#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qy6 h LEU 21 N 0.00 0.34 -0.55 -3.43 5.85 -2.01 0.17 115.31 115.69 2qy6 h LEU 21 Ca 0.00 -0.15 -0.07 0.00 0.84 0.00 0.00 57.88 58.50 2qy6 h LEU 21 Cb 0.00 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 2qy6 h LEU 21 CO 0.00 0.73 0.06 0.50 -0.34 0.00 0.00 178.44 179.39 2qy6 h LYS 22 N 0.27 0.94 0.00 1.25 1.63 -2.01 -3.36 116.57 115.29 2qy6 h LYS 22 Ca 0.02 -0.27 0.00 0.00 -0.85 0.00 0.00 60.65 59.55 2qy6 h LYS 22 Cb 0.86 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 32.39 2qy6 h LYS 22 CO 0.07 0.92 0.00 0.72 -3.45 0.00 0.00 179.45 177.71 2qy6 n HIS 23 N -4.32 0.00 0.00 1.91 8.25 -1.25 -4.98 115.22 114.83 2qy6 n HIS 23 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 2qy6 n HIS 23 Cb 0.29 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.40 2qy6 n HIS 23 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2qy6 n TYR 24 N -0.14 0.00 1.71 4.41 4.01 0.60 -2.24 117.16 125.52 2qy6 n TYR 24 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2qy6 n TYR 24 Cb 0.10 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.14 2qy6 n TYR 24 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2qy6 n SER 25 N 3.50 0.34 -3.98 7.72 3.41 -1.26 -4.71 113.62 118.65 2qy6 n SER 25 Ca 0.00 -2.01 -0.08 0.00 -0.26 0.00 0.00 58.87 56.52 2qy6 n SER 25 Cb 0.00 -0.12 -0.09 0.00 -0.26 0.00 0.00 64.21 63.73 2qy6 n SER 25 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2qy6 s ILE 26 N -1.77 0.17 0.01 -1.33 -4.36 -0.95 -4.83 121.20 108.15 2qy6 s ILE 26 Ca 0.01 -1.39 -0.05 0.00 -0.26 0.00 0.00 60.65 58.96 2qy6 s ILE 26 Cb 0.01 -1.23 -0.01 0.00 1.25 0.00 0.00 42.46 42.48 2qy6 s ILE 26 CO 0.01 -0.77 0.08 0.00 0.24 0.00 0.00 174.94 174.50 2qy6 s GLN 27 N -3.40 0.45 0.49 0.37 -2.07 -1.25 -4.63 119.66 109.62 2qy6 s GLN 27 Ca 0.02 -0.53 -0.23 0.00 -1.82 0.00 0.00 55.36 52.80 2qy6 s GLN 27 Cb 0.04 0.18 -0.08 0.00 -1.09 0.00 0.00 33.01 32.06 2qy6 s GLN 27 CO -0.08 -0.10 1.21 -2.30 -1.32 0.00 0.00 175.29 172.70 2qy6 n PRO 28 N 1.36 1.61 -1.82 9.60 -0.02 -1.26 -3.86 135.00 140.61 2qy6 n PRO 28 Ca -0.22 0.59 -0.41 0.00 -2.02 0.00 0.00 63.50 61.43 2qy6 n PRO 28 Cb 0.56 -2.36 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 2qy6 n PRO 28 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qy6 s ALA 29 N -1.29 3.71 -0.53 3.55 0.00 0.09 -4.85 121.76 122.45 2qy6 s ALA 29 Ca 0.67 1.53 -0.19 0.00 0.00 0.00 0.00 51.96 53.97 2qy6 s ALA 29 Cb -0.47 -3.63 0.07 0.00 0.00 0.00 0.00 23.12 19.09 2qy6 s ALA 29 CO 0.53 -0.94 0.62 1.21 0.00 0.00 0.00 175.76 177.18 2qy6 s ASN 30 N 0.43 6.20 0.07 0.00 2.47 -1.26 -4.71 114.94 118.14 2qy6 s ASN 30 Ca 0.62 -1.13 0.01 0.00 0.42 0.00 0.00 52.86 52.78 2qy6 s ASN 30 Cb -0.47 -2.28 -0.04 0.00 -1.45 0.00 0.00 41.25 37.01 2qy6 s ASN 30 CO 0.48 -0.93 0.15 -0.76 -3.72 0.00 0.00 177.10 172.31 2qy6 s LEU 31 N 2.52 4.10 0.00 3.21 1.02 -1.26 -0.26 118.68 128.01 2qy6 s LEU 31 Ca 0.13 0.14 0.05 0.00 0.02 0.00 0.00 54.13 54.47 2qy6 s LEU 31 Cb -0.21 -2.72 -0.02 0.00 0.02 0.00 0.00 46.19 43.26 2qy6 s LEU 31 CO 0.09 0.18 -0.17 -0.70 0.02 0.00 0.00 176.35 175.77 2qy6 s GLU 32 N -2.42 1.30 -0.17 1.70 2.12 -0.63 -4.89 118.70 115.72 2qy6 s GLU 32 Ca 0.32 -0.68 -0.05 0.00 0.36 0.00 0.00 54.97 54.92 2qy6 s GLU 32 Cb -0.13 -1.29 -0.03 0.00 0.26 0.00 0.00 34.13 32.94 2qy6 s GLU 32 CO 0.25 0.35 0.00 -0.06 -0.54 0.00 0.00 175.26 175.25 2qy6 s PHE 33 N -0.53 3.11 0.56 5.30 0.08 -1.26 -0.32 117.98 124.92 2qy6 s PHE 33 Ca 0.06 -0.17 -0.00 0.00 0.12 0.00 0.00 56.93 56.93 2qy6 s PHE 33 Cb -0.07 -2.01 0.11 0.00 -0.57 0.00 0.00 43.02 40.48 2qy6 s PHE 33 CO 0.00 0.02 0.77 0.27 -0.10 0.00 0.00 175.22 176.18 2qy6 n ASN 34 N 3.58 1.03 -0.27 1.36 0.23 -0.03 -4.81 115.26 116.34 2qy6 n ASN 34 Ca -0.17 -1.87 0.31 0.00 -0.53 0.00 0.00 54.58 52.32 2qy6 n ASN 34 Cb 0.52 -0.50 0.70 0.00 -2.08 0.00 0.00 39.78 38.43 2qy6 n ASN 34 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2qy6 h ALA 35 N -0.58 2.87 -0.01 -2.53 0.00 -1.99 0.67 119.26 117.70 2qy6 h ALA 35 Ca -0.25 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2qy6 h ALA 35 Cb 0.94 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2qy6 h ALA 35 CO 0.27 -1.19 -0.07 0.39 0.00 0.00 0.00 179.25 178.65 2qy6 n GLU 36 N -4.28 1.26 -0.86 0.00 1.02 -1.26 -4.93 120.64 111.58 2qy6 n GLU 36 Ca 0.23 -0.64 0.00 0.00 -0.02 0.00 0.00 57.16 56.73 2qy6 n GLU 36 Cb 1.07 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 31.01 2qy6 n GLU 36 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qy6 n GLY 37 N 1.21 0.55 3.75 0.62 0.00 0.23 -5.05 105.19 106.49 2qy6 n GLY 37 Ca 0.17 -0.21 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 2qy6 n GLY 37 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qy6 s THR 38 N -2.00 4.47 0.03 2.61 2.01 -1.26 -4.61 115.64 116.90 2qy6 s THR 38 Ca 0.00 1.88 -0.30 0.00 0.31 0.00 0.00 61.69 63.58 2qy6 s THR 38 Cb 0.00 -4.23 -0.08 0.00 0.01 0.00 0.00 72.50 68.20 2qy6 s THR 38 CO 0.00 0.40 1.71 -2.16 -0.69 0.00 0.00 174.62 173.88 2qy6 s PRO 39 N -0.43 4.18 -0.11 4.92 0.04 -1.26 -0.85 135.00 141.49 2qy6 s PRO 39 Ca 0.41 2.34 0.00 0.00 0.04 0.00 0.00 61.00 63.80 2qy6 s PRO 39 Cb -0.23 -3.79 -0.02 0.00 0.04 0.00 0.00 34.50 30.51 2qy6 s PRO 39 CO 0.28 -0.80 -0.12 0.08 0.04 0.00 0.00 177.00 176.47 2qy6 s VAL 40 N 3.29 3.18 -0.12 -0.36 1.01 0.56 -1.06 120.40 126.89 2qy6 s VAL 40 Ca 0.76 -0.63 -0.29 0.00 0.00 0.00 0.00 61.98 61.81 2qy6 s VAL 40 Cb -0.39 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 33.65 2qy6 s VAL 40 CO 0.33 0.54 1.25 -0.55 0.00 0.00 0.00 175.10 176.67 2qy6 s SER 41 N 0.03 6.97 0.43 3.32 0.15 0.40 -1.60 113.70 123.41 2qy6 s SER 41 Ca -0.04 1.75 0.23 0.00 0.70 0.00 0.00 55.95 58.59 2qy6 s SER 41 Cb -0.14 -2.55 0.40 0.00 -1.71 0.00 0.00 66.02 62.02 2qy6 s SER 41 CO 0.04 -0.70 1.62 0.03 1.20 0.00 0.00 173.24 175.43 2qy6 h ARG 42 N 7.96 0.00 -0.36 5.44 2.47 -0.95 0.43 114.38 129.37 2qy6 h ARG 42 Ca -0.29 0.00 -0.14 0.00 -1.26 0.00 0.00 59.98 58.28 2qy6 h ARG 42 Cb 1.13 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.44 2qy6 h ARG 42 CO 0.94 0.07 -0.35 -0.44 0.56 0.00 0.00 179.97 180.75 2qy6 h ASP 43 N 0.00 0.87 -0.00 7.04 3.32 -1.91 -3.36 116.42 122.38 2qy6 h ASP 43 Ca -0.00 -0.37 0.00 0.00 0.02 0.00 0.00 57.03 56.67 2qy6 h ASP 43 Cb 1.01 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.31 2qy6 h ASP 43 CO 0.01 1.13 -0.04 0.49 -1.72 0.00 0.00 179.24 179.11 2qy6 n PHE 44 N -4.06 0.00 -3.48 4.55 3.72 -1.23 -5.05 117.46 111.90 2qy6 n PHE 44 Ca -0.01 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.20 2qy6 n PHE 44 Cb 0.51 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 39.12 2qy6 n PHE 44 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2qy6 n ASP 45 N -0.17 -2.42 -3.60 4.37 8.00 0.15 -4.89 116.55 117.98 2qy6 n ASP 45 Ca 0.02 -0.69 -0.16 0.00 0.71 0.00 0.00 54.79 54.66 2qy6 n ASP 45 Cb 0.08 -4.83 -0.07 0.00 -0.02 0.00 0.00 41.12 36.28 2qy6 n ASP 45 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2qy6 s ASP 46 N -4.23 -0.53 0.38 -2.24 2.15 -1.15 -4.96 116.67 106.10 2qy6 s ASP 46 Ca 0.06 0.60 -0.27 0.00 0.43 0.00 0.00 52.55 53.38 2qy6 s ASP 46 Cb -0.01 0.56 -0.11 0.00 -0.30 0.00 0.00 42.92 43.06 2qy6 s ASP 46 CO 0.75 -0.52 1.35 1.33 -0.17 0.00 0.00 175.17 177.92 2qy6 n VAL 47 N 1.23 2.22 0.15 1.11 0.24 -1.26 -0.45 118.33 121.57 2qy6 n VAL 47 Ca -0.19 -0.50 0.01 0.00 -2.04 0.00 0.00 64.34 61.62 2qy6 n VAL 47 Cb 0.57 -1.71 0.32 0.00 -1.47 0.00 0.00 33.84 31.54 2qy6 n VAL 47 CO 0.00 0.00 0.00 1.88 -2.14 0.00 0.00 176.83 176.57 2qy6 h TYR 48 N 2.51 0.11 -3.15 6.34 -1.99 -1.46 -3.46 116.97 115.86 2qy6 h TYR 48 Ca -0.48 -0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.21 2qy6 h TYR 48 Cb 1.27 -0.03 -0.10 0.00 2.00 0.00 0.00 36.73 39.87 2qy6 h TYR 48 CO 0.50 0.45 0.12 -0.59 -0.00 0.00 0.00 178.16 178.64 2qy6 s PHE 49 N -4.22 -0.30 -0.17 4.88 -0.12 -1.26 -5.01 117.98 111.79 2qy6 s PHE 49 Ca -0.03 -0.01 -0.29 0.00 -0.05 0.00 0.00 56.93 56.55 2qy6 s PHE 49 Cb 0.14 0.49 -0.05 0.00 -0.63 0.00 0.00 43.02 42.97 2qy6 s PHE 49 CO 0.74 -0.91 1.88 0.45 -0.05 0.00 0.00 175.22 177.32 2qy6 s SER 50 N -2.82 6.10 0.22 1.98 0.15 -1.26 -4.92 113.70 113.15 2qy6 s SER 50 Ca 0.06 1.91 -0.08 0.00 0.70 0.00 0.00 55.95 58.54 2qy6 s SER 50 Cb -0.01 -2.53 0.33 0.00 -1.71 0.00 0.00 66.02 62.11 2qy6 s SER 50 CO -0.06 -1.44 1.73 -1.13 1.20 0.00 0.00 173.24 173.54 2qy6 h ASN 51 N 12.05 0.18 -0.10 5.45 -0.73 -2.00 -0.95 115.58 129.49 2qy6 h ASN 51 Ca -0.39 0.10 -0.15 0.00 1.87 0.00 0.00 56.30 57.72 2qy6 h ASN 51 Cb 1.20 0.09 0.01 0.00 0.27 0.00 0.00 38.32 39.89 2qy6 h ASN 51 CO 0.98 0.09 -0.53 0.44 -0.37 0.00 0.00 177.43 178.04 2qy6 h ASP 52 N 0.38 0.64 0.00 1.15 3.32 -2.01 -3.40 116.42 116.50 2qy6 h ASP 52 Ca 0.34 -0.65 0.00 0.00 0.02 0.00 0.00 57.03 56.75 2qy6 h ASP 52 Cb 0.47 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2qy6 h ASP 52 CO -0.36 1.18 -0.01 0.59 -1.72 0.00 0.00 179.24 178.92 2qy6 n ASN 53 N -4.21 1.73 -0.21 6.45 5.03 -1.18 -4.88 115.26 118.00 2qy6 n ASN 53 Ca -0.08 -1.99 0.01 0.00 0.87 0.00 0.00 54.58 53.38 2qy6 n ASN 53 Cb 0.61 -0.05 0.12 0.00 -1.02 0.00 0.00 39.78 39.44 2qy6 n ASN 53 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 2qy6 h GLY 54 N 0.00 0.89 0.79 7.41 0.00 -1.40 0.11 103.07 110.87 2qy6 h GLY 54 Ca 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 2qy6 h GLY 54 CO 0.00 -0.02 -0.05 -2.00 0.00 0.00 0.00 176.54 174.47 2qy6 h LEU 55 N 0.42 -0.12 -0.88 3.11 5.85 -1.90 0.10 115.31 121.90 2qy6 h LEU 55 Ca 0.32 -0.18 -0.12 0.00 0.84 0.00 0.00 57.88 58.74 2qy6 h LEU 55 Cb 0.40 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2qy6 h LEU 55 CO -0.31 0.11 -0.50 -0.33 -0.34 0.00 0.00 178.44 177.07 2qy6 h GLU 56 N -0.35 0.14 -0.19 1.25 4.39 -1.85 -1.10 114.58 116.88 2qy6 h GLU 56 Ca -0.01 -0.08 -0.02 0.00 0.34 0.00 0.00 59.36 59.59 2qy6 h GLU 56 Cb 0.29 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 2qy6 h GLU 56 CO 0.02 0.61 0.05 1.49 -1.16 0.00 0.00 179.01 180.03 2qy6 h GLU 57 N 0.11 0.30 -0.62 2.33 4.81 -0.73 -0.54 114.58 120.25 2qy6 h GLU 57 Ca 0.00 -0.07 0.07 0.00 -0.13 0.00 0.00 59.36 59.23 2qy6 h GLU 57 Cb 0.93 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 30.20 2qy6 h GLU 57 CO 0.07 0.43 0.30 1.15 -0.73 0.00 0.00 179.01 180.23 2qy6 h THR 58 N 0.12 0.89 -0.63 0.32 2.02 -0.55 -1.16 112.91 113.92 2qy6 h THR 58 Ca 0.06 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 67.03 2qy6 h THR 58 Cb 0.26 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 66.93 2qy6 h THR 58 CO -0.00 0.10 0.31 0.03 0.37 0.00 0.00 175.52 176.33 2qy6 h ARG 59 N 0.55 0.91 -0.17 6.66 3.08 -1.13 -1.54 114.38 122.74 2qy6 h ARG 59 Ca 0.29 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 60.20 2qy6 h ARG 59 Cb 0.26 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 2qy6 h ARG 59 CO -0.23 0.73 0.05 -0.92 -1.07 0.00 0.00 179.97 178.54 2qy6 h TYR 60 N 0.87 0.27 0.18 3.04 3.20 -0.74 0.11 116.97 123.90 2qy6 h TYR 60 Ca 0.22 -0.03 -0.25 0.00 3.14 0.00 0.00 58.73 61.81 2qy6 h TYR 60 Cb 0.12 -0.08 0.02 0.00 1.54 0.00 0.00 36.73 38.33 2qy6 h TYR 60 CO 0.00 0.37 -1.12 -0.24 -1.64 0.00 0.00 178.16 175.53 2qy6 h VAL 61 N 0.10 1.37 0.05 1.81 3.04 -1.18 -2.58 116.25 118.86 2qy6 h VAL 61 Ca 0.05 -2.58 -0.33 0.00 -1.01 0.00 0.00 66.70 62.84 2qy6 h VAL 61 Cb 0.22 3.10 -0.04 0.00 -2.01 0.00 0.00 31.29 32.56 2qy6 h VAL 61 CO -0.00 0.75 -1.84 0.49 -1.01 0.00 0.00 177.57 175.96 2qy6 n PHE 62 N -3.96 0.86 0.04 3.17 3.72 -0.59 -1.52 117.46 119.20 2qy6 n PHE 62 Ca -0.16 0.27 -0.10 0.00 -0.05 0.00 0.00 57.45 57.41 2qy6 n PHE 62 Cb 0.93 -1.10 -0.07 0.00 -0.94 0.00 0.00 39.48 38.30 2qy6 n PHE 62 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2qy6 h LEU 63 N -0.49 -0.17 -0.22 4.37 4.07 -1.54 -3.12 115.31 118.20 2qy6 h LEU 63 Ca -0.45 -0.34 0.01 0.00 0.08 0.00 0.00 57.88 57.17 2qy6 h LEU 63 Cb 1.68 0.04 -0.01 0.00 1.08 0.00 0.00 40.66 43.45 2qy6 h LEU 63 CO -0.12 0.40 0.13 1.23 -1.08 0.00 0.00 178.44 179.01 2qy6 h GLY 64 N -0.90 0.30 2.00 0.83 0.00 -0.76 0.15 103.07 104.69 2qy6 h GLY 64 Ca -0.02 -0.10 -0.03 0.00 0.00 0.00 0.00 47.33 47.18 2qy6 h GLY 64 CO 0.03 0.10 -0.13 -1.33 0.00 0.00 0.00 176.54 175.21 2qy6 h GLY 65 N 0.28 0.00 -1.33 4.60 0.00 -0.85 -1.66 103.07 104.10 2qy6 h GLY 65 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 2qy6 h GLY 65 CO -0.03 0.00 -0.17 0.70 0.00 0.00 0.00 176.54 177.03 2qy6 n ASN 66 N -3.67 2.40 -3.50 0.19 3.02 -1.08 -4.67 115.26 107.95 2qy6 n ASN 66 Ca -0.02 -1.72 -0.22 0.00 -0.03 0.00 0.00 54.58 52.59 2qy6 n ASN 66 Cb 0.25 0.17 0.08 0.00 -0.61 0.00 0.00 39.78 39.66 2qy6 n ASN 66 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qy6 n GLN 67 N 0.65 -7.53 -0.02 3.52 6.02 0.40 -4.91 117.38 115.50 2qy6 n GLN 67 Ca 0.13 0.82 -0.17 0.00 -0.01 0.00 0.00 57.00 57.77 2qy6 n GLN 67 Cb 0.52 -5.81 -0.08 0.00 1.02 0.00 0.00 30.24 25.88 2qy6 n GLN 67 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2qy6 h LEU 68 N -2.48 0.76 -0.84 1.08 3.38 -1.47 -2.46 115.31 113.28 2qy6 h LEU 68 Ca -0.56 -0.64 -0.12 0.00 0.09 0.00 0.00 57.88 56.65 2qy6 h LEU 68 Cb 1.36 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 2qy6 h LEU 68 CO 0.53 1.28 -0.42 -0.33 0.09 0.00 0.00 178.44 179.60 2qy6 h GLU 69 N 0.29 0.35 -0.56 1.13 5.08 -1.91 -0.76 114.58 118.20 2qy6 h GLU 69 Ca -0.04 -0.17 -0.07 0.00 -1.00 0.00 0.00 59.36 58.08 2qy6 h GLU 69 Cb 1.27 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.50 2qy6 h GLU 69 CO 0.13 0.71 0.08 0.00 -1.00 0.00 0.00 179.01 178.93 2qy6 h ALA 70 N 1.27 1.08 0.06 3.43 0.00 -1.94 -3.32 119.26 119.84 2qy6 h ALA 70 Ca 0.03 -0.25 -0.24 0.00 0.00 0.00 0.00 54.91 54.45 2qy6 h ALA 70 Cb 0.86 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 2qy6 h ALA 70 CO 0.07 0.59 -1.06 0.00 0.00 0.00 0.00 179.25 178.85 2qy6 h ARG 71 N 0.85 0.24 -0.31 0.00 3.08 -0.69 -3.37 114.38 114.19 2qy6 h ARG 71 Ca 0.17 -0.33 0.07 0.00 0.07 0.00 0.00 59.98 59.96 2qy6 h ARG 71 Cb 0.39 0.11 -0.07 0.00 0.08 0.00 0.00 29.97 30.49 2qy6 h ARG 71 CO 0.01 1.10 -0.14 0.74 -1.07 0.00 0.00 179.97 180.61 2qy6 h PHE 72 N 0.10 -0.35 0.00 3.04 0.04 -1.35 0.26 116.94 118.69 2qy6 h PHE 72 Ca -0.08 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.72 2qy6 h PHE 72 Cb 1.75 0.20 0.00 0.00 2.20 0.00 0.00 35.95 40.10 2qy6 h PHE 72 CO 0.05 -0.22 0.00 -2.30 -0.60 0.00 0.00 178.31 175.24 2qy6 n PRO 73 N -5.32 0.11 0.00 1.51 -0.02 -1.26 -2.61 135.00 127.41 2qy6 n PRO 73 Ca 0.00 0.36 0.10 0.00 -2.02 0.00 0.00 63.50 61.94 2qy6 n PRO 73 Cb 0.23 -1.71 0.06 0.00 -0.02 0.00 0.00 33.50 32.06 2qy6 n PRO 73 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2qy6 n GLU 74 N -1.91 1.68 -2.05 -0.52 -0.58 -0.06 -4.82 120.64 112.38 2qy6 n GLU 74 Ca 0.03 -1.45 -0.43 0.00 -0.42 0.00 0.00 57.16 54.89 2qy6 n GLU 74 Cb 0.19 -1.37 -0.03 0.00 -0.57 0.00 0.00 31.44 29.67 2qy6 n GLU 74 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 2qy6 s HIS 75 N -1.79 1.99 -0.11 -0.32 2.46 -0.40 -4.89 115.29 112.23 2qy6 s HIS 75 Ca 0.21 0.45 -0.00 0.00 0.47 0.00 0.00 55.06 56.19 2qy6 s HIS 75 Cb 0.16 -3.98 0.08 0.00 -0.13 0.00 0.00 32.58 28.71 2qy6 s HIS 75 CO 0.31 -3.25 1.88 -0.35 -2.47 0.00 0.00 174.74 170.86 2qy6 n PRO 76 N 7.64 1.27 -3.72 2.88 -0.04 -1.26 -4.17 135.00 137.59 2qy6 n PRO 76 Ca 0.19 -0.54 -0.14 0.00 -0.04 0.00 0.00 63.50 62.98 2qy6 n PRO 76 Cb 0.45 -1.21 -0.08 0.00 -0.04 0.00 0.00 33.50 32.61 2qy6 n PRO 76 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2qy6 s HIS 77 N -0.62 -0.24 -0.61 0.54 3.76 -1.26 -5.05 115.29 111.81 2qy6 s HIS 77 Ca 0.11 0.36 0.23 0.00 -0.15 0.00 0.00 55.06 55.60 2qy6 s HIS 77 Cb 0.08 0.14 0.92 0.00 1.11 0.00 0.00 32.58 34.83 2qy6 s HIS 77 CO 0.00 -0.44 1.70 -0.35 -0.85 0.00 0.00 174.74 174.80 2qy6 n PRO 78 N 1.14 0.17 -5.13 8.40 -0.04 -1.26 -3.76 135.00 134.52 2qy6 n PRO 78 Ca -0.21 0.35 -0.29 0.00 -0.04 0.00 0.00 63.50 63.32 2qy6 n PRO 78 Cb 0.57 -1.80 -0.16 0.00 -0.04 0.00 0.00 33.50 32.07 2qy6 n PRO 78 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2qy6 s LEU 79 N -4.24 2.04 -0.17 1.53 2.96 -1.26 -1.14 118.68 118.41 2qy6 s LEU 79 Ca 0.06 -0.41 -0.04 0.00 -0.22 0.00 0.00 54.13 53.52 2qy6 s LEU 79 Cb 0.10 -1.18 -0.03 0.00 0.50 0.00 0.00 46.19 45.59 2qy6 s LEU 79 CO 0.41 0.28 -0.03 0.12 -1.32 0.00 0.00 176.35 175.81 2qy6 s PHE 80 N -0.51 3.02 -0.23 5.38 5.36 -0.30 -4.98 117.98 125.72 2qy6 s PHE 80 Ca 0.08 -0.38 -0.05 0.00 -0.96 0.00 0.00 56.93 55.62 2qy6 s PHE 80 Cb -0.09 -2.00 -0.01 0.00 -0.34 0.00 0.00 43.02 40.58 2qy6 s PHE 80 CO -0.01 -0.12 -0.00 0.08 -1.46 0.00 0.00 175.22 173.71 2qy6 s VAL 81 N 0.58 3.66 -0.10 3.12 1.01 -1.26 0.12 120.40 127.52 2qy6 s VAL 81 Ca -0.02 -0.42 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 2qy6 s VAL 81 Cb -0.14 -2.69 -0.03 0.00 0.00 0.00 0.00 36.38 33.51 2qy6 s VAL 81 CO 0.02 0.38 -0.05 -0.69 0.00 0.00 0.00 175.10 174.77 2qy6 s VAL 82 N 1.52 3.87 -0.04 2.92 1.01 -0.17 -0.76 120.40 128.75 2qy6 s VAL 82 Ca 0.06 -0.40 0.06 0.00 0.00 0.00 0.00 61.98 61.70 2qy6 s VAL 82 Cb -0.15 -2.63 -0.02 0.00 0.00 0.00 0.00 36.38 33.58 2qy6 s VAL 82 CO -0.01 0.56 -0.23 0.00 0.00 0.00 0.00 175.10 175.42 2qy6 s ALA 83 N -0.41 2.26 -0.02 5.51 0.00 -0.58 -0.30 121.76 128.23 2qy6 s ALA 83 Ca 0.06 -1.07 0.06 0.00 0.00 0.00 0.00 51.96 51.01 2qy6 s ALA 83 Cb -0.12 -0.68 -0.01 0.00 0.00 0.00 0.00 23.12 22.31 2qy6 s ALA 83 CO 0.02 0.49 -0.19 -2.00 0.00 0.00 0.00 175.76 174.09 2qy6 s GLU 84 N -0.47 1.54 0.14 0.00 2.12 0.29 -0.06 118.70 122.25 2qy6 s GLU 84 Ca 0.06 -0.67 0.08 0.00 0.36 0.00 0.00 54.97 54.80 2qy6 s GLU 84 Cb -0.11 -1.48 -0.17 0.00 0.26 0.00 0.00 34.13 32.63 2qy6 s GLU 84 CO 0.01 0.39 1.27 0.66 -0.54 0.00 0.00 175.26 177.06 2qy6 h SER 85 N 5.71 0.00 -2.88 -1.70 4.64 -1.52 -3.11 113.55 114.69 2qy6 h SER 85 Ca -0.37 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 60.74 2qy6 h SER 85 Cb 1.15 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 62.92 2qy6 h SER 85 CO 0.48 0.92 -0.51 -0.83 -0.87 0.00 0.00 176.83 176.02 2qy6 s GLY 86 N -4.69 -0.13 -0.05 -0.77 0.00 -1.06 -4.20 107.32 96.42 2qy6 s GLY 86 Ca 0.01 0.98 -0.27 0.00 0.00 0.00 0.00 44.72 45.45 2qy6 s GLY 86 CO 0.81 1.94 1.16 -2.75 0.00 0.00 0.00 173.10 174.26 2qy6 h PHE 87 N 8.19 0.01 0.00 1.90 3.57 -1.28 -3.39 116.94 125.93 2qy6 h PHE 87 Ca -0.16 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.33 2qy6 h PHE 87 Cb 1.12 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.86 2qy6 h PHE 87 CO 0.36 0.60 0.00 0.41 -2.23 0.00 0.00 178.31 177.45 2qy6 n GLY 88 N 0.52 4.16 0.01 2.40 0.00 -1.26 -1.96 105.19 109.05 2qy6 n GLY 88 Ca -0.09 0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.15 2qy6 n GLY 88 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qy6 n THR 89 N 0.00 0.00 -0.84 2.61 -2.24 -1.26 -4.70 114.28 107.85 2qy6 n THR 89 Ca 0.00 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 2qy6 n THR 89 Cb 0.00 -0.40 0.00 0.00 -2.10 0.00 0.00 70.33 67.83 2qy6 n THR 89 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qy6 n GLY 90 N 1.39 0.58 0.17 3.38 0.00 -0.83 -4.93 105.19 104.95 2qy6 n GLY 90 Ca 0.10 -0.05 -0.05 0.00 0.00 0.00 0.00 46.02 46.03 2qy6 n GLY 90 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2qy6 h LEU 91 N 0.00 0.05 -0.42 0.99 5.85 -1.91 0.19 115.31 120.07 2qy6 h LEU 91 Ca 0.00 0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.82 2qy6 h LEU 91 Cb 0.00 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 2qy6 h LEU 91 CO 0.00 0.07 0.20 0.78 -0.34 0.00 0.00 178.44 179.14 2qy6 h ASN 92 N 0.24 0.28 -0.08 1.25 2.35 -1.93 -0.41 115.58 117.26 2qy6 h ASN 92 Ca 0.19 0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2qy6 h ASN 92 Cb 0.21 -0.02 -0.00 0.00 0.05 0.00 0.00 38.32 38.55 2qy6 h ASN 92 CO -0.23 0.20 0.05 0.15 -1.65 0.00 0.00 177.43 175.95 2qy6 h PHE 93 N 0.40 0.10 -0.42 1.19 3.57 -1.77 -1.70 116.94 118.31 2qy6 h PHE 93 Ca 0.18 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 2qy6 h PHE 93 Cb 0.10 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 2qy6 h PHE 93 CO -0.11 0.06 0.21 -0.07 -2.23 0.00 0.00 178.31 176.17 2qy6 h LEU 94 N 0.11 0.54 -0.44 0.59 3.38 -0.84 0.73 115.31 119.38 2qy6 h LEU 94 Ca 0.03 -0.12 0.08 0.00 0.09 0.00 0.00 57.88 57.96 2qy6 h LEU 94 Cb -0.01 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 40.53 2qy6 h LEU 94 CO -0.01 0.51 0.03 0.74 0.09 0.00 0.00 178.44 179.80 2qy6 h THR 95 N 0.54 0.69 -0.59 0.22 2.02 -1.07 0.60 112.91 115.32 2qy6 h THR 95 Ca 0.14 -0.05 -0.04 0.00 0.77 0.00 0.00 66.41 67.23 2qy6 h THR 95 Cb 0.10 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 67.02 2qy6 h THR 95 CO -0.02 0.03 0.19 0.25 0.37 0.00 0.00 175.52 176.34 2qy6 h LEU 96 N 0.14 0.85 -0.16 2.58 5.85 -0.98 -1.43 115.31 122.15 2qy6 h LEU 96 Ca 0.22 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 2qy6 h LEU 96 Cb 0.31 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2qy6 h LEU 96 CO -0.34 0.82 0.08 -0.25 -0.34 0.00 0.00 178.44 178.41 2qy6 h TRP 97 N 0.83 0.23 -0.14 1.25 7.01 -0.36 0.15 115.95 124.91 2qy6 h TRP 97 Ca 0.19 -0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.23 2qy6 h TRP 97 Cb 0.27 -0.07 -0.06 0.00 -2.10 0.00 0.00 29.16 27.20 2qy6 h TRP 97 CO 0.02 0.24 -0.22 0.37 -2.79 0.00 0.00 178.44 176.06 2qy6 h GLN 98 N 0.15 -0.27 -0.78 2.65 4.15 -0.85 -2.29 115.11 117.88 2qy6 h GLN 98 Ca 0.06 0.02 0.12 0.00 0.77 0.00 0.00 58.65 59.62 2qy6 h GLN 98 Cb 0.09 0.06 -0.05 0.00 0.21 0.00 0.00 27.48 27.79 2qy6 h GLN 98 CO -0.01 -0.18 0.51 0.00 -1.93 0.00 0.00 178.83 177.22 2qy6 h ALA 99 N 0.70 1.92 -0.25 3.38 0.00 -0.72 -2.15 119.26 122.14 2qy6 h ALA 99 Ca 0.10 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.84 2qy6 h ALA 99 Cb 0.43 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2qy6 h ALA 99 CO -0.30 -0.10 -0.51 0.35 0.00 0.00 0.00 179.25 178.69 2qy6 h PHE 100 N 0.58 0.99 -0.42 0.00 3.57 -0.31 0.78 116.94 122.15 2qy6 h PHE 100 Ca 0.37 -0.36 -0.07 0.00 3.53 0.00 0.00 57.97 61.44 2qy6 h PHE 100 Cb 0.64 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 2qy6 h PHE 100 CO -0.00 1.17 -0.02 -0.44 -2.23 0.00 0.00 178.31 176.79 2qy6 h ASP 101 N 0.53 0.65 -0.38 0.41 5.19 -1.28 -0.36 116.42 121.18 2qy6 h ASP 101 Ca 0.01 -0.15 -0.07 0.00 -0.62 0.00 0.00 57.03 56.20 2qy6 h ASP 101 Cb 1.12 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 40.45 2qy6 h ASP 101 CO 0.11 0.73 -0.04 1.56 -3.12 0.00 0.00 179.24 178.48 2qy6 h GLN 102 N 0.64 0.69 -0.73 3.56 4.20 -1.21 -1.53 115.11 120.72 2qy6 h GLN 102 Ca 0.13 -0.24 -0.00 0.00 0.06 0.00 0.00 58.65 58.59 2qy6 h GLN 102 Cb 0.42 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.11 2qy6 h GLN 102 CO 0.02 0.81 0.44 0.35 -0.67 0.00 0.00 178.83 179.78 2qy6 h PHE 103 N 0.50 0.95 0.00 2.96 3.57 -0.52 -2.53 116.94 121.88 2qy6 h PHE 103 Ca 0.10 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.53 2qy6 h PHE 103 Cb 0.53 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 2qy6 h PHE 103 CO 0.04 0.63 -0.36 0.00 -2.23 0.00 0.00 178.31 176.40 2qy6 h ARG 104 N 1.00 0.00 -0.14 1.11 3.08 -0.65 0.70 114.38 119.49 2qy6 h ARG 104 Ca 0.26 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 60.09 2qy6 h ARG 104 Cb -0.04 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.02 2qy6 h ARG 104 CO -0.05 0.36 -0.77 1.49 -1.07 0.00 0.00 179.97 179.94 2qy6 h GLU 105 N 0.00 0.76 0.00 0.04 4.57 -1.12 -2.96 114.58 115.88 2qy6 h GLU 105 Ca -0.00 -0.64 -0.16 0.00 -1.18 0.00 0.00 59.36 57.38 2qy6 h GLU 105 Cb 1.07 0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.77 2qy6 h GLU 105 CO 0.05 1.24 -0.75 0.00 -1.18 0.00 0.00 179.01 178.37 2qy6 h ALA 106 N 0.53 0.62 -2.09 2.92 0.00 -1.29 -3.39 119.26 116.57 2qy6 h ALA 106 Ca -0.06 -0.69 -0.53 0.00 0.00 0.00 0.00 54.91 53.64 2qy6 h ALA 106 Cb 1.40 -0.12 -0.41 0.00 0.00 0.00 0.00 17.79 18.67 2qy6 h ALA 106 CO 0.16 0.94 -1.01 0.72 0.00 0.00 0.00 179.25 180.06 2qy6 n HIS 107 N -3.45 1.31 0.88 0.00 8.25 0.22 -4.98 115.22 117.45 2qy6 n HIS 107 Ca 0.00 -3.85 0.08 0.00 -0.26 0.00 0.00 57.72 53.69 2qy6 n HIS 107 Cb 0.78 -0.44 0.44 0.00 1.12 0.00 0.00 29.99 31.90 2qy6 n HIS 107 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2qy6 n PRO 108 N 0.32 0.35 0.00 -0.41 -0.04 -1.12 -2.64 135.00 131.46 2qy6 n PRO 108 Ca 0.26 0.08 0.00 0.00 -0.04 0.00 0.00 63.50 63.80 2qy6 n PRO 108 Cb 0.56 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 2qy6 n PRO 108 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2qy6 n GLN 109 N -1.17 1.85 -1.68 0.54 6.02 -1.26 -5.01 117.38 116.66 2qy6 n GLN 109 Ca 0.10 -1.15 -0.38 0.00 -0.01 0.00 0.00 57.00 55.55 2qy6 n GLN 109 Cb 0.10 -0.91 0.05 0.00 1.02 0.00 0.00 30.24 30.50 2qy6 n GLN 109 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2qy6 n ALA 110 N -0.33 0.86 -0.31 -1.58 0.00 -1.08 -4.91 120.51 113.16 2qy6 n ALA 110 Ca 0.00 0.07 0.16 0.00 0.00 0.00 0.00 53.44 53.66 2qy6 n ALA 110 Cb 0.25 -2.24 0.40 0.00 0.00 0.00 0.00 19.45 17.86 2qy6 n ALA 110 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2qy6 h GLN 111 N 0.92 0.61 -6.27 0.00 4.15 -1.87 -3.40 115.11 109.25 2qy6 h GLN 111 Ca -0.49 -0.04 -0.56 0.00 0.77 0.00 0.00 58.65 58.33 2qy6 h GLN 111 Cb 1.34 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 28.86 2qy6 h GLN 111 CO 0.54 0.40 1.03 -1.17 -1.93 0.00 0.00 178.83 177.71 2qy6 s LEU 112 N -9.93 4.02 0.00 -2.39 2.96 -1.25 -3.99 118.68 108.10 2qy6 s LEU 112 Ca -0.10 1.62 0.00 0.00 -0.22 0.00 0.00 54.13 55.43 2qy6 s LEU 112 Cb 0.24 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.39 2qy6 s LEU 112 CO 0.80 -1.06 0.00 0.00 -1.32 0.00 0.00 176.35 174.77 2qy6 n GLN 113 N 7.27 1.71 -4.11 1.98 1.13 -0.51 -4.94 117.38 119.91 2qy6 n GLN 113 Ca 0.16 0.00 -0.14 0.00 -1.94 0.00 0.00 57.00 55.08 2qy6 n GLN 113 Cb 0.45 -1.00 -0.11 0.00 0.11 0.00 0.00 30.24 29.69 2qy6 n GLN 113 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2qy6 s ARG 114 N -2.00 0.65 -0.10 -1.09 0.52 -0.29 -4.87 118.95 111.77 2qy6 s ARG 114 Ca 0.00 -0.90 0.04 0.00 -0.52 0.00 0.00 55.73 54.35 2qy6 s ARG 114 Cb 0.00 -0.42 0.00 0.00 0.52 0.00 0.00 34.95 35.05 2qy6 s ARG 114 CO 0.00 0.07 -0.23 -1.17 0.02 0.00 0.00 175.30 173.99 2qy6 s LEU 115 N -1.84 2.07 -0.25 2.53 2.96 0.14 -1.15 118.68 123.13 2qy6 s LEU 115 Ca -0.05 -0.55 -0.01 0.00 -0.22 0.00 0.00 54.13 53.30 2qy6 s LEU 115 Cb -0.08 -1.39 0.03 0.00 0.50 0.00 0.00 46.19 45.26 2qy6 s LEU 115 CO 0.00 0.14 -0.06 -2.28 -1.32 0.00 0.00 176.35 172.83 2qy6 s HIS 116 N 0.42 3.09 -0.22 5.38 5.65 0.12 -1.14 115.29 128.59 2qy6 s HIS 116 Ca -0.17 -1.65 -0.05 0.00 0.25 0.00 0.00 55.06 53.43 2qy6 s HIS 116 Cb -0.18 -2.05 -0.02 0.00 -1.18 0.00 0.00 32.58 29.16 2qy6 s HIS 116 CO 0.07 -0.75 0.00 0.12 -0.65 0.00 0.00 174.74 173.53 2qy6 s PHE 117 N 1.30 3.01 -0.29 3.88 5.36 0.14 -1.00 117.98 130.38 2qy6 s PHE 117 Ca -0.01 -0.66 -0.05 0.00 -0.96 0.00 0.00 56.93 55.24 2qy6 s PHE 117 Cb -0.17 -2.14 0.01 0.00 -0.34 0.00 0.00 43.02 40.38 2qy6 s PHE 117 CO -0.04 -0.42 0.05 0.42 -1.46 0.00 0.00 175.22 173.77 2qy6 s ILE 118 N 1.41 3.69 0.24 3.12 1.01 0.59 -0.60 121.20 130.65 2qy6 s ILE 118 Ca 0.05 -0.80 0.08 0.00 0.00 0.00 0.00 60.65 59.98 2qy6 s ILE 118 Cb -0.15 -2.91 -0.05 0.00 0.01 0.00 0.00 42.46 39.36 2qy6 s ILE 118 CO 0.00 0.09 -0.13 -0.55 0.00 0.00 0.00 174.94 174.35 2qy6 s SER 119 N 1.45 2.84 -0.03 3.58 0.15 0.01 -0.55 113.70 121.15 2qy6 s SER 119 Ca 0.02 -1.07 0.05 0.00 0.70 0.00 0.00 55.95 55.64 2qy6 s SER 119 Cb -0.17 -0.18 -0.01 0.00 -1.71 0.00 0.00 66.02 63.95 2qy6 s SER 119 CO 0.01 -0.18 -0.16 -0.36 1.20 0.00 0.00 173.24 173.75 2qy6 s PHE 120 N -2.89 1.55 -0.09 3.44 0.08 -1.17 0.36 117.98 119.26 2qy6 s PHE 120 Ca 0.26 -0.37 -0.04 0.00 0.12 0.00 0.00 56.93 56.90 2qy6 s PHE 120 Cb -0.00 -1.03 0.05 0.00 -0.57 0.00 0.00 43.02 41.47 2qy6 s PHE 120 CO 0.10 -0.09 0.19 -2.00 -0.10 0.00 0.00 175.22 173.32 2qy6 s GLU 121 N -0.16 0.11 -0.03 0.44 2.56 0.12 -0.82 118.70 120.92 2qy6 s GLU 121 Ca 0.01 0.51 0.04 0.00 0.00 0.00 0.00 54.97 55.53 2qy6 s GLU 121 Cb -0.09 -0.17 -0.25 0.00 2.00 0.00 0.00 34.13 35.63 2qy6 s GLU 121 CO 0.01 -0.22 0.72 -0.22 -0.56 0.00 0.00 175.26 174.99 2qy6 h LYS 122 N 7.65 0.12 -2.86 4.30 3.64 -1.84 0.53 116.57 128.11 2qy6 h LYS 122 Ca -0.31 -0.21 -0.61 0.00 -1.27 0.00 0.00 60.65 58.24 2qy6 h LYS 122 Cb 1.13 0.08 -0.41 0.00 -0.41 0.00 0.00 32.23 32.62 2qy6 h LYS 122 CO 0.30 0.86 -0.63 1.19 -2.27 0.00 0.00 179.45 178.90 2qy6 n PHE 123 N -3.28 2.74 -2.08 1.91 3.72 -1.26 -3.94 117.46 115.28 2qy6 n PHE 123 Ca -0.18 -4.16 -0.41 0.00 -0.05 0.00 0.00 57.45 52.65 2qy6 n PHE 123 Cb 1.04 -0.51 -0.02 0.00 -0.94 0.00 0.00 39.48 39.05 2qy6 n PHE 123 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2qy6 s PRO 124 N -1.43 4.29 0.62 -1.08 0.04 -1.25 -3.75 135.00 132.45 2qy6 s PRO 124 Ca 0.28 2.25 -0.17 0.00 0.04 0.00 0.00 61.00 63.40 2qy6 s PRO 124 Cb -0.00 -3.03 -0.02 0.00 0.04 0.00 0.00 34.50 31.49 2qy6 s PRO 124 CO -0.15 -0.25 1.13 -0.51 0.04 0.00 0.00 177.00 177.25 2qy6 s LEU 125 N -1.89 3.52 0.66 -3.56 1.02 -1.26 -0.73 118.68 116.43 2qy6 s LEU 125 Ca 0.50 2.11 -0.14 0.00 0.02 0.00 0.00 54.13 56.62 2qy6 s LEU 125 Cb -0.40 -4.57 -0.00 0.00 0.02 0.00 0.00 46.19 41.24 2qy6 s LEU 125 CO 0.54 -1.54 1.07 0.42 0.02 0.00 0.00 176.35 176.86 2qy6 s THR 126 N -2.08 3.66 0.24 5.49 -4.23 -1.26 -4.84 115.64 112.61 2qy6 s THR 126 Ca 0.70 0.68 -0.05 0.00 -1.18 0.00 0.00 61.69 61.84 2qy6 s THR 126 Cb -0.23 -3.25 0.21 0.00 1.34 0.00 0.00 72.50 70.57 2qy6 s THR 126 CO 0.36 -0.56 1.85 -0.09 -0.54 0.00 0.00 174.62 175.64 2qy6 h ARG 127 N -0.16 0.95 0.19 3.99 2.43 -1.95 -0.01 114.38 119.82 2qy6 h ARG 127 Ca -0.46 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 58.65 2qy6 h ARG 127 Cb 1.23 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.56 2qy6 h ARG 127 CO 0.56 0.63 -0.09 0.00 -1.51 0.00 0.00 179.97 179.56 2qy6 h ALA 128 N 1.40 -0.25 -0.71 2.80 0.00 -1.99 0.73 119.26 121.24 2qy6 h ALA 128 Ca 0.37 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.25 2qy6 h ALA 128 Cb 0.16 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.99 2qy6 h ALA 128 CO -0.17 -0.59 0.40 -0.44 0.00 0.00 0.00 179.25 178.45 2qy6 h ASP 129 N -0.35 0.60 -0.50 0.00 3.32 -1.91 -1.28 116.42 116.30 2qy6 h ASP 129 Ca -0.03 0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.07 2qy6 h ASP 129 Cb 0.27 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 2qy6 h ASP 129 CO 0.04 0.38 0.30 0.25 -1.72 0.00 0.00 179.24 178.49 2qy6 h LEU 130 N 0.73 0.49 -0.95 1.55 5.85 -0.74 -0.83 115.31 121.41 2qy6 h LEU 130 Ca 0.32 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 59.00 2qy6 h LEU 130 Cb 0.21 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 2qy6 h LEU 130 CO -0.19 0.35 0.26 0.00 -0.34 0.00 0.00 178.44 178.52 2qy6 h ALA 131 N 1.21 1.16 0.03 1.25 0.00 -0.40 -1.66 119.26 120.87 2qy6 h ALA 131 Ca 0.20 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2qy6 h ALA 131 Cb 0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 2qy6 h ALA 131 CO -0.08 0.60 -0.02 -0.07 0.00 0.00 0.00 179.25 179.67 2qy6 h LEU 132 N 1.00 -0.06 -0.40 0.00 4.07 -0.94 -2.97 115.31 116.01 2qy6 h LEU 132 Ca 0.23 0.00 0.06 0.00 0.08 0.00 0.00 57.88 58.25 2qy6 h LEU 132 Cb 0.21 0.02 -0.05 0.00 1.08 0.00 0.00 40.66 41.92 2qy6 h LEU 132 CO -0.02 -0.04 0.09 0.00 -1.08 0.00 0.00 178.44 177.40 2qy6 h ALA 133 N 0.91 0.44 0.00 1.53 0.00 -0.63 -1.39 119.26 120.13 2qy6 h ALA 133 Ca -0.00 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2qy6 h ALA 133 Cb 0.05 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2qy6 h ALA 133 CO -0.00 -0.31 -0.03 0.45 0.00 0.00 0.00 179.25 179.37 2qy6 h HIS 134 N 0.23 0.00 -0.21 0.00 3.86 -1.32 -2.39 115.15 115.32 2qy6 h HIS 134 Ca 0.19 0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.46 2qy6 h HIS 134 Cb 0.22 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.68 2qy6 h HIS 134 CO -0.19 0.03 0.29 1.96 0.86 0.00 0.00 177.93 180.88 2qy6 h GLN 135 N 0.00 0.00 0.00 2.45 4.20 -1.08 -0.70 115.11 119.97 2qy6 h GLN 135 Ca -0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 2qy6 h GLN 135 Cb 0.12 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.90 2qy6 h GLN 135 CO 0.00 0.00 -0.09 0.45 -0.67 0.00 0.00 178.83 178.52 2qy6 h HIS 136 N 0.00 0.00 -2.61 2.96 3.86 -1.57 -3.35 115.15 114.44 2qy6 h HIS 136 Ca 0.10 0.00 -0.60 0.00 -1.16 0.00 0.00 60.37 58.71 2qy6 h HIS 136 Cb 0.67 0.00 -0.41 0.00 1.06 0.00 0.00 27.41 28.73 2qy6 h HIS 136 CO 0.00 0.09 -0.72 0.91 0.86 0.00 0.00 177.93 179.07 2qy6 n TRP 137 N -3.65 2.08 -0.19 2.45 7.02 -0.27 -4.93 117.44 119.94 2qy6 n TRP 137 Ca -0.02 -3.99 0.25 0.00 -1.02 0.00 0.00 57.50 52.73 2qy6 n TRP 137 Cb 0.20 -0.39 0.65 0.00 -2.42 0.00 0.00 31.31 29.35 2qy6 n TRP 137 CO 0.00 0.00 0.00 -1.00 -2.02 0.00 0.00 177.69 174.67 2qy6 h PRO 138 N 5.01 0.13 0.00 -0.99 0.13 -1.76 -0.14 132.00 134.38 2qy6 h PRO 138 Ca 0.18 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2qy6 h PRO 138 Cb 0.78 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.88 2qy6 h PRO 138 CO 0.64 0.09 0.00 1.05 -0.23 0.00 0.00 178.00 179.55 2qy6 h GLU 139 N 0.13 0.00 -0.01 0.86 4.11 -1.94 -2.47 114.58 115.27 2qy6 h GLU 139 Ca 0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.86 2qy6 h GLU 139 Cb 1.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.75 2qy6 h GLU 139 CO -0.07 0.00 -0.57 1.28 0.07 0.00 0.00 179.01 179.72 2qy6 n LEU 140 N -2.93 1.51 -0.33 3.06 4.77 -0.07 -4.66 117.00 118.35 2qy6 n LEU 140 Ca -0.00 -0.56 0.18 0.00 -0.03 0.00 0.00 56.01 55.60 2qy6 n LEU 140 Cb 0.24 -0.04 0.36 0.00 -2.33 0.00 0.00 43.42 41.65 2qy6 n LEU 140 CO 0.24 0.30 0.90 0.00 -1.33 0.00 0.00 177.39 177.50 2qy6 h ALA 141 N 3.58 1.43 -0.95 -1.18 0.00 -1.38 0.20 119.26 120.96 2qy6 h ALA 141 Ca 0.00 0.30 0.07 0.00 0.00 0.00 0.00 54.91 55.28 2qy6 h ALA 141 Cb 0.64 0.47 -0.07 0.00 0.00 0.00 0.00 17.79 18.83 2qy6 h ALA 141 CO 0.00 -0.64 0.60 -1.35 0.00 0.00 0.00 179.25 177.86 2qy6 h PRO 142 N 0.06 1.03 0.10 0.00 0.11 -1.83 0.56 132.00 132.03 2qy6 h PRO 142 Ca 0.65 -0.06 -0.23 0.00 0.11 0.00 0.00 66.00 66.46 2qy6 h PRO 142 Cb 1.44 -0.23 0.02 0.00 0.11 0.00 0.00 31.00 32.34 2qy6 h PRO 142 CO -0.82 0.68 -0.98 -1.49 -0.21 0.00 0.00 178.00 175.17 2qy6 h TRP 143 N 1.06 0.79 -0.78 0.65 6.55 -1.35 -3.34 115.95 119.53 2qy6 h TRP 143 Ca 0.42 -0.50 0.09 0.00 0.95 0.00 0.00 58.89 59.85 2qy6 h TRP 143 Cb 0.23 -0.06 -0.07 0.00 -0.86 0.00 0.00 29.16 28.40 2qy6 h TRP 143 CO -0.02 1.36 0.43 0.00 -1.05 0.00 0.00 178.44 179.16 2qy6 h ALA 144 N 0.23 1.09 0.00 1.49 0.00 -0.49 -1.73 119.26 119.85 2qy6 h ALA 144 Ca -0.15 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 2qy6 h ALA 144 Cb 1.71 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 2qy6 h ALA 144 CO 0.19 0.06 -0.27 0.93 0.00 0.00 0.00 179.25 180.16 2qy6 h GLU 145 N 0.73 0.00 0.04 0.00 5.08 -1.03 -1.99 114.58 117.41 2qy6 h GLU 145 Ca 0.37 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.46 2qy6 h GLU 145 Cb 0.34 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.61 2qy6 h GLU 145 CO -0.24 0.27 -1.09 1.96 -1.00 0.00 0.00 179.01 178.91 2qy6 h GLN 146 N 0.00 0.66 0.21 2.33 4.20 -1.45 -1.45 115.11 119.61 2qy6 h GLN 146 Ca -0.00 -0.77 -0.01 0.00 0.06 0.00 0.00 58.65 57.93 2qy6 h GLN 146 Cb 0.58 0.23 -0.00 0.00 0.30 0.00 0.00 27.48 28.59 2qy6 h GLN 146 CO 0.04 1.34 -0.13 1.25 -0.67 0.00 0.00 178.83 180.65 2qy6 h LEU 147 N 0.33 -0.32 -0.65 1.46 5.85 -1.33 -3.02 115.31 117.62 2qy6 h LEU 147 Ca -0.15 0.02 0.13 0.00 0.84 0.00 0.00 57.88 58.72 2qy6 h LEU 147 Cb 1.75 0.09 -0.10 0.00 0.37 0.00 0.00 40.66 42.78 2qy6 h LEU 147 CO 0.21 -0.21 0.12 1.56 -0.34 0.00 0.00 178.44 179.78 2qy6 h GLN 148 N -0.33 0.22 -0.47 1.25 4.20 -1.38 -1.98 115.11 116.63 2qy6 h GLN 148 Ca -0.02 -0.01 0.09 0.00 0.06 0.00 0.00 58.65 58.76 2qy6 h GLN 148 Cb 0.27 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.98 2qy6 h GLN 148 CO 0.02 0.15 0.32 0.00 -0.67 0.00 0.00 178.83 178.65 2qy6 h ALA 149 N 1.54 2.10 -0.27 3.87 0.00 -1.15 -2.17 119.26 123.18 2qy6 h ALA 149 Ca 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2qy6 h ALA 149 Cb 0.56 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2qy6 h ALA 149 CO -0.47 -0.20 0.00 1.04 0.00 0.00 0.00 179.25 179.62 2qy6 n GLN 150 N -4.46 2.95 -2.07 0.00 6.02 -0.85 -5.03 117.38 113.93 2qy6 n GLN 150 Ca 0.07 -2.77 -0.42 0.00 -0.01 0.00 0.00 57.00 53.87 2qy6 n GLN 150 Cb 0.35 -1.79 -0.03 0.00 1.02 0.00 0.00 30.24 29.79 2qy6 n GLN 150 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 2qy6 s TRP 151 N -2.64 2.40 0.64 1.08 -0.11 -0.80 -4.96 118.94 114.54 2qy6 s TRP 151 Ca 0.40 0.45 -0.12 0.00 1.22 0.00 0.00 56.10 58.06 2qy6 s TRP 151 Cb 0.32 -3.83 -0.02 0.00 -1.50 0.00 0.00 33.47 28.43 2qy6 s TRP 151 CO 0.10 -3.34 1.04 -1.25 -4.62 0.00 0.00 176.95 168.88 2qy6 s PRO 152 N 3.16 3.32 0.47 5.86 0.04 -1.26 -5.02 135.00 141.56 2qy6 s PRO 152 Ca 0.70 0.89 -0.22 0.00 0.04 0.00 0.00 61.00 62.41 2qy6 s PRO 152 Cb -0.34 -2.04 -0.08 0.00 0.04 0.00 0.00 34.50 32.08 2qy6 s PRO 152 CO 0.29 -0.79 1.09 1.41 0.04 0.00 0.00 177.00 179.03 2qy6 s MET 153 N -4.94 3.78 -1.35 4.56 1.75 -1.26 -4.91 119.30 116.92 2qy6 s MET 153 Ca 0.57 1.55 -0.16 0.00 -1.25 0.00 0.00 55.69 56.40 2qy6 s MET 153 Cb -0.13 -2.25 0.04 0.00 2.84 0.00 0.00 34.83 35.34 2qy6 s MET 153 CO 0.51 -0.48 1.98 -0.35 -0.65 0.00 0.00 175.02 176.03 2qy6 n PRO 154 N -0.72 2.93 -4.13 4.11 -0.04 -1.26 -4.90 135.00 130.99 2qy6 n PRO 154 Ca 0.08 -2.89 -0.30 0.00 -0.04 0.00 0.00 63.50 60.35 2qy6 n PRO 154 Cb 0.50 -3.39 -0.08 0.00 -0.04 0.00 0.00 33.50 30.50 2qy6 n PRO 154 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2qy6 s LEU 155 N 3.38 3.47 0.56 1.53 1.43 -1.26 -4.85 118.68 122.93 2qy6 s LEU 155 Ca 0.51 -0.17 -0.20 0.00 -1.03 0.00 0.00 54.13 53.23 2qy6 s LEU 155 Cb 0.09 -2.19 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 2qy6 s LEU 155 CO 0.00 0.18 1.27 -2.84 0.23 0.00 0.00 176.35 175.19 2qy6 s PRO 156 N -2.29 3.09 0.00 1.29 0.02 -1.26 -4.62 135.00 131.23 2qy6 s PRO 156 Ca 0.26 2.01 0.00 0.00 0.02 0.00 0.00 61.00 63.29 2qy6 s PRO 156 Cb -0.12 -2.12 0.00 0.00 0.02 0.00 0.00 34.50 32.29 2qy6 s PRO 156 CO 0.18 -1.16 0.00 0.41 -0.33 0.00 0.00 177.00 176.10 2qy6 n GLY 157 N 0.65 -0.42 3.67 0.52 0.00 -0.48 -4.92 105.19 104.20 2qy6 n GLY 157 Ca 0.12 -2.16 -0.38 0.00 0.00 0.00 0.00 46.02 43.59 2qy6 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qy6 s HIS 159 N 1.39 3.18 -0.32 0.00 3.76 -0.33 -4.97 115.29 117.99 2qy6 s HIS 159 Ca 0.20 -1.45 -0.14 0.00 -0.15 0.00 0.00 55.06 53.51 2qy6 s HIS 159 Cb -0.15 -2.17 -0.02 0.00 1.11 0.00 0.00 32.58 31.35 2qy6 s HIS 159 CO 0.08 -0.71 0.32 0.50 -0.85 0.00 0.00 174.74 174.09 2qy6 s ARG 160 N 1.37 3.67 -0.25 1.40 3.52 -1.26 -1.22 118.95 126.17 2qy6 s ARG 160 Ca -0.01 -0.37 -0.09 0.00 -0.13 0.00 0.00 55.73 55.12 2qy6 s ARG 160 Cb -0.18 -3.77 -0.04 0.00 -1.56 0.00 0.00 34.95 29.40 2qy6 s ARG 160 CO -0.00 -0.44 0.13 -0.51 -0.81 0.00 0.00 175.30 173.67 2qy6 s LEU 161 N 1.95 3.85 -0.38 -0.88 1.02 0.48 -5.00 118.68 119.71 2qy6 s LEU 161 Ca 0.11 -0.03 -0.16 0.00 0.02 0.00 0.00 54.13 54.07 2qy6 s LEU 161 Cb -0.16 -2.04 0.01 0.00 0.02 0.00 0.00 46.19 44.01 2qy6 s LEU 161 CO 0.11 0.01 0.40 -0.76 0.02 0.00 0.00 176.35 176.14 2qy6 s LEU 162 N 1.37 4.66 0.07 1.79 1.43 -1.26 -1.48 118.68 125.26 2qy6 s LEU 162 Ca 0.06 -0.45 0.09 0.00 -1.03 0.00 0.00 54.13 52.81 2qy6 s LEU 162 Cb -0.15 -2.37 -0.03 0.00 0.03 0.00 0.00 46.19 43.67 2qy6 s LEU 162 CO 0.06 -0.46 -0.25 -0.76 0.23 0.00 0.00 176.35 175.17 2qy6 s LEU 163 N 2.08 2.32 0.00 1.79 1.43 -0.18 -5.05 118.68 121.08 2qy6 s LEU 163 Ca 0.12 -0.61 0.00 0.00 -1.03 0.00 0.00 54.13 52.61 2qy6 s LEU 163 Cb -0.17 -1.33 0.00 0.00 0.03 0.00 0.00 46.19 44.73 2qy6 s LEU 163 CO 0.13 0.23 0.00 -0.67 0.23 0.00 0.00 176.35 176.27 2qy6 n ASP 164 N 1.41 0.00 0.00 2.29 -0.08 -1.26 -2.69 116.55 116.22 2qy6 n ASP 164 Ca -0.17 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.11 2qy6 n ASP 164 Cb 0.52 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.98 2qy6 n ASP 164 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2qy6 n ARG 167 N 0.00 0.00 -4.02 -0.67 5.12 -1.26 -5.08 116.66 110.76 2qy6 n ARG 167 Ca 0.00 0.00 -0.30 0.00 -1.93 0.00 0.00 57.85 55.62 2qy6 n ARG 167 Cb 0.00 0.00 -0.16 0.00 -1.16 0.00 0.00 32.46 31.14 2qy6 n ARG 167 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2qy6 s VAL 168 N -0.42 1.59 -0.11 1.55 1.01 -1.10 0.26 120.40 123.18 2qy6 s VAL 168 Ca 0.00 -0.69 0.02 0.00 0.00 0.00 0.00 61.98 61.32 2qy6 s VAL 168 Cb 0.00 -1.51 -0.01 0.00 0.00 0.00 0.00 36.38 34.86 2qy6 s VAL 168 CO 0.00 0.42 -0.19 -0.89 0.00 0.00 0.00 175.10 174.44 2qy6 s THR 169 N 1.47 2.54 -0.26 3.92 2.01 -0.29 -1.01 115.64 124.01 2qy6 s THR 169 Ca 0.04 -0.85 -0.03 0.00 0.31 0.00 0.00 61.69 61.16 2qy6 s THR 169 Cb -0.13 -2.01 0.02 0.00 0.01 0.00 0.00 72.50 70.39 2qy6 s THR 169 CO -0.10 0.55 -0.02 -0.22 -0.69 0.00 0.00 174.62 174.13 2qy6 s LEU 170 N 0.25 3.42 -0.47 4.42 2.96 -0.55 0.25 118.68 128.96 2qy6 s LEU 170 Ca -0.13 -0.88 -0.17 0.00 -0.22 0.00 0.00 54.13 52.73 2qy6 s LEU 170 Cb -0.16 -1.72 0.05 0.00 0.50 0.00 0.00 46.19 44.86 2qy6 s LEU 170 CO 0.07 -0.16 0.51 -1.81 -1.32 0.00 0.00 176.35 173.64 2qy6 s ASP 171 N 1.36 6.19 -0.43 3.68 1.01 0.23 -0.39 116.67 128.32 2qy6 s ASP 171 Ca 0.00 -0.99 -0.16 0.00 0.71 0.00 0.00 52.55 52.11 2qy6 s ASP 171 Cb -0.17 -2.24 0.03 0.00 1.01 0.00 0.00 42.92 41.55 2qy6 s ASP 171 CO -0.02 -0.74 0.40 -0.22 0.21 0.00 0.00 175.17 174.80 2qy6 s LEU 172 N 2.19 5.05 -0.25 1.23 2.96 -0.36 -0.81 118.68 128.69 2qy6 s LEU 172 Ca 0.11 -0.85 -0.17 0.00 -0.22 0.00 0.00 54.13 53.00 2qy6 s LEU 172 Cb -0.20 -2.30 -0.03 0.00 0.50 0.00 0.00 46.19 44.16 2qy6 s LEU 172 CO 0.11 -0.57 0.45 0.26 -1.32 0.00 0.00 176.35 175.27 2qy6 s TRP 173 N 1.97 3.29 -0.18 5.38 0.52 0.16 -1.19 118.94 128.88 2qy6 s TRP 173 Ca 0.09 0.57 -0.16 0.00 0.02 0.00 0.00 56.10 56.62 2qy6 s TRP 173 Cb -0.19 -2.63 -0.04 0.00 -1.15 0.00 0.00 33.47 29.46 2qy6 s TRP 173 CO 0.11 -0.20 0.41 -0.06 0.02 0.00 0.00 176.95 177.23 2qy6 s PHE 174 N 1.99 3.41 -4.31 -1.98 0.08 -0.56 -0.70 117.98 115.91 2qy6 s PHE 174 Ca 0.19 0.67 0.00 0.00 0.12 0.00 0.00 56.93 57.91 2qy6 s PHE 174 Cb -0.15 -2.51 0.00 0.00 -0.57 0.00 0.00 43.02 39.78 2qy6 s PHE 174 CO 0.09 0.05 0.00 0.41 -0.10 0.00 0.00 175.22 175.67 2qy6 n GLY 175 N 3.72 0.96 3.61 4.36 0.00 0.18 -1.38 105.19 116.63 2qy6 n GLY 175 Ca -0.08 -1.99 -0.43 0.00 0.00 0.00 0.00 46.02 43.53 2qy6 n GLY 175 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qy6 s ASP 176 N -1.69 6.72 0.29 1.61 -1.08 -1.26 -3.30 116.67 117.95 2qy6 s ASP 176 Ca 0.00 0.67 0.02 0.00 -0.52 0.00 0.00 52.55 52.72 2qy6 s ASP 176 Cb 0.00 -2.47 0.56 0.00 -1.46 0.00 0.00 42.92 39.56 2qy6 s ASP 176 CO 0.00 -0.82 1.85 -0.29 0.52 0.00 0.00 175.17 176.42 2qy6 h ILE 177 N 5.77 0.93 -0.15 4.11 2.10 -1.94 0.88 117.51 129.21 2qy6 h ILE 177 Ca -0.23 -0.34 -0.00 0.00 1.08 0.00 0.00 64.86 65.37 2qy6 h ILE 177 Cb 1.08 -0.14 -0.01 0.00 -1.09 0.00 0.00 36.82 36.66 2qy6 h ILE 177 CO 0.97 0.18 0.08 0.78 -1.08 0.00 0.00 178.15 179.09 2qy6 h ASN 178 N 0.99 0.17 0.16 2.19 2.35 -1.92 -0.47 115.58 119.05 2qy6 h ASN 178 Ca 0.49 -0.01 -0.28 0.00 -0.55 0.00 0.00 56.30 55.95 2qy6 h ASN 178 Cb 0.47 -0.04 0.01 0.00 0.05 0.00 0.00 38.32 38.81 2qy6 h ASN 178 CO -0.25 0.14 -1.34 -0.33 -1.65 0.00 0.00 177.43 174.00 2qy6 h GLU 179 N 0.20 0.35 0.04 0.81 4.39 -1.73 -3.41 114.58 115.22 2qy6 h GLU 179 Ca 0.05 -0.59 -0.22 0.00 0.34 0.00 0.00 59.36 58.94 2qy6 h GLU 179 Cb 0.00 0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 2qy6 h GLU 179 CO -0.01 1.28 -1.00 -0.07 -1.16 0.00 0.00 179.01 178.05 2qy6 h LEU 180 N -0.15 0.21 -2.02 1.33 3.38 -0.52 -3.34 115.31 114.19 2qy6 h LEU 180 Ca -0.26 -0.20 0.08 0.00 0.09 0.00 0.00 57.88 57.59 2qy6 h LEU 180 Cb 1.88 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 42.55 2qy6 h LEU 180 CO 0.15 1.09 0.38 -0.29 0.09 0.00 0.00 178.44 179.85 2qy6 h ILE 181 N 0.06 0.29 0.00 1.22 6.09 -1.32 0.25 117.51 124.11 2qy6 h ILE 181 Ca -0.06 0.00 -0.02 0.00 -1.37 0.00 0.00 64.86 63.42 2qy6 h ILE 181 Cb 1.70 0.68 -0.00 0.00 0.47 0.00 0.00 36.82 39.67 2qy6 h ILE 181 CO 0.15 0.00 -0.07 0.77 -3.07 0.00 0.00 178.15 175.93 2qy6 h SER 182 N 0.00 0.00 0.05 2.19 4.64 -1.84 -2.21 113.55 116.38 2qy6 h SER 182 Ca 0.13 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.44 2qy6 h SER 182 Cb 0.89 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.98 2qy6 h SER 182 CO -0.00 0.07 -0.04 1.56 -0.87 0.00 0.00 176.83 177.56 2qy6 h GLN 183 N 0.00 0.00 -5.68 4.77 1.08 -0.76 -3.27 115.11 111.26 2qy6 h GLN 183 Ca -0.00 0.00 -0.68 0.00 -1.45 0.00 0.00 58.65 56.52 2qy6 h GLN 183 Cb 0.39 0.00 -0.10 0.00 -0.05 0.00 0.00 27.48 27.72 2qy6 h GLN 183 CO 0.01 0.04 1.92 -0.51 -0.95 0.00 0.00 178.83 179.33 2qy6 s LEU 184 N -8.56 4.04 0.00 1.46 1.02 -0.83 -4.97 118.68 110.84 2qy6 s LEU 184 Ca -0.05 -2.39 0.00 0.00 0.02 0.00 0.00 54.13 51.71 2qy6 s LEU 184 Cb 0.16 -2.54 0.00 0.00 0.02 0.00 0.00 46.19 43.83 2qy6 s LEU 184 CO 0.64 -1.14 0.00 -0.90 0.02 0.00 0.00 176.35 174.97 2qy6 n ASP 185 N 7.94 -0.07 0.15 2.29 5.75 -1.23 -4.77 116.55 126.60 2qy6 n ASP 185 Ca 0.44 -0.19 0.12 0.00 -0.01 0.00 0.00 54.79 55.15 2qy6 n ASP 185 Cb 0.46 0.00 0.55 0.00 -1.03 0.00 0.00 41.12 41.10 2qy6 n ASP 185 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 2qy6 h ASP 186 N -0.07 0.00 0.93 -1.12 3.32 -1.93 -2.11 116.42 115.44 2qy6 h ASP 186 Ca 0.00 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 2qy6 h ASP 186 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 2qy6 h ASP 186 CO 0.00 0.00 -0.53 0.77 -1.72 0.00 0.00 179.24 177.76 2qy6 h SER 187 N 0.00 0.00 -0.01 6.45 4.64 -1.98 -2.84 113.55 119.80 2qy6 h SER 187 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qy6 h SER 187 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 2qy6 h SER 187 CO 0.00 0.53 -0.01 0.18 -0.87 0.00 0.00 176.83 176.66 2qy6 n LEU 188 N -3.51 1.78 -4.68 5.97 4.32 -0.80 -4.93 117.00 115.15 2qy6 n LEU 188 Ca -0.00 -0.59 -0.44 0.00 -0.02 0.00 0.00 56.01 54.96 2qy6 n LEU 188 Cb 0.63 -0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.41 2qy6 n LEU 188 CO 0.40 0.30 0.93 0.59 -1.22 0.00 0.00 177.39 178.39 2qy6 n ASN 189 N 0.38 2.64 -3.04 -1.43 4.13 -1.08 -2.33 115.26 114.54 2qy6 n ASN 189 Ca 0.18 1.17 -0.21 0.00 1.68 0.00 0.00 54.58 57.40 2qy6 n ASN 189 Cb 0.40 -1.44 0.01 0.00 -1.54 0.00 0.00 39.78 37.21 2qy6 n ASN 189 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2qy6 n GLN 190 N 1.31 -3.75 0.00 3.52 6.02 -0.75 -4.89 117.38 118.84 2qy6 n GLN 190 Ca 0.09 0.70 0.05 0.00 -0.01 0.00 0.00 57.00 57.82 2qy6 n GLN 190 Cb 0.33 -5.46 -0.05 0.00 1.02 0.00 0.00 30.24 26.08 2qy6 n GLN 190 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2qy6 n LYS 191 N -3.69 3.73 -3.24 -1.09 4.76 -0.51 -3.86 118.16 114.25 2qy6 n LYS 191 Ca -0.09 -0.01 -0.39 0.00 -2.87 0.00 0.00 58.31 54.95 2qy6 n LYS 191 Cb 0.59 -0.97 -0.07 0.00 -1.84 0.00 0.00 35.03 32.75 2qy6 n LYS 191 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2qy6 s VAL 192 N -1.92 5.09 0.04 -0.18 1.01 0.07 -4.61 120.40 119.91 2qy6 s VAL 192 Ca 0.04 0.91 -0.01 0.00 0.00 0.00 0.00 61.98 62.92 2qy6 s VAL 192 Cb 0.07 -3.83 -0.27 0.00 0.00 0.00 0.00 36.38 32.36 2qy6 s VAL 192 CO 0.40 0.13 1.01 0.44 0.00 0.00 0.00 175.10 177.09 2qy6 h ASP 193 N 7.72 0.32 -4.06 3.32 3.32 -1.27 -1.27 116.42 124.50 2qy6 h ASP 193 Ca -0.31 -0.39 -0.20 0.00 0.02 0.00 0.00 57.03 56.14 2qy6 h ASP 193 Cb 1.15 -0.10 -0.26 0.00 0.22 0.00 0.00 39.33 40.33 2qy6 h ASP 193 CO 0.73 1.32 -0.66 0.00 -1.72 0.00 0.00 179.24 178.91 2qy6 s ALA 194 N -2.64 -0.08 -0.21 3.45 0.00 -1.07 -1.03 121.76 120.17 2qy6 s ALA 194 Ca -0.05 -0.03 -0.07 0.00 0.00 0.00 0.00 51.96 51.81 2qy6 s ALA 194 Cb 0.07 -0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 2qy6 s ALA 194 CO 0.86 -0.06 0.05 -1.58 0.00 0.00 0.00 175.76 175.03 2qy6 s TRP 195 N -0.35 3.13 -0.70 0.00 0.52 0.77 -1.52 118.94 120.79 2qy6 s TRP 195 Ca -0.04 -0.23 -0.19 0.00 0.02 0.00 0.00 56.10 55.66 2qy6 s TRP 195 Cb -0.03 -2.14 0.12 0.00 -1.15 0.00 0.00 33.47 30.27 2qy6 s TRP 195 CO -0.00 -0.14 0.82 -0.06 0.02 0.00 0.00 176.95 177.59 2qy6 s PHE 196 N 1.02 3.10 -1.00 -1.98 0.40 0.91 -2.03 117.98 118.39 2qy6 s PHE 196 Ca 0.03 -1.15 -0.23 0.00 -0.60 0.00 0.00 56.93 54.98 2qy6 s PHE 196 Cb -0.14 -4.07 0.04 0.00 0.51 0.00 0.00 43.02 39.37 2qy6 s PHE 196 CO 0.03 -1.32 1.47 -1.17 0.70 0.00 0.00 175.22 174.92 2qy6 s LEU 197 N 2.46 3.47 0.19 -0.37 2.96 -0.45 -1.70 118.68 125.24 2qy6 s LEU 197 Ca 0.17 -1.37 0.03 0.00 -0.22 0.00 0.00 54.13 52.75 2qy6 s LEU 197 Cb -0.18 -2.57 -0.05 0.00 0.50 0.00 0.00 46.19 43.89 2qy6 s LEU 197 CO 0.01 -1.58 -0.03 -0.62 -1.32 0.00 0.00 176.35 172.81 2qy6 s ASP 198 N 5.07 1.66 0.00 3.68 2.15 -1.26 -4.31 116.67 123.66 2qy6 s ASP 198 Ca 0.47 -1.15 0.00 0.00 0.43 0.00 0.00 52.55 52.30 2qy6 s ASP 198 Cb -0.01 0.03 0.00 0.00 -0.30 0.00 0.00 42.92 42.65 2qy6 s ASP 198 CO -0.08 -0.47 0.00 0.61 -0.17 0.00 0.00 175.17 175.05 2qy6 n GLY 199 N -0.31 0.21 3.81 2.66 0.00 -1.26 -2.55 105.19 107.75 2qy6 n GLY 199 Ca -0.07 -1.33 -0.34 0.00 0.00 0.00 0.00 46.02 44.28 2qy6 n GLY 199 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qy6 s PHE 200 N -3.62 3.27 0.73 1.61 0.08 -1.26 -5.01 117.98 113.79 2qy6 s PHE 200 Ca 0.00 1.62 -0.16 0.00 0.12 0.00 0.00 56.93 58.52 2qy6 s PHE 200 Cb 0.00 -2.94 0.00 0.00 -0.57 0.00 0.00 43.02 39.51 2qy6 s PHE 200 CO 0.00 -0.31 0.87 0.00 -0.10 0.00 0.00 175.22 175.68 2qy6 n ALA 201 N -0.53 -0.59 -0.27 5.36 0.00 -1.26 -4.42 120.51 118.80 2qy6 n ALA 201 Ca 0.07 -0.22 0.28 0.00 0.00 0.00 0.00 53.44 53.57 2qy6 n ALA 201 Cb 0.53 -2.06 0.65 0.00 0.00 0.00 0.00 19.45 18.58 2qy6 n ALA 201 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2qy6 h PRO 202 N -0.37 0.14 0.00 0.00 0.11 -1.95 0.19 132.00 130.13 2qy6 h PRO 202 Ca -0.47 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 2qy6 h PRO 202 Cb 1.33 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.41 2qy6 h PRO 202 CO 0.45 0.09 -0.18 0.00 -0.21 0.00 0.00 178.00 178.16 2qy6 h ALA 203 N 1.53 1.01 0.01 -0.75 0.00 -1.98 -2.75 119.26 116.33 2qy6 h ALA 203 Ca 0.52 -0.16 -0.36 0.00 0.00 0.00 0.00 54.91 54.91 2qy6 h ALA 203 Cb 1.78 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 19.48 2qy6 h ALA 203 CO -0.10 0.22 -2.29 1.63 0.00 0.00 0.00 179.25 178.71 2qy6 n LYS 204 N -3.32 0.68 -3.22 0.00 4.76 0.51 -4.66 118.16 112.91 2qy6 n LYS 204 Ca 0.00 0.08 -0.24 0.00 -2.87 0.00 0.00 58.31 55.28 2qy6 n LYS 204 Cb 0.42 -1.57 -0.07 0.00 -1.84 0.00 0.00 35.03 31.97 2qy6 n LYS 204 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2qy6 n ASN 205 N -2.92 0.56 0.26 4.39 4.05 -0.20 -4.87 115.26 116.53 2qy6 n ASN 205 Ca -0.33 -2.77 0.09 0.00 0.45 0.00 0.00 54.58 52.01 2qy6 n ASN 205 Cb 1.11 -0.64 0.66 0.00 1.23 0.00 0.00 39.78 42.14 2qy6 n ASN 205 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 2qy6 h PRO 206 N 4.02 0.00 0.00 1.20 0.13 -1.71 -2.86 132.00 132.78 2qy6 h PRO 206 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 2qy6 h PRO 206 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 2qy6 h PRO 206 CO 0.50 0.01 0.00 -0.44 -0.23 0.00 0.00 178.00 177.84 2qy6 h ASP 207 N 0.00 0.00 0.17 1.44 3.32 -1.94 -2.68 116.42 116.73 2qy6 h ASP 207 Ca -0.00 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.87 2qy6 h ASP 207 Cb 0.02 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.56 2qy6 h ASP 207 CO 0.00 0.00 -0.71 -0.03 -1.72 0.00 0.00 179.24 176.79 2qy6 h MET 208 N 0.00 0.48 -3.36 3.56 4.05 -1.91 -3.40 114.93 114.35 2qy6 h MET 208 Ca 0.00 -0.37 -0.77 0.00 -0.28 0.00 0.00 59.70 58.28 2qy6 h MET 208 Cb 0.28 0.07 -0.18 0.00 -0.80 0.00 0.00 31.60 30.97 2qy6 h MET 208 CO 0.00 1.00 1.77 0.91 0.23 0.00 0.00 176.91 180.82 2qy6 n TRP 209 N -3.87 2.76 -4.23 1.39 7.02 -1.01 -4.81 117.44 114.69 2qy6 n TRP 209 Ca -0.04 -2.73 -0.23 0.00 -1.02 0.00 0.00 57.50 53.47 2qy6 n TRP 209 Cb 0.69 -1.79 -0.07 0.00 -2.42 0.00 0.00 31.31 27.72 2qy6 n TRP 209 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 2qy6 s THR 210 N -0.33 3.48 0.32 -0.99 -4.23 -1.26 -5.02 115.64 107.61 2qy6 s THR 210 Ca 0.38 -1.80 0.01 0.00 -1.18 0.00 0.00 61.69 59.10 2qy6 s THR 210 Cb 0.09 -2.95 0.21 0.00 1.34 0.00 0.00 72.50 71.19 2qy6 s THR 210 CO 0.03 -0.33 1.92 -0.61 -0.54 0.00 0.00 174.62 175.09 2qy6 h GLN 211 N 1.76 0.82 -0.76 3.99 5.75 -1.95 -1.94 115.11 122.77 2qy6 h GLN 211 Ca -0.45 -0.10 0.13 0.00 -0.15 0.00 0.00 58.65 58.08 2qy6 h GLN 211 Cb 1.25 -0.16 -0.09 0.00 1.07 0.00 0.00 27.48 29.56 2qy6 h GLN 211 CO 0.61 0.64 0.35 -0.97 -2.65 0.00 0.00 178.83 176.81 2qy6 h ASN 212 N 0.82 0.39 -0.05 -0.69 -1.24 -1.96 0.80 115.58 113.65 2qy6 h ASN 212 Ca 0.20 0.09 -0.03 0.00 0.71 0.00 0.00 56.30 57.27 2qy6 h ASN 212 Cb 0.10 0.04 -0.00 0.00 0.73 0.00 0.00 38.32 39.18 2qy6 h ASN 212 CO -0.03 0.18 -0.09 0.25 -1.29 0.00 0.00 177.43 176.46 2qy6 h LEU 213 N 0.53 0.17 -0.54 0.34 5.85 -1.70 -2.41 115.31 117.55 2qy6 h LEU 213 Ca 0.41 -0.55 0.08 0.00 0.84 0.00 0.00 57.88 58.66 2qy6 h LEU 213 Cb 0.56 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.47 2qy6 h LEU 213 CO -0.35 0.68 0.18 -0.26 -0.34 0.00 0.00 178.44 178.35 2qy6 h PHE 214 N -0.34 0.32 -0.28 1.25 0.04 -0.99 -0.85 116.94 116.08 2qy6 h PHE 214 Ca 0.00 0.03 -0.07 0.00 2.80 0.00 0.00 57.97 60.73 2qy6 h PHE 214 Cb 0.65 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.72 2qy6 h PHE 214 CO 0.11 0.08 -0.13 -0.91 -0.60 0.00 0.00 178.31 176.86 2qy6 h ASN 215 N 0.36 0.47 -0.08 2.17 2.35 -0.78 -1.60 115.58 118.46 2qy6 h ASN 215 Ca 0.27 -0.12 -0.20 0.00 -0.55 0.00 0.00 56.30 55.70 2qy6 h ASN 215 Cb 0.32 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.57 2qy6 h ASN 215 CO -0.29 0.63 -0.70 0.00 -1.65 0.00 0.00 177.43 175.43 2qy6 h ALA 216 N 1.42 0.44 -0.70 -0.83 0.00 -0.88 -2.18 119.26 116.53 2qy6 h ALA 216 Ca 0.08 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 2qy6 h ALA 216 Cb 0.50 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2qy6 h ALA 216 CO 0.03 0.70 0.40 0.52 0.00 0.00 0.00 179.25 180.90 2qy6 h MET 217 N 0.50 0.96 -0.41 0.00 2.86 -0.87 -1.73 114.93 116.25 2qy6 h MET 217 Ca -0.03 -0.10 -0.09 0.00 -2.06 0.00 0.00 59.70 57.42 2qy6 h MET 217 Cb 1.31 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.75 2qy6 h MET 217 CO 0.14 0.70 -0.11 0.00 1.06 0.00 0.00 176.91 178.71 2qy6 h ALA 218 N 1.21 1.05 -0.53 6.32 0.00 -1.19 -1.29 119.26 124.83 2qy6 h ALA 218 Ca 0.25 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2qy6 h ALA 218 Cb 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2qy6 h ALA 218 CO -0.04 0.58 0.06 -0.09 0.00 0.00 0.00 179.25 179.76 2qy6 h ARG 219 N 0.66 0.85 0.00 0.00 2.43 -1.24 -3.19 114.38 113.88 2qy6 h ARG 219 Ca 0.11 -0.21 -0.08 0.00 -0.81 0.00 0.00 59.98 59.00 2qy6 h ARG 219 Cb 0.57 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 2qy6 h ARG 219 CO 0.04 0.81 -0.85 -0.07 -1.51 0.00 0.00 179.97 178.39 2qy6 h LEU 220 N 0.80 0.00 -9.63 3.80 3.38 -1.13 -1.98 115.31 110.55 2qy6 h LEU 220 Ca 0.16 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.61 2qy6 h LEU 220 Cb 0.39 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.19 2qy6 h LEU 220 CO 0.01 0.31 0.91 0.00 0.09 0.00 0.00 178.44 179.76 2qy6 s ALA 221 N -3.10 3.81 0.28 1.53 0.00 -0.50 -0.75 121.76 123.03 2qy6 s ALA 221 Ca 0.01 1.42 -0.29 0.00 0.00 0.00 0.00 51.96 53.10 2qy6 s ALA 221 Cb 0.08 -3.64 -0.10 0.00 0.00 0.00 0.00 23.12 19.46 2qy6 s ALA 221 CO 0.77 -0.81 1.38 0.50 0.00 0.00 0.00 175.76 177.59 2qy6 s ARG 222 N 1.07 4.31 0.10 0.00 3.52 -0.48 -3.93 118.95 123.54 2qy6 s ARG 222 Ca 0.71 2.25 -0.36 0.00 -0.13 0.00 0.00 55.73 58.20 2qy6 s ARG 222 Cb -0.45 -3.10 -0.17 0.00 -1.56 0.00 0.00 34.95 29.67 2qy6 s ARG 222 CO 0.32 -0.32 1.15 -2.30 -0.81 0.00 0.00 175.30 173.34 2qy6 n PRO 223 N 1.76 0.76 -0.62 5.12 -0.02 -1.26 0.29 135.00 141.02 2qy6 n PRO 223 Ca 0.04 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 2qy6 n PRO 223 Cb 0.41 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 2qy6 n PRO 223 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qy6 n GLY 224 N 2.05 1.21 3.79 -1.23 0.00 0.22 -5.01 105.19 106.22 2qy6 n GLY 224 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 2qy6 n GLY 224 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qy6 s GLY 225 N -2.00 2.14 0.41 -0.02 0.00 0.82 -4.72 107.32 103.95 2qy6 s GLY 225 Ca 0.00 0.45 0.07 0.00 0.00 0.00 0.00 44.72 45.23 2qy6 s GLY 225 CO 0.00 0.78 0.01 -0.51 0.00 0.00 0.00 173.10 173.38 2qy6 s THR 226 N -2.41 1.94 -0.08 0.90 -4.23 -0.20 -0.49 115.64 111.07 2qy6 s THR 226 Ca 0.65 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 59.07 2qy6 s THR 226 Cb -0.18 -2.96 0.02 0.00 1.34 0.00 0.00 72.50 70.73 2qy6 s THR 226 CO 0.38 0.00 0.24 -0.22 -0.54 0.00 0.00 174.62 174.49 2qy6 s LEU 227 N -3.71 1.09 0.10 4.79 0.20 -0.20 -0.16 118.68 120.78 2qy6 s LEU 227 Ca 0.34 0.39 0.06 0.00 0.69 0.00 0.00 54.13 55.61 2qy6 s LEU 227 Cb 0.10 0.87 -0.03 0.00 -0.43 0.00 0.00 46.19 46.69 2qy6 s LEU 227 CO 0.17 -0.15 -0.14 0.00 -0.29 0.00 0.00 176.35 175.94 2qy6 s ALA 228 N -0.15 1.34 0.05 5.97 0.00 -0.86 -0.99 121.76 127.13 2qy6 s ALA 228 Ca -0.03 -1.15 -0.12 0.00 0.00 0.00 0.00 51.96 50.67 2qy6 s ALA 228 Cb -0.03 -0.09 0.01 0.00 0.00 0.00 0.00 23.12 23.02 2qy6 s ALA 228 CO 0.01 0.14 0.26 -0.08 0.00 0.00 0.00 175.76 176.09 2qy6 s THR 229 N -1.68 0.10 -0.61 0.00 -1.32 -0.14 -1.34 115.64 110.65 2qy6 s THR 229 Ca 0.03 -0.81 0.25 0.00 -1.21 0.00 0.00 61.69 59.96 2qy6 s THR 229 Cb -0.08 -1.00 0.31 0.00 -1.51 0.00 0.00 72.50 70.22 2qy6 s THR 229 CO 0.03 -0.44 1.71 2.19 -2.21 0.00 0.00 174.62 175.89 2qy6 h PHE 230 N 3.17 0.00 -3.48 9.09 -5.15 -1.85 -2.50 116.94 116.22 2qy6 h PHE 230 Ca -0.32 0.00 -0.52 0.00 -0.20 0.00 0.00 57.97 56.92 2qy6 h PHE 230 Cb 1.20 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 37.34 2qy6 h PHE 230 CO 0.46 0.00 -0.07 -0.08 -2.00 0.00 0.00 178.31 176.62 2qy6 s THR 231 N -3.15 4.89 -0.16 0.88 -1.32 -1.26 -4.60 115.64 110.92 2qy6 s THR 231 Ca 0.09 0.53 0.15 0.00 -1.21 0.00 0.00 61.69 61.24 2qy6 s THR 231 Cb 0.09 -3.63 0.43 0.00 -1.51 0.00 0.00 72.50 67.87 2qy6 s THR 231 CO 0.62 -0.14 1.20 -1.54 -2.21 0.00 0.00 174.62 172.56 2qy6 n SER 232 N -0.33 1.65 -4.59 8.08 3.41 -1.26 -3.15 113.62 117.43 2qy6 n SER 232 Ca 0.01 -3.40 -0.53 0.00 -0.26 0.00 0.00 58.87 54.69 2qy6 n SER 232 Cb 0.53 -0.46 -0.06 0.00 -0.26 0.00 0.00 64.21 63.95 2qy6 n SER 232 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qy6 n ALA 233 N -0.69 -1.13 -0.35 7.33 0.00 -1.26 -4.86 120.51 119.55 2qy6 n ALA 233 Ca 0.17 0.52 0.05 0.00 0.00 0.00 0.00 53.44 54.17 2qy6 n ALA 233 Cb 0.82 -2.06 0.21 0.00 0.00 0.00 0.00 19.45 18.42 2qy6 n ALA 233 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2qy6 h GLY 234 N 4.62 1.55 1.75 0.00 0.00 -2.00 -1.78 103.07 107.21 2qy6 h GLY 234 Ca -0.48 -0.42 -0.10 0.00 0.00 0.00 0.00 47.33 46.33 2qy6 h GLY 234 CO 0.78 0.20 -0.37 0.27 0.00 0.00 0.00 176.54 177.42 2qy6 h PHE 235 N 1.00 0.32 -0.19 5.60 -5.15 -1.99 -1.98 116.94 114.57 2qy6 h PHE 235 Ca 0.46 -0.08 0.04 0.00 -0.20 0.00 0.00 57.97 58.19 2qy6 h PHE 235 Cb 0.39 -0.07 -0.04 0.00 0.22 0.00 0.00 35.95 36.45 2qy6 h PHE 235 CO -0.01 0.62 -0.05 0.28 -2.00 0.00 0.00 178.31 177.15 2qy6 h VAL 236 N 0.24 0.81 0.44 0.88 2.07 -1.70 0.85 116.25 119.85 2qy6 h VAL 236 Ca 0.03 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.52 2qy6 h VAL 236 Cb 0.77 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2qy6 h VAL 236 CO 0.06 0.00 -0.21 -0.09 0.02 0.00 0.00 177.57 177.35 2qy6 h ARG 237 N -0.00 -0.58 -0.83 1.57 2.43 -1.19 -0.93 114.38 114.86 2qy6 h ARG 237 Ca 0.09 0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.39 2qy6 h ARG 237 Cb 0.14 0.13 -0.07 0.00 -0.42 0.00 0.00 29.97 29.75 2qy6 h ARG 237 CO -0.19 -0.32 0.48 0.00 -1.51 0.00 0.00 179.97 178.42 2qy6 h ARG 238 N -0.71 0.78 -0.25 0.20 3.08 -1.35 -1.19 114.38 114.93 2qy6 h ARG 238 Ca -0.06 -0.05 -0.16 0.00 0.07 0.00 0.00 59.98 59.78 2qy6 h ARG 238 Cb 0.52 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 2qy6 h ARG 238 CO 0.10 0.51 -0.49 0.78 -1.07 0.00 0.00 179.97 179.80 2qy6 h GLY 239 N 0.80 0.73 1.89 0.04 0.00 -0.65 -0.80 103.07 105.08 2qy6 h GLY 239 Ca 0.40 -0.81 -0.08 0.00 0.00 0.00 0.00 47.33 46.84 2qy6 h GLY 239 CO -0.24 0.73 -0.35 1.41 0.00 0.00 0.00 176.54 178.08 2qy6 h LEU 240 N 0.53 0.13 0.07 3.11 3.38 -0.68 -1.77 115.31 120.08 2qy6 h LEU 240 Ca 0.03 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2qy6 h LEU 240 Cb 1.04 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2qy6 h LEU 240 CO 0.10 0.48 -0.03 1.56 0.09 0.00 0.00 178.44 180.63 2qy6 h GLN 241 N 0.11 -0.09 -0.88 1.13 4.20 -1.00 -2.04 115.11 116.54 2qy6 h GLN 241 Ca 0.01 0.01 0.21 0.00 0.06 0.00 0.00 58.65 58.94 2qy6 h GLN 241 Cb 0.68 0.02 -0.12 0.00 0.30 0.00 0.00 27.48 28.36 2qy6 h GLN 241 CO 0.05 0.30 0.38 1.49 -0.67 0.00 0.00 178.83 180.37 2qy6 h GLU 242 N -0.50 0.40 0.00 1.46 4.81 -1.12 -0.64 114.58 118.99 2qy6 h GLU 242 Ca -0.01 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.16 2qy6 h GLU 242 Cb 0.43 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 2qy6 h GLU 242 CO 0.02 0.27 -0.17 0.00 -0.73 0.00 0.00 179.01 178.39 2qy6 h ALA 243 N 1.68 1.08 0.00 2.92 0.00 -1.27 -3.47 119.26 120.21 2qy6 h ALA 243 Ca 0.54 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2qy6 h ALA 243 Cb 0.98 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2qy6 h ALA 243 CO -0.51 0.22 0.00 0.41 0.00 0.00 0.00 179.25 179.37 2qy6 n GLY 244 N -0.09 0.68 3.79 0.00 0.00 -0.25 -4.77 105.19 104.56 2qy6 n GLY 244 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2qy6 n GLY 244 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qy6 s PHE 245 N -1.11 3.60 -0.46 1.61 0.08 -0.80 -4.57 117.98 116.33 2qy6 s PHE 245 Ca 0.00 1.70 -0.20 0.00 0.12 0.00 0.00 56.93 58.55 2qy6 s PHE 245 Cb 0.00 -2.88 0.03 0.00 -0.57 0.00 0.00 43.02 39.61 2qy6 s PHE 245 CO 0.00 0.15 0.66 0.99 -0.10 0.00 0.00 175.22 176.92 2qy6 s THR 246 N -1.73 4.81 0.12 0.64 2.01 -0.34 -4.15 115.64 117.00 2qy6 s THR 246 Ca 0.52 -0.04 0.02 0.00 0.31 0.00 0.00 61.69 62.50 2qy6 s THR 246 Cb -0.16 -4.25 -0.04 0.00 0.01 0.00 0.00 72.50 68.06 2qy6 s THR 246 CO 0.21 -0.69 0.25 -0.04 -0.69 0.00 0.00 174.62 173.67 2qy6 s MET 247 N 2.85 3.40 -0.12 4.92 1.00 -1.26 -2.33 119.30 127.75 2qy6 s MET 247 Ca 0.21 -0.57 -0.09 0.00 0.00 0.00 0.00 55.69 55.25 2qy6 s MET 247 Cb -0.15 -2.97 0.04 0.00 0.00 0.00 0.00 34.83 31.75 2qy6 s MET 247 CO 0.17 0.55 0.30 -1.14 0.00 0.00 0.00 175.02 174.90 2qy6 s GLN 248 N -3.00 0.31 0.49 2.03 2.00 0.10 -4.98 119.66 116.62 2qy6 s GLN 248 Ca 0.34 0.50 -0.19 0.00 -2.00 0.00 0.00 55.36 54.02 2qy6 s GLN 248 Cb -0.12 0.06 -0.08 0.00 0.80 0.00 0.00 33.01 33.67 2qy6 s GLN 248 CO 0.28 -0.09 1.00 -1.59 -0.50 0.00 0.00 175.29 174.39 2qy6 s LYS 249 N 0.66 3.89 -0.08 1.67 -2.85 -1.26 -1.09 119.74 120.68 2qy6 s LYS 249 Ca -0.04 1.18 -0.07 0.00 -1.00 0.00 0.00 55.97 56.04 2qy6 s LYS 249 Cb -0.05 -2.12 0.02 0.00 -2.06 0.00 0.00 37.83 33.62 2qy6 s LYS 249 CO -0.04 -0.33 0.21 0.50 0.10 0.00 0.00 175.35 175.79 2qy6 s ARG 250 N -3.52 0.24 0.50 1.78 3.52 -0.85 -4.87 118.95 115.75 2qy6 s ARG 250 Ca 0.63 0.30 -0.22 0.00 -0.13 0.00 0.00 55.73 56.31 2qy6 s ARG 250 Cb -0.13 0.11 -0.08 0.00 -1.56 0.00 0.00 34.95 33.29 2qy6 s ARG 250 CO 0.23 -0.04 1.01 1.17 -0.81 0.00 0.00 175.30 176.86 2qy6 n LYS 251 N 3.02 1.23 -1.74 5.12 4.81 -1.26 0.12 118.16 129.46 2qy6 n LYS 251 Ca -0.13 0.45 -0.30 0.00 -0.87 0.00 0.00 58.31 57.46 2qy6 n LYS 251 Cb 0.58 -2.13 0.20 0.00 0.02 0.00 0.00 35.03 33.70 2qy6 n LYS 251 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 2qy6 s GLY 252 N -0.92 1.73 0.22 3.14 0.00 -1.13 -4.41 107.32 105.95 2qy6 s GLY 252 Ca 0.68 -1.13 -0.30 0.00 0.00 0.00 0.00 44.72 43.97 2qy6 s GLY 252 CO 0.53 -0.34 1.34 -0.12 0.00 0.00 0.00 173.10 174.52 2qy6 s PHE 253 N -3.68 3.19 0.00 1.90 5.36 -1.26 -4.64 117.98 118.84 2qy6 s PHE 253 Ca 0.73 1.18 0.00 0.00 -0.96 0.00 0.00 56.93 57.88 2qy6 s PHE 253 Cb -0.05 -3.66 0.00 0.00 -0.34 0.00 0.00 43.02 38.96 2qy6 s PHE 253 CO 0.54 -2.08 0.00 0.41 -1.46 0.00 0.00 175.22 172.62 2qy6 n GLY 254 N 2.25 2.52 0.05 13.12 0.00 -1.26 -1.88 105.19 119.98 2qy6 n GLY 254 Ca 0.06 -0.29 0.13 0.00 0.00 0.00 0.00 46.02 45.92 2qy6 n GLY 254 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qy6 n ARG 255 N 13.24 0.24 -1.73 1.61 1.74 -1.26 -4.85 116.66 125.64 2qy6 n ARG 255 Ca 0.00 -0.11 -0.40 0.00 -0.77 0.00 0.00 57.85 56.58 2qy6 n ARG 255 Cb 0.00 -1.50 0.02 0.00 -1.02 0.00 0.00 32.46 29.96 2qy6 n ARG 255 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2qy6 n LYS 256 N -1.29 1.95 -0.01 5.56 5.02 -0.79 -4.95 118.16 123.66 2qy6 n LYS 256 Ca 0.08 0.70 0.03 0.00 -2.02 0.00 0.00 58.31 57.11 2qy6 n LYS 256 Cb 0.33 -2.50 -0.13 0.00 -0.02 0.00 0.00 35.03 32.71 2qy6 n LYS 256 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2qy6 n ARG 257 N -0.31 0.65 -3.64 1.97 0.63 -1.26 -2.85 116.66 111.86 2qy6 n ARG 257 Ca 0.07 -0.01 -0.10 0.00 -0.92 0.00 0.00 57.85 56.89 2qy6 n ARG 257 Cb 0.42 -1.63 -0.07 0.00 0.45 0.00 0.00 32.46 31.63 2qy6 n ARG 257 CO 0.00 0.00 0.00 -2.00 -2.51 0.00 0.00 177.63 173.12 2qy6 s GLU 258 N -3.09 0.68 0.32 -0.14 2.12 -1.26 -3.47 118.70 113.86 2qy6 s GLU 258 Ca -0.06 0.93 0.04 0.00 0.36 0.00 0.00 54.97 56.24 2qy6 s GLU 258 Cb 0.10 0.27 -0.03 0.00 0.26 0.00 0.00 34.13 34.72 2qy6 s GLU 258 CO 0.85 -0.10 0.18 0.00 -0.54 0.00 0.00 175.26 175.65 2qy6 s MET 259 N 0.78 1.66 -0.05 4.30 0.23 0.12 -4.33 119.30 122.00 2qy6 s MET 259 Ca -0.03 -1.96 0.05 0.00 -1.03 0.00 0.00 55.69 52.73 2qy6 s MET 259 Cb -0.05 -0.04 -0.01 0.00 -1.53 0.00 0.00 34.83 33.21 2qy6 s MET 259 CO -0.08 -0.50 -0.22 -0.51 -2.03 0.00 0.00 175.02 171.68 2qy6 s LEU 260 N -3.39 2.00 0.17 0.18 1.43 -0.94 -2.00 118.68 116.13 2qy6 s LEU 260 Ca 0.35 -0.44 0.01 0.00 -1.03 0.00 0.00 54.13 53.02 2qy6 s LEU 260 Cb 0.04 -1.20 -0.04 0.00 0.03 0.00 0.00 46.19 45.02 2qy6 s LEU 260 CO 0.19 0.20 0.03 0.00 0.23 0.00 0.00 176.35 177.01 2qy6 s GLY 262 N -3.15 0.08 -0.01 0.00 0.00 -0.16 0.02 107.32 104.10 2qy6 s GLY 262 Ca 0.26 -0.47 0.01 0.00 0.00 0.00 0.00 44.72 44.52 2qy6 s GLY 262 CO 0.05 -0.19 -0.01 0.14 0.00 0.00 0.00 173.10 173.08 2qy6 s VAL 263 N -3.57 0.16 -0.50 1.40 1.01 -0.99 -1.04 120.40 116.87 2qy6 s VAL 263 Ca 0.13 -0.04 -0.28 0.00 0.00 0.00 0.00 61.98 61.79 2qy6 s VAL 263 Cb -0.05 -0.17 0.03 0.00 0.00 0.00 0.00 36.38 36.19 2qy6 s VAL 263 CO 0.08 0.07 1.08 -0.32 0.00 0.00 0.00 175.10 176.01 2qy6 s MET 264 N 0.20 3.60 0.00 2.72 1.75 0.36 -1.20 119.30 126.74 2qy6 s MET 264 Ca -0.02 0.33 0.31 0.00 -1.25 0.00 0.00 55.69 55.07 2qy6 s MET 264 Cb -0.04 -3.95 1.71 0.00 2.84 0.00 0.00 34.83 35.39 2qy6 s MET 264 CO -0.01 -1.42 2.12 0.39 -0.65 0.00 0.00 175.02 175.45