#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gnq s ILE 2 N 0.00 5.15 -0.23 12.58 1.09 -0.82 -4.96 121.20 134.02 3gnq s ILE 2 Ca 0.00 0.61 -0.10 0.00 -1.10 0.00 0.00 60.65 60.07 3gnq s ILE 2 Cb 0.00 -3.63 -0.05 0.00 -1.06 0.00 0.00 42.46 37.73 3gnq s ILE 2 CO 0.00 0.53 0.13 -0.13 -0.10 0.00 0.00 174.94 175.37 3gnq s ARG 3 N -1.24 4.01 0.07 2.79 0.52 -1.26 -0.95 118.95 122.89 3gnq s ARG 3 Ca 0.24 -0.31 0.09 0.00 -0.52 0.00 0.00 55.73 55.23 3gnq s ARG 3 Cb -0.15 -3.45 -0.03 0.00 0.52 0.00 0.00 34.95 31.84 3gnq s ARG 3 CO 0.12 0.08 -0.24 0.08 0.02 0.00 0.00 175.30 175.36 3gnq s VAL 4 N 0.97 1.97 0.08 3.52 1.01 0.06 -1.67 120.40 126.35 3gnq s VAL 4 Ca 0.06 -1.43 0.06 0.00 0.00 0.00 0.00 61.98 60.68 3gnq s VAL 4 Cb -0.13 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.50 3gnq s VAL 4 CO 0.03 0.21 -0.17 0.00 0.00 0.00 0.00 175.10 175.18 3gnq s ALA 5 N -0.90 1.42 -0.24 5.51 0.00 -0.56 -1.06 121.76 125.94 3gnq s ALA 5 Ca 0.10 -1.06 -0.02 0.00 0.00 0.00 0.00 51.96 50.99 3gnq s ALA 5 Cb -0.10 -0.17 0.02 0.00 0.00 0.00 0.00 23.12 22.87 3gnq s ALA 5 CO 0.03 0.25 -0.07 0.42 0.00 0.00 0.00 175.76 176.39 3gnq s ILE 6 N -1.14 2.84 -0.35 0.00 1.01 -0.90 0.19 121.20 122.85 3gnq s ILE 6 Ca 0.02 -0.99 -0.18 0.00 0.00 0.00 0.00 60.65 59.50 3gnq s ILE 6 Cb -0.10 -2.42 -0.00 0.00 0.01 0.00 0.00 42.46 39.95 3gnq s ILE 6 CO 0.03 0.23 0.50 0.21 0.00 0.00 0.00 174.94 175.91 3gnq s ASN 7 N 1.33 6.31 0.00 3.58 2.47 0.29 -1.33 114.94 127.59 3gnq s ASN 7 Ca 0.01 -0.03 0.00 0.00 0.42 0.00 0.00 52.86 53.25 3gnq s ASN 7 Cb -0.16 -2.26 0.00 0.00 -1.45 0.00 0.00 41.25 37.37 3gnq s ASN 7 CO -0.05 -0.47 0.00 0.61 -3.72 0.00 0.00 177.10 173.47 3gnq n GLY 8 N 4.80 -0.66 2.77 1.21 0.00 0.46 0.33 105.19 114.09 3gnq n GLY 8 Ca -0.05 -0.73 -0.37 0.00 0.00 0.00 0.00 46.02 44.87 3gnq n GLY 8 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3gnq n TYR 9 N 0.93 3.08 -0.34 1.61 -0.00 -1.21 -3.85 117.16 117.37 3gnq n TYR 9 Ca 0.00 -2.52 0.00 0.00 -0.00 0.00 0.00 57.90 55.38 3gnq n TYR 9 Cb 0.00 -1.01 0.00 0.00 -0.00 0.00 0.00 39.34 38.33 3gnq n TYR 9 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 3gnq n GLY 10 N -0.57 1.80 0.32 2.98 0.00 -1.26 -4.12 105.19 104.34 3gnq n GLY 10 Ca 0.52 -1.76 -0.06 0.00 0.00 0.00 0.00 46.02 44.72 3gnq n GLY 10 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3gnq h ARG 11 N 0.00 1.10 0.08 1.61 2.47 -1.91 0.33 114.38 118.06 3gnq h ARG 11 Ca 0.00 -0.17 -0.33 0.00 -1.26 0.00 0.00 59.98 58.22 3gnq h ARG 11 Cb 0.00 -0.19 -0.03 0.00 -1.65 0.00 0.00 29.97 28.10 3gnq h ARG 11 CO 0.00 0.87 -1.81 0.82 0.56 0.00 0.00 179.97 180.41 3gnq h ILE 12 N 1.07 0.81 0.04 2.04 1.08 -1.91 -3.12 117.51 117.52 3gnq h ILE 12 Ca 0.26 -2.55 0.02 0.00 -0.39 0.00 0.00 64.86 62.19 3gnq h ILE 12 Cb 0.15 2.53 -0.05 0.00 -3.07 0.00 0.00 36.82 36.37 3gnq h ILE 12 CO -0.03 0.74 -0.52 1.23 -0.69 0.00 0.00 178.15 178.88 3gnq h GLY 13 N 2.04 -1.09 1.04 5.37 0.00 -1.62 -1.32 103.07 107.49 3gnq h GLY 13 Ca -0.34 0.64 -0.14 0.00 0.00 0.00 0.00 47.33 47.49 3gnq h GLY 13 CO 0.10 -0.25 -0.33 3.21 0.00 0.00 0.00 176.54 179.27 3gnq h ARG 14 N -0.69 0.81 -0.22 4.80 3.08 -0.50 -2.89 114.38 118.77 3gnq h ARG 14 Ca 0.01 -0.43 -0.08 0.00 0.07 0.00 0.00 59.98 59.56 3gnq h ARG 14 Cb 0.73 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.78 3gnq h ARG 14 CO -0.33 1.06 -0.19 -0.91 -1.07 0.00 0.00 179.97 178.53 3gnq h ASN 15 N 0.59 0.37 -0.14 7.04 2.35 -1.59 0.23 115.58 124.42 3gnq h ASN 15 Ca 0.05 -0.10 0.01 0.00 -0.55 0.00 0.00 56.30 55.70 3gnq h ASN 15 Cb 0.92 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 39.18 3gnq h ASN 15 CO 0.08 0.58 0.07 0.74 -1.65 0.00 0.00 177.43 177.25 3gnq h THR 16 N 0.35 1.00 -0.28 2.81 2.02 -1.16 0.43 112.91 118.07 3gnq h THR 16 Ca 0.06 -0.05 0.02 0.00 0.77 0.00 0.00 66.41 67.21 3gnq h THR 16 Cb 0.54 0.84 -0.03 0.00 -1.74 0.00 0.00 68.15 67.77 3gnq h THR 16 CO 0.04 0.03 0.13 0.25 0.37 0.00 0.00 175.52 176.33 3gnq h LEU 17 N 0.15 0.18 -0.70 2.58 6.46 -1.23 -2.16 115.31 120.59 3gnq h LEU 17 Ca 0.05 0.02 0.03 0.00 -0.12 0.00 0.00 57.88 57.86 3gnq h LEU 17 Cb 0.01 -0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 39.88 3gnq h LEU 17 CO -0.04 0.14 0.45 0.03 -0.62 0.00 0.00 178.44 178.40 3gnq h ARG 18 N 0.28 0.85 -0.81 1.25 3.08 -0.09 -2.13 114.38 116.81 3gnq h ARG 18 Ca 0.12 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 3gnq h ARG 18 Cb 0.05 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 29.87 3gnq h ARG 18 CO -0.09 0.56 0.41 0.00 -1.07 0.00 0.00 179.97 179.78 3gnq h ALA 19 N 1.29 1.19 -0.21 0.04 0.00 0.04 0.16 119.26 121.78 3gnq h ALA 19 Ca 0.28 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 3gnq h ALA 19 Cb -0.00 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 3gnq h ALA 19 CO -0.10 0.63 0.13 0.35 0.00 0.00 0.00 179.25 180.25 3gnq h PHE 20 N 1.15 0.27 -0.21 0.00 3.57 -0.74 -0.74 116.94 120.24 3gnq h PHE 20 Ca 0.28 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.72 3gnq h PHE 20 Cb 0.08 -0.09 -0.00 0.00 2.79 0.00 0.00 35.95 38.72 3gnq h PHE 20 CO 0.01 0.21 -0.13 1.88 -2.23 0.00 0.00 178.31 178.05 3gnq h TYR 21 N 0.25 0.54 0.00 0.41 -1.99 -1.22 -1.40 116.97 113.55 3gnq h TYR 21 Ca 0.07 -0.14 -0.03 0.00 2.00 0.00 0.00 58.73 60.63 3gnq h TYR 21 Cb 0.01 -0.12 -0.00 0.00 2.00 0.00 0.00 36.73 38.62 3gnq h TYR 21 CO -0.05 0.76 -0.15 0.93 -0.00 0.00 0.00 178.16 179.65 3gnq h GLU 22 N 0.15 0.00 -0.00 4.88 5.08 -0.88 0.06 114.58 123.88 3gnq h GLU 22 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3gnq h GLU 22 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 3gnq h GLU 22 CO 0.04 0.15 -0.00 -1.71 -1.00 0.00 0.00 179.01 176.49 3gnq n ASN 23 N -4.28 0.06 0.00 1.42 5.15 -0.29 -4.93 115.26 112.38 3gnq n ASN 23 Ca -0.02 -0.83 0.00 0.00 -0.60 0.00 0.00 54.58 53.13 3gnq n ASN 23 Cb 0.22 -0.06 0.00 0.00 -0.53 0.00 0.00 39.78 39.41 3gnq n ASN 23 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3gnq n GLY 24 N 1.07 0.47 3.68 8.20 0.00 0.01 -4.02 105.19 114.59 3gnq n GLY 24 Ca 0.22 -0.95 -0.24 0.00 0.00 0.00 0.00 46.02 45.05 3gnq n GLY 24 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gnq n LYS 25 N -2.79 -6.41 0.06 1.61 5.02 -0.53 -4.88 118.16 110.24 3gnq n LYS 25 Ca 0.00 0.72 0.13 0.00 -2.02 0.00 0.00 58.31 57.15 3gnq n LYS 25 Cb 0.02 -5.63 0.42 0.00 -0.02 0.00 0.00 35.03 29.82 3gnq n LYS 25 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3gnq n LYS 26 N -4.60 0.18 -2.42 1.97 5.02 -1.26 -4.71 118.16 112.34 3gnq n LYS 26 Ca -0.10 0.12 -0.42 0.00 -2.02 0.00 0.00 58.31 55.90 3gnq n LYS 26 Cb 0.60 -1.69 -0.03 0.00 -0.02 0.00 0.00 35.03 33.89 3gnq n LYS 26 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3gnq s HIS 27 N -3.08 3.46 -1.27 2.13 3.76 -1.26 -4.92 115.29 114.11 3gnq s HIS 27 Ca 0.11 1.40 -0.13 0.00 -0.15 0.00 0.00 55.06 56.28 3gnq s HIS 27 Cb 0.15 -3.40 -0.05 0.00 1.11 0.00 0.00 32.58 30.39 3gnq s HIS 27 CO 0.60 -1.14 2.34 -3.47 -0.85 0.00 0.00 174.74 172.22 3gnq n ASP 28 N 3.13 5.01 -3.76 1.40 4.64 -1.26 -4.79 116.55 120.92 3gnq n ASP 28 Ca 0.06 -2.65 -0.10 0.00 -1.38 0.00 0.00 54.79 50.72 3gnq n ASP 28 Cb 0.46 -1.43 -0.06 0.00 -1.04 0.00 0.00 41.12 39.05 3gnq n ASP 28 CO 0.00 0.00 0.00 -1.48 -0.82 0.00 0.00 177.20 174.90 3gnq s LEU 29 N 1.13 0.97 -0.01 -2.67 2.34 -1.26 -1.94 118.68 117.24 3gnq s LEU 29 Ca 0.54 -0.49 0.02 0.00 0.06 0.00 0.00 54.13 54.27 3gnq s LEU 29 Cb 0.14 1.39 -0.00 0.00 -0.56 0.00 0.00 46.19 47.16 3gnq s LEU 29 CO -0.03 -0.77 -0.08 -1.61 -1.06 0.00 0.00 176.35 172.79 3gnq s GLU 30 N -3.76 0.74 -0.34 1.48 0.41 -0.12 -4.89 118.70 112.22 3gnq s GLU 30 Ca 0.04 -0.29 -0.22 0.00 -0.41 0.00 0.00 54.97 54.09 3gnq s GLU 30 Cb 0.03 -0.71 0.00 0.00 -1.78 0.00 0.00 34.13 31.67 3gnq s GLU 30 CO -0.11 0.15 0.74 0.42 -0.49 0.00 0.00 175.26 175.96 3gnq s ILE 31 N -0.04 4.81 -0.58 -1.63 1.01 -1.26 -0.76 121.20 122.74 3gnq s ILE 31 Ca 0.01 0.91 0.16 0.00 0.00 0.00 0.00 60.65 61.73 3gnq s ILE 31 Cb -0.05 -4.14 -0.20 0.00 0.01 0.00 0.00 42.46 38.08 3gnq s ILE 31 CO -0.00 -0.32 0.61 1.33 0.00 0.00 0.00 174.94 176.56 3gnq n VAL 32 N 5.63 0.00 -3.49 2.92 0.24 -0.22 -4.74 118.33 118.66 3gnq n VAL 32 Ca 0.02 -0.18 -0.13 0.00 -2.04 0.00 0.00 64.34 62.01 3gnq n VAL 32 Cb 0.48 0.78 -0.04 0.00 -1.47 0.00 0.00 33.84 33.60 3gnq n VAL 32 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3gnq s ALA 33 N -2.69 -1.75 -0.01 2.33 0.00 -1.24 -1.85 121.76 116.54 3gnq s ALA 33 Ca 0.03 1.03 -0.02 0.00 0.00 0.00 0.00 51.96 53.00 3gnq s ALA 33 Cb 0.12 0.27 -0.00 0.00 0.00 0.00 0.00 23.12 23.51 3gnq s ALA 33 CO 0.68 -0.56 0.05 0.96 0.00 0.00 0.00 175.76 176.88 3gnq s ILE 34 N -2.42 0.03 -0.03 0.00 -4.36 -0.07 -2.11 121.20 112.24 3gnq s ILE 34 Ca -0.02 -0.25 0.05 0.00 -0.26 0.00 0.00 60.65 60.17 3gnq s ILE 34 Cb -0.01 -0.16 -0.01 0.00 1.25 0.00 0.00 42.46 43.54 3gnq s ILE 34 CO -0.03 -0.14 -0.19 0.21 0.24 0.00 0.00 174.94 175.04 3gnq s ASN 35 N -0.41 2.24 0.00 4.36 2.47 -0.44 -0.23 114.94 122.92 3gnq s ASN 35 Ca -0.05 -0.35 0.00 0.00 0.42 0.00 0.00 52.86 52.88 3gnq s ASN 35 Cb -0.03 -0.41 0.00 0.00 -1.45 0.00 0.00 41.25 39.36 3gnq s ASN 35 CO 0.00 0.20 0.00 -0.67 -3.72 0.00 0.00 177.10 172.91 3gnq n ASP 36 N 2.83 0.42 -0.08 -4.21 2.03 -1.01 -0.40 116.55 116.12 3gnq n ASP 36 Ca -0.16 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.10 3gnq n ASP 36 Cb 0.53 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.77 3gnq n ASP 36 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3gnq n LEU 37 N 0.00 0.02 0.00 -2.67 4.32 -1.26 -3.84 117.00 113.57 3gnq n LEU 37 Ca 0.00 0.01 -0.05 0.00 -0.02 0.00 0.00 56.01 55.95 3gnq n LEU 37 Cb 0.00 0.38 -0.01 0.00 -1.62 0.00 0.00 43.42 42.18 3gnq n LEU 37 CO 0.00 0.38 -0.01 0.61 -1.22 0.00 0.00 177.39 177.15 3gnq n GLY 38 N 1.64 3.48 3.83 -0.72 0.00 -1.26 -4.95 105.19 107.21 3gnq n GLY 38 Ca -0.26 -2.21 -0.29 0.00 0.00 0.00 0.00 46.02 43.26 3gnq n GLY 38 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3gnq s ASP 39 N -1.52 3.84 0.30 1.61 1.11 -1.26 -4.76 116.67 115.99 3gnq s ASP 39 Ca 0.03 0.88 -0.01 0.00 0.18 0.00 0.00 52.55 53.63 3gnq s ASP 39 Cb -0.00 -1.40 0.46 0.00 1.07 0.00 0.00 42.92 43.05 3gnq s ASP 39 CO 0.02 -2.33 1.90 0.00 1.18 0.00 0.00 175.17 175.94 3gnq h ALA 40 N -1.35 1.34 -0.45 5.23 0.00 -1.92 -2.81 119.26 119.29 3gnq h ALA 40 Ca -0.49 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.17 3gnq h ALA 40 Cb 1.33 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 3gnq h ALA 40 CO 0.63 0.52 -0.20 1.57 0.00 0.00 0.00 179.25 181.76 3gnq h LYS 41 N 0.90 0.90 -0.17 0.00 5.09 -1.92 -1.36 116.57 120.00 3gnq h LYS 41 Ca 0.22 -0.36 -0.01 0.00 0.09 0.00 0.00 60.65 60.59 3gnq h LYS 41 Cb 0.10 -0.04 -0.01 0.00 0.10 0.00 0.00 32.23 32.38 3gnq h LYS 41 CO -0.03 1.01 0.07 1.15 -2.09 0.00 0.00 179.45 179.56 3gnq h THR 42 N 0.78 1.16 0.00 0.07 2.02 -1.91 -1.21 112.91 113.82 3gnq h THR 42 Ca 0.11 -0.47 -0.08 0.00 0.77 0.00 0.00 66.41 66.74 3gnq h THR 42 Cb 0.75 1.14 -0.01 0.00 -1.74 0.00 0.00 68.15 68.29 3gnq h THR 42 CO 0.06 0.15 -0.40 0.78 0.37 0.00 0.00 175.52 176.48 3gnq h ASN 43 N 0.13 0.00 -0.19 4.18 2.35 -1.41 -1.80 115.58 118.84 3gnq h ASN 43 Ca 0.06 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.64 3gnq h ASN 43 Cb 0.17 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.53 3gnq h ASN 43 CO -0.00 0.40 -0.50 0.00 -1.65 0.00 0.00 177.43 175.68 3gnq h ALA 44 N 1.60 0.60 -0.03 -0.83 0.00 -1.11 -0.97 119.26 118.52 3gnq h ALA 44 Ca -0.00 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 3gnq h ALA 44 Cb 0.85 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 3gnq h ALA 44 CO 0.05 0.68 0.02 1.25 0.00 0.00 0.00 179.25 181.25 3gnq h HIS 45 N 0.60 0.04 0.00 0.00 -0.00 -0.72 -1.96 115.15 113.11 3gnq h HIS 45 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.40 3gnq h HIS 45 Cb 1.07 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 28.47 3gnq h HIS 45 CO 0.06 0.05 0.00 1.28 -0.00 0.00 0.00 177.93 179.32 3gnq n LEU 46 N -5.05 0.62 0.10 0.26 4.77 -0.72 -1.35 117.00 115.63 3gnq n LEU 46 Ca -0.07 0.60 -0.18 0.00 -0.03 0.00 0.00 56.01 56.33 3gnq n LEU 46 Cb 0.04 -0.45 -0.12 0.00 -2.33 0.00 0.00 43.42 40.56 3gnq n LEU 46 CO 0.33 -0.32 -0.04 0.74 -1.33 0.00 0.00 177.39 176.76 3gnq h THR 47 N 0.00 1.40 -0.01 -5.08 2.02 -1.01 -3.37 112.91 106.85 3gnq h THR 47 Ca 0.00 -2.75 -0.13 0.00 0.77 0.00 0.00 66.41 64.29 3gnq h THR 47 Cb 0.53 2.81 0.01 0.00 -1.74 0.00 0.00 68.15 69.76 3gnq h THR 47 CO 0.00 0.82 -0.51 -0.61 0.37 0.00 0.00 175.52 175.59 3gnq h GLN 48 N 0.16 0.37 -5.27 6.66 5.75 -0.96 -3.39 115.11 118.43 3gnq h GLN 48 Ca -0.16 -0.38 -0.66 0.00 -0.15 0.00 0.00 58.65 57.30 3gnq h GLN 48 Cb 1.92 0.10 -0.29 0.00 1.07 0.00 0.00 27.48 30.29 3gnq h GLN 48 CO 0.22 1.05 -0.80 0.71 -2.65 0.00 0.00 178.83 177.36 3gnq s TYR 49 N -3.26 2.76 -0.04 3.99 2.02 -0.46 -0.90 117.35 121.46 3gnq s TYR 49 Ca -0.14 -0.86 -0.03 0.00 -0.37 0.00 0.00 57.07 55.67 3gnq s TYR 49 Cb 0.03 -1.84 0.02 0.00 -0.40 0.00 0.00 41.96 39.77 3gnq s TYR 49 CO 0.80 -0.35 0.10 0.34 -1.57 0.00 0.00 175.55 174.88 3gnq s ASP 50 N 0.55 -0.08 0.01 2.29 -1.08 -0.92 -4.58 116.67 112.85 3gnq s ASP 50 Ca -0.10 0.21 -0.16 0.00 -0.52 0.00 0.00 52.55 51.99 3gnq s ASP 50 Cb -0.16 0.16 -0.09 0.00 -1.46 0.00 0.00 42.92 41.38 3gnq s ASP 50 CO 0.04 -0.08 0.98 0.74 0.52 0.00 0.00 175.17 177.37 3gnq h THR 51 N 5.49 0.00 -0.48 1.71 2.02 -1.99 0.27 112.91 119.93 3gnq h THR 51 Ca -0.33 -0.14 0.04 0.00 0.77 0.00 0.00 66.41 66.74 3gnq h THR 51 Cb 1.17 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.54 3gnq h THR 51 CO 0.44 0.00 0.25 0.00 0.37 0.00 0.00 175.52 176.58 3gnq h ALA 52 N -1.59 0.61 -0.01 6.16 0.00 -1.97 -3.20 119.26 119.25 3gnq h ALA 52 Ca -0.06 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3gnq h ALA 52 Cb 0.44 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3gnq h ALA 52 CO 0.10 -0.09 -0.37 0.72 0.00 0.00 0.00 179.25 179.60 3gnq n HIS 53 N -4.88 0.00 -2.93 0.00 8.25 -1.25 -4.97 115.22 109.44 3gnq n HIS 53 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 3gnq n HIS 53 Cb 0.11 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.22 3gnq n HIS 53 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3gnq n GLY 54 N 1.17 -1.86 3.74 -1.41 0.00 0.94 -4.87 105.19 102.90 3gnq n GLY 54 Ca 0.06 -1.56 -0.41 0.00 0.00 0.00 0.00 46.02 44.11 3gnq n GLY 54 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3gnq s LYS 55 N 0.00 4.67 0.10 1.61 2.20 -1.26 -2.17 119.74 124.90 3gnq s LYS 55 Ca 0.00 1.66 -0.32 0.00 -0.36 0.00 0.00 55.97 56.95 3gnq s LYS 55 Cb 0.00 -3.27 -0.11 0.00 -1.51 0.00 0.00 37.83 32.94 3gnq s LYS 55 CO 0.00 0.22 1.80 0.34 -0.36 0.00 0.00 175.35 177.35 3gnq n PHE 56 N 1.93 2.53 -2.18 4.03 7.35 -0.07 -4.90 117.46 126.14 3gnq n PHE 56 Ca 0.01 -0.05 -0.42 0.00 -0.76 0.00 0.00 57.45 56.22 3gnq n PHE 56 Cb 0.46 -2.69 0.00 0.00 0.35 0.00 0.00 39.48 37.61 3gnq n PHE 56 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 3gnq n PRO 57 N 5.32 3.38 -1.72 -7.13 -0.04 -1.26 -4.80 135.00 128.75 3gnq n PRO 57 Ca 0.18 -3.26 0.00 0.00 -0.04 0.00 0.00 63.50 60.39 3gnq n PRO 57 Cb 0.35 -3.05 0.00 0.00 -0.04 0.00 0.00 33.50 30.76 3gnq n PRO 57 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3gnq n GLY 58 N 3.26 0.63 3.43 0.55 0.00 -1.26 -5.00 105.19 106.81 3gnq n GLY 58 Ca 0.43 -0.81 -0.33 0.00 0.00 0.00 0.00 46.02 45.32 3gnq n GLY 58 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3gnq s GLU 59 N -1.76 2.69 -0.06 1.61 2.12 -1.26 -5.01 118.70 117.02 3gnq s GLU 59 Ca 0.00 -0.72 0.01 0.00 0.36 0.00 0.00 54.97 54.62 3gnq s GLU 59 Cb 0.00 -2.40 0.02 0.00 0.26 0.00 0.00 34.13 32.01 3gnq s GLU 59 CO 0.00 0.51 -0.07 0.08 -0.54 0.00 0.00 175.26 175.24 3gnq s VAL 60 N -0.44 0.77 0.19 3.70 1.01 -1.26 -1.74 120.40 122.64 3gnq s VAL 60 Ca 0.05 -0.23 0.04 0.00 0.00 0.00 0.00 61.98 61.83 3gnq s VAL 60 Cb -0.12 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.48 3gnq s VAL 60 CO 0.02 0.29 0.13 -1.54 0.00 0.00 0.00 175.10 174.00 3gnq n SER 61 N 4.17 0.06 -4.20 3.32 3.41 -0.38 -5.00 113.62 115.00 3gnq n SER 61 Ca -0.21 -2.20 -0.18 0.00 -0.26 0.00 0.00 58.87 56.02 3gnq n SER 61 Cb 0.51 0.81 -0.12 0.00 -0.26 0.00 0.00 64.21 65.16 3gnq n SER 61 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3gnq s VAL 62 N -2.64 1.19 -0.38 -3.33 1.01 -1.26 -1.36 120.40 113.63 3gnq s VAL 62 Ca 0.19 -1.48 0.05 0.00 0.00 0.00 0.00 61.98 60.74 3gnq s VAL 62 Cb 0.01 -1.26 0.16 0.00 0.00 0.00 0.00 36.38 35.29 3gnq s VAL 62 CO 0.13 -0.31 0.46 -0.62 0.00 0.00 0.00 175.10 174.76 3gnq s ASP 63 N -2.04 0.20 1.96 3.32 2.15 -0.54 -4.96 116.67 116.76 3gnq s ASP 63 Ca 0.02 -1.22 0.00 0.00 0.43 0.00 0.00 52.55 51.79 3gnq s ASP 63 Cb -0.08 1.07 0.00 0.00 -0.30 0.00 0.00 42.92 43.61 3gnq s ASP 63 CO 0.02 -0.24 0.00 0.61 -0.17 0.00 0.00 175.17 175.40 3gnq n GLY 64 N 4.39 3.39 0.77 2.66 0.00 -1.26 -1.83 105.19 113.31 3gnq n GLY 64 Ca 0.10 0.21 0.03 0.00 0.00 0.00 0.00 46.02 46.36 3gnq n GLY 64 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3gnq n ASP 65 N 9.91 2.12 -4.11 1.61 10.43 -1.26 -4.79 116.55 130.45 3gnq n ASP 65 Ca 0.00 -2.19 -0.26 0.00 2.57 0.00 0.00 54.79 54.92 3gnq n ASP 65 Cb 0.00 -0.40 -0.16 0.00 1.84 0.00 0.00 41.12 42.40 3gnq n ASP 65 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 3gnq s TYR 66 N -1.63 1.63 0.03 1.24 1.51 -0.76 -1.15 117.35 118.23 3gnq s TYR 66 Ca 0.18 -0.49 -0.19 0.00 -1.01 0.00 0.00 57.07 55.57 3gnq s TYR 66 Cb 0.12 -1.12 -0.06 0.00 -0.11 0.00 0.00 41.96 40.79 3gnq s TYR 66 CO 0.08 -0.18 0.53 -1.17 -1.11 0.00 0.00 175.55 173.70 3gnq s LEU 67 N 0.14 4.48 -0.16 -1.29 2.96 -0.08 -1.46 118.68 123.27 3gnq s LEU 67 Ca -0.06 1.15 0.01 0.00 -0.22 0.00 0.00 54.13 55.02 3gnq s LEU 67 Cb -0.12 -2.82 0.02 0.00 0.50 0.00 0.00 46.19 43.77 3gnq s LEU 67 CO 0.02 0.24 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.43 3gnq s VAL 68 N -0.82 1.81 -0.11 1.68 1.01 -0.46 -0.78 120.40 122.72 3gnq s VAL 68 Ca 0.28 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.48 3gnq s VAL 68 Cb -0.18 -1.65 0.02 0.00 0.00 0.00 0.00 36.38 34.56 3gnq s VAL 68 CO 0.17 0.50 -0.12 -0.69 0.00 0.00 0.00 175.10 174.96 3gnq s VAL 69 N 1.30 1.30 -1.59 2.92 1.01 -0.69 -1.25 120.40 123.41 3gnq s VAL 69 Ca 0.03 -0.49 -0.17 0.00 0.00 0.00 0.00 61.98 61.34 3gnq s VAL 69 Cb -0.13 -1.24 0.15 0.00 0.00 0.00 0.00 36.38 35.16 3gnq s VAL 69 CO -0.10 0.41 0.68 0.59 0.00 0.00 0.00 175.10 176.68 3gnq n ASN 70 N 4.55 -3.13 0.00 3.32 4.13 -0.71 -1.19 115.26 122.23 3gnq n ASN 70 Ca -0.17 -0.87 0.00 0.00 1.68 0.00 0.00 54.58 55.22 3gnq n ASN 70 Cb 0.51 -2.59 0.00 0.00 -1.54 0.00 0.00 39.78 36.16 3gnq n ASN 70 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3gnq n GLY 71 N -1.27 2.50 3.72 7.41 0.00 -1.26 -5.01 105.19 111.28 3gnq n GLY 71 Ca 0.07 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 3gnq n GLY 71 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3gnq s ASP 72 N 0.32 6.81 -0.09 1.61 1.01 -0.33 -4.99 116.67 121.01 3gnq s ASP 72 Ca 0.00 2.37 -0.18 0.00 0.71 0.00 0.00 52.55 55.45 3gnq s ASP 72 Cb 0.00 -2.59 -0.05 0.00 1.01 0.00 0.00 42.92 41.29 3gnq s ASP 72 CO 0.00 -0.65 0.48 -0.13 0.21 0.00 0.00 175.17 175.08 3gnq s ARG 73 N 0.85 4.27 -0.07 8.23 0.52 -1.26 -1.70 118.95 129.79 3gnq s ARG 73 Ca 0.63 0.47 0.00 0.00 -0.52 0.00 0.00 55.73 56.32 3gnq s ARG 73 Cb -0.37 -3.39 0.02 0.00 0.52 0.00 0.00 34.95 31.73 3gnq s ARG 73 CO 0.32 0.27 -0.05 0.42 0.02 0.00 0.00 175.30 176.28 3gnq s ILE 74 N 0.24 0.67 -0.03 1.52 1.01 0.04 -4.85 121.20 119.80 3gnq s ILE 74 Ca 0.26 -0.15 -0.30 0.00 0.00 0.00 0.00 60.65 60.46 3gnq s ILE 74 Cb -0.16 -0.71 -0.03 0.00 0.01 0.00 0.00 42.46 41.58 3gnq s ILE 74 CO 0.11 0.28 1.06 -0.60 0.00 0.00 0.00 174.94 175.79 3gnq s ARG 75 N 1.25 4.47 -0.32 2.79 3.52 -0.77 -0.91 118.95 128.97 3gnq s ARG 75 Ca -0.05 1.51 -0.12 0.00 -0.13 0.00 0.00 55.73 56.93 3gnq s ARG 75 Cb -0.14 -3.48 -0.03 0.00 -1.56 0.00 0.00 34.95 29.74 3gnq s ARG 75 CO -0.02 -0.22 0.22 0.08 -0.81 0.00 0.00 175.30 174.55 3gnq s VAL 76 N 1.49 5.29 0.35 7.11 1.01 -0.30 -0.90 120.40 134.46 3gnq s VAL 76 Ca 0.53 -0.08 0.07 0.00 0.00 0.00 0.00 61.98 62.50 3gnq s VAL 76 Cb -0.22 -3.65 -0.02 0.00 0.00 0.00 0.00 36.38 32.48 3gnq s VAL 76 CO 0.24 0.08 0.31 -0.76 0.00 0.00 0.00 175.10 174.98 3gnq s LEU 77 N 1.74 3.59 -0.43 3.92 1.43 0.68 -4.84 118.68 124.76 3gnq s LEU 77 Ca 0.06 -0.51 0.08 0.00 -1.03 0.00 0.00 54.13 52.73 3gnq s LEU 77 Cb -0.17 -2.22 0.30 0.00 0.03 0.00 0.00 46.19 44.13 3gnq s LEU 77 CO 0.11 -0.40 0.87 0.00 0.23 0.00 0.00 176.35 177.15 3gnq n ALA 78 N -1.41 0.40 -3.82 4.21 0.00 -1.26 -2.40 120.51 116.22 3gnq n ALA 78 Ca -0.01 -2.31 -0.31 0.00 0.00 0.00 0.00 53.44 50.81 3gnq n ALA 78 Cb 0.60 -1.07 -0.16 0.00 0.00 0.00 0.00 19.45 18.81 3gnq n ALA 78 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3gnq s ASN 79 N -1.67 2.78 0.57 0.00 3.84 -1.25 -4.93 114.94 114.27 3gnq s ASN 79 Ca 0.31 -0.52 0.27 0.00 0.21 0.00 0.00 52.86 53.13 3gnq s ASN 79 Cb 0.28 -1.26 1.63 0.00 -0.55 0.00 0.00 41.25 41.35 3gnq s ASN 79 CO -0.11 0.01 2.16 0.03 -2.79 0.00 0.00 177.10 176.40 3gnq h ARG 80 N 7.63 0.00 -4.49 0.43 2.47 -1.99 -3.41 114.38 115.03 3gnq h ARG 80 Ca -0.35 0.00 -0.71 0.00 -1.26 0.00 0.00 59.98 57.65 3gnq h ARG 80 Cb 1.16 0.00 -0.27 0.00 -1.65 0.00 0.00 29.97 29.21 3gnq h ARG 80 CO 0.54 0.00 -0.49 1.21 0.56 0.00 0.00 179.97 181.79 3gnq s ASN 81 N -6.19 5.63 0.57 7.04 3.84 -1.26 -4.97 114.94 119.60 3gnq s ASN 81 Ca -0.05 -1.39 0.26 0.00 0.21 0.00 0.00 52.86 51.90 3gnq s ASN 81 Cb 0.16 -1.99 1.67 0.00 -0.55 0.00 0.00 41.25 40.54 3gnq s ASN 81 CO 0.58 -0.50 2.22 -0.65 -2.79 0.00 0.00 177.10 175.97 3gnq h PRO 82 N 8.40 0.00 -0.47 0.43 0.11 -1.86 -3.31 132.00 135.31 3gnq h PRO 82 Ca -0.23 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.92 3gnq h PRO 82 Cb 1.09 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.14 3gnq h PRO 82 CO 0.73 0.00 -0.27 0.00 -0.21 0.00 0.00 178.00 178.25 3gnq n ALA 83 N -2.38 -0.28 -0.10 -0.75 0.00 -1.16 -2.75 120.51 113.10 3gnq n ALA 83 Ca -0.03 0.40 -0.10 0.00 0.00 0.00 0.00 53.44 53.72 3gnq n ALA 83 Cb 0.10 -0.08 -0.15 0.00 0.00 0.00 0.00 19.45 19.32 3gnq n ALA 83 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3gnq n GLU 84 N -4.59 0.82 -0.11 0.00 -0.00 -1.24 -1.19 120.64 114.32 3gnq n GLU 84 Ca 0.01 -0.01 -0.04 0.00 -0.00 0.00 0.00 57.16 57.12 3gnq n GLU 84 Cb 0.13 -1.50 -0.00 0.00 -0.00 0.00 0.00 31.44 30.06 3gnq n GLU 84 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 3gnq n LEU 85 N -2.72 -0.09 -3.03 -1.84 4.77 -1.11 -4.53 117.00 108.45 3gnq n LEU 85 Ca -0.32 0.09 -0.26 0.00 -0.03 0.00 0.00 56.01 55.49 3gnq n LEU 85 Cb 1.13 -0.08 -0.04 0.00 -2.33 0.00 0.00 43.42 42.11 3gnq n LEU 85 CO 0.41 -0.23 2.59 -0.81 -1.33 0.00 0.00 177.39 178.02 3gnq n PRO 86 N 0.09 2.61 -0.04 3.23 -0.04 -1.26 -4.52 135.00 135.07 3gnq n PRO 86 Ca 0.01 -1.62 -0.14 0.00 -0.04 0.00 0.00 63.50 61.72 3gnq n PRO 86 Cb 0.02 -2.48 -0.11 0.00 -0.04 0.00 0.00 33.50 30.88 3gnq n PRO 86 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3gnq h TRP 87 N 5.32 0.08 -0.89 0.54 -0.00 -1.69 -1.98 115.95 117.33 3gnq h TRP 87 Ca 0.58 -0.04 0.13 0.00 -0.00 0.00 0.00 58.89 59.56 3gnq h TRP 87 Cb 0.39 -0.01 -0.09 0.00 -0.00 0.00 0.00 29.16 29.45 3gnq h TRP 87 CO 1.87 0.78 0.50 0.78 -0.00 0.00 0.00 178.44 182.37 3gnq h GLY 88 N -0.64 1.44 1.10 1.49 0.00 -1.16 -1.11 103.07 104.20 3gnq h GLY 88 Ca -0.01 -0.31 -0.06 0.00 0.00 0.00 0.00 47.33 46.95 3gnq h GLY 88 CO 0.01 0.04 0.22 -2.09 0.00 0.00 0.00 176.54 174.73 3gnq h GLU 89 N 0.75 1.12 -0.00 4.80 4.81 -1.82 -3.08 114.58 121.16 3gnq h GLU 89 Ca 0.46 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 59.45 3gnq h GLU 89 Cb 0.57 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.79 3gnq h GLU 89 CO -0.32 0.96 -0.14 1.28 -0.73 0.00 0.00 179.01 180.06 3gnq n LEU 90 N -4.25 0.49 -1.87 1.64 4.77 -0.68 -4.96 117.00 112.14 3gnq n LEU 90 Ca 0.06 0.02 -0.10 0.00 -0.03 0.00 0.00 56.01 55.96 3gnq n LEU 90 Cb 0.23 -0.20 0.03 0.00 -2.33 0.00 0.00 43.42 41.15 3gnq n LEU 90 CO 0.42 0.09 0.09 0.61 -1.33 0.00 0.00 177.39 177.27 3gnq n GLY 91 N 1.32 0.27 3.65 -0.72 0.00 -0.51 -4.99 105.19 104.21 3gnq n GLY 91 Ca 0.13 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 3gnq n GLY 91 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gnq s VAL 92 N -3.14 4.86 -0.10 1.61 1.01 -1.07 -4.72 120.40 118.86 3gnq s VAL 92 Ca 0.20 1.54 -0.17 0.00 0.00 0.00 0.00 61.98 63.55 3gnq s VAL 92 Cb -0.09 -4.10 -0.14 0.00 0.00 0.00 0.00 36.38 32.05 3gnq s VAL 92 CO 0.31 -0.04 0.57 0.44 0.00 0.00 0.00 175.10 176.38 3gnq h ASP 93 N 7.60 -0.07 -3.16 3.32 3.32 -1.67 -2.53 116.42 123.22 3gnq h ASP 93 Ca -0.25 -0.46 -0.59 0.00 0.02 0.00 0.00 57.03 55.75 3gnq h ASP 93 Cb 1.10 0.02 -0.36 0.00 0.22 0.00 0.00 39.33 40.32 3gnq h ASP 93 CO 0.86 0.61 -0.83 -0.69 -1.72 0.00 0.00 179.24 177.47 3gnq s VAL 94 N -2.45 1.52 -0.15 -1.35 1.01 -1.16 0.08 120.40 117.90 3gnq s VAL 94 Ca -0.11 -0.61 -0.19 0.00 0.00 0.00 0.00 61.98 61.07 3gnq s VAL 94 Cb -0.01 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 3gnq s VAL 94 CO 0.40 0.45 0.52 -0.69 0.00 0.00 0.00 175.10 175.78 3gnq s VAL 95 N 1.37 5.13 -0.41 2.92 1.01 0.16 -1.49 120.40 129.10 3gnq s VAL 95 Ca 0.02 1.00 -0.22 0.00 0.00 0.00 0.00 61.98 62.79 3gnq s VAL 95 Cb -0.13 -3.85 0.02 0.00 0.00 0.00 0.00 36.38 32.41 3gnq s VAL 95 CO -0.08 0.25 0.71 -0.04 0.00 0.00 0.00 175.10 175.93 3gnq s MET 96 N 1.13 3.48 -0.56 2.72 -1.94 0.13 -0.51 119.30 123.75 3gnq s MET 96 Ca 0.26 -0.09 -0.22 0.00 -1.71 0.00 0.00 55.69 53.94 3gnq s MET 96 Cb -0.15 -3.89 0.06 0.00 2.01 0.00 0.00 34.83 32.85 3gnq s MET 96 CO 0.11 -0.96 0.81 -2.00 -0.01 0.00 0.00 175.02 172.97 3gnq s GLU 97 N 2.99 3.20 -0.12 2.03 2.56 0.91 -0.55 118.70 129.71 3gnq s GLU 97 Ca 0.27 -0.66 0.15 0.00 0.00 0.00 0.00 54.97 54.72 3gnq s GLU 97 Cb -0.13 -4.11 0.33 0.00 2.00 0.00 0.00 34.13 32.22 3gnq s GLU 97 CO 0.19 -1.45 1.16 0.00 -0.56 0.00 0.00 175.26 174.61 3gnq h THR 99 N 2.72 1.40 0.00 0.00 1.35 -1.78 -3.43 112.91 113.18 3gnq h THR 99 Ca -0.05 -3.07 0.00 0.00 -0.55 0.00 0.00 66.41 62.74 3gnq h THR 99 Cb 1.23 2.79 0.00 0.00 -1.73 0.00 0.00 68.15 70.45 3gnq h THR 99 CO 0.02 0.85 0.00 0.61 -0.25 0.00 0.00 175.52 176.75 3gnq n GLY 100 N 1.51 0.70 0.00 5.82 0.00 -1.26 -4.95 105.19 107.01 3gnq n GLY 100 Ca -0.09 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.85 3gnq n GLY 100 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3gnq n PHE 101 N -2.59 0.00 -3.11 1.61 3.01 -1.26 -4.80 117.46 110.32 3gnq n PHE 101 Ca 0.00 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.26 3gnq n PHE 101 Cb 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.44 3gnq n PHE 101 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 3gnq n PHE 102 N -0.00 1.29 1.09 1.38 3.72 -1.26 -4.92 117.46 118.76 3gnq n PHE 102 Ca 0.00 -3.86 0.12 0.00 -0.05 0.00 0.00 57.45 53.66 3gnq n PHE 102 Cb 0.03 -0.44 0.26 0.00 -0.94 0.00 0.00 39.48 38.38 3gnq n PHE 102 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3gnq n THR 103 N 0.13 0.00 -3.27 4.37 -2.24 -1.26 -4.17 114.28 107.83 3gnq n THR 103 Ca 0.27 -0.06 -0.27 0.00 -2.27 0.00 0.00 64.05 61.72 3gnq n THR 103 Cb 0.59 0.41 -0.02 0.00 -2.10 0.00 0.00 70.33 69.21 3gnq n THR 103 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3gnq s SER 104 N -2.79 6.37 0.30 3.42 1.04 -1.26 -2.24 113.70 118.54 3gnq s SER 104 Ca 0.16 0.65 0.00 0.00 0.48 0.00 0.00 55.95 57.24 3gnq s SER 104 Cb 0.18 -2.12 0.46 0.00 0.10 0.00 0.00 66.02 64.64 3gnq s SER 104 CO 0.64 -0.27 1.85 0.50 0.98 0.00 0.00 173.24 176.94 3gnq h LYS 105 N 1.20 0.78 0.99 4.02 3.64 -1.88 -1.39 116.57 123.93 3gnq h LYS 105 Ca -0.48 -0.15 -0.05 0.00 -1.27 0.00 0.00 60.65 58.70 3gnq h LYS 105 Cb 1.20 -0.12 0.01 0.00 -0.41 0.00 0.00 32.23 32.91 3gnq h LYS 105 CO 0.64 0.70 -0.47 1.49 -2.27 0.00 0.00 179.45 179.53 3gnq h GLU 106 N 0.76 -1.28 -0.94 1.90 4.81 -1.94 0.10 114.58 118.00 3gnq h GLU 106 Ca 0.17 0.09 0.02 0.00 -0.13 0.00 0.00 59.36 59.51 3gnq h GLU 106 Cb 0.26 0.29 -0.05 0.00 0.63 0.00 0.00 28.75 29.88 3gnq h GLU 106 CO -0.01 -0.85 0.62 0.87 -0.73 0.00 0.00 179.01 178.91 3gnq h LYS 107 N -1.34 1.19 0.00 1.92 1.57 -1.91 -2.41 116.57 115.58 3gnq h LYS 107 Ca -0.14 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.55 3gnq h LYS 107 Cb 1.02 -0.27 -0.00 0.00 0.08 0.00 0.00 32.23 33.06 3gnq h LYS 107 CO 0.22 0.78 -0.10 0.00 -0.57 0.00 0.00 179.45 179.79 3gnq h ALA 108 N 1.44 0.99 0.00 3.86 0.00 -1.20 -3.11 119.26 121.24 3gnq h ALA 108 Ca 0.36 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3gnq h ALA 108 Cb -0.06 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3gnq h ALA 108 CO -0.10 0.13 0.00 0.43 0.00 0.00 0.00 179.25 179.71 3gnq n SER 109 N -3.20 0.45 0.21 0.00 7.64 0.02 -1.84 113.62 116.90 3gnq n SER 109 Ca 0.01 0.67 0.14 0.00 1.01 0.00 0.00 58.87 60.70 3gnq n SER 109 Cb 0.41 -0.74 0.76 0.00 -1.01 0.00 0.00 64.21 63.63 3gnq n SER 109 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3gnq h ALA 110 N 2.13 1.01 0.16 -0.43 0.00 -1.68 -1.07 119.26 119.37 3gnq h ALA 110 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.62 3gnq h ALA 110 Cb 0.13 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.93 3gnq h ALA 110 CO 0.00 -0.01 -1.29 0.45 0.00 0.00 0.00 179.25 178.40 3gnq h HIS 111 N 0.00 0.60 -0.95 0.00 3.86 -1.58 -2.64 115.15 114.44 3gnq h HIS 111 Ca 0.00 -0.44 0.02 0.00 -1.16 0.00 0.00 60.37 58.79 3gnq h HIS 111 Cb 0.03 -0.02 -0.05 0.00 1.06 0.00 0.00 27.41 28.42 3gnq h HIS 111 CO 0.00 1.34 0.63 -0.07 0.86 0.00 0.00 177.93 180.69 3gnq h LEU 112 N 0.09 1.07 -0.92 2.43 4.07 -1.37 -1.80 115.31 118.88 3gnq h LEU 112 Ca -0.16 -0.02 -0.02 0.00 0.08 0.00 0.00 57.88 57.76 3gnq h LEU 112 Cb 2.02 -0.26 -0.04 0.00 1.08 0.00 0.00 40.66 43.46 3gnq h LEU 112 CO 0.22 0.76 0.47 0.11 -1.08 0.00 0.00 178.44 178.91 3gnq h LYS 113 N 1.26 1.23 0.00 1.13 6.56 -1.46 -2.34 116.57 122.95 3gnq h LYS 113 Ca 0.36 -0.15 0.00 0.00 -1.06 0.00 0.00 60.65 59.80 3gnq h LYS 113 Cb -0.09 -0.24 0.00 0.00 -0.57 0.00 0.00 32.23 31.33 3gnq h LYS 113 CO -0.09 0.91 0.00 0.41 -2.06 0.00 0.00 179.45 178.62 3gnq n GLY 114 N -1.11 -0.92 0.00 3.86 0.00 -0.33 -4.83 105.19 101.86 3gnq n GLY 114 Ca 0.09 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.25 3gnq n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gnq n GLY 115 N -0.97 0.87 3.78 -0.02 0.00 -0.88 -1.20 105.19 106.76 3gnq n GLY 115 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 3gnq n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnq s ALA 116 N -2.00 3.18 -0.09 4.61 0.00 -0.85 -3.35 121.76 123.27 3gnq s ALA 116 Ca 0.00 0.63 -0.26 0.00 0.00 0.00 0.00 51.96 52.33 3gnq s ALA 116 Cb 0.00 -3.23 -0.26 0.00 0.00 0.00 0.00 23.12 19.63 3gnq s ALA 116 CO 0.00 -0.01 0.91 0.87 0.00 0.00 0.00 175.76 177.53 3gnq h LYS 117 N 2.99 0.10 -4.42 0.00 6.56 -1.43 -3.36 116.57 117.01 3gnq h LYS 117 Ca -0.47 -0.14 -0.23 0.00 -1.06 0.00 0.00 60.65 58.74 3gnq h LYS 117 Cb 1.20 0.05 -0.20 0.00 -0.57 0.00 0.00 32.23 32.71 3gnq h LYS 117 CO 0.64 0.98 -0.72 0.15 -2.06 0.00 0.00 179.45 178.44 3gnq s LYS 118 N -2.69 0.53 0.07 3.15 1.02 0.11 -4.88 119.74 117.06 3gnq s LYS 118 Ca -0.17 -0.84 0.09 0.00 0.02 0.00 0.00 55.97 55.07 3gnq s LYS 118 Cb -0.01 -0.15 -0.03 0.00 -0.52 0.00 0.00 37.83 37.12 3gnq s LYS 118 CO 0.73 0.01 -0.24 0.08 -0.92 0.00 0.00 175.35 175.00 3gnq s VAL 119 N -1.89 2.00 -0.22 3.17 1.01 0.14 -0.66 120.40 123.95 3gnq s VAL 119 Ca -0.07 -1.46 0.00 0.00 0.00 0.00 0.00 61.98 60.45 3gnq s VAL 119 Cb -0.07 -1.74 0.03 0.00 0.00 0.00 0.00 36.38 34.60 3gnq s VAL 119 CO -0.01 0.20 -0.13 -0.63 0.00 0.00 0.00 175.10 174.52 3gnq s ILE 120 N -0.92 2.41 -0.14 2.22 1.01 0.33 -2.15 121.20 123.97 3gnq s ILE 120 Ca 0.11 -1.07 -0.28 0.00 0.00 0.00 0.00 60.65 59.41 3gnq s ILE 120 Cb -0.10 -2.16 -0.01 0.00 0.01 0.00 0.00 42.46 40.20 3gnq s ILE 120 CO 0.03 0.32 0.96 -0.63 0.00 0.00 0.00 174.94 175.63 3gnq s ILE 121 N 1.28 4.80 -0.01 2.92 1.01 0.49 -0.06 121.20 131.62 3gnq s ILE 121 Ca 0.01 1.94 0.00 0.00 0.00 0.00 0.00 60.65 62.60 3gnq s ILE 121 Cb -0.15 -4.27 0.01 0.00 0.01 0.00 0.00 42.46 38.06 3gnq s ILE 121 CO -0.08 -0.01 1.51 -1.54 0.00 0.00 0.00 174.94 174.81 3gnq n SER 122 N 5.22 4.20 -3.71 3.58 3.41 -0.42 -1.18 113.62 124.72 3gnq n SER 122 Ca 0.08 -2.23 -0.04 0.00 -0.26 0.00 0.00 58.87 56.43 3gnq n SER 122 Cb 0.48 -0.82 -0.01 0.00 -0.26 0.00 0.00 64.21 63.60 3gnq n SER 122 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gnq s ALA 123 N -0.05 -1.73 0.22 7.33 0.00 -1.23 -4.95 121.76 121.35 3gnq s ALA 123 Ca 0.01 0.31 -0.32 0.00 0.00 0.00 0.00 51.96 51.96 3gnq s ALA 123 Cb 0.01 0.58 -0.13 0.00 0.00 0.00 0.00 23.12 23.57 3gnq s ALA 123 CO 0.00 -0.99 1.48 -2.30 0.00 0.00 0.00 175.76 173.95 3gnq n PRO 124 N -0.44 2.14 -2.07 0.00 -0.02 -1.19 -4.08 135.00 129.34 3gnq n PRO 124 Ca -0.07 0.77 -0.27 0.00 -2.02 0.00 0.00 63.50 61.91 3gnq n PRO 124 Cb 0.61 -2.47 0.07 0.00 -0.02 0.00 0.00 33.50 31.69 3gnq n PRO 124 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3gnq s GLY 125 N 0.49 1.64 0.99 -1.23 0.00 -1.26 -4.89 107.32 103.06 3gnq s GLY 125 Ca 0.71 -0.78 -0.17 0.00 0.00 0.00 0.00 44.72 44.48 3gnq s GLY 125 CO 0.46 -0.35 0.87 0.61 0.00 0.00 0.00 173.10 174.69 3gnq n GLY 126 N -3.07 -2.76 0.09 0.20 0.00 -0.95 -4.89 105.19 93.81 3gnq n GLY 126 Ca 0.08 -1.48 0.09 0.00 0.00 0.00 0.00 46.02 44.71 3gnq n GLY 126 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gnq n LYS 127 N -4.21 0.11 0.02 1.61 4.01 -1.26 -3.57 118.16 114.86 3gnq n LYS 127 Ca 0.12 0.43 0.11 0.00 -0.51 0.00 0.00 58.31 58.46 3gnq n LYS 127 Cb 0.47 -1.74 0.09 0.00 -0.51 0.00 0.00 35.03 33.33 3gnq n LYS 127 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89 3gnq n ASP 128 N -1.95 0.64 -4.55 4.39 5.68 -1.26 -4.98 116.55 114.52 3gnq n ASP 128 Ca 0.01 -0.31 -0.34 0.00 -0.50 0.00 0.00 54.79 53.65 3gnq n ASP 128 Cb 0.14 0.60 0.11 0.00 -1.14 0.00 0.00 41.12 40.84 3gnq n ASP 128 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 3gnq n VAL 129 N -1.76 1.35 -0.04 2.12 0.24 -1.23 -4.84 118.33 114.17 3gnq n VAL 129 Ca 0.03 -0.25 -0.16 0.00 -2.04 0.00 0.00 64.34 61.92 3gnq n VAL 129 Cb 0.39 -0.90 -0.07 0.00 -1.47 0.00 0.00 33.84 31.78 3gnq n VAL 129 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 3gnq h ASP 130 N -0.96 0.74 -5.05 -1.34 5.19 -1.72 -3.46 116.42 109.82 3gnq h ASP 130 Ca -0.45 -0.61 -0.07 0.00 -0.62 0.00 0.00 57.03 55.27 3gnq h ASP 130 Cb 1.31 -0.22 -0.16 0.00 0.18 0.00 0.00 39.33 40.44 3gnq h ASP 130 CO 0.42 1.23 -0.13 0.00 -3.12 0.00 0.00 179.24 177.63 3gnq s ALA 131 N -3.81 -0.90 -0.17 3.45 0.00 -1.26 -5.06 121.76 114.02 3gnq s ALA 131 Ca -0.12 0.14 -0.00 0.00 0.00 0.00 0.00 51.96 51.98 3gnq s ALA 131 Cb 0.07 0.42 -0.00 0.00 0.00 0.00 0.00 23.12 23.61 3gnq s ALA 131 CO 0.85 -0.49 -0.13 0.99 0.00 0.00 0.00 175.76 176.98 3gnq s THR 132 N -2.83 2.78 -0.15 0.00 2.01 -1.26 -1.53 115.64 114.66 3gnq s THR 132 Ca -0.03 -0.72 0.01 0.00 0.31 0.00 0.00 61.69 61.26 3gnq s THR 132 Cb -0.00 -2.19 0.02 0.00 0.01 0.00 0.00 72.50 70.33 3gnq s THR 132 CO -0.05 0.50 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.57 3gnq s ILE 133 N 0.91 1.85 -0.39 1.82 -1.09 -0.43 -4.68 121.20 119.19 3gnq s ILE 133 Ca -0.03 -0.82 -0.15 0.00 -2.23 0.00 0.00 60.65 57.41 3gnq s ILE 133 Cb -0.15 -1.67 0.01 0.00 -1.58 0.00 0.00 42.46 39.07 3gnq s ILE 133 CO -0.01 0.51 0.34 -0.69 -1.23 0.00 0.00 174.94 173.86 3gnq s VAL 134 N 1.16 5.20 0.27 2.92 1.01 -1.26 -3.80 120.40 125.90 3gnq s VAL 134 Ca -0.00 -0.36 -0.29 0.00 0.00 0.00 0.00 61.98 61.32 3gnq s VAL 134 Cb -0.14 -3.91 -0.10 0.00 0.00 0.00 0.00 36.38 32.24 3gnq s VAL 134 CO -0.08 -0.25 1.26 -0.47 0.00 0.00 0.00 175.10 175.56 3gnq s TYR 135 N 1.89 3.24 0.00 5.22 5.04 -1.26 -1.92 117.35 129.55 3gnq s TYR 135 Ca 0.09 1.41 0.00 0.00 -2.44 0.00 0.00 57.07 56.12 3gnq s TYR 135 Cb -0.18 -3.57 0.00 0.00 0.35 0.00 0.00 41.96 38.57 3gnq s TYR 135 CO 0.11 -1.58 0.00 0.41 -1.34 0.00 0.00 175.55 173.15 3gnq n GLY 136 N 1.45 0.76 1.32 8.97 0.00 -1.26 -4.89 105.19 111.53 3gnq n GLY 136 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3gnq n GLY 136 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gnq n VAL 137 N -2.00 0.19 -1.96 1.61 0.31 -0.81 -4.72 118.33 110.95 3gnq n VAL 137 Ca 0.00 0.06 0.04 0.00 -0.01 0.00 0.00 64.34 64.44 3gnq n VAL 137 Cb 0.00 -1.21 0.08 0.00 -0.91 0.00 0.00 33.84 31.80 3gnq n VAL 137 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 3gnq n ASN 138 N -2.99 1.15 0.19 4.52 6.94 -0.99 -4.83 115.26 119.25 3gnq n ASN 138 Ca 0.00 -2.63 0.07 0.00 -0.02 0.00 0.00 54.58 52.00 3gnq n ASN 138 Cb 0.27 -0.35 0.32 0.00 -2.36 0.00 0.00 39.78 37.66 3gnq n ASN 138 CO 0.00 0.00 0.00 1.12 -1.03 0.00 0.00 177.26 177.35 3gnq h HIS 139 N 0.63 0.00 0.00 -2.53 2.07 -1.93 -2.89 115.15 110.50 3gnq h HIS 139 Ca -0.09 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.43 3gnq h HIS 139 Cb 1.43 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.41 3gnq h HIS 139 CO 0.28 0.33 0.22 -0.25 -3.07 0.00 0.00 177.93 175.44 3gnq n ASP 140 N -3.41 0.26 -0.31 3.10 9.92 -1.26 -1.31 116.55 123.55 3gnq n ASP 140 Ca 0.00 0.52 0.14 0.00 -0.53 0.00 0.00 54.79 54.92 3gnq n ASP 140 Cb 0.52 -0.50 0.66 0.00 -0.64 0.00 0.00 41.12 41.16 3gnq n ASP 140 CO 0.00 0.00 0.00 1.33 0.13 0.00 0.00 177.20 178.66 3gnq n VAL 141 N -1.86 0.01 -2.71 2.53 0.24 -1.09 -4.91 118.33 110.54 3gnq n VAL 141 Ca -0.01 -0.16 -0.40 0.00 -2.04 0.00 0.00 64.34 61.73 3gnq n VAL 141 Cb 0.23 0.13 -0.06 0.00 -1.47 0.00 0.00 33.84 32.68 3gnq n VAL 141 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3gnq s LEU 142 N -1.96 4.63 0.05 1.34 1.43 -0.42 -5.05 118.68 118.70 3gnq s LEU 142 Ca 0.41 1.98 0.05 0.00 -1.03 0.00 0.00 54.13 55.54 3gnq s LEU 142 Cb 0.21 -3.61 -0.02 0.00 0.03 0.00 0.00 46.19 42.79 3gnq s LEU 142 CO 0.34 0.11 -0.15 -0.54 0.23 0.00 0.00 176.35 176.34 3gnq s LYS 143 N -1.16 0.93 0.57 1.70 -0.14 -1.26 -4.47 119.74 115.90 3gnq s LYS 143 Ca 0.42 -0.84 0.28 0.00 -1.36 0.00 0.00 55.97 54.46 3gnq s LYS 143 Cb -0.27 -0.95 1.50 0.00 -1.68 0.00 0.00 37.83 36.43 3gnq s LYS 143 CO 0.33 0.23 1.97 0.00 -0.76 0.00 0.00 175.35 177.11 3gnq h ALA 144 N 4.69 2.22 0.00 5.17 0.00 -1.88 0.13 119.26 129.60 3gnq h ALA 144 Ca -0.39 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3gnq h ALA 144 Cb 1.18 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3gnq h ALA 144 CO 0.42 -0.63 0.00 -0.85 0.00 0.00 0.00 179.25 178.19 3gnq n GLU 145 N -3.93 0.09 -2.46 0.00 0.28 -1.26 -4.76 120.64 108.60 3gnq n GLU 145 Ca 0.08 0.17 -0.42 0.00 -0.16 0.00 0.00 57.16 56.82 3gnq n GLU 145 Cb 0.60 -1.63 -0.03 0.00 1.43 0.00 0.00 31.44 31.81 3gnq n GLU 145 CO 0.00 0.00 0.00 -1.01 -0.16 0.00 0.00 177.13 175.96 3gnq s HIS 146 N -3.07 3.24 -0.06 -1.84 3.76 0.46 -4.93 115.29 112.85 3gnq s HIS 146 Ca 0.10 1.24 0.06 0.00 -0.15 0.00 0.00 55.06 56.31 3gnq s HIS 146 Cb 0.14 -3.42 -0.09 0.00 1.11 0.00 0.00 32.58 30.32 3gnq s HIS 146 CO 0.47 -1.28 0.05 0.25 -0.85 0.00 0.00 174.74 173.38 3gnq n THR 147 N 4.49 0.37 -3.60 1.30 -2.24 -1.26 -4.94 114.28 108.40 3gnq n THR 147 Ca 0.10 -0.27 -0.29 0.00 -2.27 0.00 0.00 64.05 61.33 3gnq n THR 147 Cb 0.46 -0.59 -0.15 0.00 -2.10 0.00 0.00 70.33 67.96 3gnq n THR 147 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3gnq s VAL 148 N -2.24 0.19 0.30 2.28 1.01 -1.26 0.23 120.40 120.92 3gnq s VAL 148 Ca -0.03 -0.91 0.09 0.00 0.00 0.00 0.00 61.98 61.12 3gnq s VAL 148 Cb 0.03 -1.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 3gnq s VAL 148 CO 0.29 -0.69 0.10 0.27 0.00 0.00 0.00 175.10 175.07 3gnq s ILE 149 N 1.97 3.42 -0.02 2.22 -4.36 -0.91 -1.75 121.20 121.76 3gnq s ILE 149 Ca 0.09 -1.72 -0.02 0.00 -0.26 0.00 0.00 60.65 58.74 3gnq s ILE 149 Cb -0.16 -3.00 -0.04 0.00 1.25 0.00 0.00 42.46 40.51 3gnq s ILE 149 CO -0.32 -0.28 0.12 -0.55 0.24 0.00 0.00 174.94 174.15 3gnq s SER 150 N -3.79 5.99 -0.13 4.36 0.15 -0.58 -0.38 113.70 119.32 3gnq s SER 150 Ca 0.35 0.26 0.13 0.00 0.70 0.00 0.00 55.95 57.38 3gnq s SER 150 Cb -0.05 -1.81 0.59 0.00 -1.71 0.00 0.00 66.02 63.04 3gnq s SER 150 CO 0.22 0.29 1.45 -3.20 1.20 0.00 0.00 173.24 173.20 3gnq n ASN 151 N 1.24 4.14 -0.05 5.45 5.15 -0.32 -1.31 115.26 129.56 3gnq n ASN 151 Ca -0.13 -2.49 0.00 0.00 -0.60 0.00 0.00 54.58 51.36 3gnq n ASN 151 Cb 0.53 -0.56 0.00 0.00 -0.53 0.00 0.00 39.78 39.22 3gnq n ASN 151 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3gnq n ALA 152 N 0.69 0.00 -2.52 5.20 0.00 -1.25 -4.68 120.51 117.95 3gnq n ALA 152 Ca 0.21 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.41 3gnq n ALA 152 Cb 0.82 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.20 3gnq n ALA 152 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3gnq s SER 153 N -4.00 4.55 0.29 0.00 1.04 -1.26 -3.17 113.70 111.16 3gnq s SER 153 Ca 0.00 -0.84 0.03 0.00 0.48 0.00 0.00 55.95 55.61 3gnq s SER 153 Cb 0.00 -0.67 0.74 0.00 0.10 0.00 0.00 66.02 66.20 3gnq s SER 153 CO 0.00 -0.30 1.63 0.00 0.98 0.00 0.00 173.24 175.55 3gnq h THR 155 N 0.15 1.39 -0.98 0.00 2.02 -1.95 -1.77 112.91 111.76 3gnq h THR 155 Ca 0.57 -1.54 0.07 0.00 0.77 0.00 0.00 66.41 66.28 3gnq h THR 155 Cb 1.19 2.12 -0.07 0.00 -1.74 0.00 0.00 68.15 69.66 3gnq h THR 155 CO -0.72 0.45 0.63 0.74 0.37 0.00 0.00 175.52 176.99 3gnq h THR 156 N -0.09 1.07 0.00 3.16 2.02 -1.77 0.70 112.91 118.00 3gnq h THR 156 Ca -0.00 -0.39 -0.04 0.00 0.77 0.00 0.00 66.41 66.75 3gnq h THR 156 Cb 0.84 -0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 3gnq h THR 156 CO 0.05 0.21 -0.18 0.78 0.37 0.00 0.00 175.52 176.76 3gnq h ASN 157 N 1.14 0.00 0.21 4.18 4.21 -1.08 -1.56 115.58 122.68 3gnq h ASN 157 Ca 0.43 0.00 -0.32 0.00 1.21 0.00 0.00 56.30 57.62 3gnq h ASN 157 Cb 0.18 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 37.40 3gnq h ASN 157 CO -0.18 0.18 -1.49 0.00 -1.29 0.00 0.00 177.43 174.65 3gnq h LEU 159 N 0.03 0.18 -0.67 0.00 5.85 -0.84 -3.20 115.31 116.67 3gnq h LEU 159 Ca -0.28 -0.73 0.13 0.00 0.84 0.00 0.00 57.88 57.85 3gnq h LEU 159 Cb 2.05 -0.05 -0.13 0.00 0.37 0.00 0.00 40.66 42.90 3gnq h LEU 159 CO 0.21 0.88 -0.18 0.00 -0.34 0.00 0.00 178.44 179.02 3gnq h ALA 160 N 0.30 0.42 0.00 1.25 0.00 -1.50 0.45 119.26 120.18 3gnq h ALA 160 Ca -0.02 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3gnq h ALA 160 Cb 0.90 0.53 0.00 0.00 0.00 0.00 0.00 17.79 19.22 3gnq h ALA 160 CO 0.04 -0.43 0.00 -1.35 0.00 0.00 0.00 179.25 177.50 3gnq h PRO 161 N -0.01 0.00 -0.07 0.00 0.11 -1.77 -1.80 132.00 128.46 3gnq h PRO 161 Ca 0.32 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.40 3gnq h PRO 161 Cb 0.50 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.61 3gnq h PRO 161 CO -0.69 0.00 -0.07 1.25 -0.21 0.00 0.00 178.00 178.27 3gnq h LEU 162 N 0.00 0.19 0.00 2.35 6.46 -0.99 -3.38 115.31 119.95 3gnq h LEU 162 Ca 0.00 -0.49 -0.11 0.00 -0.12 0.00 0.00 57.88 57.17 3gnq h LEU 162 Cb 0.79 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.65 3gnq h LEU 162 CO 0.00 0.64 -0.89 1.62 -0.62 0.00 0.00 178.44 179.19 3gnq h VAL 163 N -0.25 0.53 0.91 1.05 3.04 -0.98 -3.39 116.25 117.15 3gnq h VAL 163 Ca 0.01 -1.86 -0.04 0.00 -1.01 0.00 0.00 66.70 63.80 3gnq h VAL 163 Cb 0.58 2.10 0.01 0.00 -2.01 0.00 0.00 31.29 31.98 3gnq h VAL 163 CO 0.02 0.30 -0.44 0.50 -1.01 0.00 0.00 177.57 176.94 3gnq h LYS 164 N 0.00 -1.17 -0.36 4.17 3.64 -1.49 -2.01 116.57 119.34 3gnq h LYS 164 Ca -0.07 0.08 0.10 0.00 -1.27 0.00 0.00 60.65 59.50 3gnq h LYS 164 Cb 1.38 0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 33.45 3gnq h LYS 164 CO 0.04 -0.78 0.26 -1.00 -2.27 0.00 0.00 179.45 175.71 3gnq h PRO 165 N -1.27 0.00 -0.06 1.90 0.13 -1.77 -1.01 132.00 129.92 3gnq h PRO 165 Ca -0.12 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.79 3gnq h PRO 165 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 3gnq h PRO 165 CO 0.20 0.00 -0.84 -0.07 -0.23 0.00 0.00 178.00 177.06 3gnq h LEU 166 N 0.00 0.61 -0.47 1.56 3.38 -1.69 -1.43 115.31 117.28 3gnq h LEU 166 Ca 0.17 -0.44 -0.17 0.00 0.09 0.00 0.00 57.88 57.53 3gnq h LEU 166 Cb 0.69 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 3gnq h LEU 166 CO -0.00 1.22 -0.72 -1.13 0.09 0.00 0.00 178.44 177.89 3gnq h ASN 167 N 0.31 0.30 -0.25 -0.43 -1.24 -0.85 0.41 115.58 113.84 3gnq h ASN 167 Ca -0.06 -0.20 -0.11 0.00 0.71 0.00 0.00 56.30 56.64 3gnq h ASN 167 Cb 1.45 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 40.40 3gnq h ASN 167 CO 0.15 0.93 -0.23 0.44 -1.29 0.00 0.00 177.43 177.43 3gnq h ASP 168 N 0.17 0.73 0.00 1.15 3.32 -1.10 -3.04 116.42 117.65 3gnq h ASP 168 Ca -0.02 -0.26 -0.34 0.00 0.02 0.00 0.00 57.03 56.43 3gnq h ASP 168 Cb 1.29 -0.20 -0.06 0.00 0.22 0.00 0.00 39.33 40.57 3gnq h ASP 168 CO 0.11 0.94 -2.27 0.29 -1.72 0.00 0.00 179.24 176.60 3gnq n LYS 169 N -4.11 0.82 -0.09 3.56 4.01 -0.55 -4.79 118.16 117.00 3gnq n LYS 169 Ca 0.00 0.06 -0.15 0.00 -0.51 0.00 0.00 58.31 57.72 3gnq n LYS 169 Cb 0.43 -1.46 -0.08 0.00 -0.51 0.00 0.00 35.03 33.41 3gnq n LYS 169 CO 0.00 0.00 0.00 -0.89 -1.11 0.00 0.00 177.40 175.40 3gnq n ILE 170 N -2.93 1.03 0.00 -0.18 5.41 0.04 -5.08 119.36 117.64 3gnq n ILE 170 Ca -0.35 -0.35 0.00 0.00 1.00 0.00 0.00 62.75 63.05 3gnq n ILE 170 Cb 1.00 -1.32 0.00 0.00 -0.71 0.00 0.00 39.64 38.61 3gnq n ILE 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3gnq n GLY 171 N 2.39 1.51 3.33 7.39 0.00 -0.61 -4.15 105.19 115.05 3gnq n GLY 171 Ca -0.33 -1.28 -0.36 0.00 0.00 0.00 0.00 46.02 44.05 3gnq n GLY 171 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3gnq s LEU 172 N 0.00 3.46 -0.06 0.99 0.20 -1.26 -1.11 118.68 120.90 3gnq s LEU 172 Ca 0.00 -0.59 -0.07 0.00 0.69 0.00 0.00 54.13 54.16 3gnq s LEU 172 Cb 0.00 -1.82 -0.04 0.00 -0.43 0.00 0.00 46.19 43.90 3gnq s LEU 172 CO 0.00 -0.12 0.32 -0.08 -0.29 0.00 0.00 176.35 176.18 3gnq h GLU 173 N 8.17 -0.26 -4.08 1.98 4.57 -1.36 -3.48 114.58 120.13 3gnq h GLU 173 Ca -0.35 0.02 -0.14 0.00 -1.18 0.00 0.00 59.36 57.71 3gnq h GLU 173 Cb 1.14 0.06 -0.12 0.00 -0.16 0.00 0.00 28.75 29.66 3gnq h GLU 173 CO 0.60 -0.17 -0.37 0.95 -1.18 0.00 0.00 179.01 178.83 3gnq s THR 174 N -2.40 0.02 -0.00 0.32 -4.23 -1.26 -4.92 115.64 103.18 3gnq s THR 174 Ca -0.04 -1.64 -0.23 0.00 -1.18 0.00 0.00 61.69 58.60 3gnq s THR 174 Cb 0.00 -2.21 0.05 0.00 1.34 0.00 0.00 72.50 71.69 3gnq s THR 174 CO 0.12 -0.10 0.52 -0.83 -0.54 0.00 0.00 174.62 173.79 3gnq s GLY 175 N -3.06 -0.41 -0.01 3.99 0.00 -0.48 -1.96 107.32 105.40 3gnq s GLY 175 Ca 0.27 0.77 0.01 0.00 0.00 0.00 0.00 44.72 45.77 3gnq s GLY 175 CO 0.07 0.48 -0.01 1.08 0.00 0.00 0.00 173.10 174.72 3gnq s LEU 176 N -1.55 1.82 -0.06 0.66 1.43 0.86 -2.38 118.68 119.47 3gnq s LEU 176 Ca -0.09 -0.03 0.06 0.00 -1.03 0.00 0.00 54.13 53.04 3gnq s LEU 176 Cb -0.01 -0.11 -0.01 0.00 0.03 0.00 0.00 46.19 46.08 3gnq s LEU 176 CO 0.04 -0.01 -0.24 -0.32 0.23 0.00 0.00 176.35 176.05 3gnq s MET 177 N 0.19 2.57 -0.11 1.70 -2.45 -0.35 -0.99 119.30 119.85 3gnq s MET 177 Ca -0.02 -0.89 0.03 0.00 -1.25 0.00 0.00 55.69 53.56 3gnq s MET 177 Cb -0.03 -2.18 -0.00 0.00 1.25 0.00 0.00 34.83 33.86 3gnq s MET 177 CO -0.01 0.39 -0.21 0.99 1.05 0.00 0.00 175.02 177.24 3gnq s THR 178 N -0.17 2.36 -0.14 10.11 2.01 -0.37 -1.56 115.64 127.87 3gnq s THR 178 Ca -0.03 -0.91 -0.02 0.00 0.31 0.00 0.00 61.69 61.04 3gnq s THR 178 Cb -0.14 -1.93 -0.02 0.00 0.01 0.00 0.00 72.50 70.42 3gnq s THR 178 CO 0.04 0.55 -0.08 0.28 -0.69 0.00 0.00 174.62 174.72 3gnq s THR 179 N 0.39 3.53 -0.40 -0.82 -1.32 -0.77 0.01 115.64 116.25 3gnq s THR 179 Ca -0.16 -0.49 -0.14 0.00 -1.21 0.00 0.00 61.69 59.69 3gnq s THR 179 Cb -0.17 -2.52 0.02 0.00 -1.51 0.00 0.00 72.50 68.32 3gnq s THR 179 CO 0.07 0.51 0.28 -0.63 -2.21 0.00 0.00 174.62 172.64 3gnq s ILE 180 N 0.34 5.17 -0.02 5.08 1.01 -0.10 -0.90 121.20 131.79 3gnq s ILE 180 Ca -0.07 -0.64 0.08 0.00 0.00 0.00 0.00 60.65 60.01 3gnq s ILE 180 Cb -0.15 -3.86 -0.02 0.00 0.01 0.00 0.00 42.46 38.44 3gnq s ILE 180 CO 0.04 -0.27 -0.26 -2.28 0.00 0.00 0.00 174.94 172.17 3gnq s HIS 181 N 1.67 2.34 0.75 3.97 2.46 -0.44 -1.45 115.29 124.59 3gnq s HIS 181 Ca 0.05 -0.43 -0.15 0.00 0.47 0.00 0.00 55.06 54.99 3gnq s HIS 181 Cb -0.19 -1.49 0.02 0.00 -0.13 0.00 0.00 32.58 30.79 3gnq s HIS 181 CO 0.10 -0.02 0.97 0.00 -2.47 0.00 0.00 174.74 173.32 3gnq n ALA 182 N 2.39 -0.36 -1.49 1.58 0.00 -1.22 -1.46 120.51 119.95 3gnq n ALA 182 Ca -0.16 -0.24 -0.32 0.00 0.00 0.00 0.00 53.44 52.72 3gnq n ALA 182 Cb 0.51 -2.12 0.05 0.00 0.00 0.00 0.00 19.45 17.89 3gnq n ALA 182 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 3gnq s TYR 183 N -1.92 2.85 0.31 0.00 -0.85 -0.04 -4.73 117.35 112.98 3gnq s TYR 183 Ca 0.72 1.50 0.03 0.00 -0.52 0.00 0.00 57.07 58.80 3gnq s TYR 183 Cb -0.33 -3.01 -0.05 0.00 0.38 0.00 0.00 41.96 38.96 3gnq s TYR 183 CO 0.52 -1.44 0.10 0.95 -1.52 0.00 0.00 175.55 174.15 3gnq s THR 184 N -2.75 0.76 -0.21 -3.49 -4.23 -1.26 -4.75 115.64 99.71 3gnq s THR 184 Ca 0.62 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 59.40 3gnq s THR 184 Cb -0.16 -2.63 0.30 0.00 1.34 0.00 0.00 72.50 71.34 3gnq s THR 184 CO 0.49 0.00 1.82 0.78 -0.54 0.00 0.00 174.62 177.17 3gnq h ASN 185 N 2.17 0.00 0.00 3.99 2.35 -1.99 -2.29 115.58 119.81 3gnq h ASN 185 Ca -0.38 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 3gnq h ASN 185 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.62 3gnq h ASN 185 CO 0.62 0.00 0.00 -0.90 -1.65 0.00 0.00 177.43 175.50 3gnq n ASP 186 N -2.52 0.00 -2.86 5.81 5.68 -1.26 -4.82 116.55 116.58 3gnq n ASP 186 Ca 0.01 -0.90 -0.06 0.00 -0.50 0.00 0.00 54.79 53.34 3gnq n ASP 186 Cb 0.21 0.00 0.02 0.00 -1.14 0.00 0.00 41.12 40.21 3gnq n ASP 186 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3gnq n GLN 187 N -0.90 0.89 -4.21 0.11 6.02 -0.86 -4.99 117.38 113.43 3gnq n GLN 187 Ca 0.14 -0.91 -0.15 0.00 -0.01 0.00 0.00 57.00 56.07 3gnq n GLN 187 Cb 0.07 -0.07 -0.11 0.00 1.02 0.00 0.00 30.24 31.15 3gnq n GLN 187 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3gnq s VAL 188 N -0.05 1.10 -0.08 5.09 -7.23 -1.25 -5.03 120.40 112.95 3gnq s VAL 188 Ca 0.18 -1.79 -0.22 0.00 -1.81 0.00 0.00 61.98 58.34 3gnq s VAL 188 Cb -0.01 -1.55 -0.30 0.00 0.56 0.00 0.00 36.38 35.08 3gnq s VAL 188 CO 0.11 -0.58 0.81 -0.07 -0.31 0.00 0.00 175.10 175.06 3gnq h LEU 189 N 3.31 0.36 -8.03 1.32 3.38 -1.95 -1.37 115.31 112.32 3gnq h LEU 189 Ca -0.38 -0.94 -0.21 0.00 0.09 0.00 0.00 57.88 56.45 3gnq h LEU 189 Cb 1.19 -0.12 -0.21 0.00 0.09 0.00 0.00 40.66 41.61 3gnq h LEU 189 CO 0.56 1.35 -0.71 0.28 0.09 0.00 0.00 178.44 180.00 3gnq s THR 190 N -2.39 0.25 0.06 0.22 -1.32 -1.26 -4.38 115.64 106.82 3gnq s THR 190 Ca -0.16 -0.93 -0.35 0.00 -1.21 0.00 0.00 61.69 59.04 3gnq s THR 190 Cb 0.01 -0.37 -0.14 0.00 -1.51 0.00 0.00 72.50 70.49 3gnq s THR 190 CO 0.79 -0.44 1.59 0.47 -2.21 0.00 0.00 174.62 174.82 3gnq n ASP 191 N 1.61 2.77 -3.53 8.08 9.92 -1.26 -4.77 116.55 129.37 3gnq n ASP 191 Ca -0.23 1.07 -0.09 0.00 -0.53 0.00 0.00 54.79 55.01 3gnq n ASP 191 Cb 0.55 -1.34 -0.02 0.00 -0.64 0.00 0.00 41.12 39.67 3gnq n ASP 191 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 3gnq s VAL 192 N 1.63 0.00 0.10 2.53 0.11 -0.73 -5.01 120.40 119.02 3gnq s VAL 192 Ca 0.84 -0.15 -0.36 0.00 -2.93 0.00 0.00 61.98 59.38 3gnq s VAL 192 Cb -0.78 -1.20 -0.17 0.00 -1.53 0.00 0.00 36.38 32.71 3gnq s VAL 192 CO 0.45 0.00 1.18 0.00 -3.33 0.00 0.00 175.10 173.40 3gnq n TYR 193 N -0.33 1.16 -3.89 1.54 9.36 -1.26 -4.51 117.16 119.23 3gnq n TYR 193 Ca -0.11 0.76 -0.09 0.00 3.32 0.00 0.00 57.90 61.78 3gnq n TYR 193 Cb 0.62 -2.24 -0.08 0.00 -0.63 0.00 0.00 39.34 37.01 3gnq n TYR 193 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 3gnq s HIS 194 N 0.09 0.16 -0.26 2.98 5.65 -1.26 -4.92 115.29 117.73 3gnq s HIS 194 Ca 0.81 -0.51 0.28 0.00 0.25 0.00 0.00 55.06 55.89 3gnq s HIS 194 Cb -0.99 -0.09 1.06 0.00 -1.18 0.00 0.00 32.58 31.38 3gnq s HIS 194 CO 0.51 -0.46 1.82 1.05 -0.65 0.00 0.00 174.74 177.02 3gnq h GLU 195 N 3.19 0.00 -4.96 2.88 9.09 -1.97 -3.40 114.58 119.41 3gnq h GLU 195 Ca -0.33 0.00 -0.66 0.00 0.05 0.00 0.00 59.36 58.42 3gnq h GLU 195 Cb 1.19 0.00 -0.26 0.00 -1.65 0.00 0.00 28.75 28.03 3gnq h GLU 195 CO 0.53 0.00 -0.68 0.34 0.05 0.00 0.00 179.01 179.25 3gnq s ASP 196 N -5.08 4.63 0.56 3.06 -1.08 -1.26 -5.01 116.67 112.49 3gnq s ASP 196 Ca 0.04 -0.39 0.35 0.00 -0.52 0.00 0.00 52.55 52.03 3gnq s ASP 196 Cb 0.09 -1.80 1.53 0.00 -1.46 0.00 0.00 42.92 41.27 3gnq s ASP 196 CO 0.50 -0.05 2.05 -0.07 0.52 0.00 0.00 175.17 178.13 3gnq h LEU 197 N 8.16 0.00 0.24 -1.34 4.07 -2.00 -1.18 115.31 123.27 3gnq h LEU 197 Ca -0.39 0.00 -0.32 0.00 0.08 0.00 0.00 57.88 57.25 3gnq h LEU 197 Cb 1.16 0.00 0.04 0.00 1.08 0.00 0.00 40.66 42.94 3gnq h LEU 197 CO 0.59 0.02 -1.40 0.03 -1.08 0.00 0.00 178.44 176.61 3gnq h ARG 198 N 0.00 0.52 0.00 1.13 3.08 -1.95 -3.31 114.38 113.85 3gnq h ARG 198 Ca -0.00 -0.88 0.00 0.00 0.07 0.00 0.00 59.98 59.17 3gnq h ARG 198 Cb 0.43 0.33 0.00 0.00 0.08 0.00 0.00 29.97 30.81 3gnq h ARG 198 CO 0.00 1.42 0.00 0.00 -1.07 0.00 0.00 179.97 180.32 3gnq h ARG 199 N 0.09 0.00 0.00 0.04 3.08 -1.76 -2.30 114.38 113.53 3gnq h ARG 199 Ca -0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.81 3gnq h ARG 199 Cb 2.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.15 3gnq h ARG 199 CO 0.26 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 179.16 3gnq n ALA 200 N -1.85 1.59 -2.85 0.04 0.00 -0.49 -3.96 120.51 112.99 3gnq n ALA 200 Ca 0.02 -0.05 -0.32 0.00 0.00 0.00 0.00 53.44 53.09 3gnq n ALA 200 Cb 0.28 -1.18 -0.06 0.00 0.00 0.00 0.00 19.45 18.49 3gnq n ALA 200 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3gnq s ARG 201 N -2.79 3.24 -0.29 0.00 1.81 -0.87 -1.78 118.95 118.28 3gnq s ARG 201 Ca 0.08 -0.45 -0.41 0.00 -1.72 0.00 0.00 55.73 53.23 3gnq s ARG 201 Cb 0.07 -2.96 -0.16 0.00 -0.45 0.00 0.00 34.95 31.45 3gnq s ARG 201 CO 0.19 0.64 1.70 0.45 -0.68 0.00 0.00 175.30 177.60 3gnq n SER 202 N 0.83 2.17 0.24 0.23 2.88 -1.26 -4.51 113.62 114.20 3gnq n SER 202 Ca -0.10 1.09 0.12 0.00 -1.33 0.00 0.00 58.87 58.65 3gnq n SER 202 Cb 0.52 -1.10 0.59 0.00 -0.75 0.00 0.00 64.21 63.46 3gnq n SER 202 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3gnq h ALA 203 N 6.74 1.09 0.00 -1.46 0.00 -1.45 -3.21 119.26 120.98 3gnq h ALA 203 Ca -0.46 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.30 3gnq h ALA 203 Cb 1.33 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3gnq h ALA 203 CO 0.95 0.20 -0.56 0.25 0.00 0.00 0.00 179.25 180.09 3gnq n THR 204 N -3.42 0.17 -0.08 0.00 -2.24 -1.26 -3.80 114.28 103.64 3gnq n THR 204 Ca -0.00 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 3gnq n THR 204 Cb 0.35 0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 3gnq n THR 204 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3gnq n HIS 205 N -1.80 0.00 -4.04 4.78 -0.00 -1.21 -4.76 115.22 108.18 3gnq n HIS 205 Ca 0.04 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.68 3gnq n HIS 205 Cb 0.39 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.27 3gnq n HIS 205 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 3gnq s SER 206 N -0.06 0.40 -0.12 0.41 0.01 -1.23 -5.07 113.70 108.04 3gnq s SER 206 Ca 0.00 -0.76 -0.27 0.00 1.31 0.00 0.00 55.95 56.23 3gnq s SER 206 Cb 0.00 0.15 -0.02 0.00 0.21 0.00 0.00 66.02 66.36 3gnq s SER 206 CO 0.00 -0.45 0.88 -1.10 0.41 0.00 0.00 173.24 172.98 3gnq s GLN 207 N -2.75 4.38 -0.23 12.44 -0.21 -1.26 -4.29 119.66 127.73 3gnq s GLN 207 Ca -0.04 1.15 0.01 0.00 0.02 0.00 0.00 55.36 56.50 3gnq s GLN 207 Cb -0.01 -3.54 0.06 0.00 1.00 0.00 0.00 33.01 30.53 3gnq s GLN 207 CO -0.06 -0.25 -0.05 0.42 -2.12 0.00 0.00 175.29 173.23 3gnq s ILE 208 N 1.84 1.51 0.29 1.08 1.01 -0.15 -4.94 121.20 121.83 3gnq s ILE 208 Ca 0.42 -1.22 -0.29 0.00 0.00 0.00 0.00 60.65 59.57 3gnq s ILE 208 Cb -0.18 -1.79 -0.10 0.00 0.01 0.00 0.00 42.46 40.41 3gnq s ILE 208 CO 0.16 -0.11 1.38 -2.84 0.00 0.00 0.00 174.94 173.53 3gnq s PRO 209 N 1.40 4.30 0.05 2.79 0.02 -1.26 -0.47 135.00 141.83 3gnq s PRO 209 Ca -0.06 2.27 -0.11 0.00 0.02 0.00 0.00 61.00 63.13 3gnq s PRO 209 Cb -0.19 -3.09 0.01 0.00 0.02 0.00 0.00 34.50 31.25 3gnq s PRO 209 CO -0.06 -0.32 0.24 0.95 -0.33 0.00 0.00 177.00 177.48 3gnq s THR 210 N -0.56 0.10 0.39 0.99 -4.23 0.35 -4.84 115.64 107.84 3gnq s THR 210 Ca 0.54 -0.85 -0.24 0.00 -1.18 0.00 0.00 61.69 59.96 3gnq s THR 210 Cb -0.41 -0.99 -0.09 0.00 1.34 0.00 0.00 72.50 72.35 3gnq s THR 210 CO 0.49 -0.47 1.01 -0.54 -0.54 0.00 0.00 174.62 174.56 3gnq s LYS 211 N -2.78 4.26 -0.02 3.99 1.02 -1.26 -0.93 119.74 124.02 3gnq s LYS 211 Ca -0.03 1.39 -0.07 0.00 0.02 0.00 0.00 55.97 57.28 3gnq s LYS 211 Cb -0.00 -2.52 0.01 0.00 -0.52 0.00 0.00 37.83 34.79 3gnq s LYS 211 CO -0.05 -0.04 0.15 -0.08 -0.92 0.00 0.00 175.35 174.41 3gnq s THR 212 N -1.75 0.05 -2.23 2.17 -1.32 -1.26 -4.80 115.64 106.50 3gnq s THR 212 Ca 0.57 -0.42 0.23 0.00 -1.21 0.00 0.00 61.69 60.86 3gnq s THR 212 Cb -0.19 -0.36 0.54 0.00 -1.51 0.00 0.00 72.50 70.98 3gnq s THR 212 CO 0.24 -0.23 1.47 0.61 -2.21 0.00 0.00 174.62 174.50 3gnq n GLY 213 N 2.06 2.12 0.36 6.08 0.00 -1.26 -4.65 105.19 109.91 3gnq n GLY 213 Ca -0.19 -0.77 0.02 0.00 0.00 0.00 0.00 46.02 45.08 3gnq n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnq h ALA 214 N 4.41 1.36 -0.01 4.61 0.00 -1.96 0.73 119.26 128.39 3gnq h ALA 214 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3gnq h ALA 214 Cb 0.99 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3gnq h ALA 214 CO 0.00 0.42 -0.02 0.00 0.00 0.00 0.00 179.25 179.64 3gnq h ALA 215 N 1.44 0.02 -0.69 0.00 0.00 -1.88 -2.06 119.26 116.10 3gnq h ALA 215 Ca 0.42 -0.30 0.10 0.00 0.00 0.00 0.00 54.91 55.14 3gnq h ALA 215 Cb 0.16 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.87 3gnq h ALA 215 CO -0.17 -0.17 0.30 0.00 0.00 0.00 0.00 179.25 179.21 3gnq h ALA 216 N 0.43 0.93 0.00 0.00 0.00 -1.49 -2.72 119.26 116.42 3gnq h ALA 216 Ca 0.00 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3gnq h ALA 216 Cb 0.60 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 3gnq h ALA 216 CO 0.01 -0.13 -0.05 0.00 0.00 0.00 0.00 179.25 179.08 3gnq h ALA 217 N 1.45 1.20 0.00 0.00 0.00 -0.59 0.52 119.26 121.83 3gnq h ALA 217 Ca 0.35 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3gnq h ALA 217 Cb 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3gnq h ALA 217 CO -0.31 0.06 0.00 0.28 0.00 0.00 0.00 179.25 179.28 3gnq h VAL 218 N 0.00 0.00 -0.31 0.00 2.07 -1.04 0.77 116.25 117.75 3gnq h VAL 218 Ca -0.00 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 3gnq h VAL 218 Cb 0.21 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 3gnq h VAL 218 CO 0.01 0.00 0.06 1.23 0.02 0.00 0.00 177.57 178.88 3gnq h GLY 219 N 0.60 0.48 2.00 2.17 0.00 -1.04 0.87 103.07 108.15 3gnq h GLY 219 Ca 0.00 -0.24 -0.07 0.00 0.00 0.00 0.00 47.33 47.02 3gnq h GLY 219 CO 0.00 0.23 -0.31 1.41 0.00 0.00 0.00 176.54 177.87 3gnq h LEU 220 N 0.44 0.00 0.00 3.11 3.38 -1.00 -3.03 115.31 118.21 3gnq h LEU 220 Ca 0.10 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.75 3gnq h LEU 220 Cb 0.20 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.89 3gnq h LEU 220 CO -0.00 0.31 -2.21 1.33 0.09 0.00 0.00 178.44 177.96 3gnq n VAL 221 N -3.94 1.21 -3.85 1.22 0.24 -1.14 -4.73 118.33 107.34 3gnq n VAL 221 Ca -0.02 -0.75 -0.30 0.00 -2.04 0.00 0.00 64.34 61.24 3gnq n VAL 221 Cb 0.38 -0.53 -0.14 0.00 -1.47 0.00 0.00 33.84 32.08 3gnq n VAL 221 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3gnq s LEU 222 N -5.30 3.66 0.56 1.34 1.43 0.29 -4.71 118.68 115.95 3gnq s LEU 222 Ca -0.09 -2.85 0.25 0.00 -1.03 0.00 0.00 54.13 50.41 3gnq s LEU 222 Cb 0.05 -1.39 1.61 0.00 0.03 0.00 0.00 46.19 46.48 3gnq s LEU 222 CO 0.72 -0.25 2.21 -0.65 0.23 0.00 0.00 176.35 178.62 3gnq h PRO 223 N 6.61 0.00 0.00 1.29 0.11 -1.77 -1.08 132.00 137.15 3gnq h PRO 223 Ca -0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.06 3gnq h PRO 223 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 3gnq h PRO 223 CO 0.60 0.01 0.00 -0.85 -0.21 0.00 0.00 178.00 177.55 3gnq n GLU 224 N -4.10 0.18 -0.01 1.05 0.00 -1.26 -1.74 120.64 114.76 3gnq n GLU 224 Ca -0.03 0.47 0.12 0.00 0.00 0.00 0.00 57.16 57.72 3gnq n GLU 224 Cb 0.09 -1.88 0.13 0.00 0.00 0.00 0.00 31.44 29.78 3gnq n GLU 224 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 3gnq n LEU 225 N -2.23 2.93 -4.62 -1.84 4.77 -0.41 -4.98 117.00 110.62 3gnq n LEU 225 Ca 0.01 -1.00 -0.50 0.00 -0.03 0.00 0.00 56.01 54.49 3gnq n LEU 225 Cb 0.19 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.21 3gnq n LEU 225 CO 0.17 0.50 1.03 -3.20 -1.33 0.00 0.00 177.39 174.56 3gnq n ASN 226 N 1.28 2.18 0.00 -1.43 5.15 -0.71 -0.23 115.26 121.50 3gnq n ASN 226 Ca 0.15 1.10 0.00 0.00 -0.60 0.00 0.00 54.58 55.23 3gnq n ASN 226 Cb 0.58 -1.27 0.00 0.00 -0.53 0.00 0.00 39.78 38.57 3gnq n ASN 226 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3gnq n GLY 227 N 2.93 2.05 0.11 8.20 0.00 -1.26 -4.89 105.19 112.34 3gnq n GLY 227 Ca 0.18 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.24 3gnq n GLY 227 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gnq h LYS 228 N 2.35 0.00 -6.33 1.61 1.57 -0.96 -3.47 116.57 111.34 3gnq h LYS 228 Ca 0.00 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 58.09 3gnq h LYS 228 Cb 0.00 0.00 -0.28 0.00 0.08 0.00 0.00 32.23 32.03 3gnq h LYS 228 CO 0.00 0.26 -0.84 -0.51 -0.57 0.00 0.00 179.45 177.79 3gnq s LEU 229 N -5.86 2.35 0.00 2.94 1.43 -1.26 -1.39 118.68 116.89 3gnq s LEU 229 Ca -0.00 -0.37 0.05 0.00 -1.03 0.00 0.00 54.13 52.78 3gnq s LEU 229 Cb 0.08 -1.44 -0.02 0.00 0.03 0.00 0.00 46.19 44.84 3gnq s LEU 229 CO 0.79 0.31 0.18 -0.67 0.23 0.00 0.00 176.35 177.19 3gnq n ASP 230 N 2.54 0.44 0.00 2.29 -0.08 -1.00 -3.28 116.55 117.46 3gnq n ASP 230 Ca -0.17 -3.00 0.00 0.00 -1.51 0.00 0.00 54.79 50.12 3gnq n ASP 230 Cb 0.52 1.19 0.00 0.00 2.34 0.00 0.00 41.12 45.16 3gnq n ASP 230 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3gnq n GLY 231 N -0.57 -0.63 2.50 0.27 0.00 -1.26 -1.21 105.19 104.29 3gnq n GLY 231 Ca -0.00 -1.24 -0.08 0.00 0.00 0.00 0.00 46.02 44.70 3gnq n GLY 231 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 3gnq n TYR 232 N -0.80 -1.58 -4.30 1.61 0.18 -0.60 -4.56 117.16 107.11 3gnq n TYR 232 Ca 0.00 -1.46 -0.23 0.00 1.88 0.00 0.00 57.90 58.08 3gnq n TYR 232 Cb 0.00 0.52 -0.12 0.00 -0.38 0.00 0.00 39.34 39.36 3gnq n TYR 232 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3gnq s ALA 233 N -2.06 1.89 -0.19 -3.48 0.00 -0.11 -1.85 121.76 115.95 3gnq s ALA 233 Ca 0.15 -1.33 0.01 0.00 0.00 0.00 0.00 51.96 50.79 3gnq s ALA 233 Cb -0.02 -0.23 0.04 0.00 0.00 0.00 0.00 23.12 22.91 3gnq s ALA 233 CO 0.11 0.33 -0.11 0.42 0.00 0.00 0.00 175.76 176.51 3gnq s ILE 234 N -1.43 1.67 0.12 0.00 1.01 -0.08 -0.50 121.20 122.00 3gnq s ILE 234 Ca 0.10 -0.99 -0.30 0.00 0.00 0.00 0.00 60.65 59.46 3gnq s ILE 234 Cb -0.09 -1.72 -0.06 0.00 0.01 0.00 0.00 42.46 40.60 3gnq s ILE 234 CO 0.05 0.21 0.98 -0.13 0.00 0.00 0.00 174.94 176.05 3gnq s ARG 235 N 1.39 4.69 0.25 2.79 1.81 0.38 -1.33 118.95 128.93 3gnq s ARG 235 Ca -0.01 1.48 0.07 0.00 -1.72 0.00 0.00 55.73 55.56 3gnq s ARG 235 Cb -0.16 -3.36 -0.05 0.00 -0.45 0.00 0.00 34.95 30.93 3gnq s ARG 235 CO -0.09 0.20 -0.10 0.14 -0.68 0.00 0.00 175.30 174.78 3gnq s VAL 236 N -0.05 1.70 -0.87 3.52 -7.23 -0.53 -0.98 120.40 115.96 3gnq s VAL 236 Ca 0.47 -2.17 -0.20 0.00 -1.81 0.00 0.00 61.98 58.28 3gnq s VAL 236 Cb -0.24 -2.28 -0.12 0.00 0.56 0.00 0.00 36.38 34.29 3gnq s VAL 236 CO 0.30 -0.42 1.99 -2.65 -0.31 0.00 0.00 175.10 174.01 3gnq n PRO 237 N -0.50 1.73 -4.23 4.82 -0.02 -1.25 -3.23 135.00 132.33 3gnq n PRO 237 Ca -0.06 -1.91 -0.17 0.00 -2.02 0.00 0.00 63.50 59.33 3gnq n PRO 237 Cb 0.62 -2.93 -0.13 0.00 -0.02 0.00 0.00 33.50 31.04 3gnq n PRO 237 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3gnq s THR 238 N 4.63 0.82 0.14 3.45 -4.23 -1.26 -5.01 115.64 114.18 3gnq s THR 238 Ca 0.55 -0.90 0.06 0.00 -1.18 0.00 0.00 61.69 60.22 3gnq s THR 238 Cb 0.14 -0.78 -0.19 0.00 1.34 0.00 0.00 72.50 73.02 3gnq s THR 238 CO 0.08 -0.10 1.32 -0.29 -0.54 0.00 0.00 174.62 175.10 3gnq h ILE 239 N 4.58 1.63 -2.97 2.99 2.10 -1.87 -0.06 117.51 123.92 3gnq h ILE 239 Ca -0.36 -3.10 -0.04 0.00 1.08 0.00 0.00 64.86 62.44 3gnq h ILE 239 Cb 1.19 2.71 -0.13 0.00 -1.09 0.00 0.00 36.82 39.50 3gnq h ILE 239 CO 0.44 0.89 0.12 0.21 -1.08 0.00 0.00 178.15 178.73 3gnq s ASN 240 N -6.81 -0.48 0.00 2.19 2.47 -1.26 -4.57 114.94 106.48 3gnq s ASN 240 Ca -0.00 0.02 0.00 0.00 0.42 0.00 0.00 52.86 53.29 3gnq s ASN 240 Cb 0.10 0.55 0.00 0.00 -1.45 0.00 0.00 41.25 40.45 3gnq s ASN 240 CO 0.82 -0.87 0.00 0.52 -3.72 0.00 0.00 177.10 173.85 3gnq n VAL 241 N -0.11 -0.68 -4.31 -5.21 0.31 -1.26 -4.86 118.33 102.22 3gnq n VAL 241 Ca -0.17 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 63.99 3gnq n VAL 241 Cb 0.63 -0.68 -0.10 0.00 -0.91 0.00 0.00 33.84 32.78 3gnq n VAL 241 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3gnq s SER 242 N -0.63 1.15 -0.00 4.52 0.01 -0.17 -3.39 113.70 115.20 3gnq s SER 242 Ca 0.00 -1.44 -0.00 0.00 1.31 0.00 0.00 55.95 55.82 3gnq s SER 242 Cb 0.00 0.26 -0.00 0.00 0.21 0.00 0.00 66.02 66.49 3gnq s SER 242 CO 0.00 -0.79 0.01 -0.51 0.41 0.00 0.00 173.24 172.35 3gnq s ILE 243 N -3.77 0.01 -0.17 1.44 2.07 -0.53 -1.13 121.20 119.11 3gnq s ILE 243 Ca 0.37 -0.04 -0.14 0.00 -1.41 0.00 0.00 60.65 59.44 3gnq s ILE 243 Cb 0.07 -0.03 -0.05 0.00 0.13 0.00 0.00 42.46 42.58 3gnq s ILE 243 CO 0.15 -0.02 0.28 -0.69 -1.91 0.00 0.00 174.94 172.74 3gnq s VAL 244 N -0.06 5.31 -0.33 4.00 1.01 -0.25 -0.93 120.40 129.15 3gnq s VAL 244 Ca -0.01 0.51 -0.02 0.00 0.00 0.00 0.00 61.98 62.46 3gnq s VAL 244 Cb -0.01 -3.62 0.06 0.00 0.00 0.00 0.00 36.38 32.82 3gnq s VAL 244 CO -0.00 0.37 0.06 -0.62 0.00 0.00 0.00 175.10 174.91 3gnq s ASP 245 N 0.57 5.02 -0.16 3.32 -1.08 0.10 -1.61 116.67 122.83 3gnq s ASP 245 Ca 0.15 -1.44 -0.05 0.00 -0.52 0.00 0.00 52.55 50.69 3gnq s ASP 245 Cb -0.13 -1.75 -0.03 0.00 -1.46 0.00 0.00 42.92 39.55 3gnq s ASP 245 CO 0.04 -0.33 -0.01 -0.22 0.52 0.00 0.00 175.17 175.16 3gnq s LEU 246 N 1.24 3.41 -0.09 -1.34 2.96 0.05 -1.24 118.68 123.68 3gnq s LEU 246 Ca -0.01 -0.07 0.04 0.00 -0.22 0.00 0.00 54.13 53.87 3gnq s LEU 246 Cb -0.20 -1.83 -0.01 0.00 0.50 0.00 0.00 46.19 44.65 3gnq s LEU 246 CO -0.01 0.18 -0.22 -0.44 -1.32 0.00 0.00 176.35 174.53 3gnq s SER 247 N 0.32 3.28 0.10 3.68 0.01 -0.16 -0.38 113.70 120.55 3gnq s SER 247 Ca -0.02 -0.48 -0.17 0.00 1.31 0.00 0.00 55.95 56.59 3gnq s SER 247 Cb -0.14 -1.20 0.04 0.00 0.21 0.00 0.00 66.02 64.93 3gnq s SER 247 CO 0.02 0.20 0.41 0.72 0.41 0.00 0.00 173.24 175.00 3gnq s PHE 248 N 0.09 -0.22 -0.40 2.43 -0.12 0.45 -0.10 117.98 120.11 3gnq s PHE 248 Ca -0.10 -0.00 -0.19 0.00 -0.05 0.00 0.00 56.93 56.58 3gnq s PHE 248 Cb -0.16 0.25 0.01 0.00 -0.63 0.00 0.00 43.02 42.49 3gnq s PHE 248 CO 0.06 -0.66 0.56 0.42 -0.05 0.00 0.00 175.22 175.55 3gnq s ILE 249 N -3.39 4.95 0.49 -4.49 1.01 -0.83 -0.56 121.20 118.38 3gnq s ILE 249 Ca 0.00 0.16 -0.23 0.00 0.00 0.00 0.00 60.65 60.58 3gnq s ILE 249 Cb 0.01 -4.08 -0.06 0.00 0.01 0.00 0.00 42.46 38.34 3gnq s ILE 249 CO -0.09 -0.40 1.26 0.00 0.00 0.00 0.00 174.94 175.70 3gnq s ALA 250 N 2.54 2.93 -0.71 9.38 0.00 0.76 -0.98 121.76 135.68 3gnq s ALA 250 Ca 0.19 1.12 0.26 0.00 0.00 0.00 0.00 51.96 53.54 3gnq s ALA 250 Cb -0.15 -3.47 0.86 0.00 0.00 0.00 0.00 23.12 20.36 3gnq s ALA 250 CO 0.16 -0.97 1.77 1.63 0.00 0.00 0.00 175.76 178.35 3gnq n LYS 251 N -0.66 0.23 -3.74 0.00 5.02 -0.26 -4.76 118.16 113.99 3gnq n LYS 251 Ca 0.08 0.23 -0.10 0.00 -2.02 0.00 0.00 58.31 56.51 3gnq n LYS 251 Cb 0.46 -1.80 -0.04 0.00 -0.02 0.00 0.00 35.03 33.63 3gnq n LYS 251 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3gnq s ARG 252 N -3.13 1.24 0.22 1.97 1.70 -1.26 -5.06 118.95 114.63 3gnq s ARG 252 Ca 0.10 -0.86 -0.32 0.00 -0.47 0.00 0.00 55.73 54.18 3gnq s ARG 252 Cb 0.12 0.48 -0.14 0.00 -0.57 0.00 0.00 34.95 34.85 3gnq s ARG 252 CO 0.56 -0.51 1.45 -0.25 -1.08 0.00 0.00 175.30 175.47 3gnq n ASP 253 N -0.28 2.81 -3.43 -2.89 8.00 -1.26 -4.99 116.55 114.51 3gnq n ASP 253 Ca -0.12 1.13 -0.14 0.00 0.71 0.00 0.00 54.79 56.37 3gnq n ASP 253 Cb 0.63 -1.42 -0.05 0.00 -0.02 0.00 0.00 41.12 40.26 3gnq n ASP 253 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3gnq s THR 254 N 0.18 0.00 0.25 -3.53 -1.32 -1.26 -5.14 115.64 104.81 3gnq s THR 254 Ca 0.71 -1.65 0.02 0.00 -1.21 0.00 0.00 61.69 59.56 3gnq s THR 254 Cb -0.66 -2.56 -0.05 0.00 -1.51 0.00 0.00 72.50 67.71 3gnq s THR 254 CO 0.47 0.00 0.04 0.42 -2.21 0.00 0.00 174.62 173.34 3gnq s THR 255 N -3.30 0.83 0.15 5.08 -4.23 -1.26 -4.97 115.64 107.94 3gnq s THR 255 Ca 0.31 -2.01 -0.15 0.00 -1.18 0.00 0.00 61.69 58.66 3gnq s THR 255 Cb 0.00 -2.49 0.02 0.00 1.34 0.00 0.00 72.50 71.37 3gnq s THR 255 CO 0.19 -0.18 1.73 0.00 -0.54 0.00 0.00 174.62 175.82 3gnq h ALA 256 N 2.42 0.57 -0.88 3.99 0.00 -1.93 0.16 119.26 123.59 3gnq h ALA 256 Ca -0.38 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.47 3gnq h ALA 256 Cb 1.23 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.79 3gnq h ALA 256 CO 0.64 0.13 0.56 0.00 0.00 0.00 0.00 179.25 180.57 3gnq h ALA 257 N 1.06 1.21 -0.32 0.00 0.00 -1.97 0.20 119.26 119.43 3gnq h ALA 257 Ca 0.15 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 3gnq h ALA 257 Cb 0.11 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3gnq h ALA 257 CO -0.02 0.32 -0.28 1.49 0.00 0.00 0.00 179.25 180.76 3gnq h GLU 258 N 1.02 0.76 -0.26 0.00 4.81 -1.86 -0.94 114.58 118.11 3gnq h GLU 258 Ca 0.38 -0.38 0.04 0.00 -0.13 0.00 0.00 59.36 59.26 3gnq h GLU 258 Cb 0.15 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 3gnq h GLU 258 CO -0.17 1.01 0.03 0.28 -0.73 0.00 0.00 179.01 179.43 3gnq h VAL 259 N 0.53 0.85 -0.43 0.32 2.07 -0.12 -1.95 116.25 117.52 3gnq h VAL 259 Ca 0.06 -0.04 -0.04 0.00 0.82 0.00 0.00 66.70 67.49 3gnq h VAL 259 Cb 0.85 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 3gnq h VAL 259 CO 0.07 0.02 0.10 0.78 0.02 0.00 0.00 177.57 178.56 3gnq h ASN 260 N 0.12 0.67 -0.26 0.57 2.35 -0.64 -2.51 115.58 115.88 3gnq h ASN 260 Ca 0.12 -0.24 0.06 0.00 -0.55 0.00 0.00 56.30 55.70 3gnq h ASN 260 Cb 0.14 -0.18 -0.07 0.00 0.05 0.00 0.00 38.32 38.26 3gnq h ASN 260 CO -0.18 0.73 -0.19 0.00 -1.65 0.00 0.00 177.43 176.14 3gnq h ALA 261 N 0.96 -0.03 -0.70 -0.83 0.00 -0.96 -1.28 119.26 116.42 3gnq h ALA 261 Ca 0.14 0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.21 3gnq h ALA 261 Cb 0.33 0.43 -0.06 0.00 0.00 0.00 0.00 17.79 18.48 3gnq h ALA 261 CO 0.00 -0.61 0.37 0.82 0.00 0.00 0.00 179.25 179.83 3gnq h ILE 262 N -0.18 0.91 -0.25 0.00 2.04 -1.21 -1.83 117.51 116.98 3gnq h ILE 262 Ca 0.14 -0.22 -0.10 0.00 1.00 0.00 0.00 64.86 65.68 3gnq h ILE 262 Cb 0.40 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 3gnq h ILE 262 CO -0.37 0.12 -0.29 0.24 0.00 0.00 0.00 178.15 177.85 3gnq h MET 263 N 0.65 0.49 -0.32 2.37 2.86 -1.03 -1.57 114.93 118.38 3gnq h MET 263 Ca 0.33 -0.20 -0.05 0.00 -2.06 0.00 0.00 59.70 57.72 3gnq h MET 263 Cb 0.28 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 3gnq h MET 263 CO -0.23 0.73 0.01 -0.22 1.06 0.00 0.00 176.91 178.27 3gnq h LYS 264 N 0.43 0.55 -0.37 1.72 3.64 -0.72 -2.35 116.57 119.47 3gnq h LYS 264 Ca 0.06 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 59.27 3gnq h LYS 264 Cb 0.72 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.47 3gnq h LYS 264 CO 0.06 0.67 0.23 1.49 -2.27 0.00 0.00 179.45 179.63 3gnq h GLU 265 N 0.35 0.49 -0.73 1.90 4.81 -1.19 -1.72 114.58 118.51 3gnq h GLU 265 Ca 0.09 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.31 3gnq h GLU 265 Cb 0.42 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.65 3gnq h GLU 265 CO 0.01 0.36 0.48 0.00 -0.73 0.00 0.00 179.01 179.13 3gnq h ALA 266 N 1.11 1.56 0.00 2.92 0.00 -1.23 -1.67 119.26 121.95 3gnq h ALA 266 Ca 0.13 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 3gnq h ALA 266 Cb -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3gnq h ALA 266 CO -0.03 0.38 -0.24 0.66 0.00 0.00 0.00 179.25 180.02 3gnq h SER 267 N 0.90 0.00 0.32 0.00 4.64 -0.93 -2.90 113.55 115.58 3gnq h SER 267 Ca 0.28 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.41 3gnq h SER 267 Cb 0.02 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3gnq h SER 267 CO -0.08 0.24 -0.80 -0.33 -0.87 0.00 0.00 176.83 174.99 3gnq h GLU 268 N 0.00 0.38 0.00 4.77 4.39 -0.93 -3.30 114.58 119.89 3gnq h GLU 268 Ca -0.00 -0.35 0.00 0.00 0.34 0.00 0.00 59.36 59.35 3gnq h GLU 268 Cb 1.18 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.92 3gnq h GLU 268 CO 0.03 1.00 0.00 0.41 -1.16 0.00 0.00 179.01 179.29 3gnq n GLY 269 N 0.70 0.70 3.74 -3.84 0.00 -0.66 -4.65 105.19 101.18 3gnq n GLY 269 Ca -0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 3gnq n GLY 269 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnq s ALA 270 N -3.54 3.36 0.00 4.61 0.00 -1.25 -2.34 121.76 122.59 3gnq s ALA 270 Ca 0.00 0.77 0.00 0.00 0.00 0.00 0.00 51.96 52.73 3gnq s ALA 270 Cb 0.00 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.81 3gnq s ALA 270 CO 0.00 -0.11 0.00 1.28 0.00 0.00 0.00 175.76 176.93 3gnq n LEU 271 N 2.07 0.00 -4.52 0.00 4.77 -1.26 -4.61 117.00 113.45 3gnq n LEU 271 Ca 0.01 0.00 -0.61 0.00 -0.03 0.00 0.00 56.01 55.38 3gnq n LEU 271 Cb 0.46 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.47 3gnq n LEU 271 CO 0.53 0.00 0.72 1.17 -1.33 0.00 0.00 177.39 178.47 3gnq n LYS 272 N -2.00 0.00 0.00 3.23 4.81 -0.99 -0.07 118.16 123.14 3gnq n LYS 272 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 3gnq n LYS 272 Cb 0.00 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 33.56 3gnq n LYS 272 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3gnq n GLY 273 N 2.14 2.63 0.20 3.14 0.00 -1.26 -4.68 105.19 107.35 3gnq n GLY 273 Ca 0.23 -0.60 -0.06 0.00 0.00 0.00 0.00 46.02 45.58 3gnq n GLY 273 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3gnq h ILE 274 N 0.00 1.33 -3.27 -0.61 5.03 -0.86 -3.41 117.51 115.73 3gnq h ILE 274 Ca 0.00 -1.72 -0.67 0.00 -0.12 0.00 0.00 64.86 62.35 3gnq h ILE 274 Cb 0.00 1.75 -0.35 0.00 -3.03 0.00 0.00 36.82 35.19 3gnq h ILE 274 CO 0.00 0.53 -0.84 -0.22 -0.68 0.00 0.00 178.15 176.93 3gnq s LEU 275 N -8.27 2.47 0.60 1.44 2.96 0.71 -1.57 118.68 117.02 3gnq s LEU 275 Ca -0.06 -0.83 0.00 0.00 -0.22 0.00 0.00 54.13 53.02 3gnq s LEU 275 Cb 0.12 -1.50 0.06 0.00 0.50 0.00 0.00 46.19 45.37 3gnq s LEU 275 CO 0.81 -0.05 0.84 -0.83 -1.32 0.00 0.00 176.35 175.81 3gnq s GLY 276 N 1.25 1.80 -0.03 7.98 0.00 0.65 -4.58 107.32 114.38 3gnq s GLY 276 Ca 0.02 -1.42 -0.01 0.00 0.00 0.00 0.00 44.72 43.31 3gnq s GLY 276 CO -0.11 -1.05 0.06 -0.47 0.00 0.00 0.00 173.10 171.53 3gnq s TYR 277 N -2.88 -0.01 -0.06 1.90 5.04 -1.26 -2.01 117.35 118.07 3gnq s TYR 277 Ca 0.60 0.22 0.03 0.00 -2.44 0.00 0.00 57.07 55.48 3gnq s TYR 277 Cb -0.09 -0.23 0.00 0.00 0.35 0.00 0.00 41.96 41.99 3gnq s TYR 277 CO 0.40 -0.12 -0.15 1.21 -1.34 0.00 0.00 175.55 175.55 3gnq s ASN 278 N 1.23 2.01 -0.00 4.32 2.47 -0.24 -4.94 114.94 119.79 3gnq s ASN 278 Ca -0.07 -0.34 0.04 0.00 0.42 0.00 0.00 52.86 52.91 3gnq s ASN 278 Cb -0.13 -0.77 -0.05 0.00 -1.45 0.00 0.00 41.25 38.86 3gnq s ASN 278 CO -0.04 0.09 0.13 -0.62 -3.72 0.00 0.00 177.10 172.95 3gnq n GLU 279 N 3.50 3.98 -2.28 0.43 1.02 -1.26 -1.25 120.64 124.78 3gnq n GLU 279 Ca -0.20 -0.01 -0.32 0.00 -0.02 0.00 0.00 57.16 56.60 3gnq n GLU 279 Cb 0.52 -0.81 -0.02 0.00 -0.02 0.00 0.00 31.44 31.12 3gnq n GLU 279 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3gnq s ALA 280 N -1.64 3.00 -1.31 0.62 0.00 -1.26 -4.82 121.76 116.35 3gnq s ALA 280 Ca 0.01 0.20 -0.14 0.00 0.00 0.00 0.00 51.96 52.02 3gnq s ALA 280 Cb 0.03 -3.14 0.11 0.00 0.00 0.00 0.00 23.12 20.12 3gnq s ALA 280 CO 0.15 -0.39 1.81 -0.35 0.00 0.00 0.00 175.76 176.99 3gnq n PRO 281 N -1.78 3.25 -3.53 0.00 -0.04 -1.26 -4.93 135.00 126.72 3gnq n PRO 281 Ca 0.07 -3.31 -0.20 0.00 -0.04 0.00 0.00 63.50 60.02 3gnq n PRO 281 Cb 0.54 -3.21 -0.01 0.00 -0.04 0.00 0.00 33.50 30.78 3gnq n PRO 281 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3gnq s LEU 282 N 2.12 4.02 0.46 1.53 1.43 -1.26 -5.14 118.68 121.84 3gnq s LEU 282 Ca 0.46 -0.02 0.04 0.00 -1.03 0.00 0.00 54.13 53.59 3gnq s LEU 282 Cb 0.06 -2.87 -0.05 0.00 0.03 0.00 0.00 46.19 43.37 3gnq s LEU 282 CO 0.00 -0.37 0.02 0.68 0.23 0.00 0.00 176.35 176.92 3gnq s VAL 283 N -2.18 1.62 0.27 -1.59 -7.23 -1.26 -5.04 120.40 104.99 3gnq s VAL 283 Ca 0.42 -1.98 0.00 0.00 -1.81 0.00 0.00 61.98 58.62 3gnq s VAL 283 Cb -0.09 -2.60 0.26 0.00 0.56 0.00 0.00 36.38 34.50 3gnq s VAL 283 CO 0.32 0.00 1.75 0.77 -0.31 0.00 0.00 175.10 177.63 3gnq h SER 284 N 1.55 0.52 0.68 4.85 4.64 -1.98 -0.19 113.55 123.61 3gnq h SER 284 Ca -0.44 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 3gnq h SER 284 Cb 1.28 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 3gnq h SER 284 CO 0.77 0.19 0.00 0.00 -0.87 0.00 0.00 176.83 176.92 3gnq n ILE 285 N -4.89 0.84 0.29 0.95 3.06 -1.26 -1.96 119.36 116.40 3gnq n ILE 285 Ca 0.18 0.27 0.16 0.00 -2.50 0.00 0.00 62.75 60.86 3gnq n ILE 285 Cb 0.49 -1.21 0.60 0.00 0.54 0.00 0.00 39.64 40.05 3gnq n ILE 285 CO 0.00 0.00 0.00 0.44 -2.50 0.00 0.00 176.55 174.49 3gnq h ASP 286 N 0.00 0.00 -0.37 9.51 3.45 -1.43 -2.70 116.42 124.88 3gnq h ASP 286 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3gnq h ASP 286 Cb 0.34 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.11 3gnq h ASP 286 CO 0.00 0.00 0.00 0.49 -1.57 0.00 0.00 179.24 178.16 3gnq n PHE 287 N -2.97 0.48 -1.90 4.55 3.72 -0.83 -4.91 117.46 115.60 3gnq n PHE 287 Ca 0.01 -0.24 -0.42 0.00 -0.05 0.00 0.00 57.45 56.76 3gnq n PHE 287 Cb 0.33 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.84 3gnq n PHE 287 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 3gnq s ASN 288 N -1.50 6.53 -1.01 4.37 2.47 -1.02 -2.53 114.94 122.25 3gnq s ASN 288 Ca 0.38 2.74 0.00 0.00 0.42 0.00 0.00 52.86 56.41 3gnq s ASN 288 Cb 0.23 -2.62 0.00 0.00 -1.45 0.00 0.00 41.25 37.41 3gnq s ASN 288 CO 0.31 -0.82 0.00 1.57 -3.72 0.00 0.00 177.10 174.45 3gnq n HIS 289 N 2.94 0.00 -3.09 0.43 -0.00 -1.26 -5.00 115.22 109.24 3gnq n HIS 289 Ca 0.10 0.00 -0.40 0.00 0.46 0.00 0.00 57.72 57.88 3gnq n HIS 289 Cb 0.38 -1.92 -0.05 0.00 -0.12 0.00 0.00 29.99 28.28 3gnq n HIS 289 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 3gnq s ASN 290 N -2.79 6.80 0.00 0.26 3.84 -1.05 -4.96 114.94 117.04 3gnq s ASN 290 Ca 0.00 0.97 0.18 0.00 0.21 0.00 0.00 52.86 54.22 3gnq s ASN 290 Cb 0.00 -2.37 0.91 0.00 -0.55 0.00 0.00 41.25 39.23 3gnq s ASN 290 CO 0.00 -0.23 1.61 -0.81 -2.79 0.00 0.00 177.10 174.88 3gnq n PRO 291 N 4.63 1.26 -1.65 0.43 -0.04 -1.26 -4.06 135.00 134.30 3gnq n PRO 291 Ca -0.01 -0.39 -0.33 0.00 -0.04 0.00 0.00 63.50 62.73 3gnq n PRO 291 Cb 0.50 -1.31 0.06 0.00 -0.04 0.00 0.00 33.50 32.71 3gnq n PRO 291 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3gnq s ALA 292 N -1.92 2.42 0.05 0.55 0.00 -1.26 -4.52 121.76 117.08 3gnq s ALA 292 Ca 0.28 0.50 0.09 0.00 0.00 0.00 0.00 51.96 52.83 3gnq s ALA 292 Cb 0.14 -3.31 -0.21 0.00 0.00 0.00 0.00 23.12 19.74 3gnq s ALA 292 CO 0.22 -1.39 1.07 0.77 0.00 0.00 0.00 175.76 176.43 3gnq h SER 293 N -0.21 0.00 -2.23 0.00 0.02 -1.53 -3.37 113.55 106.22 3gnq h SER 293 Ca -0.46 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.49 3gnq h SER 293 Cb 1.24 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.55 3gnq h SER 293 CO 0.53 0.98 -0.24 -0.55 -1.14 0.00 0.00 176.83 176.41 3gnq s SER 294 N -6.48 -0.74 -0.39 3.07 0.15 -1.04 -3.48 113.70 104.79 3gnq s SER 294 Ca -0.01 1.31 -0.02 0.00 0.70 0.00 0.00 55.95 57.93 3gnq s SER 294 Cb 0.09 1.87 0.10 0.00 -1.71 0.00 0.00 66.02 66.37 3gnq s SER 294 CO 0.82 -0.23 0.16 -0.89 1.20 0.00 0.00 173.24 174.30 3gnq s THR 295 N 2.77 3.17 0.19 6.45 2.01 0.15 -0.25 115.64 130.12 3gnq s THR 295 Ca -0.04 -1.96 -0.32 0.00 0.31 0.00 0.00 61.69 59.68 3gnq s THR 295 Cb -0.12 -3.13 -0.11 0.00 0.01 0.00 0.00 72.50 69.15 3gnq s THR 295 CO -0.16 -0.59 1.71 0.12 -0.69 0.00 0.00 174.62 175.01 3gnq s PHE 296 N 1.14 2.81 -0.50 4.92 5.36 -0.85 -0.38 117.98 130.47 3gnq s PHE 296 Ca 0.06 0.33 -0.16 0.00 -0.96 0.00 0.00 56.93 56.20 3gnq s PHE 296 Cb -0.22 -4.11 0.09 0.00 -0.34 0.00 0.00 43.02 38.44 3gnq s PHE 296 CO -0.04 -4.25 0.47 0.34 -1.46 0.00 0.00 175.22 170.29 3gnq s ASP 297 N 1.43 6.17 0.47 6.13 -1.08 -0.06 -1.07 116.67 128.65 3gnq s ASP 297 Ca 0.75 -1.42 0.16 0.00 -0.52 0.00 0.00 52.55 51.51 3gnq s ASP 297 Cb -0.48 -2.21 1.10 0.00 -1.46 0.00 0.00 42.92 39.87 3gnq s ASP 297 CO 0.32 -0.77 2.04 0.00 0.52 0.00 0.00 175.17 177.28 3gnq h ALA 298 N 8.85 1.75 0.00 3.66 0.00 -1.48 -2.69 119.26 129.36 3gnq h ALA 298 Ca -0.29 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 3gnq h ALA 298 Cb 1.10 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 3gnq h ALA 298 CO 0.95 0.17 -0.04 1.79 0.00 0.00 0.00 179.25 182.12 3gnq h THR 299 N 0.00 0.13 -0.07 0.00 1.35 -1.88 -2.98 112.91 109.46 3gnq h THR 299 Ca -0.00 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 65.34 3gnq h THR 299 Cb 0.24 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 68.11 3gnq h THR 299 CO 0.02 0.04 0.00 0.18 -0.25 0.00 0.00 175.52 175.51 3gnq n LEU 300 N -3.18 2.87 -4.75 3.87 4.77 -1.01 -4.98 117.00 114.58 3gnq n LEU 300 Ca -0.00 -0.99 -0.41 0.00 -0.03 0.00 0.00 56.01 54.58 3gnq n LEU 300 Cb 0.28 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.31 3gnq n LEU 300 CO 0.27 0.50 0.96 -0.89 -1.33 0.00 0.00 177.39 176.89 3gnq s THR 301 N -1.94 3.02 -0.01 -5.08 2.01 -1.13 -4.77 115.64 107.74 3gnq s THR 301 Ca 0.30 0.95 0.01 0.00 0.31 0.00 0.00 61.69 63.26 3gnq s THR 301 Cb 0.20 -3.60 0.00 0.00 0.01 0.00 0.00 72.50 69.11 3gnq s THR 301 CO 0.31 0.19 -0.05 -0.54 -0.69 0.00 0.00 174.62 173.84 3gnq s LYS 302 N -1.04 0.47 -0.02 4.92 3.01 -0.81 -5.00 119.74 121.28 3gnq s LYS 302 Ca 0.52 -0.15 0.01 0.00 -1.01 0.00 0.00 55.97 55.34 3gnq s LYS 302 Cb -0.37 -0.48 0.01 0.00 -1.01 0.00 0.00 37.83 35.98 3gnq s LYS 302 CO 0.45 0.06 -0.04 0.54 0.51 0.00 0.00 175.35 176.87 3gnq s VAL 303 N 0.14 0.42 -0.29 3.17 0.11 -1.26 -1.07 120.40 121.62 3gnq s VAL 303 Ca -0.01 -0.13 -0.02 0.00 -2.93 0.00 0.00 61.98 58.88 3gnq s VAL 303 Cb -0.05 -0.42 0.10 0.00 -1.53 0.00 0.00 36.38 34.48 3gnq s VAL 303 CO -0.00 0.16 0.11 -0.55 -3.33 0.00 0.00 175.10 171.49 3gnq s SER 304 N 0.45 3.71 1.57 3.54 0.15 -0.41 -4.93 113.70 117.78 3gnq s SER 304 Ca -0.05 -1.41 0.00 0.00 0.70 0.00 0.00 55.95 55.19 3gnq s SER 304 Cb -0.09 -0.62 0.00 0.00 -1.71 0.00 0.00 66.02 63.61 3gnq s SER 304 CO -0.00 -0.42 0.00 0.61 1.20 0.00 0.00 173.24 174.63 3gnq n GLY 305 N 5.04 2.86 0.04 9.45 0.00 -1.26 -2.10 105.19 119.22 3gnq n GLY 305 Ca -0.04 -0.23 0.13 0.00 0.00 0.00 0.00 46.02 45.88 3gnq n GLY 305 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gnq n ARG 306 N 13.14 0.22 -3.08 1.61 5.12 -1.26 -4.66 116.66 127.74 3gnq n ARG 306 Ca 0.00 -0.09 -0.40 0.00 -1.93 0.00 0.00 57.85 55.44 3gnq n ARG 306 Cb 0.00 -1.50 -0.05 0.00 -1.16 0.00 0.00 32.46 29.75 3gnq n ARG 306 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 3gnq s LEU 307 N -2.84 4.24 -0.07 0.55 2.96 -0.89 -0.17 118.68 122.46 3gnq s LEU 307 Ca 0.17 1.02 0.05 0.00 -0.22 0.00 0.00 54.13 55.16 3gnq s LEU 307 Cb 0.19 -2.99 -0.01 0.00 0.50 0.00 0.00 46.19 43.88 3gnq s LEU 307 CO 0.58 -0.19 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.49 3gnq s VAL 308 N 1.31 1.99 -0.15 1.68 1.01 0.28 -1.29 120.40 125.24 3gnq s VAL 308 Ca 0.33 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 61.32 3gnq s VAL 308 Cb -0.17 -1.70 0.01 0.00 0.00 0.00 0.00 36.38 34.52 3gnq s VAL 308 CO 0.14 0.55 -0.20 -0.75 0.00 0.00 0.00 175.10 174.84 3gnq s LYS 309 N 0.04 3.07 0.00 2.72 2.20 -0.23 -0.42 119.74 127.13 3gnq s LYS 309 Ca -0.09 -0.82 0.03 0.00 -0.36 0.00 0.00 55.97 54.72 3gnq s LYS 309 Cb -0.15 -2.50 -0.01 0.00 -1.51 0.00 0.00 37.83 33.66 3gnq s LYS 309 CO 0.05 -0.02 -0.08 0.14 -0.36 0.00 0.00 175.35 175.08 3gnq s VAL 310 N 0.85 0.65 0.11 4.02 -7.23 0.49 -1.92 120.40 117.37 3gnq s VAL 310 Ca -0.06 -0.45 0.08 0.00 -1.81 0.00 0.00 61.98 59.74 3gnq s VAL 310 Cb -0.15 -0.56 -0.04 0.00 0.56 0.00 0.00 36.38 36.19 3gnq s VAL 310 CO -0.02 0.11 -0.20 -0.44 -0.31 0.00 0.00 175.10 174.24 3gnq s SER 311 N -0.38 2.50 -0.12 4.85 0.01 -1.26 -0.77 113.70 118.53 3gnq s SER 311 Ca 0.02 -0.72 -0.06 0.00 1.31 0.00 0.00 55.95 56.49 3gnq s SER 311 Cb -0.04 -0.13 0.05 0.00 0.21 0.00 0.00 66.02 66.10 3gnq s SER 311 CO -0.00 0.02 0.28 -0.55 0.41 0.00 0.00 173.24 173.40 3gnq s SER 312 N -2.08 -0.32 0.24 2.44 0.15 -0.63 -0.88 113.70 112.62 3gnq s SER 312 Ca 0.08 0.61 -0.19 0.00 0.70 0.00 0.00 55.95 57.15 3gnq s SER 312 Cb -0.09 0.49 -0.08 0.00 -1.71 0.00 0.00 66.02 64.63 3gnq s SER 312 CO 0.05 -0.17 0.73 0.26 1.20 0.00 0.00 173.24 175.31 3gnq s TRP 313 N 1.27 3.61 -0.08 3.44 0.52 0.48 -1.09 118.94 127.10 3gnq s TRP 313 Ca -0.09 1.37 -0.06 0.00 0.02 0.00 0.00 56.10 57.35 3gnq s TRP 313 Cb -0.10 -2.61 0.03 0.00 -1.15 0.00 0.00 33.47 29.64 3gnq s TRP 313 CO -0.09 0.29 0.20 1.52 0.02 0.00 0.00 176.95 178.89 3gnq s TYR 314 N -1.60 -0.24 -0.65 -1.98 -0.00 -0.29 -0.67 117.35 111.93 3gnq s TYR 314 Ca 0.45 0.59 -0.28 0.00 -0.00 0.00 0.00 57.07 57.83 3gnq s TYR 314 Cb -0.16 0.04 0.03 0.00 -0.00 0.00 0.00 41.96 41.86 3gnq s TYR 314 CO 0.20 -0.15 1.29 0.34 -0.00 0.00 0.00 175.55 177.23 3gnq s ASP 315 N 0.64 6.22 0.24 -0.18 3.68 -1.26 -1.00 116.67 125.02 3gnq s ASP 315 Ca -0.04 -0.11 0.20 0.00 2.13 0.00 0.00 52.55 54.72 3gnq s ASP 315 Cb -0.06 -2.55 0.95 0.00 -1.45 0.00 0.00 42.92 39.81 3gnq s ASP 315 CO -0.03 -1.72 1.61 -0.46 0.13 0.00 0.00 175.17 174.70 3gnq n ASN 316 N 9.21 0.52 -0.10 -0.34 6.94 -1.26 -1.09 115.26 129.14 3gnq n ASN 316 Ca 0.07 0.68 -0.15 0.00 -0.02 0.00 0.00 54.58 55.16 3gnq n ASN 316 Cb 0.49 -0.77 -0.06 0.00 -2.36 0.00 0.00 39.78 37.08 3gnq n ASN 316 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3gnq n GLU 317 N -2.13 0.53 0.09 -3.83 1.02 -1.26 -4.53 120.64 110.53 3gnq n GLU 317 Ca 0.01 0.43 -0.16 0.00 -0.02 0.00 0.00 57.16 57.42 3gnq n GLU 317 Cb 0.12 -1.62 -0.10 0.00 -0.02 0.00 0.00 31.44 29.82 3gnq n GLU 317 CO 0.00 0.00 0.00 2.35 1.18 0.00 0.00 177.13 180.66 3gnq h TRP 318 N -1.00 0.62 0.51 -0.32 2.91 -1.85 -1.78 115.95 115.04 3gnq h TRP 318 Ca -0.23 -0.39 -0.03 0.00 1.13 0.00 0.00 58.89 59.37 3gnq h TRP 318 Cb 1.04 -0.05 0.01 0.00 -0.51 0.00 0.00 29.16 29.65 3gnq h TRP 318 CO -0.14 1.25 -0.25 0.78 -1.03 0.00 0.00 178.44 179.06 3gnq h GLY 319 N 1.23 -0.72 -0.39 2.65 0.00 -1.25 -1.96 103.07 102.63 3gnq h GLY 319 Ca -0.12 0.27 0.15 0.00 0.00 0.00 0.00 47.33 47.62 3gnq h GLY 319 CO 0.19 -0.26 -0.13 -2.75 0.00 0.00 0.00 176.54 173.59 3gnq h PHE 320 N -0.88 -0.29 -0.97 5.60 3.57 -1.70 -1.23 116.94 121.05 3gnq h PHE 320 Ca -0.07 0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.54 3gnq h PHE 320 Cb 0.53 0.24 -0.06 0.00 2.79 0.00 0.00 35.95 39.44 3gnq h PHE 320 CO 0.05 -0.29 0.62 0.77 -2.23 0.00 0.00 178.31 177.24 3gnq h SER 321 N 0.03 1.02 0.50 0.41 0.02 -1.32 0.69 113.55 114.91 3gnq h SER 321 Ca 0.36 -0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 61.19 3gnq h SER 321 Cb 0.57 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.87 3gnq h SER 321 CO -0.71 0.68 -0.54 0.78 -1.14 0.00 0.00 176.83 175.91 3gnq h ASN 322 N 1.18 0.04 0.19 3.07 2.35 -0.45 -3.05 115.58 118.91 3gnq h ASN 322 Ca 0.40 -0.02 -0.14 0.00 -0.55 0.00 0.00 56.30 55.99 3gnq h ASN 322 Cb 0.07 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 3gnq h ASN 322 CO -0.14 0.57 -0.51 0.03 -1.65 0.00 0.00 177.43 175.72 3gnq h ARG 323 N 0.03 0.36 -0.99 0.81 2.47 -0.10 -3.04 114.38 113.92 3gnq h ARG 323 Ca -0.00 -0.22 0.11 0.00 -1.26 0.00 0.00 59.98 58.61 3gnq h ARG 323 Cb 0.96 0.02 -0.08 0.00 -1.65 0.00 0.00 29.97 29.21 3gnq h ARG 323 CO 0.07 0.79 0.62 0.52 0.56 0.00 0.00 179.97 182.54 3gnq h MET 324 N 0.29 0.98 -0.19 0.04 2.86 -0.82 0.85 114.93 118.95 3gnq h MET 324 Ca 0.01 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 3gnq h MET 324 Cb 1.00 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.44 3gnq h MET 324 CO 0.09 0.65 0.04 -0.07 1.06 0.00 0.00 176.91 178.68 3gnq h LEU 325 N 1.01 0.29 -0.65 1.22 3.38 -1.61 0.79 115.31 119.74 3gnq h LEU 325 Ca 0.48 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 58.22 3gnq h LEU 325 Cb 0.42 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 3gnq h LEU 325 CO -0.25 0.46 0.42 0.44 0.09 0.00 0.00 178.44 179.60 3gnq h ASP 326 N 0.11 0.71 0.01 -0.43 3.32 -1.23 -2.15 116.42 116.76 3gnq h ASP 326 Ca 0.06 -0.01 -0.14 0.00 0.02 0.00 0.00 57.03 56.96 3gnq h ASP 326 Cb 0.29 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 3gnq h ASP 326 CO 0.00 0.51 -0.44 0.74 -1.72 0.00 0.00 179.24 178.33 3gnq h THR 327 N 0.85 1.31 -0.02 0.35 2.02 -0.86 -2.38 112.91 114.17 3gnq h THR 327 Ca 0.24 -1.63 0.03 0.00 0.77 0.00 0.00 66.41 65.83 3gnq h THR 327 Cb -0.06 1.63 -0.05 0.00 -1.74 0.00 0.00 68.15 67.92 3gnq h THR 327 CO -0.07 0.51 -0.36 0.00 0.37 0.00 0.00 175.52 175.97 3gnq h ALA 328 N 1.10 -0.52 0.11 6.16 0.00 -0.36 -1.67 119.26 124.08 3gnq h ALA 328 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3gnq h ALA 328 Cb 0.95 0.64 -0.03 0.00 0.00 0.00 0.00 17.79 19.35 3gnq h ALA 328 CO 0.08 -0.87 -0.31 0.82 0.00 0.00 0.00 179.25 178.97 3gnq h ILE 329 N -0.50 0.00 -0.25 0.00 1.08 -1.36 -2.78 117.51 113.70 3gnq h ILE 329 Ca 0.06 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.61 3gnq h ILE 329 Cb 0.59 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.33 3gnq h ILE 329 CO -0.30 0.00 0.24 0.00 -0.69 0.00 0.00 178.15 177.39 3gnq h ALA 330 N -1.01 2.00 -0.02 1.87 0.00 -1.30 -2.10 119.26 118.70 3gnq h ALA 330 Ca -0.01 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 3gnq h ALA 330 Cb 0.46 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3gnq h ALA 330 CO -0.15 -0.37 -0.22 1.25 0.00 0.00 0.00 179.25 179.77 3gnq h LEU 331 N 0.00 0.23 0.45 0.00 5.85 -1.14 -3.02 115.31 117.68 3gnq h LEU 331 Ca 0.12 -0.72 -0.02 0.00 0.84 0.00 0.00 57.88 58.10 3gnq h LEU 331 Cb 0.59 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.56 3gnq h LEU 331 CO -0.00 0.92 -0.22 0.00 -0.34 0.00 0.00 178.44 178.80 3gnq h ALA 332 N 0.32 -0.61 0.00 1.25 0.00 -1.12 -2.92 119.26 116.17 3gnq h ALA 332 Ca -0.02 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3gnq h ALA 332 Cb 0.93 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3gnq h ALA 332 CO 0.04 -0.76 0.00 0.09 0.00 0.00 0.00 179.25 178.62 3gnq n ASN 333 N -5.29 0.00 -4.78 0.00 3.02 -0.96 -4.88 115.26 102.38 3gnq n ASN 333 Ca -0.11 -0.69 -0.41 0.00 -0.03 0.00 0.00 54.58 53.34 3gnq n ASN 333 Cb 0.29 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.45 3gnq n ASN 333 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gnq s ALA 334 N -2.00 3.55 0.00 5.41 0.00 -1.11 -5.00 121.76 122.62 3gnq s ALA 334 Ca 0.04 1.47 0.00 0.00 0.00 0.00 0.00 51.96 53.47 3gnq s ALA 334 Cb 0.02 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.57 3gnq s ALA 334 CO 0.03 -0.92 0.00 1.63 0.00 0.00 0.00 175.76 176.50