#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 0.20 -3.47 3.44 -1.51 -1.97 -3.42 116.25 109.52 1zgq h VAL 7 Ca 0.00 -1.28 -0.68 0.00 -1.23 0.00 0.00 66.70 63.51 1zgq h VAL 7 Cb 0.00 2.06 -0.17 0.00 -2.13 0.00 0.00 31.29 31.05 1zgq h VAL 7 CO 0.00 0.11 -0.02 -0.63 -1.23 0.00 0.00 177.57 175.81 1zgq s ILE 8 N -3.16 4.93 0.76 7.19 1.01 -1.26 -4.98 121.20 125.69 1zgq s ILE 8 Ca 0.06 -0.24 -0.09 0.00 0.00 0.00 0.00 60.65 60.38 1zgq s ILE 8 Cb 0.06 -4.18 0.08 0.00 0.01 0.00 0.00 42.46 38.44 1zgq s ILE 8 CO 0.70 -0.60 1.09 -0.54 0.00 0.00 0.00 174.94 175.59 1zgq s LYS 9 N 2.52 1.97 0.56 2.79 1.02 -1.26 -4.98 119.74 122.35 1zgq s LYS 9 Ca 0.17 -0.20 0.29 0.00 0.02 0.00 0.00 55.97 56.25 1zgq s LYS 9 Cb -0.17 -2.08 1.65 0.00 -0.52 0.00 0.00 37.83 36.71 1zgq s LYS 9 CO 0.15 -1.46 2.17 1.05 -0.92 0.00 0.00 175.35 176.34 1zgq h GLU 10 N -0.82 0.00 -4.13 1.68 4.11 -1.97 -3.40 114.58 110.05 1zgq h GLU 10 Ca -0.45 0.00 -0.47 0.00 0.07 0.00 0.00 59.36 58.52 1zgq h GLU 10 Cb 1.31 0.00 -0.35 0.00 0.50 0.00 0.00 28.75 30.21 1zgq h GLU 10 CO 0.59 0.06 -0.79 0.12 0.07 0.00 0.00 179.01 179.06 1zgq s PHE 11 N -4.41 1.07 -0.00 2.06 5.36 -1.26 -4.08 117.98 116.71 1zgq s PHE 11 Ca -0.04 -0.40 0.01 0.00 -0.96 0.00 0.00 56.93 55.55 1zgq s PHE 11 Cb 0.14 -0.91 -0.00 0.00 -0.34 0.00 0.00 43.02 41.90 1zgq s PHE 11 CO 0.56 -0.31 -0.05 -1.64 -1.46 0.00 0.00 175.22 172.32 1zgq s MET 12 N 1.23 0.40 0.25 10.12 -1.94 -0.55 -5.02 119.30 123.78 1zgq s MET 12 Ca -0.05 -0.17 0.07 0.00 -1.71 0.00 0.00 55.69 53.82 1zgq s MET 12 Cb -0.14 -0.39 -0.03 0.00 2.01 0.00 0.00 34.83 36.28 1zgq s MET 12 CO -0.02 0.10 0.24 1.03 -0.01 0.00 0.00 175.02 176.36 1zgq s ARG 13 N -0.09 3.05 0.06 2.03 0.52 -1.26 -1.76 118.95 121.49 1zgq s ARG 13 Ca 0.02 -0.98 -0.05 0.00 -0.52 0.00 0.00 55.73 54.19 1zgq s ARG 13 Cb -0.02 -2.64 -0.02 0.00 0.52 0.00 0.00 34.95 32.79 1zgq s ARG 13 CO -0.00 0.41 0.09 -0.59 0.02 0.00 0.00 175.30 175.23 1zgq s PHE 14 N -2.10 0.27 -0.05 -0.53 -0.12 0.84 -1.64 117.98 114.65 1zgq s PHE 14 Ca 0.33 -0.68 0.05 0.00 -0.05 0.00 0.00 56.93 56.58 1zgq s PHE 14 Cb -0.08 -0.18 -0.00 0.00 -0.63 0.00 0.00 43.02 42.12 1zgq s PHE 14 CO 0.26 -0.43 -0.20 0.15 -0.05 0.00 0.00 175.22 174.95 1zgq s LYS 15 N -3.37 2.08 0.01 1.99 1.02 -0.48 -0.44 119.74 120.56 1zgq s LYS 15 Ca 0.01 -0.71 0.04 0.00 0.02 0.00 0.00 55.97 55.34 1zgq s LYS 15 Cb 0.03 -1.77 -0.01 0.00 -0.52 0.00 0.00 37.83 35.56 1zgq s LYS 15 CO -0.08 0.28 -0.13 0.54 -0.92 0.00 0.00 175.35 175.04 1zgq s VAL 16 N 0.01 1.02 -0.02 3.17 0.11 0.01 -0.81 120.40 123.88 1zgq s VAL 16 Ca -0.05 -0.70 0.01 0.00 -2.93 0.00 0.00 61.98 58.31 1zgq s VAL 16 Cb -0.13 -0.88 0.02 0.00 -1.53 0.00 0.00 36.38 33.86 1zgq s VAL 16 CO 0.03 0.17 -0.03 -0.60 -3.33 0.00 0.00 175.10 171.34 1zgq s ARG 17 N -0.61 0.46 -0.05 1.54 3.52 -0.64 0.03 118.95 123.19 1zgq s ARG 17 Ca 0.03 -0.04 0.04 0.00 -0.13 0.00 0.00 55.73 55.63 1zgq s ARG 17 Cb -0.06 -0.53 0.00 0.00 -1.56 0.00 0.00 34.95 32.80 1zgq s ARG 17 CO 0.00 -0.05 -0.17 1.41 -0.81 0.00 0.00 175.30 175.68 1zgq s MET 18 N 0.64 1.89 -0.25 5.12 -2.45 0.76 -0.33 119.30 124.68 1zgq s MET 18 Ca -0.07 -0.60 0.02 0.00 -1.25 0.00 0.00 55.69 53.79 1zgq s MET 18 Cb -0.10 -1.60 0.05 0.00 1.25 0.00 0.00 34.83 34.43 1zgq s MET 18 CO -0.01 0.20 -0.11 -1.21 1.05 0.00 0.00 175.02 174.94 1zgq s GLU 19 N 0.18 2.37 0.27 4.11 2.02 -0.19 -0.82 118.70 126.65 1zgq s GLU 19 Ca -0.07 -1.26 0.02 0.00 0.02 0.00 0.00 54.97 53.67 1zgq s GLU 19 Cb -0.13 -2.88 -0.04 0.00 0.10 0.00 0.00 34.13 31.18 1zgq s GLU 19 CO 0.03 -0.52 0.13 0.20 0.02 0.00 0.00 175.26 175.12 1zgq s GLY 20 N 1.15 1.86 -0.13 -1.39 0.00 -0.40 -1.73 107.32 106.69 1zgq s GLY 20 Ca -0.07 -1.79 -0.06 0.00 0.00 0.00 0.00 44.72 42.80 1zgq s GLY 20 CO -0.06 -1.57 0.29 -1.59 0.00 0.00 0.00 173.10 170.17 1zgq s THR 21 N -3.73 -0.17 -0.09 0.90 2.01 -0.38 -0.95 115.64 113.22 1zgq s THR 21 Ca 0.37 0.18 -0.01 0.00 0.31 0.00 0.00 61.69 62.54 1zgq s THR 21 Cb 0.06 -0.45 0.03 0.00 0.01 0.00 0.00 72.50 72.15 1zgq s THR 21 CO 0.15 0.07 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.42 1zgq s VAL 22 N 1.67 0.77 -1.63 3.82 1.01 -0.68 0.19 120.40 125.55 1zgq s VAL 22 Ca -0.06 -0.13 -0.16 0.00 0.00 0.00 0.00 61.98 61.62 1zgq s VAL 22 Cb -0.11 -0.83 0.13 0.00 0.00 0.00 0.00 36.38 35.57 1zgq s VAL 22 CO -0.09 0.32 0.88 0.59 0.00 0.00 0.00 175.10 176.80 1zgq n ASN 23 N 4.95 -3.98 0.00 3.32 4.13 -0.82 -1.11 115.26 121.75 1zgq n ASN 23 Ca -0.11 -0.91 0.00 0.00 1.68 0.00 0.00 54.58 55.24 1zgq n ASN 23 Cb 0.50 -3.26 0.00 0.00 -1.54 0.00 0.00 39.78 35.48 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 -1.53 2.90 3.62 7.41 0.00 -1.26 -5.01 105.19 111.31 1zgq n GLY 24 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.05 2.93 0.21 1.61 5.04 -0.26 -5.02 115.29 117.75 1zgq s HIS 25 Ca 0.00 0.90 -0.22 0.00 -1.54 0.00 0.00 55.06 54.20 1zgq s HIS 25 Cb 0.00 -4.14 -0.08 0.00 0.04 0.00 0.00 32.58 28.39 1zgq s HIS 25 CO 0.00 -1.10 0.77 -1.21 -2.34 0.00 0.00 174.74 170.86 1zgq s GLU 26 N 4.15 4.40 0.18 2.88 2.02 -1.26 -1.68 118.70 129.39 1zgq s GLU 26 Ca 0.47 1.03 -0.16 0.00 0.02 0.00 0.00 54.97 56.33 1zgq s GLU 26 Cb -0.09 -3.00 0.02 0.00 0.10 0.00 0.00 34.13 31.16 1zgq s GLU 26 CO 0.25 0.44 0.47 -0.59 0.02 0.00 0.00 175.26 175.86 1zgq s PHE 27 N -1.40 -0.06 -0.02 1.61 -0.12 -0.13 -4.43 117.98 113.43 1zgq s PHE 27 Ca 0.41 -0.28 0.00 0.00 -0.05 0.00 0.00 56.93 57.01 1zgq s PHE 27 Cb -0.19 0.31 0.02 0.00 -0.63 0.00 0.00 43.02 42.53 1zgq s PHE 27 CO 0.23 -0.86 0.02 -1.21 -0.05 0.00 0.00 175.22 173.35 1zgq s GLU 28 N -3.88 0.03 -0.02 1.99 2.02 -0.53 -1.27 118.70 117.05 1zgq s GLU 28 Ca 0.09 0.13 0.06 0.00 0.02 0.00 0.00 54.97 55.27 1zgq s GLU 28 Cb 0.00 -0.24 -0.01 0.00 0.10 0.00 0.00 34.13 33.98 1zgq s GLU 28 CO -0.04 -0.13 -0.19 0.42 0.02 0.00 0.00 175.26 175.34 1zgq s ILE 29 N 0.85 1.50 0.06 -1.63 1.01 -0.00 -1.04 121.20 121.95 1zgq s ILE 29 Ca -0.07 -0.81 0.07 0.00 0.00 0.00 0.00 60.65 59.84 1zgq s ILE 29 Cb -0.10 -1.25 -0.03 0.00 0.01 0.00 0.00 42.46 41.09 1zgq s ILE 29 CO -0.02 0.42 -0.19 -1.61 0.00 0.00 0.00 174.94 173.54 1zgq s GLU 30 N -0.42 1.18 0.20 2.79 2.02 -0.07 -0.17 118.70 124.23 1zgq s GLU 30 Ca 0.07 -0.98 -0.23 0.00 0.02 0.00 0.00 54.97 53.85 1zgq s GLU 30 Cb -0.08 -1.32 0.05 0.00 0.10 0.00 0.00 34.13 32.89 1zgq s GLU 30 CO -0.01 0.32 0.67 0.20 0.02 0.00 0.00 175.26 176.47 1zgq s GLY 31 N -1.44 -0.38 -0.02 -1.39 0.00 0.10 -0.43 107.32 103.76 1zgq s GLY 31 Ca 0.05 0.17 0.04 0.00 0.00 0.00 0.00 44.72 44.98 1zgq s GLY 31 CO 0.02 0.06 -0.12 -0.54 0.00 0.00 0.00 173.10 172.53 1zgq s GLU 32 N -3.77 1.07 0.20 2.90 2.02 -0.67 -0.81 118.70 119.63 1zgq s GLU 32 Ca 0.06 -0.42 -0.01 0.00 0.02 0.00 0.00 54.97 54.61 1zgq s GLU 32 Cb -0.03 -1.01 -0.04 0.00 0.10 0.00 0.00 34.13 33.15 1zgq s GLU 32 CO -0.04 0.23 0.12 0.20 0.02 0.00 0.00 175.26 175.78 1zgq s GLY 33 N -0.14 1.42 0.17 -1.39 0.00 0.42 -0.72 107.32 107.07 1zgq s GLY 33 Ca 0.02 -1.69 -0.18 0.00 0.00 0.00 0.00 44.72 42.87 1zgq s GLY 33 CO 0.00 -1.41 0.49 -1.83 0.00 0.00 0.00 173.10 170.35 1zgq s GLU 34 N -4.14 1.26 0.00 2.90 -1.05 -0.52 -0.12 118.70 117.03 1zgq s GLU 34 Ca 0.37 -0.76 0.00 0.00 -0.15 0.00 0.00 54.97 54.44 1zgq s GLU 34 Cb 0.07 0.51 0.00 0.00 -0.44 0.00 0.00 34.13 34.27 1zgq s GLU 34 CO 0.11 -0.52 0.00 0.41 0.95 0.00 0.00 175.26 176.21 1zgq n GLY 35 N -0.31 -1.68 3.08 -3.83 0.00 -0.73 -0.22 105.19 101.50 1zgq n GLY 35 Ca -0.13 -1.09 -0.34 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 -1.60 1.77 0.40 1.61 0.52 -0.08 -1.48 118.95 120.09 1zgq s ARG 36 Ca 0.00 -1.84 0.16 0.00 -0.52 0.00 0.00 55.73 53.53 1zgq s ARG 36 Cb 0.00 -3.42 1.04 0.00 0.52 0.00 0.00 34.95 33.10 1zgq s ARG 36 CO 0.00 -1.01 1.82 -1.35 0.02 0.00 0.00 175.30 174.78 1zgq h PRO 37 N 7.86 0.44 -0.06 3.54 0.11 -1.80 -1.81 132.00 140.27 1zgq h PRO 37 Ca -0.09 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.99 1zgq h PRO 37 Cb 1.04 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1zgq h PRO 37 CO 0.62 0.29 0.00 0.66 -0.21 0.00 0.00 178.00 179.36 1zgq n TYR 38 N -4.57 0.06 0.22 0.65 4.02 -1.26 -4.03 117.16 112.24 1zgq n TYR 38 Ca 0.21 -0.03 0.03 0.00 -0.01 0.00 0.00 57.90 58.10 1zgq n TYR 38 Cb 0.73 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 40.01 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 0.62 4.03 -1.77 -0.72 -0.58 -0.73 -4.82 120.64 116.66 1zgq n GLU 39 Ca 0.17 -0.01 -0.03 0.00 -0.42 0.00 0.00 57.16 56.87 1zgq n GLU 39 Cb 0.44 -0.85 -0.00 0.00 -0.57 0.00 0.00 31.44 30.45 1zgq n GLU 39 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1zgq n GLY 40 N 1.36 0.35 3.24 0.62 0.00 -0.88 -4.79 105.19 105.09 1zgq n GLY 40 Ca 0.01 -0.81 -0.30 0.00 0.00 0.00 0.00 46.02 44.91 1zgq n GLY 40 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1zgq s HIS 41 N -2.14 2.20 -0.11 1.61 3.76 -1.20 -0.88 115.29 118.52 1zgq s HIS 41 Ca 0.00 -0.59 -0.26 0.00 -0.15 0.00 0.00 55.06 54.06 1zgq s HIS 41 Cb 0.00 -1.44 0.06 0.00 1.11 0.00 0.00 32.58 32.31 1zgq s HIS 41 CO 0.00 -0.16 0.63 0.54 -0.85 0.00 0.00 174.74 174.90 1zgq s ASN 42 N -0.22 -0.62 0.20 1.40 6.03 -0.90 -0.90 114.94 119.93 1zgq s ASN 42 Ca -0.00 0.86 0.08 0.00 -1.03 0.00 0.00 52.86 52.77 1zgq s ASN 42 Cb -0.12 0.79 -0.05 0.00 -3.03 0.00 0.00 41.25 38.84 1zgq s ASN 42 CO 0.02 -0.46 -0.16 0.42 -2.03 0.00 0.00 177.10 174.89 1zgq s THR 43 N -0.68 1.84 -0.19 0.54 -4.23 0.69 -1.29 115.64 112.32 1zgq s THR 43 Ca -0.07 -2.16 -0.15 0.00 -1.18 0.00 0.00 61.69 58.12 1zgq s THR 43 Cb -0.02 -2.02 0.05 0.00 1.34 0.00 0.00 72.50 71.85 1zgq s THR 43 CO 0.06 -0.51 0.49 0.54 -0.54 0.00 0.00 174.62 174.66 1zgq s VAL 44 N -2.71 -0.01 -0.20 2.29 0.11 -0.71 -1.44 120.40 117.74 1zgq s VAL 44 Ca 0.22 0.02 -0.04 0.00 -2.93 0.00 0.00 61.98 59.25 1zgq s VAL 44 Cb -0.02 -0.70 -0.01 0.00 -1.53 0.00 0.00 36.38 34.11 1zgq s VAL 44 CO 0.08 0.01 -0.04 -0.75 -3.33 0.00 0.00 175.10 171.07 1zgq s LYS 45 N 0.67 3.46 0.14 1.54 2.20 0.10 -0.63 119.74 127.22 1zgq s LYS 45 Ca -0.03 -0.60 0.08 0.00 -0.36 0.00 0.00 55.97 55.06 1zgq s LYS 45 Cb -0.05 -2.98 -0.04 0.00 -1.51 0.00 0.00 37.83 33.25 1zgq s LYS 45 CO -0.05 -0.08 -0.09 -0.51 -0.36 0.00 0.00 175.35 174.27 1zgq s LEU 46 N 1.18 3.04 -0.06 5.43 2.01 0.12 -1.67 118.68 128.73 1zgq s LEU 46 Ca 0.02 -0.47 -0.03 0.00 0.01 0.00 0.00 54.13 53.67 1zgq s LEU 46 Cb -0.14 -1.78 0.04 0.00 0.01 0.00 0.00 46.19 44.32 1zgq s LEU 46 CO -0.01 0.14 0.12 -0.75 1.01 0.00 0.00 176.35 176.86 1zgq s LYS 47 N -2.55 0.01 -0.53 1.70 2.20 0.43 -1.70 119.74 119.30 1zgq s LYS 47 Ca 0.23 0.45 -0.29 0.00 -0.36 0.00 0.00 55.97 56.01 1zgq s LYS 47 Cb -0.10 -0.31 0.03 0.00 -1.51 0.00 0.00 37.83 35.94 1zgq s LYS 47 CO 0.15 -0.27 1.21 0.08 -0.36 0.00 0.00 175.35 176.15 1zgq s VAL 48 N 1.94 4.05 -0.06 4.02 1.01 -0.45 -0.89 120.40 130.03 1zgq s VAL 48 Ca 0.00 1.00 0.13 0.00 0.00 0.00 0.00 61.98 63.11 1zgq s VAL 48 Cb -0.12 -4.62 -0.11 0.00 0.00 0.00 0.00 36.38 31.53 1zgq s VAL 48 CO -0.05 -1.17 1.10 0.71 0.00 0.00 0.00 175.10 175.70 1zgq h THR 49 N 6.23 0.96 -3.31 3.92 1.35 -1.42 -3.44 112.91 117.19 1zgq h THR 49 Ca -0.25 -2.51 -0.18 0.00 -0.55 0.00 0.00 66.41 62.92 1zgq h THR 49 Cb 1.06 2.41 -0.26 0.00 -1.73 0.00 0.00 68.15 69.63 1zgq h THR 49 CO 1.16 0.54 -0.51 -0.75 -0.25 0.00 0.00 175.52 175.72 1zgq s LYS 50 N -2.83 0.22 0.00 4.72 2.20 -1.08 -4.90 119.74 118.07 1zgq s LYS 50 Ca -0.00 0.22 0.00 0.00 -0.36 0.00 0.00 55.97 55.83 1zgq s LYS 50 Cb 0.09 0.11 0.00 0.00 -1.51 0.00 0.00 37.83 36.51 1zgq s LYS 50 CO 0.79 -0.03 0.00 0.41 -0.36 0.00 0.00 175.35 176.17 1zgq n GLY 51 N 2.92 0.62 3.83 5.54 0.00 -1.26 -1.45 105.19 115.40 1zgq n GLY 51 Ca -0.13 -0.39 -0.36 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.36 2.53 0.44 -0.02 0.00 -1.26 -4.07 107.32 102.58 1zgq s GLY 52 Ca 0.00 -0.03 -0.21 0.00 0.00 0.00 0.00 44.72 44.49 1zgq s GLY 52 CO 0.00 0.29 0.95 2.56 0.00 0.00 0.00 173.10 176.91 1zgq s PRO 53 N -1.86 4.20 0.02 2.90 0.04 -1.26 -5.13 135.00 133.92 1zgq s PRO 53 Ca 0.38 1.10 -0.30 0.00 0.04 0.00 0.00 61.00 62.22 1zgq s PRO 53 Cb -0.16 -2.18 -0.05 0.00 0.04 0.00 0.00 34.50 32.15 1zgq s PRO 53 CO 0.20 -0.06 1.23 -0.51 0.04 0.00 0.00 177.00 177.90 1zgq s LEU 54 N -3.28 4.34 -0.02 -3.56 1.43 -1.26 -4.93 118.68 111.40 1zgq s LEU 54 Ca 0.62 1.99 0.04 0.00 -1.03 0.00 0.00 54.13 55.74 1zgq s LEU 54 Cb -0.09 -3.57 0.15 0.00 0.03 0.00 0.00 46.19 42.71 1zgq s LEU 54 CO 0.15 -0.54 0.99 -0.81 0.23 0.00 0.00 176.35 176.37 1zgq n PRO 55 N 4.45 1.54 -4.25 1.29 -0.04 -1.26 -4.87 135.00 131.86 1zgq n PRO 55 Ca 0.10 -0.61 -0.14 0.00 -0.04 0.00 0.00 63.50 62.81 1zgq n PRO 55 Cb 0.46 -1.33 -0.10 0.00 -0.04 0.00 0.00 33.50 32.49 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 -1.63 1.26 0.12 0.54 -0.12 -1.26 -4.62 117.98 112.27 1zgq s PHE 56 Ca 0.11 -1.07 -0.31 0.00 -0.05 0.00 0.00 56.93 55.61 1zgq s PHE 56 Cb 0.07 -0.72 -0.10 0.00 -0.63 0.00 0.00 43.02 41.64 1zgq s PHE 56 CO 0.06 -0.26 1.82 0.00 -0.05 0.00 0.00 175.22 176.78 1zgq s ALA 57 N -3.71 3.77 0.34 1.99 0.00 0.79 -4.90 121.76 120.03 1zgq s ALA 57 Ca 0.27 1.44 0.02 0.00 0.00 0.00 0.00 51.96 53.69 1zgq s ALA 57 Cb 0.06 -3.76 0.61 0.00 0.00 0.00 0.00 23.12 20.04 1zgq s ALA 57 CO 0.06 -1.21 1.97 2.35 0.00 0.00 0.00 175.76 178.93 1zgq h TRP 58 N 8.53 0.88 -1.43 0.00 2.91 -1.95 -3.18 115.95 121.71 1zgq h TRP 58 Ca -0.46 0.02 0.42 0.00 1.13 0.00 0.00 58.89 60.00 1zgq h TRP 58 Cb 1.22 -0.29 -0.07 0.00 -0.51 0.00 0.00 29.16 29.50 1zgq h TRP 58 CO 0.79 0.51 1.01 -0.44 -1.03 0.00 0.00 178.44 179.27 1zgq h ASP 59 N 0.91 0.06 1.27 2.65 3.32 -1.95 0.72 116.42 123.41 1zgq h ASP 59 Ca 0.30 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.37 1zgq h ASP 59 Cb 0.06 0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.63 1zgq h ASP 59 CO -0.09 -0.01 0.00 0.16 -1.72 0.00 0.00 179.24 177.58 1zgq h ILE 60 N 0.04 0.00 0.00 0.35 3.07 -1.96 -3.13 117.51 115.88 1zgq h ILE 60 Ca 0.71 -0.62 -0.19 0.00 1.55 0.00 0.00 64.86 66.31 1zgq h ILE 60 Cb 2.69 1.60 -0.03 0.00 -0.27 0.00 0.00 36.82 40.80 1zgq h ILE 60 CO -0.08 0.00 -1.77 0.18 -1.05 0.00 0.00 178.15 175.44 1zgq n LEU 61 N -3.01 0.49 -0.33 0.16 4.77 0.23 -4.49 117.00 114.82 1zgq n LEU 61 Ca 0.02 0.22 0.11 0.00 -0.03 0.00 0.00 56.01 56.32 1zgq n LEU 61 Cb 0.36 0.17 0.28 0.00 -2.33 0.00 0.00 43.42 41.90 1zgq n LEU 61 CO 0.29 0.21 1.16 0.77 -1.33 0.00 0.00 177.39 178.48 1zgq h SER 62 N 0.00 0.68 -0.10 -1.43 4.64 -1.45 -1.72 113.55 114.17 1zgq h SER 62 Ca -0.23 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 1zgq h SER 62 Cb 1.65 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.72 1zgq h SER 62 CO 0.03 0.25 0.00 -2.65 -0.87 0.00 0.00 176.83 173.60 1zgq n PRO 63 N -4.81 1.48 0.00 4.77 -0.02 -1.26 -3.34 135.00 131.81 1zgq n PRO 63 Ca 0.21 -0.46 0.08 0.00 -2.02 0.00 0.00 63.50 61.31 1zgq n PRO 63 Cb 0.52 -1.42 -0.02 0.00 -0.02 0.00 0.00 33.50 32.56 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 -0.00 1.71 -2.17 -0.52 1.13 -0.65 -4.89 117.38 111.98 1zgq n GLN 64 Ca 0.04 -0.64 -0.39 0.00 -1.94 0.00 0.00 57.00 54.08 1zgq n GLN 64 Cb 0.29 -1.27 0.01 0.00 0.11 0.00 0.00 30.24 29.38 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 -0.39 2.68 0.00 1.08 3.01 -1.21 -4.99 117.46 117.63 1zgq n PHE 65 Ca 0.06 -2.44 0.00 0.00 1.01 0.00 0.00 57.45 56.08 1zgq n PHE 65 Cb 0.32 -1.31 0.00 0.00 -0.01 0.00 0.00 39.48 38.49 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 0.14 0.00 0.00 4.37 3.41 -1.26 -5.05 113.62 115.22 1zgq n SER 69 Ca 0.52 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 59.19 1zgq n SER 69 Cb 0.28 0.00 0.39 0.00 -0.26 0.00 0.00 64.21 64.62 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 0.59 0.09 4.33 4.76 -1.26 -1.96 118.16 124.71 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 -1.35 0.44 0.00 -1.84 0.00 0.00 35.03 32.28 1zgq n LYS 70 CO 0.00 0.00 0.00 1.55 -1.37 0.00 0.00 177.40 177.58 1zgq n VAL 71 N -0.85 0.56 1.34 -0.18 3.14 -1.26 -2.73 118.33 118.35 1zgq n VAL 71 Ca 0.10 -0.16 0.11 0.00 -2.96 0.00 0.00 64.34 61.43 1zgq n VAL 71 Cb 0.05 -0.67 0.41 0.00 -1.06 0.00 0.00 33.84 32.57 1zgq n VAL 71 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 1zgq n TYR 72 N -2.14 0.16 -2.36 1.45 4.02 -0.83 -4.79 117.16 112.67 1zgq n TYR 72 Ca 0.05 -0.08 -0.42 0.00 -0.01 0.00 0.00 57.90 57.44 1zgq n TYR 72 Cb 0.38 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.67 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 -1.84 3.95 -0.11 -0.72 1.01 -1.11 -3.37 120.40 118.22 1zgq s VAL 73 Ca 0.33 1.35 -0.30 0.00 0.00 0.00 0.00 61.98 63.36 1zgq s VAL 73 Cb 0.17 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1zgq s VAL 73 CO 0.27 0.05 1.37 -0.75 0.00 0.00 0.00 175.10 176.03 1zgq s LYS 74 N 1.75 4.24 -0.09 2.72 2.20 -0.89 -4.82 119.74 124.85 1zgq s LYS 74 Ca 0.60 1.82 0.04 0.00 -0.36 0.00 0.00 55.97 58.07 1zgq s LYS 74 Cb -0.29 -3.78 -0.01 0.00 -1.51 0.00 0.00 37.83 32.25 1zgq s LYS 74 CO 0.26 -0.70 -0.22 -1.01 -0.36 0.00 0.00 175.35 173.33 1zgq s HIS 75 N 3.38 2.59 0.67 4.03 3.76 -1.26 0.49 115.29 128.94 1zgq s HIS 75 Ca 0.60 -0.85 -0.13 0.00 -0.15 0.00 0.00 55.06 54.53 1zgq s HIS 75 Cb -0.26 -1.71 -0.00 0.00 1.11 0.00 0.00 32.58 31.72 1zgq s HIS 75 CO 0.20 -0.30 1.07 -1.25 -0.85 0.00 0.00 174.74 173.61 1zgq s PRO 76 N 0.18 2.95 0.40 8.40 0.04 -1.26 -4.93 135.00 140.77 1zgq s PRO 76 Ca -0.13 1.14 0.15 0.00 0.04 0.00 0.00 61.00 62.20 1zgq s PRO 76 Cb -0.16 -1.98 1.01 0.00 0.04 0.00 0.00 34.50 33.40 1zgq s PRO 76 CO 0.07 -1.10 1.84 0.00 0.04 0.00 0.00 177.00 177.85 1zgq h ALA 77 N -0.26 2.10 0.00 8.56 0.00 -2.00 -2.29 119.26 125.36 1zgq h ALA 77 Ca -0.45 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1zgq h ALA 77 Cb 1.22 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1zgq h ALA 77 CO 0.56 -0.40 0.00 -0.40 0.00 0.00 0.00 179.25 179.01 1zgq n ASP 78 N -4.55 0.00 -4.18 0.00 5.75 -1.26 -4.49 116.55 107.81 1zgq n ASP 78 Ca 0.20 0.04 -0.36 0.00 -0.01 0.00 0.00 54.79 54.66 1zgq n ASP 78 Cb 0.67 -0.32 -0.13 0.00 -1.03 0.00 0.00 41.12 40.30 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 -2.65 3.16 -0.08 2.12 1.01 -0.86 -5.01 121.20 118.90 1zgq s ILE 79 Ca 0.21 -1.44 -0.36 0.00 0.00 0.00 0.00 60.65 59.07 1zgq s ILE 79 Cb 0.16 -2.87 -0.14 0.00 0.01 0.00 0.00 42.46 39.63 1zgq s ILE 79 CO 0.39 -0.20 1.74 -2.65 0.00 0.00 0.00 174.94 174.21 1zgq n PRO 80 N 4.65 1.81 -2.78 2.79 -0.02 -1.26 -4.59 135.00 135.60 1zgq n PRO 80 Ca -0.11 0.66 -0.44 0.00 -2.02 0.00 0.00 63.50 61.59 1zgq n PRO 80 Cb 0.43 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 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 5.36 5.15 -0.27 2.55 -0.08 -1.26 -4.36 116.55 123.63 1zgq n ASP 81 Ca 0.22 -2.99 0.02 0.00 -1.51 0.00 0.00 54.79 50.53 1zgq n ASP 81 Cb 0.24 -1.57 0.10 0.00 2.34 0.00 0.00 41.12 42.23 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 6.89 -0.36 -0.47 -0.67 3.20 -1.90 -0.38 116.97 123.28 1zgq h TYR 82 Ca 0.35 0.07 -0.09 0.00 3.14 0.00 0.00 58.73 62.20 1zgq h TYR 82 Cb 0.82 0.28 -0.02 0.00 1.54 0.00 0.00 36.73 39.35 1zgq h TYR 82 CO 1.17 -0.32 -0.06 0.87 -1.64 0.00 0.00 178.16 178.17 1zgq h LYS 83 N 0.01 0.81 -0.04 1.82 1.57 -1.91 -1.99 116.57 116.85 1zgq h LYS 83 Ca 0.38 -0.25 -0.23 0.00 -1.87 0.00 0.00 60.65 58.68 1zgq h LYS 83 Cb 0.59 -0.08 0.01 0.00 0.08 0.00 0.00 32.23 32.83 1zgq h LYS 83 CO -0.78 0.86 -0.91 0.87 -0.57 0.00 0.00 179.45 178.92 1zgq h LYS 84 N 0.74 0.53 0.00 3.15 1.57 -1.62 -3.19 116.57 117.75 1zgq h LYS 84 Ca 0.13 -0.53 -0.02 0.00 -1.87 0.00 0.00 60.65 58.37 1zgq h LYS 84 Cb 0.54 0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.99 1zgq h LYS 84 CO 0.03 1.16 -0.10 -0.07 -0.57 0.00 0.00 179.45 179.89 1zgq h LEU 85 N 0.32 0.00 -1.59 2.94 3.38 -0.98 -2.97 115.31 116.42 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 1.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.28 1zgq h LEU 85 CO 0.17 0.10 0.00 0.77 0.09 0.00 0.00 178.44 179.57 1zgq h SER 86 N 0.00 0.00 -4.14 -0.43 4.64 -1.35 -3.45 113.55 108.82 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 0.51 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.63 1zgq h SER 86 CO 0.01 0.00 0.34 -0.36 -0.87 0.00 0.00 176.83 175.95 1zgq s PHE 87 N -3.69 3.54 0.51 4.77 0.40 -1.12 -0.93 117.98 121.46 1zgq s PHE 87 Ca 0.01 1.28 0.32 0.00 -0.60 0.00 0.00 56.93 57.93 1zgq s PHE 87 Cb 0.09 -2.67 1.77 0.00 0.51 0.00 0.00 43.02 42.72 1zgq s PHE 87 CO 0.50 -0.46 2.19 -1.00 0.70 0.00 0.00 175.22 177.15 1zgq h PRO 88 N 0.39 0.00 -0.22 0.24 0.13 -1.89 -3.45 132.00 127.20 1zgq h PRO 88 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1zgq h PRO 88 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1zgq h PRO 88 CO 0.62 0.05 0.14 0.93 -0.23 0.00 0.00 178.00 179.51 1zgq h GLU 89 N 0.00 0.28 0.00 0.86 3.07 -1.93 -3.30 114.58 113.56 1zgq h GLU 89 Ca -0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 1zgq h GLU 89 Cb 0.15 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.00 1zgq h GLU 89 CO 0.01 0.18 0.00 0.41 -1.40 0.00 0.00 179.01 178.21 1zgq n GLY 90 N -1.15 -1.73 3.32 -3.84 0.00 -0.11 -4.55 105.19 97.13 1zgq n GLY 90 Ca -0.03 -2.04 -0.10 0.00 0.00 0.00 0.00 46.02 43.85 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 0.52 0.03 1.61 -0.12 -0.70 -2.07 117.98 117.26 1zgq s PHE 91 Ca 0.00 -0.88 0.07 0.00 -0.05 0.00 0.00 56.93 56.08 1zgq s PHE 91 Cb 0.00 -0.14 -0.03 0.00 -0.63 0.00 0.00 43.02 42.22 1zgq s PHE 91 CO 0.00 -0.70 -0.20 0.15 -0.05 0.00 0.00 175.22 174.41 1zgq s LYS 92 N -4.00 2.03 0.00 1.99 1.02 0.38 -0.16 119.74 121.01 1zgq s LYS 92 Ca 0.20 -0.99 0.03 0.00 0.02 0.00 0.00 55.97 55.23 1zgq s LYS 92 Cb 0.04 -2.14 -0.01 0.00 -0.52 0.00 0.00 37.83 35.20 1zgq s LYS 92 CO 0.02 0.54 -0.09 1.67 -0.92 0.00 0.00 175.35 176.56 1zgq s TRP 93 N -0.87 0.84 0.17 3.18 1.48 -0.65 -0.25 118.94 122.85 1zgq s TRP 93 Ca 0.13 -0.19 0.07 0.00 -1.06 0.00 0.00 56.10 55.06 1zgq s TRP 93 Cb -0.10 -0.54 -0.04 0.00 -1.16 0.00 0.00 33.47 31.63 1zgq s TRP 93 CO 0.04 -0.01 -0.15 -1.21 -4.06 0.00 0.00 176.95 171.55 1zgq s GLU 94 N -0.38 1.22 0.01 3.25 2.02 -0.10 -0.13 118.70 124.60 1zgq s GLU 94 Ca 0.03 -1.44 -0.19 0.00 0.02 0.00 0.00 54.97 53.39 1zgq s GLU 94 Cb -0.04 -1.12 0.04 0.00 0.10 0.00 0.00 34.13 33.11 1zgq s GLU 94 CO -0.00 0.21 0.43 0.50 0.02 0.00 0.00 175.26 176.41 1zgq s ARG 95 N -3.12 0.88 -0.07 1.61 3.52 0.07 -0.82 118.95 121.01 1zgq s ARG 95 Ca 0.17 -0.22 0.03 0.00 -0.13 0.00 0.00 55.73 55.58 1zgq s ARG 95 Cb -0.03 0.40 0.01 0.00 -1.56 0.00 0.00 34.95 33.76 1zgq s ARG 95 CO 0.05 -0.28 -0.15 0.08 -0.81 0.00 0.00 175.30 174.20 1zgq s VAL 96 N -1.96 1.32 -0.25 7.11 1.01 -0.07 -0.92 120.40 126.64 1zgq s VAL 96 Ca -0.08 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.33 1zgq s VAL 96 Cb -0.02 -1.19 0.05 0.00 0.00 0.00 0.00 36.38 35.22 1zgq s VAL 96 CO 0.01 0.40 -0.11 -0.04 0.00 0.00 0.00 175.10 175.36 1zgq s MET 97 N 0.62 2.40 -0.46 2.72 -1.94 0.16 -1.03 119.30 121.76 1zgq s MET 97 Ca -0.15 -1.25 -0.14 0.00 -1.71 0.00 0.00 55.69 52.44 1zgq s MET 97 Cb -0.16 -2.88 0.07 0.00 2.01 0.00 0.00 34.83 33.87 1zgq s MET 97 CO 0.05 -0.52 0.36 -0.80 -0.01 0.00 0.00 175.02 174.10 1zgq s ASN 98 N 1.16 6.02 0.28 3.03 0.01 0.08 -1.71 114.94 123.81 1zgq s ASN 98 Ca -0.06 -1.36 -0.21 0.00 -0.71 0.00 0.00 52.86 50.51 1zgq s ASN 98 Cb -0.19 -2.13 -0.09 0.00 0.41 0.00 0.00 41.25 39.25 1zgq s ASN 98 CO -0.06 -0.62 0.81 -0.36 -1.51 0.00 0.00 177.10 175.37 1zgq s PHE 99 N 1.59 3.59 0.54 2.20 0.40 -0.15 -1.07 117.98 125.08 1zgq s PHE 99 Ca 0.04 1.50 0.37 0.00 -0.60 0.00 0.00 56.93 58.23 1zgq s PHE 99 Cb -0.24 -2.71 1.99 0.00 0.51 0.00 0.00 43.02 42.57 1zgq s PHE 99 CO 0.06 0.23 2.25 1.05 0.70 0.00 0.00 175.22 179.50 1zgq h GLU 100 N 3.05 0.00 -0.64 0.44 4.11 -1.64 -2.59 114.58 117.31 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 0.02 0.00 -0.40 0.07 0.00 0.00 179.01 179.35 1zgq n ASP 101 N -3.38 4.29 0.00 3.06 3.85 -1.26 -4.93 116.55 118.19 1zgq n ASP 101 Ca -0.02 -2.41 0.00 0.00 -0.71 0.00 0.00 54.79 51.64 1zgq n ASP 101 Cb 0.13 -0.55 0.00 0.00 -1.35 0.00 0.00 41.12 39.35 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 1.02 1.17 3.75 6.12 0.00 -0.97 -4.72 105.19 111.55 1zgq n GLY 102 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.28 2.43 -0.02 -0.02 0.00 -1.20 -4.73 107.32 101.49 1zgq s GLY 103 Ca 0.00 1.27 0.03 0.00 0.00 0.00 0.00 44.72 46.02 1zgq s GLY 103 CO 0.00 2.19 -0.09 0.14 0.00 0.00 0.00 173.10 175.34 1zgq s VAL 104 N -0.10 0.78 -0.02 1.40 1.01 -0.03 -0.98 120.40 122.46 1zgq s VAL 104 Ca 0.58 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 62.22 1zgq s VAL 104 Cb -0.40 -0.69 -0.00 0.00 0.00 0.00 0.00 36.38 35.28 1zgq s VAL 104 CO 0.43 0.24 -0.11 -0.69 0.00 0.00 0.00 175.10 174.97 1zgq s VAL 105 N 0.13 0.93 -0.03 2.92 1.01 -0.69 -0.44 120.40 124.22 1zgq s VAL 105 Ca -0.02 -0.47 0.06 0.00 0.00 0.00 0.00 61.98 61.55 1zgq s VAL 105 Cb -0.08 -0.80 -0.01 0.00 0.00 0.00 0.00 36.38 35.49 1zgq s VAL 105 CO 0.00 0.27 -0.23 0.42 0.00 0.00 0.00 175.10 175.57 1zgq s THR 106 N -0.07 1.83 0.03 3.92 -4.23 -0.93 -0.67 115.64 115.52 1zgq s THR 106 Ca 0.01 -0.97 0.06 0.00 -1.18 0.00 0.00 61.69 59.61 1zgq s THR 106 Cb -0.07 -1.54 -0.02 0.00 1.34 0.00 0.00 72.50 72.21 1zgq s THR 106 CO 0.00 0.52 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.74 1zgq s VAL 107 N -0.32 1.34 -0.02 2.29 1.01 -0.10 -2.36 120.40 122.24 1zgq s VAL 107 Ca 0.03 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 61.03 1zgq s VAL 107 Cb -0.11 -1.17 0.02 0.00 0.00 0.00 0.00 36.38 35.11 1zgq s VAL 107 CO 0.01 0.16 -0.03 0.28 0.00 0.00 0.00 175.10 175.53 1zgq s THR 108 N -0.71 0.33 0.04 3.92 -1.32 -0.79 -0.75 115.64 116.36 1zgq s THR 108 Ca 0.05 -0.07 -0.02 0.00 -1.21 0.00 0.00 61.69 60.44 1zgq s THR 108 Cb -0.08 -0.36 -0.03 0.00 -1.51 0.00 0.00 72.50 70.52 1zgq s THR 108 CO 0.01 0.15 -0.01 -1.58 -2.21 0.00 0.00 174.62 170.98 1zgq s GLN 109 N 0.59 0.55 -0.07 7.08 -0.44 0.82 -1.31 119.66 126.88 1zgq s GLN 109 Ca -0.07 -1.02 0.02 0.00 -2.50 0.00 0.00 55.36 51.80 1zgq s GLN 109 Cb -0.10 0.20 0.01 0.00 -1.64 0.00 0.00 33.01 31.48 1zgq s GLN 109 CO -0.01 -0.11 -0.13 0.34 0.50 0.00 0.00 175.29 175.88 1zgq s ASP 110 N -2.51 1.87 -0.19 6.67 2.15 -0.79 -1.63 116.67 122.23 1zgq s ASP 110 Ca 0.01 -0.32 0.01 0.00 0.43 0.00 0.00 52.55 52.68 1zgq s ASP 110 Cb 0.03 -0.84 0.03 0.00 -0.30 0.00 0.00 42.92 41.83 1zgq s ASP 110 CO -0.07 0.05 -0.18 -0.44 -0.17 0.00 0.00 175.17 174.35 1zgq s SER 111 N 0.60 3.33 0.35 -0.34 0.01 0.78 -1.85 113.70 116.58 1zgq s SER 111 Ca -0.14 -0.77 0.03 0.00 1.31 0.00 0.00 55.95 56.39 1zgq s SER 111 Cb -0.16 -1.48 -0.04 0.00 0.21 0.00 0.00 66.02 64.56 1zgq s SER 111 CO 0.04 -0.03 0.12 -0.94 0.41 0.00 0.00 173.24 172.84 1zgq s SER 112 N 1.27 2.27 -0.12 2.44 1.04 -0.56 -1.72 113.70 118.32 1zgq s SER 112 Ca 0.03 -1.57 0.01 0.00 0.48 0.00 0.00 55.95 54.90 1zgq s SER 112 Cb -0.14 0.33 0.02 0.00 0.10 0.00 0.00 66.02 66.33 1zgq s SER 112 CO -0.12 -0.84 -0.13 -0.22 0.98 0.00 0.00 173.24 172.92 1zgq s LEU 113 N -3.50 1.56 -0.14 2.42 0.20 -1.25 -0.28 118.68 117.69 1zgq s LEU 113 Ca 0.31 -0.40 -0.02 0.00 0.69 0.00 0.00 54.13 54.71 1zgq s LEU 113 Cb 0.05 -1.02 0.04 0.00 -0.43 0.00 0.00 46.19 44.83 1zgq s LEU 113 CO 0.16 -0.04 -0.00 -1.58 -0.29 0.00 0.00 176.35 174.59 1zgq s GLN 114 N 1.28 0.90 -1.35 1.98 0.74 -0.13 -4.86 119.66 118.22 1zgq s GLN 114 Ca -0.01 -0.28 -0.04 0.00 0.05 0.00 0.00 55.36 55.08 1zgq s GLN 114 Cb -0.14 -1.71 0.02 0.00 1.10 0.00 0.00 33.01 32.28 1zgq s GLN 114 CO -0.05 -0.46 0.86 -0.25 -0.55 0.00 0.00 175.29 174.83 1zgq n ASP 115 N 5.03 -2.62 -0.02 6.67 10.43 -1.26 -2.45 116.55 132.33 1zgq n ASP 115 Ca -0.09 -0.75 -0.00 0.00 2.57 0.00 0.00 54.79 56.51 1zgq n ASP 115 Cb 0.48 -4.27 -0.00 0.00 1.84 0.00 0.00 41.12 39.17 1zgq n ASP 115 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1zgq n GLY 116 N -1.58 0.40 3.13 0.44 0.00 -1.26 -5.02 105.19 101.30 1zgq n GLY 116 Ca -0.19 -0.05 -0.26 0.00 0.00 0.00 0.00 46.02 45.52 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 0.07 3.67 -0.17 0.00 2.99 -0.65 -0.95 117.98 122.93 1zgq s PHE 118 Ca -0.04 1.74 0.01 0.00 0.00 0.00 0.00 56.93 58.64 1zgq s PHE 118 Cb -0.12 -3.22 0.02 0.00 0.00 0.00 0.00 43.02 39.71 1zgq s PHE 118 CO 0.02 -0.33 -0.20 0.42 -0.00 0.00 0.00 175.22 175.13 1zgq s ILE 119 N -1.12 2.03 -0.17 0.64 -1.09 0.61 -1.38 121.20 120.72 1zgq s ILE 119 Ca 0.44 -0.93 -0.01 0.00 -2.23 0.00 0.00 60.65 57.92 1zgq s ILE 119 Cb -0.31 -1.84 -0.00 0.00 -1.58 0.00 0.00 42.46 38.73 1zgq s ILE 119 CO 0.39 0.54 -0.12 -0.31 -1.23 0.00 0.00 174.94 174.21 1zgq s TYR 120 N 1.24 2.85 -0.24 3.97 2.02 0.01 -1.49 117.35 125.71 1zgq s TYR 120 Ca 0.03 -0.97 -0.01 0.00 -0.37 0.00 0.00 57.07 55.75 1zgq s TYR 120 Cb -0.13 -1.95 0.03 0.00 -0.40 0.00 0.00 41.96 39.50 1zgq s TYR 120 CO -0.12 -0.47 -0.09 0.15 -1.57 0.00 0.00 175.55 173.45 1zgq s LYS 121 N 0.97 2.80 -0.06 -0.62 1.02 -0.77 -1.62 119.74 121.45 1zgq s LYS 121 Ca -0.02 -0.99 0.04 0.00 0.02 0.00 0.00 55.97 55.03 1zgq s LYS 121 Cb -0.15 -2.90 -0.02 0.00 -0.52 0.00 0.00 37.83 34.25 1zgq s LYS 121 CO -0.01 -0.38 -0.19 0.08 -0.92 0.00 0.00 175.35 173.92 1zgq s VAL 122 N 1.29 2.58 -0.08 3.17 1.01 0.55 -1.89 120.40 127.04 1zgq s VAL 122 Ca -0.00 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.14 1zgq s VAL 122 Cb -0.16 -1.99 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 1zgq s VAL 122 CO -0.06 0.57 -0.22 -0.54 0.00 0.00 0.00 175.10 174.85 1zgq s LYS 123 N -0.32 2.81 -0.03 2.72 -0.14 -0.43 -1.02 119.74 123.33 1zgq s LYS 123 Ca 0.02 -0.85 0.01 0.00 -1.36 0.00 0.00 55.97 53.78 1zgq s LYS 123 Cb -0.13 -2.28 0.02 0.00 -1.68 0.00 0.00 37.83 33.76 1zgq s LYS 123 CO 0.02 0.32 -0.02 0.12 -0.76 0.00 0.00 175.35 175.03 1zgq s PHE 124 N 0.01 0.43 -0.13 3.18 5.36 -0.71 -1.89 117.98 124.23 1zgq s PHE 124 Ca -0.08 -0.06 -0.01 0.00 -0.96 0.00 0.00 56.93 55.82 1zgq s PHE 124 Cb -0.15 -0.43 0.04 0.00 -0.34 0.00 0.00 43.02 42.13 1zgq s PHE 124 CO 0.05 -0.12 -0.02 0.42 -1.46 0.00 0.00 175.22 174.09 1zgq s ILE 125 N 0.76 0.75 -0.17 3.12 1.01 -0.99 -1.25 121.20 124.42 1zgq s ILE 125 Ca -0.08 -0.29 -0.03 0.00 0.00 0.00 0.00 60.65 60.25 1zgq s ILE 125 Cb -0.12 -0.94 -0.02 0.00 0.01 0.00 0.00 42.46 41.40 1zgq s ILE 125 CO -0.01 0.17 -0.07 -0.83 0.00 0.00 0.00 174.94 174.20 1zgq s GLY 126 N 1.80 1.62 0.20 6.18 0.00 0.13 -2.20 107.32 115.05 1zgq s GLY 126 Ca 0.03 -0.95 0.02 0.00 0.00 0.00 0.00 44.72 43.82 1zgq s GLY 126 CO -0.07 0.05 0.00 -1.34 0.00 0.00 0.00 173.10 171.74 1zgq s VAL 127 N 0.72 0.82 -1.79 1.40 -7.23 0.41 -1.95 120.40 112.76 1zgq s VAL 127 Ca -0.03 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.13 1zgq s VAL 127 Cb -0.15 -2.23 0.00 0.00 0.56 0.00 0.00 36.38 34.56 1zgq s VAL 127 CO 0.02 -0.39 0.00 -3.20 -0.31 0.00 0.00 175.10 171.22 1zgq n ASN 128 N -0.32 -5.78 -4.69 4.85 5.15 -1.26 -0.85 115.26 112.36 1zgq n ASN 128 Ca -0.06 0.05 -0.41 0.00 -0.60 0.00 0.00 54.58 53.56 1zgq n ASN 128 Cb 0.64 -4.84 -0.04 0.00 -0.53 0.00 0.00 39.78 35.00 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 -2.99 3.50 0.30 1.20 0.40 -1.26 -3.27 117.98 115.85 1zgq s PHE 129 Ca 0.00 1.34 -0.30 0.00 -0.60 0.00 0.00 56.93 57.37 1zgq s PHE 129 Cb 0.00 -2.99 -0.11 0.00 0.51 0.00 0.00 43.02 40.43 1zgq s PHE 129 CO 0.00 -0.13 1.54 -2.14 0.70 0.00 0.00 175.22 175.19 1zgq s PRO 130 N 1.66 4.15 0.47 0.24 0.02 -1.26 -4.90 135.00 135.39 1zgq s PRO 130 Ca 0.41 2.52 0.17 0.00 0.02 0.00 0.00 61.00 64.11 1zgq s PRO 130 Cb -0.18 -3.03 1.15 0.00 0.02 0.00 0.00 34.50 32.46 1zgq s PRO 130 CO 0.16 -0.57 2.01 0.66 -0.33 0.00 0.00 177.00 178.94 1zgq h SER 131 N 4.59 0.22 -0.55 2.53 4.64 -1.99 -1.08 113.55 121.92 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 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1zgq h SER 131 CO 0.77 0.14 0.00 -0.90 -0.87 0.00 0.00 176.83 175.96 1zgq n ASP 132 N -4.46 3.50 -4.88 4.97 5.75 -1.26 -4.47 116.55 115.70 1zgq n ASP 132 Ca 0.07 -1.98 -0.30 0.00 -0.01 0.00 0.00 54.79 52.57 1zgq n ASP 132 Cb 0.37 -0.36 0.04 0.00 -1.03 0.00 0.00 41.12 40.14 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 -1.22 1.63 0.58 6.12 0.00 -0.41 -4.84 107.32 109.19 1zgq s GLY 133 Ca 0.43 -0.30 0.28 0.00 0.00 0.00 0.00 44.72 45.13 1zgq s GLY 133 CO 0.31 0.06 2.06 -0.56 0.00 0.00 0.00 173.10 174.98 1zgq h PRO 134 N -0.63 0.00 0.09 2.90 0.13 -1.94 -0.83 132.00 131.72 1zgq h PRO 134 Ca -0.45 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1zgq h PRO 134 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1zgq h PRO 134 CO 0.63 0.00 -0.05 0.28 -0.23 0.00 0.00 178.00 178.64 1zgq h VAL 135 N 0.00 0.89 0.00 1.56 2.07 -1.94 -0.64 116.25 118.19 1zgq h VAL 135 Ca 0.12 -1.38 -0.03 0.00 0.82 0.00 0.00 66.70 66.22 1zgq h VAL 135 Cb 0.61 1.58 -0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1zgq h VAL 135 CO -0.00 0.26 -0.14 0.24 0.02 0.00 0.00 177.57 177.95 1zgq h MET 136 N -0.93 0.00 -0.34 1.57 2.86 -1.74 0.23 114.93 116.58 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 0.53 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.19 1zgq h MET 136 CO 0.02 0.14 0.00 1.04 1.06 0.00 0.00 176.91 179.17 1zgq n GLN 137 N -3.26 2.44 -3.73 1.72 1.13 -0.34 -4.58 117.38 110.77 1zgq n GLN 137 Ca 0.01 -2.17 -0.23 0.00 -1.94 0.00 0.00 57.00 52.67 1zgq n GLN 137 Cb 0.41 -1.50 0.03 0.00 0.11 0.00 0.00 30.24 29.28 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 1.40 -3.98 -0.29 -1.09 5.02 -1.07 -4.93 118.16 113.22 1zgq n LYS 138 Ca 0.19 0.57 0.12 0.00 -2.02 0.00 0.00 58.31 57.16 1zgq n LYS 138 Cb 0.59 -4.94 0.27 0.00 -0.02 0.00 0.00 35.03 30.92 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 -4.24 2.62 -3.29 1.97 5.02 -0.27 -4.99 118.16 114.99 1zgq n LYS 139 Ca -0.27 -2.47 -0.35 0.00 -2.02 0.00 0.00 58.31 53.20 1zgq n LYS 139 Cb 0.67 -1.53 -0.06 0.00 -0.02 0.00 0.00 35.03 34.09 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 -1.20 4.78 -0.34 -0.18 -4.23 -1.25 -1.76 115.64 111.45 1zgq s THR 140 Ca 0.43 0.93 0.10 0.00 -1.18 0.00 0.00 61.69 61.98 1zgq s THR 140 Cb 0.24 -3.76 0.45 0.00 1.34 0.00 0.00 72.50 70.77 1zgq s THR 140 CO 0.32 0.20 1.11 0.23 -0.54 0.00 0.00 174.62 175.94 1zgq n MET 141 N 0.69 2.92 0.00 3.99 2.81 0.12 -4.89 117.12 122.76 1zgq n MET 141 Ca -0.04 -4.06 0.00 0.00 -1.81 0.00 0.00 57.70 51.79 1zgq n MET 141 Cb 0.52 -2.02 0.00 0.00 -0.71 0.00 0.00 33.22 31.01 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 -0.52 -0.21 3.85 3.03 0.00 -1.26 -4.61 105.19 105.47 1zgq n GLY 142 Ca 0.32 -1.67 -0.32 0.00 0.00 0.00 0.00 46.02 44.35 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 -3.00 3.39 0.51 1.61 0.52 -1.26 -1.35 118.94 119.35 1zgq s TRP 143 Ca 0.00 1.26 -0.08 0.00 0.02 0.00 0.00 56.10 57.30 1zgq s TRP 143 Cb 0.00 -2.58 -0.04 0.00 -1.15 0.00 0.00 33.47 29.70 1zgq s TRP 143 CO 0.00 -0.00 0.86 -1.21 0.02 0.00 0.00 176.95 176.61 1zgq s GLU 144 N -3.24 3.61 0.44 4.98 0.41 -0.64 -4.86 118.70 119.40 1zgq s GLU 144 Ca 0.55 0.43 -0.25 0.00 -0.41 0.00 0.00 54.97 55.29 1zgq s GLU 144 Cb -0.10 -2.29 -0.08 0.00 -1.78 0.00 0.00 34.13 29.88 1zgq s GLU 144 CO 0.20 -0.28 1.35 0.00 -0.49 0.00 0.00 175.26 176.04 1zgq s ALA 145 N -2.79 3.20 0.30 5.21 0.00 -1.26 -4.78 121.76 121.63 1zgq s ALA 145 Ca 0.51 1.32 0.05 0.00 0.00 0.00 0.00 51.96 53.84 1zgq s ALA 145 Cb -0.10 -3.53 -0.06 0.00 0.00 0.00 0.00 23.12 19.42 1zgq s ALA 145 CO 0.45 -1.01 -0.00 -1.54 0.00 0.00 0.00 175.76 173.65 1zgq s SER 146 N -0.69 2.55 -0.16 0.00 1.04 0.13 -4.98 113.70 111.59 1zgq s SER 146 Ca 0.60 -1.28 -0.02 0.00 0.48 0.00 0.00 55.95 55.73 1zgq s SER 146 Cb -0.40 -0.13 0.05 0.00 0.10 0.00 0.00 66.02 65.64 1zgq s SER 146 CO 0.51 -0.48 0.02 -0.89 0.98 0.00 0.00 173.24 173.39 1zgq s THR 147 N -3.16 0.51 0.07 2.02 2.01 -1.26 -1.05 115.64 114.78 1zgq s THR 147 Ca 0.32 -0.38 -0.20 0.00 0.31 0.00 0.00 61.69 61.75 1zgq s THR 147 Cb 0.06 -0.91 -0.07 0.00 0.01 0.00 0.00 72.50 71.60 1zgq s THR 147 CO 0.13 -0.07 0.58 -0.70 -0.69 0.00 0.00 174.62 173.87 1zgq s GLU 148 N 1.88 4.22 -0.31 4.92 2.12 0.50 -4.49 118.70 127.53 1zgq s GLU 148 Ca 0.01 0.75 -0.09 0.00 0.36 0.00 0.00 54.97 56.00 1zgq s GLU 148 Cb -0.16 -3.24 -0.00 0.00 0.26 0.00 0.00 34.13 30.99 1zgq s GLU 148 CO -0.07 0.63 0.15 0.50 -0.54 0.00 0.00 175.26 175.93 1zgq s ARG 149 N -1.09 3.29 0.19 4.30 3.00 0.46 -1.66 118.95 127.44 1zgq s ARG 149 Ca 0.29 -0.75 0.08 0.00 -1.00 0.00 0.00 55.73 54.35 1zgq s ARG 149 Cb -0.20 -3.56 -0.04 0.00 0.00 0.00 0.00 34.95 31.15 1zgq s ARG 149 CO 0.19 -0.43 -0.05 -0.51 0.00 0.00 0.00 175.30 174.50 1zgq s LEU 150 N 1.60 3.12 -0.04 -0.88 1.02 0.56 -1.14 118.68 122.92 1zgq s LEU 150 Ca 0.04 -0.52 -0.29 0.00 0.02 0.00 0.00 54.13 53.38 1zgq s LEU 150 Cb -0.17 -1.77 0.10 0.00 0.02 0.00 0.00 46.19 44.37 1zgq s LEU 150 CO 0.06 0.09 0.87 -0.72 0.02 0.00 0.00 176.35 176.67 1zgq s TYR 151 N -1.79 -0.41 0.10 0.29 -0.85 -0.78 -1.54 117.35 112.37 1zgq s TYR 151 Ca 0.27 0.46 -0.22 0.00 -0.52 0.00 0.00 57.07 57.05 1zgq s TYR 151 Cb -0.09 0.50 -0.07 0.00 0.38 0.00 0.00 41.96 42.68 1zgq s TYR 151 CO 0.17 -0.52 0.66 -1.25 -1.52 0.00 0.00 175.55 173.08 1zgq s PRO 152 N -2.36 4.36 -0.26 -3.49 0.04 -1.26 -1.96 135.00 130.06 1zgq s PRO 152 Ca 0.01 0.91 -0.15 0.00 0.04 0.00 0.00 61.00 61.80 1zgq s PRO 152 Cb -0.01 -3.26 0.08 0.00 0.04 0.00 0.00 34.50 31.35 1zgq s PRO 152 CO -0.04 0.58 0.65 0.50 0.04 0.00 0.00 177.00 178.73 1zgq s ARG 153 N -1.02 0.67 -1.38 4.56 6.06 -0.34 -4.95 118.95 122.55 1zgq s ARG 153 Ca 0.32 1.16 -0.09 0.00 -2.50 0.00 0.00 55.73 54.62 1zgq s ARG 153 Cb -0.21 0.12 0.02 0.00 0.06 0.00 0.00 34.95 34.94 1zgq s ARG 153 CO 0.22 -0.15 1.16 -3.47 -2.50 0.00 0.00 175.30 170.56 1zgq n ASP 154 N 4.28 -6.14 0.00 -2.12 2.03 -1.26 -1.81 116.55 111.54 1zgq n ASP 154 Ca -0.20 -0.57 0.00 0.00 0.52 0.00 0.00 54.79 54.54 1zgq n ASP 154 Cb 0.58 -4.92 0.00 0.00 -0.72 0.00 0.00 41.12 36.07 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 -1.97 0.57 3.57 0.27 0.00 -1.26 -4.98 105.19 101.40 1zgq n GLY 155 Ca 0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.65 0.83 -0.16 1.61 -7.23 -0.75 -4.94 120.40 107.12 1zgq s VAL 156 Ca 0.00 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.11 1zgq s VAL 156 Cb 0.00 -2.38 -0.04 0.00 0.56 0.00 0.00 36.38 34.52 1zgq s VAL 156 CO 0.00 0.00 0.05 -0.22 -0.31 0.00 0.00 175.10 174.62 1zgq s LEU 157 N -3.66 3.75 0.16 1.32 2.96 -0.85 -1.19 118.68 121.17 1zgq s LEU 157 Ca 0.22 0.09 0.08 0.00 -0.22 0.00 0.00 54.13 54.29 1zgq s LEU 157 Cb 0.03 -1.93 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 1zgq s LEU 157 CO 0.12 0.22 -0.17 -0.54 -1.32 0.00 0.00 176.35 174.66 1zgq s LYS 158 N 0.10 1.24 -0.22 1.98 1.02 -0.83 0.25 119.74 123.28 1zgq s LYS 158 Ca 0.04 -1.39 -0.19 0.00 0.02 0.00 0.00 55.97 54.45 1zgq s LYS 158 Cb -0.12 -1.25 0.06 0.00 -0.52 0.00 0.00 37.83 35.99 1zgq s LYS 158 CO 0.01 0.25 0.58 0.20 -0.92 0.00 0.00 175.35 175.47 1zgq s GLY 159 N -2.67 -0.44 0.03 -3.33 0.00 -0.12 -1.86 107.32 98.93 1zgq s GLY 159 Ca 0.15 1.70 0.08 0.00 0.00 0.00 0.00 44.72 46.65 1zgq s GLY 159 CO 0.06 1.51 -0.23 -0.54 0.00 0.00 0.00 173.10 173.90 1zgq s GLU 160 N 0.49 1.62 0.01 2.90 8.01 -0.29 0.12 118.70 131.57 1zgq s GLU 160 Ca -0.01 -0.99 0.01 0.00 0.01 0.00 0.00 54.97 53.99 1zgq s GLU 160 Cb -0.04 -1.73 -0.01 0.00 -4.31 0.00 0.00 34.13 28.03 1zgq s GLU 160 CO -0.02 0.45 -0.05 0.42 0.01 0.00 0.00 175.26 176.07 1zgq s ILE 161 N -0.76 0.35 -0.61 -1.63 1.01 -0.45 -0.40 121.20 118.71 1zgq s ILE 161 Ca 0.09 -0.48 -0.10 0.00 0.00 0.00 0.00 60.65 60.16 1zgq s ILE 161 Cb -0.09 -0.36 0.16 0.00 0.01 0.00 0.00 42.46 42.18 1zgq s ILE 161 CO 0.01 -0.10 0.50 -1.00 0.00 0.00 0.00 174.94 174.36 1zgq s HIS 162 N -0.57 3.49 0.34 3.97 3.76 -1.26 -1.02 115.29 124.00 1zgq s HIS 162 Ca -0.03 -1.99 0.07 0.00 -0.15 0.00 0.00 55.06 52.96 1zgq s HIS 162 Cb -0.05 -3.57 -0.01 0.00 1.11 0.00 0.00 32.58 30.06 1zgq s HIS 162 CO -0.00 -0.97 0.43 0.15 -0.85 0.00 0.00 174.74 173.50 1zgq s LYS 163 N 0.78 3.01 -0.15 1.40 1.02 -0.19 -4.81 119.74 120.80 1zgq s LYS 163 Ca 0.11 -1.09 -0.13 0.00 0.02 0.00 0.00 55.97 54.87 1zgq s LYS 163 Cb -0.21 -2.73 0.04 0.00 -0.52 0.00 0.00 37.83 34.41 1zgq s LYS 163 CO -0.03 0.06 0.40 0.00 -0.92 0.00 0.00 175.35 174.86 1zgq s ALA 164 N -2.21 -0.99 -0.16 5.17 0.00 -1.26 -1.42 121.76 120.88 1zgq s ALA 164 Ca 0.44 1.17 -0.08 0.00 0.00 0.00 0.00 51.96 53.49 1zgq s ALA 164 Cb -0.09 -0.69 -0.04 0.00 0.00 0.00 0.00 23.12 22.31 1zgq s ALA 164 CO 0.30 -0.20 0.11 -0.51 0.00 0.00 0.00 175.76 175.46 1zgq s LEU 165 N 0.34 4.13 0.34 0.00 1.43 -0.02 -1.62 118.68 123.28 1zgq s LEU 165 Ca -0.01 0.26 -0.26 0.00 -1.03 0.00 0.00 54.13 53.10 1zgq s LEU 165 Cb -0.03 -2.03 -0.10 0.00 0.03 0.00 0.00 46.19 44.05 1zgq s LEU 165 CO -0.01 0.26 0.98 -0.54 0.23 0.00 0.00 176.35 177.27 1zgq s LYS 166 N -0.16 4.49 0.14 1.70 3.01 -0.46 -0.56 119.74 127.91 1zgq s LYS 166 Ca 0.09 1.40 0.05 0.00 -1.01 0.00 0.00 55.97 56.50 1zgq s LYS 166 Cb -0.12 -2.76 -0.04 0.00 -1.01 0.00 0.00 37.83 33.90 1zgq s LYS 166 CO 0.01 0.18 0.11 -0.51 0.51 0.00 0.00 175.35 175.64 1zgq s LEU 167 N -2.15 3.75 0.14 3.17 1.43 -0.87 0.15 118.68 124.30 1zgq s LEU 167 Ca 0.52 -0.12 -0.18 0.00 -1.03 0.00 0.00 54.13 53.31 1zgq s LEU 167 Cb -0.20 -2.39 -0.02 0.00 0.03 0.00 0.00 46.19 43.61 1zgq s LEU 167 CO 0.26 0.10 1.79 0.11 0.23 0.00 0.00 176.35 178.84 1zgq h LYS 168 N 2.69 0.38 -0.83 1.70 1.57 -1.69 -2.53 116.57 117.86 1zgq h LYS 168 Ca -0.47 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.28 1zgq h LYS 168 Cb 1.19 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.41 1zgq h LYS 168 CO 0.63 0.25 0.01 -0.25 -0.57 0.00 0.00 179.45 179.52 1zgq n ASP 169 N -4.89 2.99 0.00 0.86 8.00 -1.26 -5.00 116.55 117.25 1zgq n ASP 169 Ca -0.01 -2.40 0.00 0.00 0.71 0.00 0.00 54.79 53.09 1zgq n ASP 169 Cb 0.03 -0.58 0.00 0.00 -0.02 0.00 0.00 41.12 40.55 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 0.24 -1.09 0.47 0.44 0.00 -0.95 -5.11 105.19 99.19 1zgq n GLY 170 Ca 0.12 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.54 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 -0.78 -3.32 3.26 -0.02 0.00 -1.26 -4.57 105.19 98.51 1zgq n GLY 171 Ca 0.00 -1.96 -0.20 0.00 0.00 0.00 0.00 46.02 43.87 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 -0.73 1.53 -0.28 1.61 3.76 -1.26 -2.05 115.29 117.87 1zgq s HIS 172 Ca 0.00 -0.51 0.03 0.00 -0.15 0.00 0.00 55.06 54.43 1zgq s HIS 172 Cb 0.00 -0.80 0.07 0.00 1.11 0.00 0.00 32.58 32.96 1zgq s HIS 172 CO 0.00 0.19 -0.07 -0.47 -0.85 0.00 0.00 174.74 173.54 1zgq s TYR 173 N -1.96 3.34 0.18 1.40 5.04 0.28 -4.94 117.35 120.68 1zgq s TYR 173 Ca 0.10 -2.46 -0.30 0.00 -2.44 0.00 0.00 57.07 51.96 1zgq s TYR 173 Cb -0.06 -2.16 -0.07 0.00 0.35 0.00 0.00 41.96 40.02 1zgq s TYR 173 CO 0.04 -0.89 0.95 -0.51 -1.34 0.00 0.00 175.55 173.80 1zgq s LEU 174 N 1.07 4.57 -0.03 6.97 1.43 -1.26 -0.84 118.68 130.59 1zgq s LEU 174 Ca -0.04 1.88 -0.01 0.00 -1.03 0.00 0.00 54.13 54.93 1zgq s LEU 174 Cb -0.20 -3.60 0.03 0.00 0.03 0.00 0.00 46.19 42.45 1zgq s LEU 174 CO -0.06 0.04 0.05 -0.69 0.23 0.00 0.00 176.35 175.92 1zgq s VAL 175 N -0.59 -0.07 -0.22 -1.59 1.01 -0.51 -1.76 120.40 116.67 1zgq s VAL 175 Ca 0.44 0.25 -0.11 0.00 0.00 0.00 0.00 61.98 62.56 1zgq s VAL 175 Cb -0.25 -0.11 -0.05 0.00 0.00 0.00 0.00 36.38 35.97 1zgq s VAL 175 CO 0.31 0.10 0.17 -0.70 0.00 0.00 0.00 175.10 174.99 1zgq s GLU 176 N 1.26 4.13 -0.14 2.72 2.12 -0.23 -1.02 118.70 127.54 1zgq s GLU 176 Ca -0.07 -0.20 -0.06 0.00 0.36 0.00 0.00 54.97 55.00 1zgq s GLU 176 Cb -0.13 -3.49 -0.04 0.00 0.26 0.00 0.00 34.13 30.73 1zgq s GLU 176 CO -0.03 0.14 0.07 -0.06 -0.54 0.00 0.00 175.26 174.84 1zgq s PHE 177 N 0.81 3.34 -0.20 5.30 0.40 -0.19 -0.74 117.98 126.70 1zgq s PHE 177 Ca 0.09 0.26 -0.01 0.00 -0.60 0.00 0.00 56.93 56.67 1zgq s PHE 177 Cb -0.13 -1.96 0.06 0.00 0.51 0.00 0.00 43.02 41.50 1zgq s PHE 177 CO 0.03 0.43 -0.01 0.15 0.70 0.00 0.00 175.22 176.51 1zgq s LYS 178 N -0.40 1.13 0.10 0.44 1.02 -0.20 -1.34 119.74 120.48 1zgq s LYS 178 Ca 0.10 -0.62 0.08 0.00 0.02 0.00 0.00 55.97 55.55 1zgq s LYS 178 Cb -0.12 -2.22 -0.04 0.00 -0.52 0.00 0.00 37.83 34.93 1zgq s LYS 178 CO 0.02 -0.58 -0.16 -1.12 -0.92 0.00 0.00 175.35 172.59 1zgq s SER 179 N 1.66 4.02 -0.06 2.83 0.01 0.12 -0.89 113.70 121.40 1zgq s SER 179 Ca -0.02 -0.49 0.02 0.00 1.31 0.00 0.00 55.95 56.77 1zgq s SER 179 Cb -0.17 -0.64 0.02 0.00 0.21 0.00 0.00 66.02 65.43 1zgq s SER 179 CO -0.07 0.19 -0.10 -0.63 0.41 0.00 0.00 173.24 173.04 1zgq s ILE 180 N -1.13 0.96 -0.19 1.44 1.09 -0.00 -0.94 121.20 122.42 1zgq s ILE 180 Ca 0.18 -0.38 0.01 0.00 -1.10 0.00 0.00 60.65 59.36 1zgq s ILE 180 Cb -0.11 -0.90 0.02 0.00 -1.06 0.00 0.00 42.46 40.42 1zgq s ILE 180 CO 0.10 0.32 -0.17 -0.31 -0.10 0.00 0.00 174.94 174.78 1zgq s TYR 181 N 0.73 2.85 -0.22 3.97 1.51 0.14 -0.92 117.35 125.41 1zgq s TYR 181 Ca -0.14 -1.66 0.02 0.00 -1.01 0.00 0.00 57.07 54.28 1zgq s TYR 181 Cb -0.15 -1.94 0.04 0.00 -0.11 0.00 0.00 41.96 39.79 1zgq s TYR 181 CO 0.03 -0.79 -0.15 -1.64 -1.11 0.00 0.00 175.55 171.89 1zgq s MET 182 N 1.29 2.51 0.34 -0.62 -1.94 0.65 -2.01 119.30 119.53 1zgq s MET 182 Ca 0.03 -1.04 -0.26 0.00 -1.71 0.00 0.00 55.69 52.71 1zgq s MET 182 Cb -0.14 -2.67 -0.09 0.00 2.01 0.00 0.00 34.83 33.94 1zgq s MET 182 CO -0.11 -0.39 1.06 0.00 -0.01 0.00 0.00 175.02 175.56 1zgq s ALA 183 N 1.23 3.22 -2.13 3.03 0.00 -1.26 -0.47 121.76 125.38 1zgq s ALA 183 Ca -0.02 0.76 0.30 0.00 0.00 0.00 0.00 51.96 53.00 1zgq s ALA 183 Cb -0.16 -3.28 1.60 0.00 0.00 0.00 0.00 23.12 21.27 1zgq s ALA 183 CO -0.09 -0.15 2.05 1.63 0.00 0.00 0.00 175.76 179.20 1zgq n LYS 184 N 0.49 1.19 -3.86 0.00 5.02 -0.88 -4.75 118.16 115.36 1zgq n LYS 184 Ca 0.02 -0.27 -0.12 0.00 -2.02 0.00 0.00 58.31 55.92 1zgq n LYS 184 Cb 0.48 -1.48 -0.13 0.00 -0.02 0.00 0.00 35.03 33.88 1zgq n LYS 184 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1zgq s LYS 185 N -1.99 0.13 -0.35 1.97 2.20 -1.26 -5.02 119.74 115.42 1zgq s LYS 185 Ca 0.43 -0.02 -0.29 0.00 -0.36 0.00 0.00 55.97 55.74 1zgq s LYS 185 Cb 0.21 0.06 -0.01 0.00 -1.51 0.00 0.00 37.83 36.58 1zgq s LYS 185 CO 0.35 -0.02 1.68 -2.14 -0.36 0.00 0.00 175.35 174.85 1zgq s PRO 186 N -0.22 3.43 0.31 4.03 0.02 -1.26 -4.94 135.00 136.37 1zgq s PRO 186 Ca -0.03 1.29 0.04 0.00 0.02 0.00 0.00 61.00 62.33 1zgq s PRO 186 Cb -0.02 -4.14 -0.06 0.00 0.02 0.00 0.00 34.50 30.30 1zgq s PRO 186 CO 0.00 -1.75 0.04 0.14 -0.33 0.00 0.00 177.00 175.10 1zgq s VAL 187 N 6.38 1.25 0.13 3.83 -7.23 -1.26 -5.11 120.40 118.40 1zgq s VAL 187 Ca 0.74 -2.02 -0.31 0.00 -1.81 0.00 0.00 61.98 58.58 1zgq s VAL 187 Cb -0.20 -2.73 -0.10 0.00 0.56 0.00 0.00 36.38 33.91 1zgq s VAL 187 CO 0.33 -0.06 1.83 -1.10 -0.31 0.00 0.00 175.10 175.80 1zgq s GLN 188 N -3.87 4.13 -0.07 4.82 -1.52 -1.26 -5.01 119.66 116.88 1zgq s GLN 188 Ca 0.35 2.61 -0.12 0.00 -1.95 0.00 0.00 55.36 56.25 1zgq s GLN 188 Cb 0.08 -3.57 -0.05 0.00 -0.22 0.00 0.00 33.01 29.25 1zgq s GLN 188 CO 0.15 -0.84 0.29 -0.51 -0.25 0.00 0.00 175.29 174.12 1zgq s LEU 189 N 2.67 4.41 0.90 2.90 1.43 -1.26 -4.14 118.68 125.58 1zgq s LEU 189 Ca 0.81 0.70 -0.12 0.00 -1.03 0.00 0.00 54.13 54.50 1zgq s LEU 189 Cb -0.46 -2.36 0.19 0.00 0.03 0.00 0.00 46.19 43.59 1zgq s LEU 189 CO 0.36 0.32 1.24 -2.16 0.23 0.00 0.00 176.35 176.34 1zgq s PRO 190 N -0.81 0.87 0.00 1.29 0.04 -1.26 -4.86 135.00 130.26 1zgq s PRO 190 Ca 0.19 -0.66 0.00 0.00 0.04 0.00 0.00 61.00 60.57 1zgq s PRO 190 Cb -0.14 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1zgq s PRO 190 CO 0.08 -2.18 0.00 0.41 0.04 0.00 0.00 177.00 175.35 1zgq n GLY 191 N -3.52 1.43 3.65 0.56 0.00 -1.26 -4.18 105.19 101.87 1zgq n GLY 191 Ca 0.16 -1.91 -0.43 0.00 0.00 0.00 0.00 46.02 43.84 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 1.79 2.28 0.26 1.61 5.04 -1.26 -4.39 117.35 122.68 1zgq s TYR 192 Ca 0.00 0.57 -0.02 0.00 -2.44 0.00 0.00 57.07 55.18 1zgq s TYR 192 Cb 0.00 -3.84 0.01 0.00 0.35 0.00 0.00 41.96 38.48 1zgq s TYR 192 CO 0.00 -2.84 0.38 2.48 -1.34 0.00 0.00 175.55 174.23 1zgq n TYR 193 N 7.54 -1.26 -4.20 4.97 0.18 -0.59 -4.86 117.16 118.94 1zgq n TYR 193 Ca 0.17 -1.68 -0.20 0.00 1.88 0.00 0.00 57.90 58.07 1zgq n TYR 193 Cb 0.44 0.43 -0.12 0.00 -0.38 0.00 0.00 39.34 39.71 1zgq n TYR 193 CO 0.00 0.00 0.00 0.71 -2.08 0.00 0.00 176.86 175.49 1zgq s TYR 194 N -3.54 1.33 -0.12 -3.48 1.51 0.13 -0.32 117.35 112.85 1zgq s TYR 194 Ca 0.20 -0.45 -0.00 0.00 -1.01 0.00 0.00 57.07 55.81 1zgq s TYR 194 Cb -0.01 -0.75 0.03 0.00 -0.11 0.00 0.00 41.96 41.12 1zgq s TYR 194 CO 0.15 0.09 -0.08 0.08 -1.11 0.00 0.00 175.55 174.67 1zgq s VAL 195 N -1.24 1.11 -0.04 0.71 1.01 -0.66 -0.52 120.40 120.77 1zgq s VAL 195 Ca -0.00 -0.37 -0.15 0.00 0.00 0.00 0.00 61.98 61.46 1zgq s VAL 195 Cb -0.10 -1.13 -0.05 0.00 0.00 0.00 0.00 36.38 35.10 1zgq s VAL 195 CO 0.03 0.36 0.39 -1.81 0.00 0.00 0.00 175.10 174.06 1zgq s ASP 196 N 1.67 6.72 0.02 3.32 1.01 -0.03 -0.37 116.67 129.01 1zgq s ASP 196 Ca 0.05 0.86 -0.03 0.00 0.71 0.00 0.00 52.55 54.13 1zgq s ASP 196 Cb -0.13 -2.24 -0.02 0.00 1.01 0.00 0.00 42.92 41.55 1zgq s ASP 196 CO -0.09 0.26 0.04 -0.44 0.21 0.00 0.00 175.17 175.15 1zgq s SER 197 N -0.66 0.21 -0.26 0.27 0.01 -0.22 -1.36 113.70 111.69 1zgq s SER 197 Ca 0.23 -0.50 -0.02 0.00 1.31 0.00 0.00 55.95 56.97 1zgq s SER 197 Cb -0.16 0.16 0.12 0.00 0.21 0.00 0.00 66.02 66.35 1zgq s SER 197 CO 0.11 -0.40 0.26 -0.75 0.41 0.00 0.00 173.24 172.88 1zgq s LYS 198 N -1.98 0.27 -0.19 12.44 2.20 -0.52 -0.69 119.74 131.28 1zgq s LYS 198 Ca -0.11 -0.01 -0.09 0.00 -0.36 0.00 0.00 55.97 55.40 1zgq s LYS 198 Cb -0.05 -0.87 -0.05 0.00 -1.51 0.00 0.00 37.83 35.35 1zgq s LYS 198 CO -0.02 -0.88 0.13 -1.17 -0.36 0.00 0.00 175.35 173.05 1zgq s LEU 199 N 2.34 4.22 0.00 5.43 0.20 -1.26 -2.26 118.68 127.36 1zgq s LEU 199 Ca 0.09 0.26 0.06 0.00 0.69 0.00 0.00 54.13 55.23 1zgq s LEU 199 Cb -0.15 -2.08 -0.02 0.00 -0.43 0.00 0.00 46.19 43.52 1zgq s LEU 199 CO -0.25 0.22 -0.18 -1.81 -0.29 0.00 0.00 176.35 174.04 1zgq s ASP 200 N 0.12 2.08 -0.45 3.68 1.01 0.52 -4.63 116.67 119.00 1zgq s ASP 200 Ca 0.09 -0.36 -0.21 0.00 0.71 0.00 0.00 52.55 52.78 1zgq s ASP 200 Cb -0.11 -0.21 0.03 0.00 1.01 0.00 0.00 42.92 43.63 1zgq s ASP 200 CO -0.01 0.19 0.68 -0.63 0.21 0.00 0.00 175.17 175.61 1zgq s ILE 201 N -0.51 4.78 0.09 0.77 -1.09 -1.26 -0.63 121.20 123.35 1zgq s ILE 201 Ca 0.06 0.15 -0.09 0.00 -2.23 0.00 0.00 60.65 58.55 1zgq s ILE 201 Cb -0.07 -4.25 -0.25 0.00 -1.58 0.00 0.00 42.46 36.31 1zgq s ILE 201 CO -0.00 -0.65 1.18 0.71 -1.23 0.00 0.00 174.94 174.95 1zgq h THR 202 N 5.90 1.37 -2.70 2.92 1.35 -1.38 -3.48 112.91 116.89 1zgq h THR 202 Ca -0.25 -2.59 -0.05 0.00 -0.55 0.00 0.00 66.41 62.97 1zgq h THR 202 Cb 1.09 2.65 -0.16 0.00 -1.73 0.00 0.00 68.15 70.00 1zgq h THR 202 CO 0.92 0.77 0.09 -0.94 -0.25 0.00 0.00 175.52 176.11 1zgq s SER 203 N -7.25 -0.49 -0.04 5.36 1.04 -1.17 -5.02 113.70 106.13 1zgq s SER 203 Ca -0.07 0.22 -0.30 0.00 0.48 0.00 0.00 55.95 56.28 1zgq s SER 203 Cb 0.07 0.52 0.08 0.00 0.10 0.00 0.00 66.02 66.79 1zgq s SER 203 CO 0.90 -0.75 0.75 -1.38 0.98 0.00 0.00 173.24 173.74 1zgq s HIS 204 N -2.50 -0.56 0.82 5.02 -0.00 -1.26 -0.48 115.29 116.33 1zgq s HIS 204 Ca -0.05 0.85 -0.09 0.00 -0.00 0.00 0.00 55.06 55.78 1zgq s HIS 204 Cb -0.01 0.45 0.14 0.00 -0.00 0.00 0.00 32.58 33.16 1zgq s HIS 204 CO -0.02 -0.58 1.14 0.54 -0.00 0.00 0.00 174.74 175.82 1zgq s ASN 205 N -1.47 3.96 0.23 7.38 4.22 -0.90 -4.98 114.94 123.38 1zgq s ASN 205 Ca -0.06 0.12 -0.06 0.00 -2.14 0.00 0.00 52.86 50.71 1zgq s ASN 205 Cb -0.00 -0.43 0.41 0.00 1.28 0.00 0.00 41.25 42.51 1zgq s ASN 205 CO 0.04 -2.16 1.71 -0.08 -2.04 0.00 0.00 177.10 174.57 1zgq h GLU 206 N -1.01 0.34 -0.70 3.55 4.22 -2.03 -2.90 114.58 116.05 1zgq h GLU 206 Ca -0.42 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.00 1zgq h GLU 206 Cb 1.27 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1zgq h GLU 206 CO 0.45 0.23 0.00 -0.40 -2.18 0.00 0.00 179.01 177.10 1zgq n ASP 207 N -5.07 4.10 -2.88 1.04 3.85 -1.26 -4.97 116.55 111.36 1zgq n ASP 207 Ca 0.13 -2.10 -0.21 0.00 -0.71 0.00 0.00 54.79 51.90 1zgq n ASP 207 Cb 0.40 -0.50 0.04 0.00 -1.35 0.00 0.00 41.12 39.71 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 1.49 -1.97 0.08 2.11 4.02 -1.10 -4.40 117.16 117.40 1zgq n TYR 208 Ca 0.24 0.57 0.11 0.00 -0.01 0.00 0.00 57.90 58.81 1zgq n TYR 208 Cb 0.67 -4.31 -0.03 0.00 -0.02 0.00 0.00 39.34 35.65 1zgq n TYR 208 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1zgq n THR 209 N -4.49 0.56 -3.88 -0.72 -2.24 -1.26 -4.74 114.28 97.51 1zgq n THR 209 Ca -0.08 -0.55 -0.26 0.00 -2.27 0.00 0.00 64.05 60.89 1zgq n THR 209 Cb 0.60 -0.31 -0.17 0.00 -2.10 0.00 0.00 70.33 68.35 1zgq n THR 209 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1zgq s ILE 210 N -3.37 0.92 -0.01 2.28 1.01 -1.26 -1.34 121.20 119.43 1zgq s ILE 210 Ca -0.02 -0.26 0.01 0.00 0.00 0.00 0.00 60.65 60.38 1zgq s ILE 210 Cb 0.10 -0.99 0.00 0.00 0.01 0.00 0.00 42.46 41.59 1zgq s ILE 210 CO 0.81 0.31 -0.03 -0.69 0.00 0.00 0.00 174.94 175.34 1zgq s VAL 211 N 1.75 0.27 -0.10 2.92 1.01 -0.69 -2.11 120.40 123.45 1zgq s VAL 211 Ca 0.04 -0.11 0.03 0.00 0.00 0.00 0.00 61.98 61.94 1zgq s VAL 211 Cb -0.13 -0.26 -0.01 0.00 0.00 0.00 0.00 36.38 35.98 1zgq s VAL 211 CO -0.08 0.10 -0.18 -1.61 0.00 0.00 0.00 175.10 173.33 1zgq s GLU 212 N 0.16 3.00 0.19 2.72 2.02 0.37 0.15 118.70 127.31 1zgq s GLU 212 Ca -0.01 -0.77 0.08 0.00 0.02 0.00 0.00 54.97 54.28 1zgq s GLU 212 Cb -0.04 -2.42 -0.04 0.00 0.10 0.00 0.00 34.13 31.72 1zgq s GLU 212 CO -0.00 0.31 -0.15 -0.65 0.02 0.00 0.00 175.26 174.78 1zgq s GLN 213 N 0.06 1.29 0.01 1.61 -0.21 0.20 -0.96 119.66 121.66 1zgq s GLN 213 Ca -0.07 -1.52 0.02 0.00 0.02 0.00 0.00 55.36 53.81 1zgq s GLN 213 Cb -0.15 -1.14 -0.01 0.00 1.00 0.00 0.00 33.01 32.71 1zgq s GLN 213 CO 0.05 0.20 -0.06 -0.47 -2.12 0.00 0.00 175.29 172.89 1zgq s TYR 214 N -2.70 0.51 -0.03 0.91 5.04 0.20 -1.73 117.35 119.54 1zgq s TYR 214 Ca 0.20 -0.17 -0.01 0.00 -2.44 0.00 0.00 57.07 54.65 1zgq s TYR 214 Cb -0.02 -0.32 0.03 0.00 0.35 0.00 0.00 41.96 42.00 1zgq s TYR 214 CO 0.06 -0.02 0.06 -2.00 -1.34 0.00 0.00 175.55 172.31 1zgq s GLU 215 N -0.42 -0.01 -0.20 4.97 2.12 -0.41 -0.35 118.70 124.40 1zgq s GLU 215 Ca -0.00 0.25 -0.05 0.00 0.36 0.00 0.00 54.97 55.53 1zgq s GLU 215 Cb -0.04 -0.25 -0.02 0.00 0.26 0.00 0.00 34.13 34.08 1zgq s GLU 215 CO -0.00 -0.18 -0.01 0.50 -0.54 0.00 0.00 175.26 175.03 1zgq s ARG 216 N 1.19 3.61 -0.09 4.30 3.52 -0.96 -2.12 118.95 128.39 1zgq s ARG 216 Ca -0.08 -0.53 -0.04 0.00 -0.13 0.00 0.00 55.73 54.95 1zgq s ARG 216 Cb -0.13 -3.06 0.05 0.00 -1.56 0.00 0.00 34.95 30.26 1zgq s ARG 216 CO -0.04 0.02 0.19 -0.08 -0.81 0.00 0.00 175.30 174.59 1zgq s THR 217 N 0.96 -0.20 -0.00 4.11 -1.32 -0.06 -1.44 115.64 117.70 1zgq s THR 217 Ca 0.01 0.26 0.02 0.00 -1.21 0.00 0.00 61.69 60.77 1zgq s THR 217 Cb -0.14 -0.32 -0.01 0.00 -1.51 0.00 0.00 72.50 70.51 1zgq s THR 217 CO 0.02 0.11 -0.08 -1.61 -2.21 0.00 0.00 174.62 170.85 1zgq s GLU 218 N 1.84 0.60 0.09 7.08 2.02 -0.46 -2.09 118.70 127.77 1zgq s GLU 218 Ca -0.03 -0.32 -0.07 0.00 0.02 0.00 0.00 54.97 54.57 1zgq s GLU 218 Cb -0.12 -0.57 -0.06 0.00 0.10 0.00 0.00 34.13 33.49 1zgq s GLU 218 CO -0.07 0.15 0.37 0.20 0.02 0.00 0.00 175.26 175.93 1zgq s GLY 219 N -0.32 2.29 0.16 -1.39 0.00 0.18 -0.86 107.32 107.38 1zgq s GLY 219 Ca 0.02 -0.48 -0.24 0.00 0.00 0.00 0.00 44.72 44.02 1zgq s GLY 219 CO -0.00 -0.31 0.81 1.09 0.00 0.00 0.00 173.10 174.68 1zgq s ARG 220 N -2.15 1.30 0.71 2.90 1.70 0.32 -4.45 118.95 119.27 1zgq s ARG 220 Ca 0.35 -0.64 -0.07 0.00 -0.47 0.00 0.00 55.73 54.90 1zgq s ARG 220 Cb -0.13 0.49 0.06 0.00 -0.57 0.00 0.00 34.95 34.80 1zgq s ARG 220 CO 0.20 -0.59 1.01 -1.01 -1.08 0.00 0.00 175.30 173.84 1zgq s HIS 221 N -3.51 2.88 0.48 5.89 3.76 -1.26 -0.69 115.29 122.84 1zgq s HIS 221 Ca 0.08 0.42 -0.23 0.00 -0.15 0.00 0.00 55.06 55.19 1zgq s HIS 221 Cb -0.02 -3.20 -0.07 0.00 1.11 0.00 0.00 32.58 30.40 1zgq s HIS 221 CO -0.02 -1.42 1.26 -1.58 -0.85 0.00 0.00 174.74 172.13 1zgq s HIS 222 N -3.25 2.64 0.41 1.40 2.46 -1.26 -4.81 115.29 112.88 1zgq s HIS 222 Ca 0.60 1.45 0.30 0.00 0.47 0.00 0.00 55.06 57.88 1zgq s HIS 222 Cb -0.11 -3.59 1.54 0.00 -0.13 0.00 0.00 32.58 30.30 1zgq s HIS 222 CO 0.45 -2.14 2.09 -0.07 -2.47 0.00 0.00 174.74 172.60 1zgq h LEU 223 N 1.92 0.00 -1.57 8.88 3.38 -2.04 -3.35 115.31 122.53 1zgq h LEU 223 Ca -0.50 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.43 1zgq h LEU 223 Cb 1.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 1zgq h LEU 223 CO 0.59 0.09 -0.20 -0.26 0.09 0.00 0.00 178.44 178.76 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 0.32 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.88 1zgq h PHE 224 CO 0.00 0.20 0.00 1.28 -1.61 0.00 0.00 178.31 178.18