#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 0.54 -3.49 2.41 -1.51 -1.98 -3.42 116.25 108.80 1zgq h VAL 7 Ca 0.00 -1.77 -0.71 0.00 -1.23 0.00 0.00 66.70 62.99 1zgq h VAL 7 Cb 0.00 2.26 -0.20 0.00 -2.13 0.00 0.00 31.29 31.22 1zgq h VAL 7 CO 0.00 0.31 -0.31 -0.63 -1.23 0.00 0.00 177.57 175.71 1zgq s ILE 8 N -3.05 5.17 0.77 7.19 1.01 -1.26 -4.97 121.20 126.05 1zgq s ILE 8 Ca 0.05 -0.55 -0.09 0.00 0.00 0.00 0.00 60.65 60.06 1zgq s ILE 8 Cb 0.07 -4.00 0.09 0.00 0.01 0.00 0.00 42.46 38.62 1zgq s ILE 8 CO 0.72 -0.39 1.10 -0.54 0.00 0.00 0.00 174.94 175.82 1zgq s LYS 9 N 1.90 1.87 0.43 2.79 -0.14 -1.26 -4.98 119.74 120.35 1zgq s LYS 9 Ca 0.08 -0.27 0.10 0.00 -1.36 0.00 0.00 55.97 54.53 1zgq s LYS 9 Cb -0.19 -2.09 0.95 0.00 -1.68 0.00 0.00 37.83 34.83 1zgq s LYS 9 CO 0.11 -1.51 2.04 0.93 -0.76 0.00 0.00 175.35 176.16 1zgq h GLU 10 N -0.85 0.30 -4.89 1.68 5.08 -1.97 -3.40 114.58 110.54 1zgq h GLU 10 Ca -0.44 -0.03 -0.61 0.00 -1.00 0.00 0.00 59.36 57.28 1zgq h GLU 10 Cb 1.30 -0.06 -0.34 0.00 0.50 0.00 0.00 28.75 30.15 1zgq h GLU 10 CO 0.56 0.26 -0.85 0.12 -1.00 0.00 0.00 179.01 178.11 1zgq s PHE 11 N -5.16 2.15 -0.00 4.33 5.36 -1.26 -3.95 117.98 119.45 1zgq s PHE 11 Ca -0.07 -1.00 0.01 0.00 -0.96 0.00 0.00 56.93 54.92 1zgq s PHE 11 Cb 0.17 -1.51 -0.00 0.00 -0.34 0.00 0.00 43.02 41.33 1zgq s PHE 11 CO 0.71 -0.49 -0.05 -1.64 -1.46 0.00 0.00 175.22 172.30 1zgq s MET 12 N 0.86 0.38 0.17 10.12 -1.94 -0.78 -5.02 119.30 123.09 1zgq s MET 12 Ca -0.08 -0.16 0.05 0.00 -1.71 0.00 0.00 55.69 53.79 1zgq s MET 12 Cb -0.15 -0.37 -0.04 0.00 2.01 0.00 0.00 34.83 36.28 1zgq s MET 12 CO -0.00 0.10 0.14 1.03 -0.01 0.00 0.00 175.02 176.27 1zgq s ARG 13 N -0.09 2.90 0.04 2.03 0.52 -1.26 -1.90 118.95 121.19 1zgq s ARG 13 Ca 0.02 -0.89 -0.01 0.00 -0.52 0.00 0.00 55.73 54.32 1zgq s ARG 13 Cb -0.02 -2.64 -0.03 0.00 0.52 0.00 0.00 34.95 32.78 1zgq s ARG 13 CO -0.00 0.48 -0.02 -0.59 0.02 0.00 0.00 175.30 175.19 1zgq s PHE 14 N -1.79 0.40 -0.07 -0.53 -0.12 0.42 -1.67 117.98 114.62 1zgq s PHE 14 Ca 0.31 -0.84 0.04 0.00 -0.05 0.00 0.00 56.93 56.40 1zgq s PHE 14 Cb -0.10 -0.30 -0.00 0.00 -0.63 0.00 0.00 43.02 41.99 1zgq s PHE 14 CO 0.24 -0.32 -0.20 0.15 -0.05 0.00 0.00 175.22 175.03 1zgq s LYS 15 N -2.99 2.36 0.01 1.99 1.02 -0.47 -0.13 119.74 121.54 1zgq s LYS 15 Ca -0.02 -0.73 0.05 0.00 0.02 0.00 0.00 55.97 55.28 1zgq s LYS 15 Cb 0.01 -1.91 -0.02 0.00 -0.52 0.00 0.00 37.83 35.39 1zgq s LYS 15 CO -0.07 0.22 -0.14 0.54 -0.92 0.00 0.00 175.35 174.98 1zgq s VAL 16 N 0.19 1.11 -0.02 3.17 0.11 -0.07 -0.73 120.40 124.17 1zgq s VAL 16 Ca -0.10 -0.76 0.01 0.00 -2.93 0.00 0.00 61.98 58.19 1zgq s VAL 16 Cb -0.15 -0.96 0.01 0.00 -1.53 0.00 0.00 36.38 33.75 1zgq s VAL 16 CO 0.05 0.19 -0.03 -0.60 -3.33 0.00 0.00 175.10 171.38 1zgq s ARG 17 N -0.66 0.43 -0.05 1.54 3.52 -0.74 -0.63 118.95 122.36 1zgq s ARG 17 Ca 0.04 -0.07 0.03 0.00 -0.13 0.00 0.00 55.73 55.60 1zgq s ARG 17 Cb -0.06 -0.49 0.00 0.00 -1.56 0.00 0.00 34.95 32.85 1zgq s ARG 17 CO 0.00 -0.02 -0.14 1.41 -0.81 0.00 0.00 175.30 175.74 1zgq s MET 18 N 0.48 1.72 -0.28 5.12 -2.45 0.92 -0.24 119.30 124.56 1zgq s MET 18 Ca -0.05 -0.50 0.02 0.00 -1.25 0.00 0.00 55.69 53.91 1zgq s MET 18 Cb -0.08 -1.45 0.07 0.00 1.25 0.00 0.00 34.83 34.61 1zgq s MET 18 CO -0.01 0.13 -0.06 -1.21 1.05 0.00 0.00 175.02 174.92 1zgq s GLU 19 N 0.35 2.13 0.30 4.11 2.02 -0.47 -0.65 118.70 126.49 1zgq s GLU 19 Ca -0.09 -1.44 0.03 0.00 0.02 0.00 0.00 54.97 53.49 1zgq s GLU 19 Cb -0.13 -2.99 -0.04 0.00 0.10 0.00 0.00 34.13 31.06 1zgq s GLU 19 CO 0.03 -0.65 0.12 0.20 0.02 0.00 0.00 175.26 174.98 1zgq s GLY 20 N 1.10 2.00 -0.12 -1.39 0.00 -0.41 -1.98 107.32 106.52 1zgq s GLY 20 Ca -0.05 -1.78 -0.05 0.00 0.00 0.00 0.00 44.72 42.84 1zgq s GLY 20 CO -0.05 -1.65 0.26 -1.59 0.00 0.00 0.00 173.10 170.07 1zgq s THR 21 N -3.58 -0.33 -0.16 0.90 2.01 -0.58 -1.21 115.64 112.69 1zgq s THR 21 Ca 0.35 0.26 0.00 0.00 0.31 0.00 0.00 61.69 62.61 1zgq s THR 21 Cb 0.06 -0.43 0.03 0.00 0.01 0.00 0.00 72.50 72.18 1zgq s THR 21 CO 0.15 0.11 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.40 1zgq s VAL 22 N 2.18 1.43 -1.44 3.82 1.01 -0.73 0.66 120.40 127.32 1zgq s VAL 22 Ca -0.01 -0.70 -0.09 0.00 0.00 0.00 0.00 61.98 61.18 1zgq s VAL 22 Cb -0.12 -1.45 0.05 0.00 0.00 0.00 0.00 36.38 34.86 1zgq s VAL 22 CO -0.08 0.30 0.69 0.59 0.00 0.00 0.00 175.10 176.59 1zgq n ASN 23 N 4.79 -4.87 0.00 3.32 5.03 -0.57 -1.73 115.26 121.23 1zgq n ASN 23 Ca -0.15 -0.46 0.00 0.00 0.87 0.00 0.00 54.58 54.84 1zgq n ASN 23 Cb 0.49 -3.94 0.00 0.00 -1.02 0.00 0.00 39.78 35.30 1zgq n ASN 23 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1zgq n GLY 24 N -1.45 1.74 3.62 7.41 0.00 -1.26 -5.03 105.19 110.21 1zgq n GLY 24 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 3.24 0.14 1.61 5.04 -0.71 -5.05 115.29 117.18 1zgq s HIS 25 Ca 0.00 0.86 -0.19 0.00 -1.54 0.00 0.00 55.06 54.19 1zgq s HIS 25 Cb 0.00 -3.10 -0.07 0.00 0.04 0.00 0.00 32.58 29.44 1zgq s HIS 25 CO 0.00 -0.49 0.62 -1.21 -2.34 0.00 0.00 174.74 171.33 1zgq s GLU 26 N 2.83 4.19 0.10 2.88 2.02 -1.26 -1.78 118.70 127.68 1zgq s GLU 26 Ca 0.31 0.75 -0.16 0.00 0.02 0.00 0.00 54.97 55.89 1zgq s GLU 26 Cb -0.15 -3.06 0.03 0.00 0.10 0.00 0.00 34.13 31.05 1zgq s GLU 26 CO 0.11 0.52 0.39 -0.59 0.02 0.00 0.00 175.26 175.71 1zgq s PHE 27 N -1.32 -0.19 -0.04 1.61 -0.12 -0.35 -4.36 117.98 113.21 1zgq s PHE 27 Ca 0.36 -0.05 0.01 0.00 -0.05 0.00 0.00 56.93 57.20 1zgq s PHE 27 Cb -0.18 0.22 0.02 0.00 -0.63 0.00 0.00 43.02 42.45 1zgq s PHE 27 CO 0.20 -0.65 -0.05 -1.21 -0.05 0.00 0.00 175.22 173.46 1zgq s GLU 28 N -3.41 0.85 -0.01 1.99 2.02 -0.51 -1.28 118.70 118.34 1zgq s GLU 28 Ca 0.01 -0.14 0.06 0.00 0.02 0.00 0.00 54.97 54.92 1zgq s GLU 28 Cb 0.01 -0.83 -0.01 0.00 0.10 0.00 0.00 34.13 33.40 1zgq s GLU 28 CO -0.09 -0.05 -0.19 0.42 0.02 0.00 0.00 175.26 175.37 1zgq s ILE 29 N 0.77 1.49 0.07 -1.63 1.01 0.17 -1.17 121.20 121.92 1zgq s ILE 29 Ca -0.11 -0.81 0.06 0.00 0.00 0.00 0.00 60.65 59.79 1zgq s ILE 29 Cb -0.13 -1.24 -0.03 0.00 0.01 0.00 0.00 42.46 41.07 1zgq s ILE 29 CO 0.00 0.42 -0.16 -1.61 0.00 0.00 0.00 174.94 173.60 1zgq s GLU 30 N -0.45 0.93 0.11 2.79 2.02 -0.30 -0.06 118.70 123.74 1zgq s GLU 30 Ca 0.07 -0.96 -0.26 0.00 0.02 0.00 0.00 54.97 53.84 1zgq s GLU 30 Cb -0.07 -1.00 0.07 0.00 0.10 0.00 0.00 34.13 33.24 1zgq s GLU 30 CO -0.01 0.23 0.95 0.20 0.02 0.00 0.00 175.26 176.65 1zgq s GLY 31 N -1.63 -0.29 -0.01 -1.39 0.00 0.20 -0.49 107.32 103.70 1zgq s GLY 31 Ca 0.01 0.34 0.03 0.00 0.00 0.00 0.00 44.72 45.09 1zgq s GLY 31 CO 0.02 0.08 -0.09 -1.83 0.00 0.00 0.00 173.10 171.28 1zgq s GLU 32 N -3.23 0.84 0.34 2.90 -1.05 -0.63 -0.89 118.70 116.98 1zgq s GLU 32 Ca 0.11 -0.33 0.04 0.00 -0.15 0.00 0.00 54.97 54.64 1zgq s GLU 32 Cb -0.01 -0.81 -0.03 0.00 -0.44 0.00 0.00 34.13 32.84 1zgq s GLU 32 CO -0.01 0.18 0.18 0.20 0.95 0.00 0.00 175.26 176.76 1zgq s GLY 33 N -0.09 2.29 0.20 -3.83 0.00 0.82 -0.93 107.32 105.78 1zgq s GLY 33 Ca 0.02 -1.67 -0.23 0.00 0.00 0.00 0.00 44.72 42.83 1zgq s GLY 33 CO -0.00 -1.64 0.76 -1.83 0.00 0.00 0.00 173.10 170.39 1zgq s GLU 34 N -3.70 1.46 0.00 2.90 -1.05 -0.47 -0.43 118.70 117.41 1zgq s GLU 34 Ca 0.33 -0.74 0.00 0.00 -0.15 0.00 0.00 54.97 54.41 1zgq s GLU 34 Cb 0.04 0.54 0.00 0.00 -0.44 0.00 0.00 34.13 34.27 1zgq s GLU 34 CO 0.19 -0.66 0.00 0.41 0.95 0.00 0.00 175.26 176.15 1zgq n GLY 35 N -0.42 -1.95 3.10 -3.83 0.00 -0.80 -0.40 105.19 100.89 1zgq n GLY 35 Ca -0.08 -1.20 -0.34 0.00 0.00 0.00 0.00 46.02 44.40 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 -1.77 1.95 0.32 1.61 0.52 -0.32 -1.87 118.95 119.39 1zgq s ARG 36 Ca 0.00 -1.70 0.08 0.00 -0.52 0.00 0.00 55.73 53.58 1zgq s ARG 36 Cb 0.00 -3.36 0.78 0.00 0.52 0.00 0.00 34.95 32.90 1zgq s ARG 36 CO 0.00 -0.92 1.80 -1.35 0.02 0.00 0.00 175.30 174.85 1zgq h PRO 37 N 7.90 0.71 -0.01 3.54 0.11 -1.82 -2.06 132.00 140.36 1zgq h PRO 37 Ca -0.12 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.94 1zgq h PRO 37 Cb 1.04 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1zgq h PRO 37 CO 0.60 0.47 -0.09 0.66 -0.21 0.00 0.00 178.00 179.43 1zgq n TYR 38 N -4.69 0.00 0.20 0.65 4.02 -1.26 -4.02 117.16 112.05 1zgq n TYR 38 Ca 0.22 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 58.16 1zgq n TYR 38 Cb 0.57 -0.04 -0.07 0.00 -0.02 0.00 0.00 39.34 39.77 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 -0.10 1.68 -1.58 -0.72 1.02 -0.82 -4.77 120.64 115.35 1zgq n GLU 39 Ca 0.17 -0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 1zgq n GLU 39 Cb 0.35 -1.14 0.00 0.00 -0.02 0.00 0.00 31.44 30.63 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 1.62 0.67 3.07 0.62 0.00 -0.93 -4.75 105.19 105.49 1zgq n GLY 40 Ca -0.00 -0.73 -0.12 0.00 0.00 0.00 0.00 46.02 45.16 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 -2.00 -0.17 0.08 1.61 -3.43 -1.23 -0.41 115.29 109.74 1zgq s HIS 41 Ca 0.00 0.42 -0.12 0.00 -0.80 0.00 0.00 55.06 54.56 1zgq s HIS 41 Cb 0.00 0.06 0.02 0.00 -1.43 0.00 0.00 32.58 31.22 1zgq s HIS 41 CO 0.00 -0.12 0.28 0.54 -2.00 0.00 0.00 174.74 173.44 1zgq s ASN 42 N -0.08 -0.06 0.13 7.38 6.03 -0.63 -1.17 114.94 126.55 1zgq s ASN 42 Ca -0.02 -0.40 0.07 0.00 -1.03 0.00 0.00 52.86 51.48 1zgq s ASN 42 Cb -0.02 0.38 -0.04 0.00 -3.03 0.00 0.00 41.25 38.54 1zgq s ASN 42 CO 0.00 -0.72 -0.16 0.42 -2.03 0.00 0.00 177.10 174.62 1zgq s THR 43 N -3.38 1.51 -0.12 0.54 -4.23 0.47 -1.15 115.64 109.28 1zgq s THR 43 Ca 0.01 -1.76 -0.10 0.00 -1.18 0.00 0.00 61.69 58.66 1zgq s THR 43 Cb 0.02 -1.62 0.04 0.00 1.34 0.00 0.00 72.50 72.27 1zgq s THR 43 CO -0.09 -0.35 0.31 0.54 -0.54 0.00 0.00 174.62 174.50 1zgq s VAL 44 N -2.00 -0.01 -0.26 2.29 0.11 -0.62 -1.36 120.40 118.55 1zgq s VAL 44 Ca 0.11 0.03 -0.03 0.00 -2.93 0.00 0.00 61.98 59.15 1zgq s VAL 44 Cb -0.06 -0.45 0.02 0.00 -1.53 0.00 0.00 36.38 34.37 1zgq s VAL 44 CO 0.04 0.01 -0.02 -0.54 -3.33 0.00 0.00 175.10 171.26 1zgq s LYS 45 N 0.44 2.95 0.08 1.54 3.01 -0.10 -0.45 119.74 127.21 1zgq s LYS 45 Ca -0.02 -0.92 0.05 0.00 -1.01 0.00 0.00 55.97 54.07 1zgq s LYS 45 Cb -0.04 -3.10 -0.04 0.00 -1.01 0.00 0.00 37.83 33.65 1zgq s LYS 45 CO -0.02 -0.40 -0.01 -0.51 0.51 0.00 0.00 175.35 174.92 1zgq s LEU 46 N 1.39 3.41 -0.03 3.17 2.01 0.13 -1.61 118.68 127.15 1zgq s LEU 46 Ca 0.01 -0.19 0.01 0.00 0.01 0.00 0.00 54.13 53.97 1zgq s LEU 46 Cb -0.17 -2.13 0.02 0.00 0.01 0.00 0.00 46.19 43.92 1zgq s LEU 46 CO -0.02 0.18 -0.00 -0.54 1.01 0.00 0.00 176.35 176.98 1zgq s LYS 47 N -2.23 0.32 -0.42 1.70 1.02 0.36 -1.43 119.74 119.04 1zgq s LYS 47 Ca 0.25 0.05 -0.26 0.00 0.02 0.00 0.00 55.97 56.03 1zgq s LYS 47 Cb -0.12 -0.47 0.02 0.00 -0.52 0.00 0.00 37.83 36.74 1zgq s LYS 47 CO 0.17 -0.11 0.95 0.08 -0.92 0.00 0.00 175.35 175.52 1zgq s VAL 48 N 0.92 4.49 -0.18 3.17 1.01 -0.15 -1.15 120.40 128.50 1zgq s VAL 48 Ca -0.09 0.99 0.18 0.00 0.00 0.00 0.00 61.98 63.06 1zgq s VAL 48 Cb -0.13 -4.41 -0.02 0.00 0.00 0.00 0.00 36.38 31.83 1zgq s VAL 48 CO -0.01 -0.73 1.10 0.71 0.00 0.00 0.00 175.10 176.17 1zgq h THR 49 N 5.99 0.45 -2.85 3.92 1.35 -1.49 -3.45 112.91 116.83 1zgq h THR 49 Ca -0.24 -1.77 -0.12 0.00 -0.55 0.00 0.00 66.41 63.74 1zgq h THR 49 Cb 1.07 2.02 -0.22 0.00 -1.73 0.00 0.00 68.15 69.30 1zgq h THR 49 CO 1.02 0.26 -0.24 -0.75 -0.25 0.00 0.00 175.52 175.56 1zgq s LYS 50 N -3.05 0.58 0.00 4.72 2.20 -1.03 -4.91 119.74 118.25 1zgq s LYS 50 Ca 0.00 0.21 0.00 0.00 -0.36 0.00 0.00 55.97 55.82 1zgq s LYS 50 Cb 0.08 0.27 0.00 0.00 -1.51 0.00 0.00 37.83 36.67 1zgq s LYS 50 CO 0.78 -0.13 0.00 0.41 -0.36 0.00 0.00 175.35 176.05 1zgq n GLY 51 N 2.06 0.42 3.86 5.54 0.00 -1.26 -1.42 105.19 114.39 1zgq n GLY 51 Ca -0.17 -0.90 -0.36 0.00 0.00 0.00 0.00 46.02 44.59 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 -2.82 2.37 0.56 -0.02 0.00 -1.26 -4.05 107.32 102.09 1zgq s GLY 52 Ca 0.00 -0.35 -0.16 0.00 0.00 0.00 0.00 44.72 44.20 1zgq s GLY 52 CO 0.00 -0.09 1.03 2.56 0.00 0.00 0.00 173.10 176.59 1zgq s PRO 53 N -1.62 3.59 -0.02 2.90 0.04 -1.26 -5.13 135.00 133.49 1zgq s PRO 53 Ca 0.29 1.10 -0.30 0.00 0.04 0.00 0.00 61.00 62.13 1zgq s PRO 53 Cb -0.15 -2.08 -0.03 0.00 0.04 0.00 0.00 34.50 32.29 1zgq s PRO 53 CO 0.16 -0.58 0.97 -0.51 0.04 0.00 0.00 177.00 177.08 1zgq s LEU 54 N -4.31 4.34 -0.05 -3.56 1.43 -1.26 -4.95 118.68 110.32 1zgq s LEU 54 Ca 0.62 1.61 0.03 0.00 -1.03 0.00 0.00 54.13 55.35 1zgq s LEU 54 Cb -0.13 -3.54 0.17 0.00 0.03 0.00 0.00 46.19 42.71 1zgq s LEU 54 CO 0.35 -0.29 0.81 -0.81 0.23 0.00 0.00 176.35 176.63 1zgq n PRO 55 N 4.10 1.74 -4.14 1.29 -0.04 -1.26 -4.86 135.00 131.83 1zgq n PRO 55 Ca 0.06 -0.64 -0.11 0.00 -0.04 0.00 0.00 63.50 62.77 1zgq n PRO 55 Cb 0.51 -1.61 -0.09 0.00 -0.04 0.00 0.00 33.50 32.27 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 -1.28 0.91 0.16 0.54 -0.12 -1.26 -4.61 117.98 112.32 1zgq s PHE 56 Ca 0.11 -1.20 -0.31 0.00 -0.05 0.00 0.00 56.93 55.48 1zgq s PHE 56 Cb 0.09 -0.39 -0.10 0.00 -0.63 0.00 0.00 43.02 41.99 1zgq s PHE 56 CO 0.03 -0.67 1.56 0.00 -0.05 0.00 0.00 175.22 176.10 1zgq s ALA 57 N -4.10 3.76 0.30 1.99 0.00 0.91 -4.91 121.76 119.72 1zgq s ALA 57 Ca 0.31 1.35 -0.01 0.00 0.00 0.00 0.00 51.96 53.62 1zgq s ALA 57 Cb 0.06 -3.62 0.45 0.00 0.00 0.00 0.00 23.12 20.01 1zgq s ALA 57 CO 0.08 -0.79 1.88 2.35 0.00 0.00 0.00 175.76 179.28 1zgq h TRP 58 N 6.88 0.86 -1.39 0.00 2.91 -1.95 -3.22 115.95 120.02 1zgq h TRP 58 Ca -0.43 -0.05 0.41 0.00 1.13 0.00 0.00 58.89 59.96 1zgq h TRP 58 Cb 1.20 -0.26 -0.08 0.00 -0.51 0.00 0.00 29.16 29.51 1zgq h TRP 58 CO 0.66 0.66 0.97 -0.44 -1.03 0.00 0.00 178.44 179.26 1zgq h ASP 59 N 0.84 0.13 1.16 2.65 3.32 -1.94 0.46 116.42 123.05 1zgq h ASP 59 Ca 0.20 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1zgq h ASP 59 Cb 0.17 0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.76 1zgq h ASP 59 CO -0.02 -0.03 0.00 0.16 -1.72 0.00 0.00 179.24 177.63 1zgq h ILE 60 N 0.08 0.00 0.00 0.35 3.07 -1.97 -3.11 117.51 115.93 1zgq h ILE 60 Ca 0.73 -0.52 -0.19 0.00 1.55 0.00 0.00 64.86 66.43 1zgq h ILE 60 Cb 2.60 1.46 -0.03 0.00 -0.27 0.00 0.00 36.82 40.57 1zgq h ILE 60 CO -0.16 0.00 -1.88 0.18 -1.05 0.00 0.00 178.15 175.25 1zgq n LEU 61 N -2.81 0.36 -0.33 0.16 4.77 0.13 -4.53 117.00 114.76 1zgq n LEU 61 Ca 0.02 0.16 0.14 0.00 -0.03 0.00 0.00 56.01 56.29 1zgq n LEU 61 Cb 0.34 0.19 0.36 0.00 -2.33 0.00 0.00 43.42 41.98 1zgq n LEU 61 CO 0.27 0.22 1.21 0.77 -1.33 0.00 0.00 177.39 178.52 1zgq h SER 62 N 0.00 0.71 -0.18 -1.43 4.64 -1.43 -1.84 113.55 114.02 1zgq h SER 62 Ca -0.24 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1zgq h SER 62 Cb 1.64 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.68 1zgq h SER 62 CO 0.03 0.28 0.00 -2.65 -0.87 0.00 0.00 176.83 173.62 1zgq n PRO 63 N -4.67 2.00 0.00 4.77 -0.02 -1.26 -3.55 135.00 132.27 1zgq n PRO 63 Ca 0.22 -0.90 0.07 0.00 -2.02 0.00 0.00 63.50 60.87 1zgq n PRO 63 Cb 0.57 -1.59 -0.01 0.00 -0.02 0.00 0.00 33.50 32.45 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 0.17 1.87 -2.29 -0.52 1.13 -0.69 -4.92 117.38 112.14 1zgq n GLN 64 Ca 0.08 -0.66 -0.40 0.00 -1.94 0.00 0.00 57.00 54.07 1zgq n GLN 64 Cb 0.45 -1.21 0.03 0.00 0.11 0.00 0.00 30.24 29.61 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 -0.30 2.82 0.00 1.08 3.01 -1.23 -4.99 117.46 117.86 1zgq n PHE 65 Ca 0.06 -2.45 0.00 0.00 1.01 0.00 0.00 57.45 56.06 1zgq n PHE 65 Cb 0.29 -1.22 0.00 0.00 -0.01 0.00 0.00 39.48 38.54 1zgq n PHE 65 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1zgq n SER 69 N -0.17 0.00 0.00 4.37 3.41 -1.26 -5.04 113.62 114.92 1zgq n SER 69 Ca 0.50 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 59.19 1zgq n SER 69 Cb 0.26 0.00 0.43 0.00 -0.26 0.00 0.00 64.21 64.63 1zgq n SER 69 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1zgq n LYS 70 N 0.00 0.60 0.12 4.33 4.76 -1.26 -1.86 118.16 124.85 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 -1.38 0.41 0.00 -1.84 0.00 0.00 35.03 32.23 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 -0.04 -0.18 3.04 -1.96 -2.97 116.25 114.14 1zgq h VAL 71 Ca 0.00 -0.46 0.00 0.00 -1.01 0.00 0.00 66.70 65.23 1zgq h VAL 71 Cb 0.00 1.41 0.00 0.00 -2.01 0.00 0.00 31.29 30.69 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 -2.32 0.04 -2.34 3.17 4.02 -0.78 -4.80 117.16 114.15 1zgq n TYR 72 Ca 0.05 -0.02 -0.42 0.00 -0.01 0.00 0.00 57.90 57.50 1zgq n TYR 72 Cb 0.40 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.69 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 -1.96 3.96 -0.07 -0.72 1.01 -1.12 -3.23 120.40 118.26 1zgq s VAL 73 Ca 0.39 1.33 -0.30 0.00 0.00 0.00 0.00 61.98 63.40 1zgq s VAL 73 Cb 0.20 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.69 1zgq s VAL 73 CO 0.32 0.02 1.28 -0.75 0.00 0.00 0.00 175.10 175.96 1zgq s LYS 74 N 2.08 4.30 -0.07 2.72 2.20 -1.01 -4.81 119.74 125.15 1zgq s LYS 74 Ca 0.60 1.75 0.03 0.00 -0.36 0.00 0.00 55.97 57.99 1zgq s LYS 74 Cb -0.29 -3.63 -0.02 0.00 -1.51 0.00 0.00 37.83 32.38 1zgq s LYS 74 CO 0.25 -0.56 -0.16 -1.01 -0.36 0.00 0.00 175.35 173.51 1zgq s HIS 75 N 2.67 2.67 0.73 4.03 3.76 -1.26 0.08 115.29 127.97 1zgq s HIS 75 Ca 0.58 -0.42 -0.13 0.00 -0.15 0.00 0.00 55.06 54.94 1zgq s HIS 75 Cb -0.26 -1.68 0.04 0.00 1.11 0.00 0.00 32.58 31.79 1zgq s HIS 75 CO 0.21 -0.01 1.13 -2.14 -0.85 0.00 0.00 174.74 173.08 1zgq s PRO 76 N -0.30 2.34 0.56 8.40 0.02 -1.26 -4.91 135.00 139.84 1zgq s PRO 76 Ca 0.02 1.42 0.25 0.00 0.02 0.00 0.00 61.00 62.71 1zgq s PRO 76 Cb -0.13 -1.89 1.50 0.00 0.02 0.00 0.00 34.50 34.00 1zgq s PRO 76 CO 0.03 -1.62 2.07 0.00 -0.33 0.00 0.00 177.00 177.15 1zgq h ALA 77 N -0.54 2.07 -0.01 -1.55 0.00 -1.99 -2.17 119.26 115.06 1zgq h ALA 77 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1zgq h ALA 77 Cb 1.25 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1zgq h ALA 77 CO 0.51 -0.36 -0.06 -0.40 0.00 0.00 0.00 179.25 178.94 1zgq n ASP 78 N -4.12 1.32 -4.19 0.00 5.75 -1.26 -4.71 116.55 109.34 1zgq n ASP 78 Ca 0.03 -1.32 -0.36 0.00 -0.01 0.00 0.00 54.79 53.14 1zgq n ASP 78 Cb 0.37 0.03 -0.13 0.00 -1.03 0.00 0.00 41.12 40.36 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 -2.13 3.23 -0.11 2.12 1.01 -0.82 -5.03 121.20 119.48 1zgq s ILE 79 Ca 0.35 -1.46 -0.37 0.00 0.00 0.00 0.00 60.65 59.17 1zgq s ILE 79 Cb 0.21 -2.92 -0.14 0.00 0.01 0.00 0.00 42.46 39.61 1zgq s ILE 79 CO 0.38 -0.24 1.70 -2.65 0.00 0.00 0.00 174.94 174.13 1zgq n PRO 80 N 4.66 1.56 -2.78 2.79 -0.02 -1.26 -4.57 135.00 135.39 1zgq n PRO 80 Ca -0.11 0.57 -0.44 0.00 -2.02 0.00 0.00 63.50 61.51 1zgq n PRO 80 Cb 0.43 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 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 5.05 5.14 -0.24 2.55 -0.08 -1.26 -4.37 116.55 123.34 1zgq n ASP 81 Ca 0.23 -2.99 -0.01 0.00 -1.51 0.00 0.00 54.79 50.51 1zgq n ASP 81 Cb 0.21 -1.58 0.06 0.00 2.34 0.00 0.00 41.12 42.15 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 6.92 -0.54 -0.46 -0.67 3.20 -1.90 -1.13 116.97 122.40 1zgq h TYR 82 Ca 0.35 0.07 -0.06 0.00 3.14 0.00 0.00 58.73 62.23 1zgq h TYR 82 Cb 0.83 0.34 -0.02 0.00 1.54 0.00 0.00 36.73 39.42 1zgq h TYR 82 CO 1.17 -0.33 0.05 0.87 -1.64 0.00 0.00 178.16 178.28 1zgq h LYS 83 N -0.04 0.72 -0.10 1.82 1.57 -1.91 -2.02 116.57 116.61 1zgq h LYS 83 Ca 0.32 -0.16 -0.23 0.00 -1.87 0.00 0.00 60.65 58.70 1zgq h LYS 83 Cb 0.54 -0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.76 1zgq h LYS 83 CO -0.74 0.70 -0.86 0.87 -0.57 0.00 0.00 179.45 178.85 1zgq h LYS 84 N 0.69 0.72 0.00 3.15 1.57 -1.70 -3.16 116.57 117.84 1zgq h LYS 84 Ca 0.15 -0.65 -0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1zgq h LYS 84 Cb 0.35 0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.81 1zgq h LYS 84 CO 0.01 1.25 -0.00 -0.07 -0.57 0.00 0.00 179.45 180.07 1zgq h LEU 85 N 0.47 0.00 -0.97 2.94 3.38 -0.99 -2.68 115.31 117.46 1zgq h LEU 85 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1zgq h LEU 85 Cb 1.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.25 1zgq h LEU 85 CO 0.17 0.00 0.00 0.77 0.09 0.00 0.00 178.44 179.47 1zgq h SER 86 N 0.00 0.00 -4.06 -0.43 4.64 -1.33 -3.45 113.55 108.91 1zgq h SER 86 Ca -0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 1zgq h SER 86 Cb 0.32 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.43 1zgq h SER 86 CO 0.00 0.00 0.30 -0.36 -0.87 0.00 0.00 176.83 175.90 1zgq s PHE 87 N -3.49 3.51 0.54 4.77 0.40 -1.01 -0.80 117.98 121.89 1zgq s PHE 87 Ca 0.03 1.27 0.28 0.00 -0.60 0.00 0.00 56.93 57.91 1zgq s PHE 87 Cb 0.08 -2.65 1.67 0.00 0.51 0.00 0.00 43.02 42.63 1zgq s PHE 87 CO 0.55 -0.38 2.20 -1.00 0.70 0.00 0.00 175.22 177.29 1zgq h PRO 88 N 0.63 0.00 0.05 0.24 0.13 -1.88 -3.45 132.00 127.72 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 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1zgq h PRO 88 CO 0.62 0.04 -0.02 1.49 -0.23 0.00 0.00 178.00 179.89 1zgq h GLU 89 N 0.00 -0.07 0.00 0.86 4.57 -1.93 -3.31 114.58 114.70 1zgq h GLU 89 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1zgq h GLU 89 Cb 0.09 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 1zgq h GLU 89 CO 0.00 0.02 0.00 0.41 -1.18 0.00 0.00 179.01 178.27 1zgq n GLY 90 N -0.93 -1.15 3.28 1.92 0.00 0.02 -4.48 105.19 103.85 1zgq n GLY 90 Ca -0.08 -2.12 -0.10 0.00 0.00 0.00 0.00 46.02 43.72 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 0.68 -0.00 1.61 -0.12 -0.78 -2.16 117.98 117.21 1zgq s PHE 91 Ca 0.00 -1.02 0.07 0.00 -0.05 0.00 0.00 56.93 55.93 1zgq s PHE 91 Cb 0.00 -0.26 -0.02 0.00 -0.63 0.00 0.00 43.02 42.11 1zgq s PHE 91 CO 0.00 -0.67 -0.23 0.15 -0.05 0.00 0.00 175.22 174.42 1zgq s LYS 92 N -4.03 1.82 0.04 1.99 1.02 -0.03 -0.39 119.74 120.15 1zgq s LYS 92 Ca 0.24 -0.88 0.07 0.00 0.02 0.00 0.00 55.97 55.42 1zgq s LYS 92 Cb 0.05 -1.81 -0.02 0.00 -0.52 0.00 0.00 37.83 35.53 1zgq s LYS 92 CO 0.04 0.49 -0.19 1.67 -0.92 0.00 0.00 175.35 176.44 1zgq s TRP 93 N -0.61 1.65 0.20 3.18 1.48 -0.70 -0.04 118.94 124.10 1zgq s TRP 93 Ca 0.09 -0.36 0.09 0.00 -1.06 0.00 0.00 56.10 54.86 1zgq s TRP 93 Cb -0.09 -0.99 -0.04 0.00 -1.16 0.00 0.00 33.47 31.18 1zgq s TRP 93 CO -0.00 0.07 -0.18 -1.21 -4.06 0.00 0.00 176.95 171.57 1zgq s GLU 94 N -1.10 1.36 -0.06 3.25 2.02 -0.03 -0.20 118.70 123.93 1zgq s GLU 94 Ca 0.06 -1.53 -0.22 0.00 0.02 0.00 0.00 54.97 53.31 1zgq s GLU 94 Cb -0.08 -1.35 0.05 0.00 0.10 0.00 0.00 34.13 32.84 1zgq s GLU 94 CO 0.01 0.26 0.49 0.50 0.02 0.00 0.00 175.26 176.54 1zgq s ARG 95 N -3.17 0.81 -0.09 1.61 3.52 -0.25 -0.92 118.95 120.47 1zgq s ARG 95 Ca 0.20 0.16 0.03 0.00 -0.13 0.00 0.00 55.73 55.98 1zgq s ARG 95 Cb -0.04 0.37 0.01 0.00 -1.56 0.00 0.00 34.95 33.73 1zgq s ARG 95 CO 0.08 -0.22 -0.17 0.08 -0.81 0.00 0.00 175.30 174.26 1zgq s VAL 96 N -0.97 1.56 -0.24 7.11 1.01 -0.31 -0.61 120.40 127.95 1zgq s VAL 96 Ca -0.10 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.18 1zgq s VAL 96 Cb -0.03 -1.39 0.04 0.00 0.00 0.00 0.00 36.38 35.01 1zgq s VAL 96 CO 0.06 0.45 -0.12 -0.04 0.00 0.00 0.00 175.10 175.45 1zgq s MET 97 N 0.65 2.52 -0.40 2.72 1.00 0.19 -1.12 119.30 124.87 1zgq s MET 97 Ca -0.14 -1.16 -0.13 0.00 0.00 0.00 0.00 55.69 54.26 1zgq s MET 97 Cb -0.16 -2.83 0.03 0.00 0.00 0.00 0.00 34.83 31.86 1zgq s MET 97 CO 0.04 -0.46 0.26 -0.80 0.00 0.00 0.00 175.02 174.06 1zgq s ASN 98 N 1.19 5.90 0.17 3.03 0.01 0.09 -1.75 114.94 123.58 1zgq s ASN 98 Ca -0.04 -1.00 -0.17 0.00 -0.71 0.00 0.00 52.86 50.94 1zgq s ASN 98 Cb -0.18 -2.08 -0.07 0.00 0.41 0.00 0.00 41.25 39.32 1zgq s ASN 98 CO -0.07 -0.43 0.63 -0.36 -1.51 0.00 0.00 177.10 175.35 1zgq s PHE 99 N 1.60 3.64 0.56 2.20 0.40 -0.23 -0.68 117.98 125.48 1zgq s PHE 99 Ca 0.03 1.22 0.42 0.00 -0.60 0.00 0.00 56.93 58.00 1zgq s PHE 99 Cb -0.20 -2.49 2.21 0.00 0.51 0.00 0.00 43.02 43.06 1zgq s PHE 99 CO 0.08 0.40 2.30 1.05 0.70 0.00 0.00 175.22 179.75 1zgq h GLU 100 N 3.57 0.00 -0.67 0.44 4.11 -1.68 -2.60 114.58 117.75 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 4.43 0.00 3.06 3.85 -1.26 -4.94 116.55 118.55 1zgq n ASP 101 Ca -0.02 -2.32 0.00 0.00 -0.71 0.00 0.00 54.79 51.74 1zgq n ASP 101 Cb 0.11 -0.55 0.00 0.00 -1.35 0.00 0.00 41.12 39.34 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 1.27 2.67 3.74 6.12 0.00 -0.98 -4.72 105.19 113.29 1zgq n GLY 102 Ca 0.25 0.00 -0.42 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 -2.58 2.10 -0.02 -0.02 0.00 -1.18 -4.74 107.32 100.88 1zgq s GLY 103 Ca 0.00 1.33 0.04 0.00 0.00 0.00 0.00 44.72 46.09 1zgq s GLY 103 CO 0.00 2.38 -0.13 0.14 0.00 0.00 0.00 173.10 175.49 1zgq s VAL 104 N 0.36 1.05 -0.02 1.40 1.01 -0.14 -1.06 120.40 123.00 1zgq s VAL 104 Ca 0.63 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 62.08 1zgq s VAL 104 Cb -0.42 -0.89 0.00 0.00 0.00 0.00 0.00 36.38 35.07 1zgq s VAL 104 CO 0.39 0.30 -0.08 -0.69 0.00 0.00 0.00 175.10 175.03 1zgq s VAL 105 N -0.17 0.69 -0.05 2.92 1.01 -0.72 -0.58 120.40 123.50 1zgq s VAL 105 Ca 0.02 -0.32 0.06 0.00 0.00 0.00 0.00 61.98 61.74 1zgq s VAL 105 Cb -0.07 -0.62 -0.01 0.00 0.00 0.00 0.00 36.38 35.69 1zgq s VAL 105 CO 0.00 0.22 -0.23 0.42 0.00 0.00 0.00 175.10 175.51 1zgq s THR 106 N 0.16 1.90 0.07 3.92 -4.23 -0.92 -0.64 115.64 115.90 1zgq s THR 106 Ca -0.02 -0.98 0.08 0.00 -1.18 0.00 0.00 61.69 59.59 1zgq s THR 106 Cb -0.07 -1.61 -0.03 0.00 1.34 0.00 0.00 72.50 72.13 1zgq s THR 106 CO 0.00 0.53 -0.21 -0.69 -0.54 0.00 0.00 174.62 173.71 1zgq s VAL 107 N -0.11 1.73 -0.03 2.29 1.01 0.22 -2.32 120.40 123.19 1zgq s VAL 107 Ca -0.04 -1.37 -0.01 0.00 0.00 0.00 0.00 61.98 60.56 1zgq s VAL 107 Cb -0.13 -1.53 0.03 0.00 0.00 0.00 0.00 36.38 34.75 1zgq s VAL 107 CO 0.03 0.10 0.05 0.28 0.00 0.00 0.00 175.10 175.57 1zgq s THR 108 N -0.96 -0.06 0.06 3.92 -1.32 -0.79 -1.09 115.64 115.41 1zgq s THR 108 Ca 0.07 0.21 0.01 0.00 -1.21 0.00 0.00 61.69 60.77 1zgq s THR 108 Cb -0.09 -0.11 -0.03 0.00 -1.51 0.00 0.00 72.50 70.75 1zgq s THR 108 CO 0.03 0.08 -0.06 -1.58 -2.21 0.00 0.00 174.62 170.89 1zgq s GLN 109 N 1.08 0.62 -0.08 7.08 -0.44 0.71 -1.39 119.66 127.24 1zgq s GLN 109 Ca -0.09 -1.03 0.02 0.00 -2.50 0.00 0.00 55.36 51.76 1zgq s GLN 109 Cb -0.12 -0.10 0.01 0.00 -1.64 0.00 0.00 33.01 31.16 1zgq s GLN 109 CO -0.04 -0.02 -0.13 0.34 0.50 0.00 0.00 175.29 175.94 1zgq s ASP 110 N -2.35 2.07 -0.17 6.67 2.15 -0.58 -1.73 116.67 122.73 1zgq s ASP 110 Ca 0.00 -0.35 0.01 0.00 0.43 0.00 0.00 52.55 52.64 1zgq s ASP 110 Cb -0.01 -0.93 0.01 0.00 -0.30 0.00 0.00 42.92 41.69 1zgq s ASP 110 CO -0.04 0.02 -0.18 -0.44 -0.17 0.00 0.00 175.17 174.36 1zgq s SER 111 N 0.86 3.38 0.35 -0.34 0.01 0.48 -1.61 113.70 116.83 1zgq s SER 111 Ca -0.10 -0.57 0.05 0.00 1.31 0.00 0.00 55.95 56.64 1zgq s SER 111 Cb -0.15 -1.52 -0.03 0.00 0.21 0.00 0.00 66.02 64.53 1zgq s SER 111 CO 0.01 0.04 0.19 -0.94 0.41 0.00 0.00 173.24 172.95 1zgq s SER 112 N 1.08 2.07 -0.13 2.44 1.04 -0.73 -1.86 113.70 117.60 1zgq s SER 112 Ca -0.00 -1.67 -0.01 0.00 0.48 0.00 0.00 55.95 54.75 1zgq s SER 112 Cb -0.14 0.49 0.03 0.00 0.10 0.00 0.00 66.02 66.50 1zgq s SER 112 CO -0.06 -0.96 -0.06 -0.22 0.98 0.00 0.00 173.24 172.92 1zgq s LEU 113 N -3.46 1.33 -0.13 2.42 2.96 -1.25 -1.00 118.68 119.55 1zgq s LEU 113 Ca 0.33 -0.45 -0.01 0.00 -0.22 0.00 0.00 54.13 53.77 1zgq s LEU 113 Cb 0.03 -0.84 0.04 0.00 0.50 0.00 0.00 46.19 45.91 1zgq s LEU 113 CO 0.20 -0.16 -0.04 -1.58 -1.32 0.00 0.00 176.35 173.45 1zgq s GLN 114 N 1.70 1.17 -1.37 1.98 2.00 -0.38 -4.86 119.66 119.90 1zgq s GLN 114 Ca 0.03 -0.28 -0.05 0.00 -2.00 0.00 0.00 55.36 53.06 1zgq s GLN 114 Cb -0.14 -1.65 0.03 0.00 0.80 0.00 0.00 33.01 32.05 1zgq s GLN 114 CO -0.08 -0.38 0.87 -0.25 -0.50 0.00 0.00 175.29 174.95 1zgq n ASP 115 N 4.98 -2.91 -0.02 6.67 8.00 -1.26 -2.36 116.55 129.65 1zgq n ASP 115 Ca -0.11 -0.76 -0.00 0.00 0.71 0.00 0.00 54.79 54.64 1zgq n ASP 115 Cb 0.49 -4.22 -0.00 0.00 -0.02 0.00 0.00 41.12 37.36 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 -1.61 0.40 3.11 0.44 0.00 -1.26 -5.02 105.19 101.26 1zgq n GLY 116 Ca -0.16 -0.04 -0.26 0.00 0.00 0.00 0.00 46.02 45.56 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 0.17 3.65 -0.20 0.00 2.99 -0.67 -1.24 117.98 122.68 1zgq s PHE 118 Ca -0.07 1.66 -0.02 0.00 0.00 0.00 0.00 56.93 58.51 1zgq s PHE 118 Cb -0.13 -3.23 0.00 0.00 0.00 0.00 0.00 43.02 39.67 1zgq s PHE 118 CO 0.03 -0.42 -0.11 0.42 -0.00 0.00 0.00 175.22 175.14 1zgq s ILE 119 N -0.46 2.83 -0.16 0.64 -1.09 -0.17 -1.36 121.20 121.43 1zgq s ILE 119 Ca 0.48 -0.68 -0.01 0.00 -2.23 0.00 0.00 60.65 58.20 1zgq s ILE 119 Cb -0.29 -2.25 -0.01 0.00 -1.58 0.00 0.00 42.46 38.33 1zgq s ILE 119 CO 0.35 0.48 -0.10 -0.31 -1.23 0.00 0.00 174.94 174.13 1zgq s TYR 120 N 1.33 2.87 -0.22 3.97 2.02 0.09 -1.77 117.35 125.64 1zgq s TYR 120 Ca 0.04 -0.73 0.02 0.00 -0.37 0.00 0.00 57.07 56.04 1zgq s TYR 120 Cb -0.14 -1.93 0.04 0.00 -0.40 0.00 0.00 41.96 39.53 1zgq s TYR 120 CO -0.06 -0.31 -0.15 0.15 -1.57 0.00 0.00 175.55 173.61 1zgq s LYS 121 N 0.69 2.60 -0.04 -0.62 -0.14 -0.63 -1.80 119.74 119.80 1zgq s LYS 121 Ca -0.05 -1.10 0.06 0.00 -1.36 0.00 0.00 55.97 53.51 1zgq s LYS 121 Cb -0.15 -2.74 -0.02 0.00 -1.68 0.00 0.00 37.83 33.24 1zgq s LYS 121 CO 0.02 -0.40 -0.20 0.08 -0.76 0.00 0.00 175.35 174.09 1zgq s VAL 122 N 1.19 2.56 -0.10 3.17 1.01 0.66 -1.53 120.40 127.37 1zgq s VAL 122 Ca -0.02 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.06 1zgq s VAL 122 Cb -0.17 -1.95 0.01 0.00 0.00 0.00 0.00 36.38 34.27 1zgq s VAL 122 CO -0.09 0.58 -0.15 -0.54 0.00 0.00 0.00 175.10 174.91 1zgq s LYS 123 N -0.64 2.15 -0.05 2.72 1.02 -0.49 -1.36 119.74 123.09 1zgq s LYS 123 Ca 0.10 -0.54 0.04 0.00 0.02 0.00 0.00 55.97 55.59 1zgq s LYS 123 Cb -0.10 -1.81 0.00 0.00 -0.52 0.00 0.00 37.83 35.40 1zgq s LYS 123 CO -0.00 -0.03 -0.16 0.12 -0.92 0.00 0.00 175.35 174.35 1zgq s PHE 124 N 0.90 1.68 -0.15 3.18 5.36 -0.84 -1.89 117.98 126.22 1zgq s PHE 124 Ca -0.09 -0.52 -0.02 0.00 -0.96 0.00 0.00 56.93 55.34 1zgq s PHE 124 Cb -0.15 -1.15 0.05 0.00 -0.34 0.00 0.00 43.02 41.43 1zgq s PHE 124 CO 0.00 -0.20 0.01 0.42 -1.46 0.00 0.00 175.22 173.99 1zgq s ILE 125 N 0.18 0.54 -0.18 3.12 1.01 -0.98 -1.52 121.20 123.37 1zgq s ILE 125 Ca -0.07 -0.31 -0.03 0.00 0.00 0.00 0.00 60.65 60.24 1zgq s ILE 125 Cb -0.13 -0.88 -0.01 0.00 0.01 0.00 0.00 42.46 41.45 1zgq s ILE 125 CO 0.03 0.00 -0.07 -0.83 0.00 0.00 0.00 174.94 174.07 1zgq s GLY 126 N 1.88 1.60 0.23 6.18 0.00 0.21 -2.16 107.32 115.26 1zgq s GLY 126 Ca 0.02 -1.01 0.04 0.00 0.00 0.00 0.00 44.72 43.76 1zgq s GLY 126 CO -0.07 0.13 -0.01 -1.34 0.00 0.00 0.00 173.10 171.81 1zgq s VAL 127 N 0.90 1.10 -1.81 1.40 -7.23 0.25 -1.51 120.40 113.49 1zgq s VAL 127 Ca -0.02 -2.04 0.00 0.00 -1.81 0.00 0.00 61.98 58.11 1zgq s VAL 127 Cb -0.15 -2.34 0.00 0.00 0.56 0.00 0.00 36.38 34.45 1zgq s VAL 127 CO 0.01 -0.33 0.00 -3.20 -0.31 0.00 0.00 175.10 171.27 1zgq n ASN 128 N -0.43 -5.64 -4.71 4.85 2.85 -1.26 -0.96 115.26 109.96 1zgq n ASN 128 Ca -0.05 0.12 -0.41 0.00 -0.11 0.00 0.00 54.58 54.12 1zgq n ASN 128 Cb 0.64 -4.76 -0.04 0.00 1.24 0.00 0.00 39.78 36.86 1zgq n ASN 128 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 1zgq s PHE 129 N -2.93 3.62 0.40 1.20 0.40 -1.26 -3.12 117.98 116.28 1zgq s PHE 129 Ca 0.00 1.49 -0.27 0.00 -0.60 0.00 0.00 56.93 57.55 1zgq s PHE 129 Cb 0.00 -2.97 -0.09 0.00 0.51 0.00 0.00 43.02 40.47 1zgq s PHE 129 CO 0.00 0.04 1.35 -2.14 0.70 0.00 0.00 175.22 175.17 1zgq s PRO 130 N 0.92 3.99 0.45 0.24 0.02 -1.26 -4.92 135.00 134.44 1zgq s PRO 130 Ca 0.45 2.27 0.12 0.00 0.02 0.00 0.00 61.00 63.86 1zgq s PRO 130 Cb -0.19 -2.81 1.02 0.00 0.02 0.00 0.00 34.50 32.53 1zgq s PRO 130 CO 0.23 -0.52 2.06 0.66 -0.33 0.00 0.00 177.00 179.10 1zgq h SER 131 N 2.75 0.18 -0.18 2.53 4.64 -1.99 -1.92 113.55 119.57 1zgq h SER 131 Ca -0.50 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 1zgq h SER 131 Cb 1.25 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1zgq h SER 131 CO 0.63 0.20 0.00 -0.90 -0.87 0.00 0.00 176.83 175.89 1zgq n ASP 132 N -4.44 2.83 -4.81 4.97 3.85 -1.26 -4.51 116.55 113.17 1zgq n ASP 132 Ca -0.01 -1.90 -0.30 0.00 -0.71 0.00 0.00 54.79 51.87 1zgq n ASP 132 Cb 0.14 -0.11 0.08 0.00 -1.35 0.00 0.00 41.12 39.88 1zgq n ASP 132 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 1zgq s GLY 133 N -1.75 1.63 0.61 6.12 0.00 -0.72 -4.84 107.32 108.37 1zgq s GLY 133 Ca 0.34 -0.17 0.32 0.00 0.00 0.00 0.00 44.72 45.20 1zgq s GLY 133 CO 0.31 0.23 2.20 -0.56 0.00 0.00 0.00 173.10 175.28 1zgq h PRO 134 N -0.99 0.00 0.14 2.90 0.13 -1.94 -1.80 132.00 130.44 1zgq h PRO 134 Ca -0.46 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1zgq h PRO 134 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1zgq h PRO 134 CO 0.59 0.00 -0.07 0.28 -0.23 0.00 0.00 178.00 178.58 1zgq h VAL 135 N 0.00 0.73 0.00 1.56 2.07 -1.93 -1.23 116.25 117.44 1zgq h VAL 135 Ca 0.03 -1.22 -0.02 0.00 0.82 0.00 0.00 66.70 66.32 1zgq h VAL 135 Cb 0.22 1.27 -0.00 0.00 -1.52 0.00 0.00 31.29 31.25 1zgq h VAL 135 CO -0.00 0.21 -0.08 0.24 0.02 0.00 0.00 177.57 177.96 1zgq h MET 136 N -0.94 0.00 -0.40 1.57 2.86 -1.76 0.26 114.93 116.52 1zgq h MET 136 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1zgq h MET 136 Cb 0.48 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.14 1zgq h MET 136 CO 0.03 0.08 0.00 1.04 1.06 0.00 0.00 176.91 179.12 1zgq n GLN 137 N -3.20 2.47 -3.76 1.72 1.13 -0.69 -4.55 117.38 110.50 1zgq n GLN 137 Ca 0.01 -2.27 -0.24 0.00 -1.94 0.00 0.00 57.00 52.56 1zgq n GLN 137 Cb 0.36 -1.50 0.02 0.00 0.11 0.00 0.00 30.24 29.23 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 1.44 -3.75 -0.13 -1.09 5.02 -1.03 -4.92 118.16 113.69 1zgq n LYS 138 Ca 0.19 0.53 0.12 0.00 -2.02 0.00 0.00 58.31 57.13 1zgq n LYS 138 Cb 0.59 -4.83 0.21 0.00 -0.02 0.00 0.00 35.03 30.98 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 -4.27 2.40 -3.20 1.97 5.02 -0.49 -4.97 118.16 114.62 1zgq n LYS 139 Ca -0.27 -2.09 -0.38 0.00 -2.02 0.00 0.00 58.31 53.55 1zgq n LYS 139 Cb 0.67 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 34.12 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 -1.65 4.65 -0.38 -0.18 -4.23 -1.25 -1.48 115.64 111.12 1zgq s THR 140 Ca 0.36 1.30 0.07 0.00 -1.18 0.00 0.00 61.69 62.24 1zgq s THR 140 Cb 0.22 -3.93 0.44 0.00 1.34 0.00 0.00 72.50 70.56 1zgq s THR 140 CO 0.31 0.49 1.13 0.23 -0.54 0.00 0.00 174.62 176.24 1zgq n MET 141 N 1.53 3.29 0.00 3.99 2.81 0.13 -4.92 117.12 123.95 1zgq n MET 141 Ca -0.08 -4.29 0.00 0.00 -1.81 0.00 0.00 57.70 51.52 1zgq n MET 141 Cb 0.50 -2.18 0.00 0.00 -0.71 0.00 0.00 33.22 30.84 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 -0.53 -1.01 3.88 3.03 0.00 -1.26 -4.59 105.19 104.71 1zgq n GLY 142 Ca 0.38 -1.62 -0.30 0.00 0.00 0.00 0.00 46.02 44.48 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 -2.57 3.47 0.48 1.61 0.52 -1.26 -1.53 118.94 119.66 1zgq s TRP 143 Ca 0.00 0.92 -0.05 0.00 0.02 0.00 0.00 56.10 56.99 1zgq s TRP 143 Cb 0.00 -2.34 -0.04 0.00 -1.15 0.00 0.00 33.47 29.94 1zgq s TRP 143 CO 0.00 -0.01 0.78 -1.21 0.02 0.00 0.00 176.95 176.53 1zgq s GLU 144 N -3.73 3.55 0.42 4.98 0.41 -0.83 -4.87 118.70 118.63 1zgq s GLU 144 Ca 0.49 0.20 -0.25 0.00 -0.41 0.00 0.00 54.97 55.00 1zgq s GLU 144 Cb -0.10 -2.38 -0.08 0.00 -1.78 0.00 0.00 34.13 29.79 1zgq s GLU 144 CO 0.30 -0.20 1.28 0.00 -0.49 0.00 0.00 175.26 176.16 1zgq s ALA 145 N -2.73 3.18 0.35 5.21 0.00 -1.26 -4.79 121.76 121.70 1zgq s ALA 145 Ca 0.47 1.19 0.07 0.00 0.00 0.00 0.00 51.96 53.69 1zgq s ALA 145 Cb -0.10 -3.47 -0.07 0.00 0.00 0.00 0.00 23.12 19.48 1zgq s ALA 145 CO 0.45 -0.83 -0.02 -1.54 0.00 0.00 0.00 175.76 173.81 1zgq s SER 146 N -0.86 3.27 -0.17 0.00 1.04 0.45 -4.98 113.70 112.44 1zgq s SER 146 Ca 0.59 -1.29 -0.02 0.00 0.48 0.00 0.00 55.95 55.71 1zgq s SER 146 Cb -0.37 -0.27 0.05 0.00 0.10 0.00 0.00 66.02 65.54 1zgq s SER 146 CO 0.46 -0.40 0.02 -0.89 0.98 0.00 0.00 173.24 173.41 1zgq s THR 147 N -2.88 0.58 0.06 2.02 2.01 -1.26 -0.98 115.64 115.19 1zgq s THR 147 Ca 0.33 -0.45 -0.20 0.00 0.31 0.00 0.00 61.69 61.69 1zgq s THR 147 Cb 0.07 -0.98 -0.06 0.00 0.01 0.00 0.00 72.50 71.53 1zgq s THR 147 CO 0.16 -0.08 0.58 -0.70 -0.69 0.00 0.00 174.62 173.89 1zgq s GLU 148 N 1.85 4.24 -0.29 4.92 2.12 0.15 -4.52 118.70 127.16 1zgq s GLU 148 Ca 0.00 0.75 -0.08 0.00 0.36 0.00 0.00 54.97 56.00 1zgq s GLU 148 Cb -0.16 -3.26 -0.01 0.00 0.26 0.00 0.00 34.13 30.96 1zgq s GLU 148 CO -0.07 0.57 0.12 0.50 -0.54 0.00 0.00 175.26 175.83 1zgq s ARG 149 N -0.88 3.38 0.20 4.30 3.00 0.32 -1.48 118.95 127.79 1zgq s ARG 149 Ca 0.30 -0.68 0.10 0.00 -1.00 0.00 0.00 55.73 54.45 1zgq s ARG 149 Cb -0.19 -3.46 -0.04 0.00 0.00 0.00 0.00 34.95 31.25 1zgq s ARG 149 CO 0.19 -0.36 -0.13 -0.51 0.00 0.00 0.00 175.30 174.49 1zgq s LEU 150 N 1.59 2.82 -0.04 -0.88 1.02 0.26 -0.90 118.68 122.55 1zgq s LEU 150 Ca 0.05 -0.69 -0.29 0.00 0.02 0.00 0.00 54.13 53.22 1zgq s LEU 150 Cb -0.17 -1.49 0.10 0.00 0.02 0.00 0.00 46.19 44.65 1zgq s LEU 150 CO 0.05 0.10 0.87 -0.72 0.02 0.00 0.00 176.35 176.66 1zgq s TYR 151 N -1.80 -0.41 0.21 0.29 -0.85 -0.83 -1.70 117.35 112.28 1zgq s TYR 151 Ca 0.25 0.45 -0.15 0.00 -0.52 0.00 0.00 57.07 57.10 1zgq s TYR 151 Cb -0.08 0.50 -0.08 0.00 0.38 0.00 0.00 41.96 42.68 1zgq s TYR 151 CO 0.14 -0.52 0.63 -1.25 -1.52 0.00 0.00 175.55 173.03 1zgq s PRO 152 N -2.38 4.01 -0.27 -3.49 0.04 -1.26 -1.83 135.00 129.83 1zgq s PRO 152 Ca 0.01 0.57 -0.25 0.00 0.04 0.00 0.00 61.00 61.37 1zgq s PRO 152 Cb -0.01 -2.77 0.11 0.00 0.04 0.00 0.00 34.50 31.87 1zgq s PRO 152 CO -0.04 0.36 0.93 0.50 0.04 0.00 0.00 177.00 178.80 1zgq s ARG 153 N -2.33 0.62 -1.46 4.56 3.52 0.08 -4.94 118.95 119.00 1zgq s ARG 153 Ca 0.44 0.69 -0.10 0.00 -0.13 0.00 0.00 55.73 56.62 1zgq s ARG 153 Cb -0.14 0.30 0.06 0.00 -1.56 0.00 0.00 34.95 33.61 1zgq s ARG 153 CO 0.20 -0.08 0.78 -3.47 -0.81 0.00 0.00 175.30 171.92 1zgq n ASP 154 N 2.25 -4.93 0.00 -2.12 4.64 -1.26 -1.42 116.55 113.72 1zgq n ASP 154 Ca -0.13 -0.55 0.00 0.00 -1.38 0.00 0.00 54.79 52.73 1zgq n ASP 154 Cb 0.56 -3.97 0.00 0.00 -1.04 0.00 0.00 41.12 36.67 1zgq n ASP 154 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1zgq n GLY 155 N -1.54 0.33 3.39 0.27 0.00 -1.26 -4.98 105.19 101.40 1zgq n GLY 155 Ca -0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.70 0.43 -0.16 1.61 -7.23 -0.51 -4.94 120.40 107.90 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 -2.48 -0.04 0.00 0.56 0.00 0.00 36.38 34.42 1zgq s VAL 156 CO 0.00 0.00 0.09 -0.22 -0.31 0.00 0.00 175.10 174.66 1zgq s LEU 157 N -3.46 4.02 0.19 1.32 2.96 -0.91 -0.74 118.68 122.07 1zgq s LEU 157 Ca 0.32 0.22 0.08 0.00 -0.22 0.00 0.00 54.13 54.54 1zgq s LEU 157 Cb 0.04 -2.00 -0.04 0.00 0.50 0.00 0.00 46.19 44.68 1zgq s LEU 157 CO 0.18 0.25 -0.17 -0.54 -1.32 0.00 0.00 176.35 174.75 1zgq s LYS 158 N -0.10 1.32 -0.25 1.98 1.02 -0.76 0.21 119.74 123.16 1zgq s LYS 158 Ca 0.08 -1.51 -0.24 0.00 0.02 0.00 0.00 55.97 54.32 1zgq s LYS 158 Cb -0.12 -1.26 0.07 0.00 -0.52 0.00 0.00 37.83 36.00 1zgq s LYS 158 CO 0.01 0.23 0.68 0.20 -0.92 0.00 0.00 175.35 175.55 1zgq s GLY 159 N -3.02 -0.51 0.05 -3.33 0.00 -0.07 -1.96 107.32 98.48 1zgq s GLY 159 Ca 0.20 1.90 0.07 0.00 0.00 0.00 0.00 44.72 46.89 1zgq s GLY 159 CO 0.07 1.63 -0.20 -0.54 0.00 0.00 0.00 173.10 174.06 1zgq s GLU 160 N 0.33 1.32 0.00 2.90 8.01 -0.08 0.19 118.70 131.38 1zgq s GLU 160 Ca -0.00 -0.96 0.00 0.00 0.01 0.00 0.00 54.97 54.02 1zgq s GLU 160 Cb -0.05 -1.45 -0.00 0.00 -4.31 0.00 0.00 34.13 28.32 1zgq s GLU 160 CO 0.01 0.37 -0.02 0.42 0.01 0.00 0.00 175.26 176.05 1zgq s ILE 161 N -0.85 0.11 -0.62 -1.63 1.01 -0.45 -0.52 121.20 118.24 1zgq s ILE 161 Ca 0.07 -0.18 -0.14 0.00 0.00 0.00 0.00 60.65 60.40 1zgq s ILE 161 Cb -0.09 -0.12 0.16 0.00 0.01 0.00 0.00 42.46 42.42 1zgq s ILE 161 CO 0.02 -0.04 0.56 -1.00 0.00 0.00 0.00 174.94 174.48 1zgq s HIS 162 N -0.23 3.44 0.32 3.97 3.76 -1.26 -0.57 115.29 124.74 1zgq s HIS 162 Ca -0.02 -1.66 0.07 0.00 -0.15 0.00 0.00 55.06 53.30 1zgq s HIS 162 Cb -0.02 -3.74 -0.01 0.00 1.11 0.00 0.00 32.58 29.92 1zgq s HIS 162 CO -0.00 -1.00 0.43 0.15 -0.85 0.00 0.00 174.74 173.47 1zgq s LYS 163 N 1.04 3.08 -0.14 1.40 1.02 0.08 -4.79 119.74 121.43 1zgq s LYS 163 Ca 0.09 -1.04 -0.15 0.00 0.02 0.00 0.00 55.97 54.89 1zgq s LYS 163 Cb -0.23 -2.77 0.04 0.00 -0.52 0.00 0.00 37.83 34.35 1zgq s LYS 163 CO -0.02 0.11 0.41 0.00 -0.92 0.00 0.00 175.35 174.93 1zgq s ALA 164 N -2.18 -1.01 -0.16 5.17 0.00 -1.26 -1.25 121.76 121.08 1zgq s ALA 164 Ca 0.43 1.08 -0.07 0.00 0.00 0.00 0.00 51.96 53.41 1zgq s ALA 164 Cb -0.09 -0.59 -0.04 0.00 0.00 0.00 0.00 23.12 22.40 1zgq s ALA 164 CO 0.30 -0.20 0.07 -0.51 0.00 0.00 0.00 175.76 175.42 1zgq s LEU 165 N 0.05 3.94 0.27 0.00 1.43 0.15 -1.97 118.68 122.55 1zgq s LEU 165 Ca -0.01 0.19 -0.29 0.00 -1.03 0.00 0.00 54.13 52.98 1zgq s LEU 165 Cb -0.03 -1.98 -0.09 0.00 0.03 0.00 0.00 46.19 44.12 1zgq s LEU 165 CO 0.01 0.26 0.99 -0.54 0.23 0.00 0.00 176.35 177.29 1zgq s LYS 166 N -0.12 4.74 0.17 1.70 1.02 -0.58 -0.55 119.74 126.12 1zgq s LYS 166 Ca 0.08 1.55 0.04 0.00 0.02 0.00 0.00 55.97 57.66 1zgq s LYS 166 Cb -0.12 -3.16 -0.04 0.00 -0.52 0.00 0.00 37.83 33.99 1zgq s LYS 166 CO 0.01 0.38 0.18 -0.51 -0.92 0.00 0.00 175.35 174.49 1zgq s LEU 167 N -1.43 3.96 0.15 3.17 1.43 -0.71 0.20 118.68 125.44 1zgq s LEU 167 Ca 0.44 -0.05 -0.13 0.00 -1.03 0.00 0.00 54.13 53.36 1zgq s LEU 167 Cb -0.26 -2.55 0.02 0.00 0.03 0.00 0.00 46.19 43.43 1zgq s LEU 167 CO 0.33 0.06 1.62 0.11 0.23 0.00 0.00 176.35 178.70 1zgq h LYS 168 N 2.27 0.84 -0.38 1.70 1.57 -1.60 -2.80 116.57 118.17 1zgq h LYS 168 Ca -0.48 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.06 1zgq h LYS 168 Cb 1.20 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.42 1zgq h LYS 168 CO 0.64 0.85 0.00 -0.25 -0.57 0.00 0.00 179.45 180.13 1zgq n ASP 169 N -4.38 1.83 0.00 0.86 9.92 -1.26 -4.98 116.55 118.54 1zgq n ASP 169 Ca 0.01 -2.06 0.00 0.00 -0.53 0.00 0.00 54.79 52.21 1zgq n ASP 169 Cb 0.28 -0.26 0.00 0.00 -0.64 0.00 0.00 41.12 40.50 1zgq n ASP 169 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1zgq n GLY 170 N 0.88 0.88 0.87 0.44 0.00 -1.06 -5.11 105.19 102.09 1zgq n GLY 170 Ca 0.10 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.34 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 0.89 -3.03 3.33 -0.02 0.00 -1.26 -4.58 105.19 100.53 1zgq n GLY 171 Ca 0.00 -1.87 -0.21 0.00 0.00 0.00 0.00 46.02 43.94 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 -0.67 1.78 -0.27 1.61 3.76 -1.26 -1.74 115.29 118.49 1zgq s HIS 172 Ca 0.00 -0.49 0.02 0.00 -0.15 0.00 0.00 55.06 54.44 1zgq s HIS 172 Cb 0.00 -0.87 0.07 0.00 1.11 0.00 0.00 32.58 32.89 1zgq s HIS 172 CO 0.00 0.33 -0.04 -0.47 -0.85 0.00 0.00 174.74 173.71 1zgq s TYR 173 N -2.26 2.88 0.21 1.40 5.04 0.29 -4.93 117.35 119.97 1zgq s TYR 173 Ca 0.17 -2.17 -0.29 0.00 -2.44 0.00 0.00 57.07 52.34 1zgq s TYR 173 Cb -0.05 -1.94 -0.08 0.00 0.35 0.00 0.00 41.96 40.24 1zgq s TYR 173 CO 0.07 -0.85 0.92 -0.51 -1.34 0.00 0.00 175.55 173.84 1zgq s LEU 174 N 1.22 4.62 -0.03 6.97 1.43 -1.26 -0.67 118.68 130.96 1zgq s LEU 174 Ca -0.03 1.87 -0.01 0.00 -1.03 0.00 0.00 54.13 54.94 1zgq s LEU 174 Cb -0.19 -3.56 0.03 0.00 0.03 0.00 0.00 46.19 42.50 1zgq s LEU 174 CO -0.07 0.13 0.06 -0.69 0.23 0.00 0.00 176.35 176.01 1zgq s VAL 175 N -0.98 -0.06 -0.22 -1.59 1.01 -0.38 -1.90 120.40 116.29 1zgq s VAL 175 Ca 0.41 0.21 -0.10 0.00 0.00 0.00 0.00 61.98 62.50 1zgq s VAL 175 Cb -0.25 -0.12 -0.05 0.00 0.00 0.00 0.00 36.38 35.96 1zgq s VAL 175 CO 0.31 0.09 0.14 -0.70 0.00 0.00 0.00 175.10 174.93 1zgq s GLU 176 N 1.11 4.11 -0.13 2.72 2.12 0.14 -0.74 118.70 128.04 1zgq s GLU 176 Ca -0.09 -0.25 -0.06 0.00 0.36 0.00 0.00 54.97 54.93 1zgq s GLU 176 Cb -0.13 -3.46 -0.04 0.00 0.26 0.00 0.00 34.13 30.76 1zgq s GLU 176 CO -0.04 0.18 0.08 -0.06 -0.54 0.00 0.00 175.26 174.88 1zgq s PHE 177 N 0.71 3.37 -0.25 5.30 0.40 0.27 -0.73 117.98 127.04 1zgq s PHE 177 Ca 0.07 0.31 -0.01 0.00 -0.60 0.00 0.00 56.93 56.70 1zgq s PHE 177 Cb -0.12 -1.93 0.08 0.00 0.51 0.00 0.00 43.02 41.55 1zgq s PHE 177 CO 0.01 0.50 0.05 0.15 0.70 0.00 0.00 175.22 176.63 1zgq s LYS 178 N -0.60 0.84 0.07 0.44 1.02 -0.27 -1.34 119.74 119.89 1zgq s LYS 178 Ca 0.11 -0.78 0.05 0.00 0.02 0.00 0.00 55.97 55.37 1zgq s LYS 178 Cb -0.12 -2.14 -0.04 0.00 -0.52 0.00 0.00 37.83 35.01 1zgq s LYS 178 CO 0.02 -0.77 -0.04 -1.12 -0.92 0.00 0.00 175.35 172.52 1zgq s SER 179 N 1.68 4.80 -0.10 2.83 0.01 0.13 -1.16 113.70 121.89 1zgq s SER 179 Ca 0.03 -0.22 0.00 0.00 1.31 0.00 0.00 55.95 57.07 1zgq s SER 179 Cb -0.17 -1.09 0.02 0.00 0.21 0.00 0.00 66.02 64.99 1zgq s SER 179 CO -0.15 0.20 -0.09 -0.63 0.41 0.00 0.00 173.24 172.99 1zgq s ILE 180 N -1.22 1.04 -0.23 1.44 1.09 -0.09 -0.89 121.20 122.33 1zgq s ILE 180 Ca 0.23 -0.33 -0.05 0.00 -1.10 0.00 0.00 60.65 59.40 1zgq s ILE 180 Cb -0.11 -1.03 -0.01 0.00 -1.06 0.00 0.00 42.46 40.25 1zgq s ILE 180 CO 0.15 0.36 -0.01 -0.31 -0.10 0.00 0.00 174.94 175.03 1zgq s TYR 181 N 1.40 3.01 -0.29 3.97 1.51 0.13 -0.85 117.35 126.24 1zgq s TYR 181 Ca -0.01 -0.86 0.03 0.00 -1.01 0.00 0.00 57.07 55.23 1zgq s TYR 181 Cb -0.13 -2.15 0.07 0.00 -0.11 0.00 0.00 41.96 39.64 1zgq s TYR 181 CO -0.05 -0.52 -0.04 -1.64 -1.11 0.00 0.00 175.55 172.19 1zgq s MET 182 N 1.50 1.86 0.22 -0.62 -1.94 0.93 -2.14 119.30 119.11 1zgq s MET 182 Ca 0.05 -1.47 -0.30 0.00 -1.71 0.00 0.00 55.69 52.26 1zgq s MET 182 Cb -0.15 -2.93 -0.10 0.00 2.01 0.00 0.00 34.83 33.67 1zgq s MET 182 CO -0.01 -0.71 1.45 0.00 -0.01 0.00 0.00 175.02 175.74 1zgq s ALA 183 N 1.09 3.65 0.52 3.03 0.00 -1.26 -0.85 121.76 127.94 1zgq s ALA 183 Ca -0.01 1.31 0.37 0.00 0.00 0.00 0.00 51.96 53.62 1zgq s ALA 183 Cb -0.19 -3.56 1.97 0.00 0.00 0.00 0.00 23.12 21.34 1zgq s ALA 183 CO -0.07 -0.73 2.24 0.87 0.00 0.00 0.00 175.76 178.07 1zgq h LYS 184 N 5.57 0.00 -3.87 0.00 1.57 -1.75 -3.41 116.57 114.68 1zgq h LYS 184 Ca -0.45 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.04 1zgq h LYS 184 Cb 1.21 0.00 -0.30 0.00 0.08 0.00 0.00 32.23 33.22 1zgq h LYS 184 CO 0.81 0.02 -0.74 0.15 -0.57 0.00 0.00 179.45 179.13 1zgq s LYS 185 N -4.17 0.18 -0.11 3.15 1.02 -1.26 -5.11 119.74 113.44 1zgq s LYS 185 Ca -0.04 -0.02 -0.34 0.00 0.02 0.00 0.00 55.97 55.60 1zgq s LYS 185 Cb 0.13 -0.24 -0.11 0.00 -0.52 0.00 0.00 37.83 37.09 1zgq s LYS 185 CO 0.49 -0.01 1.94 -2.30 -0.92 0.00 0.00 175.35 174.55 1zgq n PRO 186 N 3.36 2.14 -4.28 -1.68 -0.02 -1.26 -4.91 135.00 128.35 1zgq n PRO 186 Ca -0.17 0.76 -0.15 0.00 -2.02 0.00 0.00 63.50 61.92 1zgq n PRO 186 Cb 0.57 -2.70 -0.10 0.00 -0.02 0.00 0.00 33.50 31.24 1zgq n PRO 186 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1zgq s VAL 187 N 4.65 1.14 -0.07 -1.45 -7.23 -1.26 -5.10 120.40 111.08 1zgq s VAL 187 Ca 0.94 -2.06 -0.38 0.00 -1.81 0.00 0.00 61.98 58.68 1zgq s VAL 187 Cb -0.66 -2.02 -0.16 0.00 0.56 0.00 0.00 36.38 34.10 1zgq s VAL 187 CO 0.50 -0.60 1.54 1.67 -0.31 0.00 0.00 175.10 177.90 1zgq n GLN 188 N -0.28 1.23 -3.73 4.82 7.27 -1.26 -4.98 117.38 120.44 1zgq n GLN 188 Ca -0.08 0.45 -0.37 0.00 0.07 0.00 0.00 57.00 57.06 1zgq n GLN 188 Cb 0.62 -2.12 -0.06 0.00 2.41 0.00 0.00 30.24 31.09 1zgq n GLN 188 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1zgq s LEU 189 N 1.90 4.42 0.88 1.69 1.43 -1.26 -4.15 118.68 123.59 1zgq s LEU 189 Ca 0.90 0.66 -0.10 0.00 -1.03 0.00 0.00 54.13 54.57 1zgq s LEU 189 Cb -0.98 -2.29 0.18 0.00 0.03 0.00 0.00 46.19 43.13 1zgq s LEU 189 CO 0.54 0.37 1.20 -2.16 0.23 0.00 0.00 176.35 176.54 1zgq s PRO 190 N -1.09 0.93 0.00 1.29 0.04 -1.26 -4.86 135.00 130.06 1zgq s PRO 190 Ca 0.19 -0.78 0.00 0.00 0.04 0.00 0.00 61.00 60.45 1zgq s PRO 190 Cb -0.14 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.36 1zgq s PRO 190 CO 0.08 -2.10 0.00 0.41 0.04 0.00 0.00 177.00 175.43 1zgq n GLY 191 N -3.43 1.67 3.69 0.56 0.00 -1.26 -4.24 105.19 102.18 1zgq n GLY 191 Ca 0.16 -1.82 -0.42 0.00 0.00 0.00 0.00 46.02 43.94 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 2.29 3.07 0.37 1.61 5.04 -1.26 -4.34 117.35 124.12 1zgq s TYR 192 Ca 0.00 1.06 -0.13 0.00 -2.44 0.00 0.00 57.07 55.56 1zgq s TYR 192 Cb 0.00 -3.52 0.04 0.00 0.35 0.00 0.00 41.96 38.83 1zgq s TYR 192 CO 0.00 -1.76 0.70 1.52 -1.34 0.00 0.00 175.55 174.67 1zgq s TYR 193 N 2.24 0.34 0.11 4.97 -0.85 -0.69 -4.91 117.35 118.56 1zgq s TYR 193 Ca 0.59 -0.89 0.08 0.00 -0.52 0.00 0.00 57.07 56.33 1zgq s TYR 193 Cb -0.28 0.60 -0.04 0.00 0.38 0.00 0.00 41.96 42.62 1zgq s TYR 193 CO 0.24 -1.44 -0.20 0.71 -1.52 0.00 0.00 175.55 173.34 1zgq s TYR 194 N -2.61 1.78 -0.12 -3.49 1.51 0.41 -0.58 117.35 114.25 1zgq s TYR 194 Ca 0.19 -0.43 -0.00 0.00 -1.01 0.00 0.00 57.07 55.82 1zgq s TYR 194 Cb -0.04 -0.96 0.03 0.00 -0.11 0.00 0.00 41.96 40.88 1zgq s TYR 194 CO 0.13 0.22 -0.08 0.08 -1.11 0.00 0.00 175.55 174.80 1zgq s VAL 195 N -1.33 1.07 -0.10 0.71 1.01 -0.55 -0.28 120.40 120.93 1zgq s VAL 195 Ca 0.08 -0.34 -0.15 0.00 0.00 0.00 0.00 61.98 61.57 1zgq s VAL 195 Cb -0.09 -1.09 -0.05 0.00 0.00 0.00 0.00 36.38 35.15 1zgq s VAL 195 CO 0.05 0.36 0.37 -1.81 0.00 0.00 0.00 175.10 174.06 1zgq s ASP 196 N 1.69 6.60 0.04 3.32 1.01 -0.33 0.29 116.67 129.29 1zgq s ASP 196 Ca 0.05 0.71 0.01 0.00 0.71 0.00 0.00 52.55 54.03 1zgq s ASP 196 Cb -0.13 -2.22 -0.02 0.00 1.01 0.00 0.00 42.92 41.56 1zgq s ASP 196 CO -0.08 0.15 -0.06 -0.44 0.21 0.00 0.00 175.17 174.95 1zgq s SER 197 N 0.02 0.64 -0.23 0.27 0.01 -0.15 -1.34 113.70 112.92 1zgq s SER 197 Ca 0.21 -0.57 -0.03 0.00 1.31 0.00 0.00 55.95 56.87 1zgq s SER 197 Cb -0.14 0.07 0.10 0.00 0.21 0.00 0.00 66.02 66.25 1zgq s SER 197 CO 0.08 -0.26 0.22 -0.75 0.41 0.00 0.00 173.24 172.94 1zgq s LYS 198 N -1.72 0.21 -0.18 12.44 2.20 -0.22 -0.41 119.74 132.06 1zgq s LYS 198 Ca -0.11 0.02 -0.08 0.00 -0.36 0.00 0.00 55.97 55.44 1zgq s LYS 198 Cb -0.09 -1.11 -0.04 0.00 -1.51 0.00 0.00 37.83 35.08 1zgq s LYS 198 CO -0.01 -0.79 0.10 -1.17 -0.36 0.00 0.00 175.35 173.13 1zgq s LEU 199 N 2.30 4.07 -0.02 5.43 0.20 -1.26 -2.10 118.68 127.29 1zgq s LEU 199 Ca 0.07 0.21 0.05 0.00 0.69 0.00 0.00 54.13 55.15 1zgq s LEU 199 Cb -0.15 -2.03 -0.01 0.00 -0.43 0.00 0.00 46.19 43.56 1zgq s LEU 199 CO -0.20 0.22 -0.17 -1.81 -0.29 0.00 0.00 176.35 174.10 1zgq s ASP 200 N 0.13 2.05 -0.46 3.68 1.01 0.06 -4.59 116.67 118.56 1zgq s ASP 200 Ca 0.07 -0.32 -0.23 0.00 0.71 0.00 0.00 52.55 52.78 1zgq s ASP 200 Cb -0.12 -0.29 0.03 0.00 1.01 0.00 0.00 42.92 43.55 1zgq s ASP 200 CO -0.00 0.20 0.81 -0.63 0.21 0.00 0.00 175.17 175.76 1zgq s ILE 201 N -0.33 4.61 0.02 0.77 -1.09 -1.26 -1.28 121.20 122.64 1zgq s ILE 201 Ca 0.05 0.46 -0.18 0.00 -2.23 0.00 0.00 60.65 58.75 1zgq s ILE 201 Cb -0.07 -4.35 -0.31 0.00 -1.58 0.00 0.00 42.46 36.15 1zgq s ILE 201 CO -0.00 -0.75 1.02 0.71 -1.23 0.00 0.00 174.94 174.69 1zgq h THR 202 N 6.00 1.36 -2.55 2.92 1.35 -1.37 -3.48 112.91 117.14 1zgq h THR 202 Ca -0.25 -2.49 -0.07 0.00 -0.55 0.00 0.00 66.41 63.05 1zgq h THR 202 Cb 1.08 2.90 -0.18 0.00 -1.73 0.00 0.00 68.15 70.22 1zgq h THR 202 CO 0.98 0.74 0.02 -0.94 -0.25 0.00 0.00 175.52 176.07 1zgq s SER 203 N -7.28 -0.46 0.07 5.36 1.04 -1.18 -5.02 113.70 106.23 1zgq s SER 203 Ca -0.11 0.36 -0.26 0.00 0.48 0.00 0.00 55.95 56.42 1zgq s SER 203 Cb 0.04 0.47 0.08 0.00 0.10 0.00 0.00 66.02 66.70 1zgq s SER 203 CO 0.90 -0.62 0.68 -1.38 0.98 0.00 0.00 173.24 173.80 1zgq s HIS 204 N -1.73 -0.54 0.68 5.02 -0.00 -1.26 -0.47 115.29 117.00 1zgq s HIS 204 Ca -0.09 0.53 -0.02 0.00 -0.00 0.00 0.00 55.06 55.48 1zgq s HIS 204 Cb -0.01 0.51 0.09 0.00 -0.00 0.00 0.00 32.58 33.17 1zgq s HIS 204 CO 0.04 -0.73 0.95 0.54 -0.00 0.00 0.00 174.74 175.54 1zgq s ASN 205 N -2.25 4.66 0.21 7.38 4.22 -1.01 -4.99 114.94 123.16 1zgq s ASN 205 Ca -0.02 -0.05 -0.10 0.00 -2.14 0.00 0.00 52.86 50.54 1zgq s ASN 205 Cb -0.01 -0.52 0.29 0.00 1.28 0.00 0.00 41.25 42.29 1zgq s ASN 205 CO -0.06 -1.63 1.69 -0.08 -2.04 0.00 0.00 177.10 174.98 1zgq h GLU 206 N -0.41 0.19 -0.55 3.55 4.57 -2.03 -2.72 114.58 117.17 1zgq h GLU 206 Ca -0.40 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.77 1zgq h GLU 206 Cb 1.28 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.83 1zgq h GLU 206 CO 0.48 0.12 0.00 -0.40 -1.18 0.00 0.00 179.01 178.03 1zgq n ASP 207 N -5.19 3.01 -2.99 1.04 3.85 -1.26 -4.96 116.55 110.05 1zgq n ASP 207 Ca 0.09 -2.04 -0.22 0.00 -0.71 0.00 0.00 54.79 51.90 1zgq n ASP 207 Cb 0.33 -0.38 0.03 0.00 -1.35 0.00 0.00 41.12 39.75 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 1.06 -1.88 0.10 2.11 4.02 -1.03 -4.43 117.16 117.11 1zgq n TYR 208 Ca 0.18 0.47 0.07 0.00 -0.01 0.00 0.00 57.90 58.62 1zgq n TYR 208 Cb 0.49 -4.32 -0.01 0.00 -0.02 0.00 0.00 39.34 35.48 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 -1.23 0.21 -3.41 -0.72 1.35 -1.93 -3.43 112.91 103.76 1zgq h THR 209 Ca -0.52 -1.39 -0.56 0.00 -0.55 0.00 0.00 66.41 63.40 1zgq h THR 209 Cb 1.36 1.78 -0.39 0.00 -1.73 0.00 0.00 68.15 69.17 1zgq h THR 209 CO 0.57 0.12 -0.78 -0.63 -0.25 0.00 0.00 175.52 174.55 1zgq s ILE 210 N -3.19 1.05 0.00 6.82 1.01 -1.26 -0.98 121.20 124.66 1zgq s ILE 210 Ca -0.00 -0.77 0.04 0.00 0.00 0.00 0.00 60.65 59.91 1zgq s ILE 210 Cb 0.09 -1.35 -0.01 0.00 0.01 0.00 0.00 42.46 41.19 1zgq s ILE 210 CO 0.78 -0.04 -0.12 -0.69 0.00 0.00 0.00 174.94 174.87 1zgq s VAL 211 N 1.63 0.98 -0.09 2.92 1.01 -0.52 -2.41 120.40 123.93 1zgq s VAL 211 Ca -0.02 -0.61 0.04 0.00 0.00 0.00 0.00 61.98 61.39 1zgq s VAL 211 Cb -0.17 -0.83 -0.01 0.00 0.00 0.00 0.00 36.38 35.37 1zgq s VAL 211 CO -0.07 0.21 -0.22 -1.61 0.00 0.00 0.00 175.10 173.41 1zgq s GLU 212 N -0.46 2.89 0.18 2.72 2.02 0.39 0.21 118.70 126.65 1zgq s GLU 212 Ca 0.04 -0.84 0.08 0.00 0.02 0.00 0.00 54.97 54.27 1zgq s GLU 212 Cb -0.05 -2.32 -0.04 0.00 0.10 0.00 0.00 34.13 31.82 1zgq s GLU 212 CO -0.00 0.29 -0.17 -0.65 0.02 0.00 0.00 175.26 174.75 1zgq s GLN 213 N 0.08 1.31 0.01 1.61 -0.21 0.40 -0.93 119.66 121.95 1zgq s GLN 213 Ca -0.10 -1.49 0.03 0.00 0.02 0.00 0.00 55.36 53.82 1zgq s GLN 213 Cb -0.16 -1.29 -0.01 0.00 1.00 0.00 0.00 33.01 32.56 1zgq s GLN 213 CO 0.06 0.25 -0.09 -0.47 -2.12 0.00 0.00 175.29 172.92 1zgq s TYR 214 N -2.37 0.76 -0.06 0.91 5.04 -0.40 -1.59 117.35 119.64 1zgq s TYR 214 Ca 0.19 -0.24 -0.03 0.00 -2.44 0.00 0.00 57.07 54.55 1zgq s TYR 214 Cb -0.04 -0.47 0.04 0.00 0.35 0.00 0.00 41.96 41.84 1zgq s TYR 214 CO 0.07 -0.02 0.13 -2.00 -1.34 0.00 0.00 175.55 172.40 1zgq s GLU 215 N -0.62 0.07 -0.16 4.97 2.12 -0.30 -0.76 118.70 124.01 1zgq s GLU 215 Ca 0.00 0.37 -0.04 0.00 0.36 0.00 0.00 54.97 55.66 1zgq s GLU 215 Cb -0.05 -0.20 -0.03 0.00 0.26 0.00 0.00 34.13 34.11 1zgq s GLU 215 CO 0.00 -0.18 -0.02 0.50 -0.54 0.00 0.00 175.26 175.02 1zgq s ARG 216 N 1.29 3.72 -0.16 4.30 3.52 -0.89 -1.60 118.95 129.13 1zgq s ARG 216 Ca -0.08 -0.49 -0.06 0.00 -0.13 0.00 0.00 55.73 54.97 1zgq s ARG 216 Cb -0.12 -2.97 0.07 0.00 -1.56 0.00 0.00 34.95 30.37 1zgq s ARG 216 CO -0.06 0.23 0.34 -0.08 -0.81 0.00 0.00 175.30 174.92 1zgq s THR 217 N 0.41 -0.43 -0.01 4.11 -1.32 0.45 -1.05 115.64 117.80 1zgq s THR 217 Ca -0.03 0.20 0.02 0.00 -1.21 0.00 0.00 61.69 60.68 1zgq s THR 217 Cb -0.14 -0.55 -0.00 0.00 -1.51 0.00 0.00 72.50 70.30 1zgq s THR 217 CO 0.02 0.09 -0.06 -1.61 -2.21 0.00 0.00 174.62 170.85 1zgq s GLU 218 N 2.28 0.52 0.20 7.08 2.02 -0.45 -2.40 118.70 127.95 1zgq s GLU 218 Ca -0.02 -0.21 -0.10 0.00 0.02 0.00 0.00 54.97 54.66 1zgq s GLU 218 Cb -0.11 -0.51 -0.07 0.00 0.10 0.00 0.00 34.13 33.54 1zgq s GLU 218 CO -0.11 0.12 0.53 0.20 0.02 0.00 0.00 175.26 176.02 1zgq s GLY 219 N -0.07 2.32 0.16 -1.39 0.00 0.11 -1.19 107.32 107.26 1zgq s GLY 219 Ca 0.01 -0.27 -0.24 0.00 0.00 0.00 0.00 44.72 44.22 1zgq s GLY 219 CO -0.00 -0.10 0.86 1.09 0.00 0.00 0.00 173.10 174.95 1zgq s ARG 220 N -2.58 1.29 0.76 2.90 1.70 0.61 -4.37 118.95 119.26 1zgq s ARG 220 Ca 0.44 -0.67 -0.08 0.00 -0.47 0.00 0.00 55.73 54.96 1zgq s ARG 220 Cb -0.12 0.47 0.10 0.00 -0.57 0.00 0.00 34.95 34.82 1zgq s ARG 220 CO 0.21 -0.58 1.08 -1.01 -1.08 0.00 0.00 175.30 173.91 1zgq s HIS 221 N -3.45 2.48 0.51 5.89 3.76 -1.26 -0.44 115.29 122.77 1zgq s HIS 221 Ca 0.10 0.33 -0.21 0.00 -0.15 0.00 0.00 55.06 55.13 1zgq s HIS 221 Cb -0.02 -3.36 -0.06 0.00 1.11 0.00 0.00 32.58 30.24 1zgq s HIS 221 CO 0.00 -1.71 1.15 -1.58 -0.85 0.00 0.00 174.74 171.75 1zgq s HIS 222 N -3.37 2.75 0.41 1.40 2.46 -1.26 -4.77 115.29 112.90 1zgq s HIS 222 Ca 0.64 1.54 0.27 0.00 0.47 0.00 0.00 55.06 57.97 1zgq s HIS 222 Cb -0.09 -3.33 1.42 0.00 -0.13 0.00 0.00 32.58 30.45 1zgq s HIS 222 CO 0.46 -1.56 2.06 -0.07 -2.47 0.00 0.00 174.74 173.16 1zgq h LEU 223 N 1.55 0.00 -0.49 8.88 3.38 -2.04 -3.29 115.31 123.30 1zgq h LEU 223 Ca -0.50 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.41 1zgq h LEU 223 Cb 1.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 1zgq h LEU 223 CO 0.58 0.12 -0.29 -0.26 0.09 0.00 0.00 178.44 178.68 1zgq h PHE 224 N 0.00 0.00 0.00 1.13 -1.00 -2.06 -3.57 116.94 111.44 1zgq h PHE 224 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1zgq h PHE 224 Cb 0.34 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.90 1zgq h PHE 224 CO 0.00 0.29 0.00 1.28 -1.61 0.00 0.00 178.31 178.27