 179.33 1zgq h LYS 168 N 4.60 0.00 -0.65 1.70 2.10 -1.78 -1.70 116.57 120.84 1zgq h LYS 168 Ca -0.50 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.15 1zgq h LYS 168 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1zgq h LYS 168 CO 0.58 0.08 0.00 -0.25 -2.00 0.00 0.00 179.45 177.86 1zgq n ASP 169 N -3.29 4.14 0.00 7.07 8.00 -1.26 -5.02 116.55 126.20 1zgq n ASP 169 Ca -0.01 -2.49 0.00 0.00 0.71 0.00 0.00 54.79 53.01 1zgq n ASP 169 Cb 0.29 -0.56 0.00 0.00 -0.02 0.00 0.00 41.12 40.83 1zgq n ASP 169 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1zgq n GLY 170 N 0.78 -1.10 0.86 0.44 0.00 -0.64 -5.11 105.19 100.43 1zgq n GLY 170 Ca 0.21 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1zgq n GLY 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zgq n GLY 171 N -0.69 -2.94 3.16 -0.02 0.00 -1.26 -4.55 105.19 98.88 1zgq n GLY 171 Ca 0.00 -1.92 -0.16 0.00 0.00 0.00 0.00 46.02 43.93 1zgq n GLY 171 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1zgq s HIS 172 N -0.57 1.09 -0.27 1.61 3.76 -1.26 -2.01 115.29 117.64 1zgq s HIS 172 Ca 0.00 -0.52 0.01 0.00 -0.15 0.00 0.00 55.06 54.41 1zgq s HIS 172 Cb 0.00 -0.61 0.06 0.00 1.11 0.00 0.00 32.58 33.13 1zgq s HIS 172 CO 0.00 0.02 -0.08 -0.47 -0.85 0.00 0.00 174.74 173.37 1zgq s TYR 173 N -1.62 3.26 0.14 1.40 5.04 0.35 -4.94 117.35 120.99 1zgq s TYR 173 Ca -0.01 -2.17 -0.27 0.00 -2.44 0.00 0.00 57.07 52.19 1zgq s TYR 173 Cb -0.08 -1.99 -0.07 0.00 0.35 0.00 0.00 41.96 40.17 1zgq s TYR 173 CO 0.01 -0.85 0.83 -0.51 -1.34 0.00 0.00 175.55 173.69 1zgq s LEU 174 N 1.15 4.56 -0.04 6.97 1.43 -1.26 -0.48 118.68 131.00 1zgq s LEU 174 Ca -0.08 1.67 -0.01 0.00 -1.03 0.00 0.00 54.13 54.68 1zgq s LEU 174 Cb -0.20 -3.37 0.03 0.00 0.03 0.00 0.00 46.19 42.68 1zgq s LEU 174 CO -0.04 0.12 0.08 -0.69 0.23 0.00 0.00 176.35 176.05 1zgq s VAL 175 N -0.73 -0.06 -0.23 -1.59 1.01 -0.67 -1.35 120.40 116.77 1zgq s VAL 175 Ca 0.39 0.21 -0.10 0.00 0.00 0.00 0.00 61.98 62.48 1zgq s VAL 175 Cb -0.23 -0.16 -0.05 0.00 0.00 0.00 0.00 36.38 35.94 1zgq s VAL 175 CO 0.27 0.09 0.15 -0.70 0.00 0.00 0.00 175.10 174.90 1zgq s GLU 176 N 1.18 4.07 -0.13 2.72 2.12 0.24 -0.65 118.70 128.25 1zgq s GLU 176 Ca -0.08 -0.27 -0.07 0.00 0.36 0.00 0.00 54.97 54.90 1zgq s GLU 176 Cb -0.12 -3.50 -0.04 0.00 0.26 0.00 0.00 34.13 30.73 1zgq s GLU 176 CO -0.04 0.10 0.14 -0.06 -0.54 0.00 0.00 175.26 174.85 1zgq s PHE 177 N 0.94 3.58 -0.16 5.30 0.40 0.49 -0.55 117.98 127.98 1zgq s PHE 177 Ca 0.07 0.51 -0.02 0.00 -0.60 0.00 0.00 56.93 56.89 1zgq s PHE 177 Cb -0.13 -1.95 0.05 0.00 0.51 0.00 0.00 43.02 41.49 1zgq s PHE 177 CO 0.03 0.70 0.00 0.15 0.70 0.00 0.00 175.22 176.81 1zgq s LYS 178 N -0.92 0.87 0.09 0.44 1.02 -0.16 -1.30 119.74 119.78 1zgq s LYS 178 Ca 0.14 -0.33 0.10 0.00 0.02 0.00 0.00 55.97 55.90 1zgq s LYS 178 Cb -0.12 -1.82 -0.04 0.00 -0.52 0.00 0.00 37.83 35.34 1zgq s LYS 178 CO 0.04 -0.50 -0.25 -1.12 -0.92 0.00 0.00 175.35 172.59 1zgq s SER 179 N 1.82 3.38 -0.09 2.83 0.01 0.14 -0.67 113.70 121.12 1zgq s SER 179 Ca 0.01 -0.65 0.01 0.00 1.31 0.00 0.00 55.95 56.63 1zgq s SER 179 Cb -0.15 -0.32 0.02 0.00 0.21 0.00 0.00 66.02 65.78 1zgq s SER 179 CO -0.07 0.21 -0.11 -0.63 0.41 0.00 0.00 173.24 173.06 1zgq s ILE 180 N -0.97 1.12 -0.23 1.44 1.09 0.21 -1.18 121.20 122.68 1zgq s ILE 180 Ca 0.14 -0.41 -0.03 0.00 -1.10 0.00 0.00 60.65 59.25 1zgq s ILE 180 Cb -0.10 -1.07 0.01 0.00 -1.06 0.00 0.00 42.46 40.24 1zgq s ILE 180 CO 0.05 0.37 -0.06 -0.31 -0.10 0.00 0.00 174.94 174.89 1zgq s TYR 181 N 1.13 2.99 -0.23 3.97 1.51 0.16 -0.83 117.35 126.05 1zgq s TYR 181 Ca -0.06 -1.24 0.02 0.00 -1.01 0.00 0.00 57.07 54.78 1zgq s TYR 181 Cb -0.14 -2.08 0.04 0.00 -0.11 0.00 0.00 41.96 39.67 1zgq s TYR 181 CO -0.02 -0.64 -0.14 -1.64 -1.11 0.00 0.00 175.55 172.00 1zgq s MET 182 N 1.40 2.58 0.39 -0.62 -1.94 0.89 -1.88 119.30 120.11 1zgq s MET 182 Ca 0.03 -1.12 -0.25 0.00 -1.71 0.00 0.00 55.69 52.64 1zgq s MET 182 Cb -0.15 -2.78 -0.09 0.00 2.01 0.00 0.00 34.83 33.82 1zgq s MET 182 CO -0.04 -0.42 1.08 0.00 -0.01 0.00 0.00 175.02 175.63 1zgq s ALA 183 N 1.19 3.13 -0.77 3.03 0.00 -1.26 -0.12 121.76 126.96 1zgq s ALA 183 Ca -0.03 0.79 0.26 0.00 0.00 0.00 0.00 51.96 52.98 1zgq s ALA 183 Cb -0.17 -3.30 0.92 0.00 0.00 0.00 0.00 23.12 20.56 1zgq s ALA 183 CO -0.08 -0.29 1.79 1.63 0.00 0.00 0.00 175.76 178.81 1zgq n LYS 184 N 0.10 0.19 -4.06 0.00 5.02 -0.71 -4.75 118.16 113.96 1zgq n LYS 184 Ca 0.04 0.19 -0.14 0.00 -2.02 0.00 0.00 58.31 56.39 1zgq n LYS 184 Cb 0.48 -1.73 -0.14 0.00 -0.02 0.00 0.00 35.03 33.62 1zgq n LYS 184 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1zgq s LYS 185 N -3.10 0.32 -0.43 1.97 -2.85 -1.26 -5.05 119.74 109.34 1zgq s LYS 185 Ca 0.10 -0.25 -0.27 0.00 -1.00 0.00 0.00 55.97 54.55 1zgq s LYS 185 Cb 0.13 -0.25 -0.05 0.00 -2.06 0.00 0.00 37.83 35.61 1zgq s LYS 185 CO 0.54 0.06 2.14 -1.25 0.10 0.00 0.00 175.35 176.95 1zgq s PRO 186 N -0.40 2.64 0.41 1.78 0.04 -1.26 -4.92 135.00 133.29 1zgq s PRO 186 Ca -0.02 1.37 0.07 0.00 0.04 0.00 0.00 61.00 62.46 1zgq s PRO 186 Cb -0.03 -4.43 -0.07 0.00 0.04 0.00 0.00 34.50 30.01 1zgq s PRO 186 CO -0.00 -2.67 0.05 0.14 0.04 0.00 0.00 177.00 174.55 1zgq s VAL 187 N 9.80 2.10 0.12 -0.36 -7.23 -1.26 -5.10 120.40 118.46 1zgq s VAL 187 Ca 0.88 -1.93 -0.31 0.00 -1.81 0.00 0.00 61.98 58.81 1zgq s VAL 187 Cb -0.20 -2.98 -0.10 0.00 0.56 0.00 0.00 36.38 33.66 1zgq s VAL 187 CO 0.28 -0.01 1.80 -1.58 -0.31 0.00 0.00 175.10 175.27 1zgq s GLN 188 N -3.75 4.15 -0.02 4.82 2.00 -1.26 -5.01 119.66 120.58 1zgq s GLN 188 Ca 0.36 2.55 -0.13 0.00 -2.00 0.00 0.00 55.36 56.15 1zgq s GLN 188 Cb 0.08 -3.58 -0.05 0.00 0.80 0.00 0.00 33.01 30.26 1zgq s GLN 188 CO 0.19 -0.82 0.36 -0.51 -0.50 0.00 0.00 175.29 174.01 1zgq s LEU 189 N 2.68 4.46 0.00 3.68 1.43 -1.26 -4.25 118.68 125.41 1zgq s LEU 189 Ca 0.80 0.87 -0.08 0.00 -1.03 0.00 0.00 54.13 54.68 1zgq s LEU 189 Cb -0.45 -2.49 0.15 0.00 0.03 0.00 0.00 46.19 43.42 1zgq s LEU 189 CO 0.36 0.34 0.89 -0.81 0.23 0.00 0.00 176.35 177.36 1zgq n PRO 190 N 1.83 -0.63 0.00 1.29 -0.04 -1.26 -4.89 135.00 131.30 1zgq n PRO 190 Ca -0.15 -1.64 0.00 0.00 -0.04 0.00 0.00 63.50 61.67 1zgq n PRO 190 Cb 0.53 -0.84 0.00 0.00 -0.04 0.00 0.00 33.50 33.15 1zgq n PRO 190 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1zgq n GLY 191 N -1.08 1.84 3.71 0.55 0.00 -1.26 -4.22 105.19 104.74 1zgq n GLY 191 Ca 0.12 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 1zgq n GLY 191 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1zgq s TYR 192 N 2.69 3.33 0.33 1.61 5.04 -1.26 -4.30 117.35 124.79 1zgq s TYR 192 Ca 0.00 1.16 -0.17 0.00 -2.44 0.00 0.00 57.07 55.62 1zgq s TYR 192 Cb 0.00 -3.52 0.06 0.00 0.35 0.00 0.00 41.96 38.86 1zgq s TYR 192 CO 0.00 -1.69 0.86 1.52 -1.34 0.00 0.00 175.55 174.90 1zgq s TYR 193 N 1.20 0.12 0.09 4.97 -0.85 -0.67 -4.94 117.35 117.26 1zgq s TYR 193 Ca 0.61 -0.72 0.06 0.00 -0.52 0.00 0.00 57.07 56.50 1zgq s TYR 193 Cb -0.32 0.81 -0.03 0.00 0.38 0.00 0.00 41.96 42.80 1zgq s TYR 193 CO 0.29 -1.40 -0.17 0.71 -1.52 0.00 0.00 175.55 173.46 1zgq s TYR 194 N -2.21 1.47 -0.14 -3.49 1.51 0.15 -0.49 117.35 114.14 1zgq s TYR 194 Ca 0.17 -0.45 -0.00 0.00 -1.01 0.00 0.00 57.07 55.79 1zgq s TYR 194 Cb -0.04 -0.81 0.03 0.00 -0.11 0.00 0.00 41.96 41.02 1zgq s TYR 194 CO 0.10 0.13 -0.09 0.08 -1.11 0.00 0.00 175.55 174.66 1zgq s VAL 195 N -1.28 1.25 0.03 0.71 1.01 -0.52 -0.11 120.40 121.49 1zgq s VAL 195 Ca 0.02 -0.54 -0.19 0.00 0.00 0.00 0.00 61.98 61.28 1zgq s VAL 195 Cb -0.10 -1.29 -0.06 0.00 0.00 0.00 0.00 36.38 34.94 1zgq s VAL 195 CO 0.03 0.31 0.54 -1.81 0.00 0.00 0.00 175.10 174.17 1zgq s ASP 196 N 1.60 6.97 0.03 3.32 1.01 -0.34 -0.23 116.67 129.03 1zgq s ASP 196 Ca 0.03 1.15 -0.01 0.00 0.71 0.00 0.00 52.55 54.44 1zgq s ASP 196 Cb -0.14 -2.34 -0.03 0.00 1.01 0.00 0.00 42.92 41.43 1zgq s ASP 196 CO -0.09 0.22 -0.02 -0.44 0.21 0.00 0.00 175.17 175.05 1zgq s SER 197 N -0.76 0.35 -0.25 0.27 0.01 0.07 -1.34 113.70 112.06 1zgq s SER 197 Ca 0.28 -0.73 -0.02 0.00 1.31 0.00 0.00 55.95 56.79 1zgq s SER 197 Cb -0.18 0.15 0.13 0.00 0.21 0.00 0.00 66.02 66.33 1zgq s SER 197 CO 0.17 -0.45 0.34 -0.75 0.41 0.00 0.00 173.24 172.96 1zgq s LYS 198 N -2.63 0.32 -0.17 12.44 2.20 -0.31 -0.40 119.74 131.18 1zgq s LYS 198 Ca -0.05 0.35 -0.07 0.00 -0.36 0.00 0.00 55.97 55.85 1zgq s LYS 198 Cb -0.01 -0.63 -0.04 0.00 -1.51 0.00 0.00 37.83 35.64 1zgq s LYS 198 CO -0.05 -0.73 0.04 -1.17 -0.36 0.00 0.00 175.35 173.08 1zgq s LEU 199 N 2.48 3.73 0.06 5.43 0.20 -1.26 -1.96 118.68 127.35 1zgq s LEU 199 Ca 0.11 0.06 0.07 0.00 0.69 0.00 0.00 54.13 55.06 1zgq s LEU 199 Cb -0.15 -1.93 -0.03 0.00 -0.43 0.00 0.00 46.19 43.65 1zgq s LEU 199 CO -0.18 0.19 -0.20 -1.81 -0.29 0.00 0.00 176.35 174.06 1zgq s ASP 200 N 0.27 2.37 -0.44 3.68 1.01 0.16 -4.54 116.67 119.19 1zgq s ASP 200 Ca 0.03 -0.55 -0.18 0.00 0.71 0.00 0.00 52.55 52.55 1zgq s ASP 200 Cb -0.13 -0.18 0.03 0.00 1.01 0.00 0.00 42.92 43.66 1zgq s ASP 200 CO 0.01 0.12 0.49 -0.63 0.21 0.00 0.00 175.17 175.37 1zgq s ILE 201 N -0.89 5.02 0.09 0.77 -1.09 -1.26 -1.18 121.20 122.66 1zgq s ILE 201 Ca 0.06 -0.31 -0.05 0.00 -2.23 0.00 0.00 60.65 58.13 1zgq s ILE 201 Cb -0.09 -4.10 -0.25 0.00 -1.58 0.00 0.00 42.46 36.44 1zgq s ILE 201 CO 0.02 -0.50 1.20 0.71 -1.23 0.00 0.00 174.94 175.13 1zgq h THR 202 N 5.77 1.46 -2.42 2.92 1.35 -1.39 -3.48 112.91 117.12 1zgq h THR 202 Ca -0.26 -2.84 -0.04 0.00 -0.55 0.00 0.00 66.41 62.72 1zgq h THR 202 Cb 1.11 2.77 -0.16 0.00 -1.73 0.00 0.00 68.15 70.13 1zgq h THR 202 CO 0.83 0.84 0.21 -0.94 -0.25 0.00 0.00 175.52 176.21 1zgq s SER 203 N -7.14 -0.61 0.02 5.36 1.04 -1.18 -5.02 113.70 106.16 1zgq s SER 203 Ca -0.05 0.40 -0.28 0.00 0.48 0.00 0.00 55.95 56.50 1zgq s SER 203 Cb 0.08 0.56 0.07 0.00 0.10 0.00 0.00 66.02 66.83 1zgq s SER 203 CO 0.88 -0.76 0.68 -1.38 0.98 0.00 0.00 173.24 173.64 1zgq s HIS 204 N -2.30 -0.59 0.76 5.02 -0.00 -1.26 -0.43 115.29 116.48 1zgq s HIS 204 Ca -0.05 0.79 -0.07 0.00 -0.00 0.00 0.00 55.06 55.73 1zgq s HIS 204 Cb -0.00 0.47 0.10 0.00 -0.00 0.00 0.00 32.58 33.15 1zgq s HIS 204 CO -0.00 -0.67 1.07 0.54 -0.00 0.00 0.00 174.74 175.68 1zgq s ASN 205 N -1.76 4.37 0.28 7.38 4.22 -0.75 -4.97 114.94 123.71 1zgq s ASN 205 Ca -0.06 0.23 -0.00 0.00 -2.14 0.00 0.00 52.86 50.89 1zgq s ASN 205 Cb -0.00 -0.70 0.63 0.00 1.28 0.00 0.00 41.25 42.46 1zgq s ASN 205 CO 0.01 -1.89 1.64 -0.33 -2.04 0.00 0.00 177.10 174.50 1zgq h GLU 206 N -0.79 0.18 -0.57 3.55 5.08 -2.03 -2.58 114.58 117.42 1zgq h GLU 206 Ca -0.43 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 1zgq h GLU 206 Cb 1.29 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1zgq h GLU 206 CO 0.51 0.12 0.00 -0.40 -1.00 0.00 0.00 179.01 178.24 1zgq n ASP 207 N -5.26 4.07 -2.77 1.42 3.85 -1.26 -4.97 116.55 111.63 1zgq n ASP 207 Ca 0.19 -2.28 -0.22 0.00 -0.71 0.00 0.00 54.79 51.78 1zgq n ASP 207 Cb 0.62 -0.47 0.02 0.00 -1.35 0.00 0.00 41.12 39.94 1zgq n ASP 207 CO 0.00 0.00 0.00 -1.22 -1.01 0.00 0.00 177.20 174.97 1zgq n TYR 208 N 0.99 -1.63 0.13 2.11 4.02 -0.97 -4.50 117.16 117.30 1zgq n TYR 208 Ca 0.22 0.35 0.11 0.00 -0.01 0.00 0.00 57.90 58.57 1zgq n TYR 208 Cb 0.72 -4.30 0.04 0.00 -0.02 0.00 0.00 39.34 35.78 1zgq n TYR 208 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 176.86 177.64 1zgq h THR 209 N -0.94 0.04 -3.23 -0.72 1.35 -1.94 -3.43 112.91 104.04 1zgq h THR 209 Ca -0.51 -1.07 -0.49 0.00 -0.55 0.00 0.00 66.41 63.79 1zgq h THR 209 Cb 1.36 1.66 -0.38 0.00 -1.73 0.00 0.00 68.15 69.06 1zgq h THR 209 CO 0.57 0.02 -0.78 -0.63 -0.25 0.00 0.00 175.52 174.44 1zgq s ILE 210 N -3.30 0.71 0.00 6.82 1.01 -1.26 -0.74 121.20 124.43 1zgq s ILE 210 Ca 0.01 -0.15 0.02 0.00 0.00 0.00 0.00 60.65 60.53 1zgq s ILE 210 Cb 0.08 -0.83 -0.01 0.00 0.01 0.00 0.00 42.46 41.71 1zgq s ILE 210 CO 0.76 0.26 -0.05 -0.69 0.00 0.00 0.00 174.94 175.22 1zgq s VAL 211 N 1.83 0.42 -0.10 2.92 1.01 -0.28 -1.80 120.40 124.41 1zgq s VAL 211 Ca 0.04 -0.31 0.03 0.00 0.00 0.00 0.00 61.98 61.74 1zgq s VAL 211 Cb -0.13 -0.37 -0.01 0.00 0.00 0.00 0.00 36.38 35.87 1zgq s VAL 211 CO -0.07 0.06 -0.20 -1.61 0.00 0.00 0.00 175.10 173.28 1zgq s GLU 212 N -0.27 3.00 0.15 2.72 2.02 0.43 0.26 118.70 127.00 1zgq s GLU 212 Ca 0.01 -0.82 0.08 0.00 0.02 0.00 0.00 54.97 54.26 1zgq s GLU 212 Cb -0.03 -2.37 -0.04 0.00 0.10 0.00 0.00 34.13 31.79 1zgq s GLU 212 CO -0.00 0.26 -0.19 -0.65 0.02 0.00 0.00 175.26 174.71 1zgq s GLN 213 N 0.16 1.24 -0.02 1.61 -0.21 0.08 -0.96 119.66 121.55 1zgq s GLN 213 Ca -0.11 -1.36 0.03 0.00 0.02 0.00 0.00 55.36 53.94 1zgq s GLN 213 Cb -0.16 -1.34 0.00 0.00 1.00 0.00 0.00 33.01 32.51 1zgq s GLN 213 CO 0.06 0.28 -0.10 -0.47 -2.12 0.00 0.00 175.29 172.95 1zgq s TYR 214 N -1.87 1.00 -0.04 0.91 5.04 -0.33 -1.64 117.35 120.43 1zgq s TYR 214 Ca 0.14 -0.24 -0.01 0.00 -2.44 0.00 0.00 57.07 54.52 1zgq s TYR 214 Cb -0.07 -0.70 0.03 0.00 0.35 0.00 0.00 41.96 41.57 1zgq s TYR 214 CO 0.06 -0.09 0.02 -2.00 -1.34 0.00 0.00 175.55 172.20 1zgq s GLU 215 N 0.12 0.24 -0.18 4.97 2.12 -0.62 -0.67 118.70 124.68 1zgq s GLU 215 Ca -0.02 0.16 -0.05 0.00 0.36 0.00 0.00 54.97 55.42 1zgq s GLU 215 Cb -0.08 -0.56 -0.03 0.00 0.26 0.00 0.00 34.13 33.72 1zgq s GLU 215 CO 0.00 -0.21 0.01 0.50 -0.54 0.00 0.00 175.26 175.02 1zgq s ARG 216 N 1.47 3.73 -0.11 4.30 3.52 -0.83 -1.84 118.95 129.19 1zgq s ARG 216 Ca -0.04 -0.47 -0.04 0.00 -0.13 0.00 0.00 55.73 55.05 1zgq s ARG 216 Cb -0.13 -3.08 0.05 0.00 -1.56 0.00 0.00 34.95 30.24 1zgq s ARG 216 CO -0.03 0.14 0.22 -0.08 -0.81 0.00 0.00 175.30 174.75 1zgq s THR 217 N 0.67 -0.29 -0.02 4.11 -1.32 0.15 -1.16 115.64 117.78 1zgq s THR 217 Ca 0.00 0.27 0.02 0.00 -1.21 0.00 0.00 61.69 60.78 1zgq s THR 217 Cb -0.14 -0.38 0.00 0.00 -1.51 0.00 0.00 72.50 70.48 1zgq s THR 217 CO 0.02 0.11 -0.07 -1.61 -2.21 0.00 0.00 174.62 170.86 1zgq s GLU 218 N 2.11 0.74 0.18 7.08 2.02 -0.45 -2.59 118.70 127.80 1zgq s GLU 218 Ca -0.01 -0.24 -0.14 0.00 0.02 0.00 0.00 54.97 54.60 1zgq s GLU 218 Cb -0.12 -0.72 -0.07 0.00 0.10 0.00 0.00 34.13 33.32 1zgq s GLU 218 CO -0.08 0.10 0.57 0.20 0.02 0.00 0.00 175.26 176.07 1zgq s GLY 219 N 0.16 2.43 0.20 -1.39 0.00 0.12 -1.20 107.32 107.63 1zgq s GLY 219 Ca -0.02 -0.13 -0.23 0.00 0.00 0.00 0.00 44.72 44.34 1zgq s GLY 219 CO 0.00 0.12 0.82 1.09 0.00 0.00 0.00 173.10 175.13 1zgq s ARG 220 N -2.18 1.43 0.56 2.90 1.70 0.85 -4.42 118.95 119.78 1zgq s ARG 220 Ca 0.41 -0.75 -0.05 0.00 -0.47 0.00 0.00 55.73 54.86 1zgq s ARG 220 Cb -0.14 0.51 0.00 0.00 -0.57 0.00 0.00 34.95 34.75 1zgq s ARG 220 CO 0.20 -0.65 0.86 -1.01 -1.08 0.00 0.00 175.30 173.62 1zgq s HIS 221 N -3.58 3.29 0.38 5.89 3.76 -1.26 -0.68 115.29 123.09 1zgq s HIS 221 Ca 0.10 0.62 -0.28 0.00 -0.15 0.00 0.00 55.06 55.35 1zgq s HIS 221 Cb -0.03 -2.63 -0.10 0.00 1.11 0.00 0.00 32.58 30.92 1zgq s HIS 221 CO 0.02 -0.70 1.42 -1.58 -0.85 0.00 0.00 174.74 173.05 1zgq s HIS 222 N -2.91 2.69 0.64 1.40 2.46 -1.26 -4.83 115.29 113.48 1zgq s HIS 222 Ca 0.52 1.26 0.35 0.00 0.47 0.00 0.00 55.06 57.67 1zgq s HIS 222 Cb -0.10 -3.90 1.94 0.00 -0.13 0.00 0.00 32.58 30.39 1zgq s HIS 222 CO 0.44 -2.65 2.15 -0.07 -2.47 0.00 0.00 174.74 172.14 1zgq h LEU 223 N 2.93 0.00 -0.41 8.88 3.38 -2.04 -2.43 115.31 125.63 1zgq h LEU 223 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1zgq h LEU 223 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 1zgq h LEU 223 CO 0.64 0.00 -0.22 0.49 0.09 0.00 0.00 178.44 179.44 1zgq n PHE 224 N -3.23 0.00 1.59 1.13 3.01 -1.26 -5.32 117.46 113.37 1zgq n PHE 224 Ca -0.01 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.59 1zgq n PHE 224 Cb 0.25 -0.14 0.60 0.00 -0.01 0.00 0.00 39.48 40.17 1zgq n PHE 224 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05