#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qqk n GLY 29 N -3.22 -2.70 0.00 0.00 0.00 -1.26 -4.89 105.19 93.11 2qqk n GLY 29 Ca 0.13 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.46 2qqk n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qqk n GLY 30 N -0.54 2.52 3.40 -0.02 0.00 -1.05 -4.92 105.19 104.57 2qqk n GLY 30 Ca 0.00 -1.99 -0.34 0.00 0.00 0.00 0.00 46.02 43.69 2qqk n GLY 30 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qqk s ARG 31 N -1.82 3.50 -0.10 1.61 0.52 -1.26 -1.22 118.95 120.17 2qqk s ARG 31 Ca 0.00 -0.60 0.03 0.00 -0.52 0.00 0.00 55.73 54.63 2qqk s ARG 31 Cb 0.00 -2.84 0.01 0.00 0.52 0.00 0.00 34.95 32.64 2qqk s ARG 31 CO 0.00 0.12 -0.18 -0.51 0.02 0.00 0.00 175.30 174.75 2qqk s LEU 32 N 0.65 1.88 -0.10 2.53 1.43 -0.18 -4.98 118.68 119.90 2qqk s LEU 32 Ca -0.04 -0.47 -0.30 0.00 -1.03 0.00 0.00 54.13 52.29 2qqk s LEU 32 Cb -0.15 -1.19 -0.03 0.00 0.03 0.00 0.00 46.19 44.85 2qqk s LEU 32 CO 0.02 0.07 1.33 0.21 0.23 0.00 0.00 176.35 178.21 2qqk s ASN 33 N 0.73 6.91 0.00 2.29 3.84 -1.26 -2.13 114.94 125.32 2qqk s ASN 33 Ca -0.11 1.86 0.31 0.00 0.21 0.00 0.00 52.86 55.12 2qqk s ASN 33 Cb -0.16 -2.55 1.62 0.00 -0.55 0.00 0.00 41.25 39.61 2qqk s ASN 33 CO 0.02 -0.74 2.09 -0.24 -2.79 0.00 0.00 177.10 175.44 2qqk n SER 34 N 6.18 0.09 -0.34 -4.21 2.88 -0.37 -3.42 113.62 114.42 2qqk n SER 34 Ca 0.14 -0.53 0.17 0.00 -1.33 0.00 0.00 58.87 57.31 2qqk n SER 34 Cb 0.45 -0.15 0.38 0.00 -0.75 0.00 0.00 64.21 64.14 2qqk n SER 34 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2qqk h LYS 35 N 0.12 0.60 -5.63 -1.46 3.64 -1.91 -3.34 116.57 108.59 2qqk h LYS 35 Ca 0.00 -0.04 -0.59 0.00 -1.27 0.00 0.00 60.65 58.76 2qqk h LYS 35 Cb 0.20 -0.14 -0.09 0.00 -0.41 0.00 0.00 32.23 31.79 2qqk h LYS 35 CO 0.00 0.40 -0.24 -0.51 -2.27 0.00 0.00 179.45 176.83 2qqk s ASP 36 N -5.32 6.57 0.30 4.20 1.01 -1.22 -4.97 116.67 117.24 2qqk s ASP 36 Ca -0.10 0.67 -0.29 0.00 0.71 0.00 0.00 52.55 53.53 2qqk s ASP 36 Cb 0.26 -2.23 -0.10 0.00 1.01 0.00 0.00 42.92 41.86 2qqk s ASP 36 CO 0.80 0.08 1.29 0.00 0.21 0.00 0.00 175.17 177.55 2qqk s ALA 37 N 0.40 3.50 0.07 5.23 0.00 -1.25 -4.89 121.76 124.82 2qqk s ALA 37 Ca 0.21 1.20 -0.05 0.00 0.00 0.00 0.00 51.96 53.32 2qqk s ALA 37 Cb -0.14 -3.46 -0.02 0.00 0.00 0.00 0.00 23.12 19.50 2qqk s ALA 37 CO 0.07 -0.57 0.10 0.20 0.00 0.00 0.00 175.76 175.56 2qqk s GLY 38 N -0.38 0.27 0.35 0.00 0.00 -1.14 -5.00 107.32 101.42 2qqk s GLY 38 Ca 0.50 -0.89 -0.14 0.00 0.00 0.00 0.00 44.72 44.19 2qqk s GLY 38 CO 0.49 -1.03 0.76 -0.19 0.00 0.00 0.00 173.10 173.12 2qqk s TYR 39 N -3.89 3.40 -0.04 1.90 1.51 -1.26 -1.44 117.35 117.52 2qqk s TYR 39 Ca 0.06 1.19 0.00 0.00 -1.01 0.00 0.00 57.07 57.31 2qqk s TYR 39 Cb 0.06 -2.52 0.02 0.00 -0.11 0.00 0.00 41.96 39.41 2qqk s TYR 39 CO -0.10 0.02 -0.02 0.42 -1.11 0.00 0.00 175.55 174.77 2qqk s ILE 40 N -2.11 0.36 0.19 2.71 1.01 -0.45 -4.96 121.20 117.95 2qqk s ILE 40 Ca 0.54 0.02 0.05 0.00 0.00 0.00 0.00 60.65 61.25 2qqk s ILE 40 Cb -0.10 -0.44 -0.05 0.00 0.01 0.00 0.00 42.46 41.88 2qqk s ILE 40 CO 0.21 0.20 -0.07 0.42 0.00 0.00 0.00 174.94 175.70 2qqk s THR 41 N 1.21 1.21 0.56 2.92 -4.23 -1.26 -0.33 115.64 115.72 2qqk s THR 41 Ca -0.07 -2.07 -0.21 0.00 -1.18 0.00 0.00 61.69 58.16 2qqk s THR 41 Cb -0.14 -2.06 -0.04 0.00 1.34 0.00 0.00 72.50 71.60 2qqk s THR 41 CO -0.02 -0.57 1.32 -0.94 -0.54 0.00 0.00 174.62 173.87 2qqk s SER 42 N -3.24 5.24 0.08 3.99 1.04 -0.55 -4.92 113.70 115.34 2qqk s SER 42 Ca 0.22 2.67 -0.16 0.00 0.48 0.00 0.00 55.95 59.16 2qqk s SER 42 Cb 0.03 -2.63 -0.04 0.00 0.10 0.00 0.00 66.02 63.49 2qqk s SER 42 CO 0.05 -1.58 0.83 -2.65 0.98 0.00 0.00 173.24 170.86 2qqk n PRO 43 N -1.16 -0.22 -0.39 4.02 -0.02 -1.26 -2.01 135.00 133.95 2qqk n PRO 43 Ca 0.11 0.81 0.12 0.00 -2.02 0.00 0.00 63.50 62.52 2qqk n PRO 43 Cb 0.46 -1.20 0.33 0.00 -0.02 0.00 0.00 33.50 33.08 2qqk n PRO 43 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qqk n GLY 44 N -1.13 2.51 3.64 -1.23 0.00 -1.26 -5.04 105.19 102.69 2qqk n GLY 44 Ca 0.01 -0.81 -0.45 0.00 0.00 0.00 0.00 46.02 44.77 2qqk n GLY 44 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2qqk n TYR 45 N 1.67 1.83 0.31 1.61 9.36 -0.85 -1.81 117.16 129.29 2qqk n TYR 45 Ca 0.25 0.56 0.04 0.00 3.32 0.00 0.00 57.90 62.07 2qqk n TYR 45 Cb 0.64 -2.37 0.18 0.00 -0.63 0.00 0.00 39.34 37.16 2qqk n TYR 45 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2qqk n PRO 46 N 1.42 2.56 -2.49 2.98 -0.04 -1.26 -5.04 135.00 133.14 2qqk n PRO 46 Ca 0.10 -1.39 -0.34 0.00 -0.04 0.00 0.00 63.50 61.83 2qqk n PRO 46 Cb 0.31 -1.72 -0.03 0.00 -0.04 0.00 0.00 33.50 32.02 2qqk n PRO 46 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 2qqk s GLN 47 N -1.75 3.73 0.26 0.54 2.00 -0.75 -4.69 119.66 119.01 2qqk s GLN 47 Ca 0.24 1.38 -0.30 0.00 -2.00 0.00 0.00 55.36 54.68 2qqk s GLN 47 Cb 0.17 -2.08 -0.14 0.00 0.80 0.00 0.00 33.01 31.77 2qqk s GLN 47 CO 0.09 -0.49 1.28 -0.25 -0.50 0.00 0.00 175.29 175.42 2qqk n ASP 48 N -1.05 2.30 -4.81 6.67 8.00 -1.26 -4.57 116.55 121.83 2qqk n ASP 48 Ca 0.09 1.16 -0.32 0.00 0.71 0.00 0.00 54.79 56.44 2qqk n ASP 48 Cb 0.52 -1.38 0.03 0.00 -0.02 0.00 0.00 41.12 40.27 2qqk n ASP 48 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2qqk s TYR 49 N -0.44 3.04 0.52 1.24 -0.85 -0.86 -4.78 117.35 115.22 2qqk s TYR 49 Ca 0.65 1.47 -0.21 0.00 -0.52 0.00 0.00 57.07 58.45 2qqk s TYR 49 Cb -0.67 -2.94 -0.06 0.00 0.38 0.00 0.00 41.96 38.67 2qqk s TYR 49 CO 0.54 -1.20 1.20 -2.14 -1.52 0.00 0.00 175.55 172.43 2qqk s PRO 50 N -4.63 3.39 0.60 -3.49 0.02 -1.26 -4.37 135.00 125.27 2qqk s PRO 50 Ca 0.60 1.84 -0.13 0.00 0.02 0.00 0.00 61.00 63.33 2qqk s PRO 50 Cb -0.15 -2.20 -0.04 0.00 0.02 0.00 0.00 34.50 32.13 2qqk s PRO 50 CO 0.47 -0.87 1.03 -1.54 -0.33 0.00 0.00 177.00 175.76 2qqk s SER 51 N -1.42 6.12 -1.18 2.53 1.04 -1.26 -4.56 113.70 114.97 2qqk s SER 51 Ca 0.70 1.56 -0.06 0.00 0.48 0.00 0.00 55.95 58.62 2qqk s SER 51 Cb -0.30 -2.49 -0.02 0.00 0.10 0.00 0.00 66.02 63.30 2qqk s SER 51 CO 0.35 -0.94 0.83 1.57 0.98 0.00 0.00 173.24 176.03 2qqk n HIS 52 N -2.39 -2.12 -3.64 5.02 -0.00 -1.22 -4.86 115.22 106.01 2qqk n HIS 52 Ca 0.07 0.78 -0.05 0.00 -0.00 0.00 0.00 57.72 58.52 2qqk n HIS 52 Cb 0.54 -4.23 -0.07 0.00 -0.00 0.00 0.00 29.99 26.23 2qqk n HIS 52 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.34 175.20 2qqk s GLN 53 N -5.41 0.40 -0.04 1.57 -0.44 -1.12 -4.94 119.66 109.69 2qqk s GLN 53 Ca 0.23 0.58 0.07 0.00 -2.50 0.00 0.00 55.36 53.74 2qqk s GLN 53 Cb -0.05 0.14 -0.02 0.00 -1.64 0.00 0.00 33.01 31.45 2qqk s GLN 53 CO 0.79 -0.06 -0.25 -0.80 0.50 0.00 0.00 175.29 175.46 2qqk s ASN 54 N 0.76 3.02 0.27 6.67 0.01 -1.26 -3.15 114.94 121.27 2qqk s ASN 54 Ca -0.03 -0.48 0.10 0.00 -0.71 0.00 0.00 52.86 51.74 2qqk s ASN 54 Cb -0.04 -0.56 -0.04 0.00 0.41 0.00 0.00 41.25 41.01 2qqk s ASN 54 CO -0.11 0.28 -0.04 0.00 -1.51 0.00 0.00 177.10 175.72 2qqk s GLU 56 N -3.64 0.51 0.09 0.00 -1.05 -1.26 -1.64 118.70 111.71 2qqk s GLU 56 Ca 0.31 0.90 0.09 0.00 -0.15 0.00 0.00 54.97 56.12 2qqk s GLU 56 Cb -0.06 0.07 -0.03 0.00 -0.44 0.00 0.00 34.13 33.66 2qqk s GLU 56 CO 0.19 -0.14 -0.24 -1.58 0.95 0.00 0.00 175.26 174.43 2qqk s TRP 57 N 1.30 2.09 -0.19 4.83 0.51 0.31 -2.54 118.94 125.25 2qqk s TRP 57 Ca -0.08 -0.40 -0.02 0.00 -2.12 0.00 0.00 56.10 53.48 2qqk s TRP 57 Cb -0.07 -1.18 -0.00 0.00 -0.81 0.00 0.00 33.47 31.41 2qqk s TRP 57 CO -0.13 0.21 -0.10 0.42 -0.51 0.00 0.00 176.95 176.85 2qqk s ILE 58 N -0.98 2.99 -0.11 2.03 1.09 -0.36 -0.99 121.20 124.86 2qqk s ILE 58 Ca 0.10 -0.64 -0.05 0.00 -1.10 0.00 0.00 60.65 58.97 2qqk s ILE 58 Cb -0.10 -2.32 -0.04 0.00 -1.06 0.00 0.00 42.46 38.95 2qqk s ILE 58 CO 0.04 0.47 0.08 -0.69 -0.10 0.00 0.00 174.94 174.75 2qqk s VAL 59 N 1.18 5.02 -0.04 2.92 1.01 -0.59 -1.01 120.40 128.89 2qqk s VAL 59 Ca 0.02 0.02 -0.12 0.00 0.00 0.00 0.00 61.98 61.91 2qqk s VAL 59 Cb -0.14 -3.17 0.02 0.00 0.00 0.00 0.00 36.38 33.09 2qqk s VAL 59 CO -0.03 0.60 0.26 -0.72 0.00 0.00 0.00 175.10 175.21 2qqk s TYR 60 N -0.86 -0.16 0.22 5.22 1.13 -0.91 -0.80 117.35 121.20 2qqk s TYR 60 Ca 0.13 0.30 -0.01 0.00 -1.41 0.00 0.00 57.07 56.09 2qqk s TYR 60 Cb -0.12 0.06 -0.04 0.00 -1.10 0.00 0.00 41.96 40.76 2qqk s TYR 60 CO 0.03 -0.30 0.42 0.00 -2.51 0.00 0.00 175.55 173.19 2qqk s ALA 61 N -0.93 3.81 0.31 9.51 0.00 0.17 -1.24 121.76 133.38 2qqk s ALA 61 Ca -0.10 -0.83 0.06 0.00 0.00 0.00 0.00 51.96 51.09 2qqk s ALA 61 Cb -0.05 -2.02 0.84 0.00 0.00 0.00 0.00 23.12 21.89 2qqk s ALA 61 CO 0.03 0.37 1.66 -1.35 0.00 0.00 0.00 175.76 176.46 2qqk h PRO 62 N 1.83 0.26 -3.13 0.00 0.11 -1.95 -3.44 132.00 125.68 2qqk h PRO 62 Ca -0.48 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 65.49 2qqk h PRO 62 Cb 1.19 -0.06 -0.20 0.00 0.11 0.00 0.00 31.00 32.04 2qqk h PRO 62 CO 0.67 0.17 -0.32 -1.83 -0.21 0.00 0.00 178.00 176.48 2qqk s GLU 63 N -5.84 0.63 0.65 1.05 1.03 -1.26 -5.05 118.70 109.91 2qqk s GLU 63 Ca -0.11 -0.23 0.25 0.00 0.03 0.00 0.00 54.97 54.90 2qqk s GLU 63 Cb 0.27 0.28 1.32 0.00 -0.80 0.00 0.00 34.13 35.20 2qqk s GLU 63 CO 0.78 -0.17 1.75 -1.00 -1.33 0.00 0.00 175.26 175.29 2qqk h PRO 64 N 3.95 0.00 -0.72 -4.83 0.13 -1.92 -2.15 132.00 126.47 2qqk h PRO 64 Ca -0.30 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 64.96 2qqk h PRO 64 Cb 1.18 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.22 2qqk h PRO 64 CO 0.40 0.00 0.29 -0.97 -0.23 0.00 0.00 178.00 177.49 2qqk h ASN 65 N 0.00 0.28 -3.49 1.44 -1.24 -1.97 -3.43 115.58 107.18 2qqk h ASN 65 Ca 0.05 0.10 -0.49 0.00 0.71 0.00 0.00 56.30 56.67 2qqk h ASN 65 Cb 1.04 0.07 0.03 0.00 0.73 0.00 0.00 38.32 40.19 2qqk h ASN 65 CO -0.00 0.13 0.08 -1.10 -1.29 0.00 0.00 177.43 175.25 2qqk s GLN 66 N -6.04 3.49 0.42 6.67 -0.21 -0.81 -4.80 119.66 118.38 2qqk s GLN 66 Ca -0.13 0.13 0.07 0.00 0.02 0.00 0.00 55.36 55.45 2qqk s GLN 66 Cb 0.20 -2.40 -0.07 0.00 1.00 0.00 0.00 33.01 31.74 2qqk s GLN 66 CO 0.76 -0.20 0.05 0.15 -2.12 0.00 0.00 175.29 173.93 2qqk s LYS 67 N -4.71 2.03 -0.11 2.91 3.01 -0.68 -4.08 119.74 118.11 2qqk s LYS 67 Ca 0.47 -2.06 0.03 0.00 -1.01 0.00 0.00 55.97 53.40 2qqk s LYS 67 Cb -0.10 -1.71 -0.01 0.00 -1.01 0.00 0.00 37.83 35.00 2qqk s LYS 67 CO 0.44 -0.08 -0.21 0.42 0.51 0.00 0.00 175.35 176.43 2qqk s ILE 68 N -2.69 2.37 -0.10 2.17 1.01 -1.26 0.74 121.20 123.44 2qqk s ILE 68 Ca 0.35 -0.91 -0.03 0.00 0.00 0.00 0.00 60.65 60.06 2qqk s ILE 68 Cb 0.08 -1.94 -0.03 0.00 0.01 0.00 0.00 42.46 40.58 2qqk s ILE 68 CO 0.18 0.55 0.02 0.54 0.00 0.00 0.00 174.94 176.24 2qqk s VAL 69 N 0.31 4.50 -0.10 2.92 0.11 -0.58 -0.70 120.40 126.85 2qqk s VAL 69 Ca -0.16 -0.17 0.01 0.00 -2.93 0.00 0.00 61.98 58.73 2qqk s VAL 69 Cb -0.17 -2.91 -0.02 0.00 -1.53 0.00 0.00 36.38 31.74 2qqk s VAL 69 CO 0.08 0.59 -0.12 -0.76 -3.33 0.00 0.00 175.10 171.56 2qqk s LEU 70 N -0.78 2.82 -0.26 2.54 1.43 0.00 -2.28 118.68 122.15 2qqk s LEU 70 Ca 0.12 -0.23 0.01 0.00 -1.03 0.00 0.00 54.13 53.00 2qqk s LEU 70 Cb -0.12 -1.62 0.07 0.00 0.03 0.00 0.00 46.19 44.56 2qqk s LEU 70 CO 0.02 0.25 -0.01 0.20 0.23 0.00 0.00 176.35 177.04 2qqk s ASN 71 N -0.15 4.05 0.33 2.29 -0.87 0.12 -2.48 114.94 118.22 2qqk s ASN 71 Ca -0.00 -1.42 -0.27 0.00 -1.57 0.00 0.00 52.86 49.59 2qqk s ASN 71 Cb -0.13 -1.22 -0.09 0.00 -0.02 0.00 0.00 41.25 39.78 2qqk s ASN 71 CO 0.03 -0.29 1.09 -0.36 -2.57 0.00 0.00 177.10 175.01 2qqk s PHE 72 N 1.33 3.44 0.41 2.20 0.40 -1.26 -1.27 117.98 123.23 2qqk s PHE 72 Ca -0.01 1.67 -0.26 0.00 -0.60 0.00 0.00 56.93 57.73 2qqk s PHE 72 Cb -0.19 -3.25 -0.08 0.00 0.51 0.00 0.00 43.02 40.00 2qqk s PHE 72 CO -0.09 -0.66 1.26 1.21 0.70 0.00 0.00 175.22 177.64 2qqk s ASN 73 N -1.09 6.36 0.27 1.36 3.84 0.26 -4.93 114.94 121.01 2qqk s ASN 73 Ca 0.49 2.56 0.24 0.00 0.21 0.00 0.00 52.86 56.36 2qqk s ASN 73 Cb -0.29 -2.63 1.01 0.00 -0.55 0.00 0.00 41.25 38.78 2qqk s ASN 73 CO 0.37 -0.81 1.72 -2.65 -2.79 0.00 0.00 177.10 172.94 2qqk n PRO 74 N 0.10 0.20 -2.93 0.43 -0.02 -1.26 -4.38 135.00 127.14 2qqk n PRO 74 Ca 0.04 0.44 -0.44 0.00 -2.02 0.00 0.00 63.50 61.53 2qqk n PRO 74 Cb 0.44 -1.89 -0.04 0.00 -0.02 0.00 0.00 33.50 32.00 2qqk n PRO 74 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2qqk s HIS 75 N -3.34 2.86 -0.04 6.00 3.76 -1.26 -4.65 115.29 118.62 2qqk s HIS 75 Ca 0.04 -0.87 -0.01 0.00 -0.15 0.00 0.00 55.06 54.06 2qqk s HIS 75 Cb 0.09 -4.23 0.03 0.00 1.11 0.00 0.00 32.58 29.58 2qqk s HIS 75 CO 0.38 -1.53 0.06 0.12 -0.85 0.00 0.00 174.74 172.92 2qqk s PHE 76 N 3.40 0.03 -0.21 1.40 5.36 -1.26 -4.53 117.98 122.17 2qqk s PHE 76 Ca 0.23 0.24 -0.04 0.00 -0.96 0.00 0.00 56.93 56.40 2qqk s PHE 76 Cb -0.15 -0.37 0.09 0.00 -0.34 0.00 0.00 43.02 42.26 2qqk s PHE 76 CO 0.04 -0.16 0.23 -2.00 -1.46 0.00 0.00 175.22 171.87 2qqk s GLU 77 N 1.74 0.20 0.12 10.12 2.12 0.81 -4.36 118.70 129.45 2qqk s GLU 77 Ca -0.01 0.21 0.06 0.00 0.36 0.00 0.00 54.97 55.59 2qqk s GLU 77 Cb -0.12 -1.19 -0.04 0.00 0.26 0.00 0.00 34.13 33.04 2qqk s GLU 77 CO -0.03 -0.66 -0.14 0.42 -0.54 0.00 0.00 175.26 174.31 2qqk s ILE 78 N 2.33 1.31 0.55 -3.70 1.01 -0.95 0.75 121.20 122.51 2qqk s ILE 78 Ca 0.07 -1.69 -0.21 0.00 0.00 0.00 0.00 60.65 58.83 2qqk s ILE 78 Cb -0.16 -1.50 -0.06 0.00 0.01 0.00 0.00 42.46 40.76 2qqk s ILE 78 CO -0.12 -0.40 1.13 -0.62 0.00 0.00 0.00 174.94 174.92 2qqk n GLU 79 N 0.59 1.27 0.00 2.79 -0.58 -1.26 -2.74 120.64 120.71 2qqk n GLU 79 Ca -0.16 0.47 0.00 0.00 -0.42 0.00 0.00 57.16 57.05 2qqk n GLU 79 Cb 0.57 -2.31 0.00 0.00 -0.57 0.00 0.00 31.44 29.13 2qqk n GLU 79 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2qqk n LYS 80 N -0.86 0.00 0.00 3.49 5.02 -1.26 -3.35 118.16 121.20 2qqk n LYS 80 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 2qqk n LYS 80 Cb 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.46 2qqk n LYS 80 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2qqk n HIS 81 N 0.00 0.00 -2.23 2.13 8.25 -1.26 -3.11 115.22 119.00 2qqk n HIS 81 Ca 0.00 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.19 2qqk n HIS 81 Cb 0.00 0.02 0.01 0.00 1.12 0.00 0.00 29.99 31.14 2qqk n HIS 81 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2qqk n ASP 82 N 2.23 5.02 -3.93 0.41 9.92 -1.26 -4.89 116.55 124.05 2qqk n ASP 82 Ca 0.00 -3.74 -0.31 0.00 -0.53 0.00 0.00 54.79 50.21 2qqk n ASP 82 Cb 0.00 -0.45 0.00 0.00 -0.64 0.00 0.00 41.12 40.03 2qqk n ASP 82 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2qqk h LYS 84 N -1.65 0.00 0.00 0.00 1.57 -1.90 -3.43 116.57 111.15 2qqk h LYS 84 Ca -0.56 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.22 2qqk h LYS 84 Cb 1.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.67 2qqk h LYS 84 CO 0.69 0.42 -0.06 0.66 -0.57 0.00 0.00 179.45 180.59 2qqk n TYR 85 N -3.22 0.00 -4.28 -1.35 4.02 -1.26 -5.04 117.16 106.03 2qqk n TYR 85 Ca 0.02 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.56 2qqk n TYR 85 Cb 0.70 -0.03 -0.10 0.00 -0.02 0.00 0.00 39.34 39.89 2qqk n TYR 85 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2qqk s ASP 86 N -5.39 5.34 -0.03 7.72 1.01 -1.26 -4.36 116.67 119.70 2qqk s ASP 86 Ca -0.02 0.13 -0.30 0.00 0.71 0.00 0.00 52.55 53.08 2qqk s ASP 86 Cb 0.00 -1.64 0.11 0.00 1.01 0.00 0.00 42.92 42.40 2qqk s ASP 86 CO 0.03 0.32 0.94 0.72 0.21 0.00 0.00 175.17 177.39 2qqk s PHE 87 N -0.55 -0.31 -0.14 4.23 -0.12 -1.07 -4.65 117.98 115.36 2qqk s PHE 87 Ca 0.10 0.19 -0.03 0.00 -0.05 0.00 0.00 56.93 57.14 2qqk s PHE 87 Cb -0.12 0.54 -0.03 0.00 -0.63 0.00 0.00 43.02 42.78 2qqk s PHE 87 CO 0.02 -0.50 -0.05 -1.50 -0.05 0.00 0.00 175.22 173.14 2qqk s ILE 88 N -3.02 3.78 -0.09 -4.49 2.07 -0.35 -1.54 121.20 117.55 2qqk s ILE 88 Ca 0.06 -0.41 0.01 0.00 -1.41 0.00 0.00 60.65 58.90 2qqk s ILE 88 Cb -0.01 -2.63 -0.02 0.00 0.13 0.00 0.00 42.46 39.93 2qqk s ILE 88 CO -0.08 0.52 -0.12 -1.61 -1.91 0.00 0.00 174.94 171.73 2qqk s GLU 89 N 0.13 2.97 -0.09 3.50 2.02 -0.45 -1.16 118.70 125.62 2qqk s GLU 89 Ca -0.02 -0.67 0.04 0.00 0.02 0.00 0.00 54.97 54.34 2qqk s GLU 89 Cb -0.14 -2.54 0.00 0.00 0.10 0.00 0.00 34.13 31.56 2qqk s GLU 89 CO 0.03 0.43 -0.22 0.42 0.02 0.00 0.00 175.26 175.94 2qqk s ILE 90 N -0.22 1.89 0.04 -1.63 1.09 -0.68 -1.16 121.20 120.53 2qqk s ILE 90 Ca 0.01 -0.93 0.09 0.00 -1.10 0.00 0.00 60.65 58.72 2qqk s ILE 90 Cb -0.13 -1.64 -0.03 0.00 -1.06 0.00 0.00 42.46 39.60 2qqk s ILE 90 CO 0.03 0.52 -0.25 -0.13 -0.10 0.00 0.00 174.94 175.01 2qqk s ARG 91 N 0.35 1.71 -0.65 2.79 0.52 0.53 -1.06 118.95 123.14 2qqk s ARG 91 Ca -0.17 -1.06 -0.26 0.00 -0.52 0.00 0.00 55.73 53.73 2qqk s ARG 91 Cb -0.17 -1.86 0.04 0.00 0.52 0.00 0.00 34.95 33.48 2qqk s ARG 91 CO 0.08 0.48 1.15 0.34 0.02 0.00 0.00 175.30 177.36 2qqk s ASP 92 N -1.19 6.27 0.00 0.23 2.15 0.12 -1.93 116.67 122.32 2qqk s ASP 92 Ca 0.11 -0.38 0.00 0.00 0.43 0.00 0.00 52.55 52.71 2qqk s ASP 92 Cb -0.10 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 40.01 2qqk s ASP 92 CO 0.02 -1.57 0.00 0.61 -0.17 0.00 0.00 175.17 174.05 2qqk n GLY 93 N 5.24 1.33 3.56 2.66 0.00 -0.84 -3.80 105.19 113.33 2qqk n GLY 93 Ca 0.03 -0.98 -0.15 0.00 0.00 0.00 0.00 46.02 44.92 2qqk n GLY 93 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qqk s ASP 94 N -4.00 -0.57 0.24 1.61 2.15 -1.26 -2.72 116.67 112.12 2qqk s ASP 94 Ca 0.00 0.71 0.00 0.00 0.43 0.00 0.00 52.55 53.69 2qqk s ASP 94 Cb 0.00 0.59 0.00 0.00 -0.30 0.00 0.00 42.92 43.21 2qqk s ASP 94 CO 0.00 -0.46 0.00 -1.54 -0.17 0.00 0.00 175.17 173.00 2qqk n SER 95 N 1.12 -3.52 0.28 -0.34 3.41 -1.26 -4.12 113.62 109.19 2qqk n SER 95 Ca -0.15 0.54 0.18 0.00 -0.26 0.00 0.00 58.87 59.17 2qqk n SER 95 Cb 0.57 -2.07 0.72 0.00 -0.26 0.00 0.00 64.21 63.17 2qqk n SER 95 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2qqk h GLU 96 N -0.60 0.00 -0.01 4.33 4.81 -2.00 -2.96 114.58 118.15 2qqk h GLU 96 Ca -0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2qqk h GLU 96 Cb 0.59 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.97 2qqk h GLU 96 CO 0.03 0.00 -0.18 -1.13 -0.73 0.00 0.00 179.01 177.00 2qqk n SER 97 N -3.10 0.80 -4.63 1.04 3.41 -1.26 -4.91 113.62 104.97 2qqk n SER 97 Ca 0.00 -0.79 -0.29 0.00 -0.26 0.00 0.00 58.87 57.53 2qqk n SER 97 Cb 0.29 0.04 0.18 0.00 -0.26 0.00 0.00 64.21 64.46 2qqk n SER 97 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qqk s ALA 98 N -2.46 0.81 0.36 7.33 0.00 -1.12 -4.94 121.76 121.73 2qqk s ALA 98 Ca 0.27 0.02 -0.28 0.00 0.00 0.00 0.00 51.96 51.97 2qqk s ALA 98 Cb 0.20 -3.26 -0.11 0.00 0.00 0.00 0.00 23.12 19.95 2qqk s ALA 98 CO 0.49 -2.97 1.48 -0.25 0.00 0.00 0.00 175.76 174.51 2qqk n ASP 99 N -4.33 3.69 -4.56 0.00 8.00 -1.25 -4.63 116.55 113.48 2qqk n ASP 99 Ca 0.06 1.21 -0.41 0.00 0.71 0.00 0.00 54.79 56.37 2qqk n ASP 99 Cb 0.54 -1.60 -0.03 0.00 -0.02 0.00 0.00 41.12 40.01 2qqk n ASP 99 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2qqk s LEU 100 N -1.68 3.28 0.19 0.64 2.96 -1.26 0.12 118.68 122.92 2qqk s LEU 100 Ca 0.55 0.02 -0.04 0.00 -0.22 0.00 0.00 54.13 54.43 2qqk s LEU 100 Cb -0.49 -2.73 0.10 0.00 0.50 0.00 0.00 46.19 43.57 2qqk s LEU 100 CO 0.61 -1.93 1.52 -0.07 -1.32 0.00 0.00 176.35 175.16 2qqk h LEU 101 N 13.90 0.70 -7.00 -0.68 3.38 -1.43 -3.48 115.31 120.71 2qqk h LEU 101 Ca -0.27 -0.35 0.20 0.00 0.09 0.00 0.00 57.88 57.55 2qqk h LEU 101 Cb 1.09 -0.20 -0.28 0.00 0.09 0.00 0.00 40.66 41.37 2qqk h LEU 101 CO 1.23 1.07 0.84 -0.83 0.09 0.00 0.00 178.44 180.84 2qqk s GLY 102 N -4.05 0.06 -0.22 0.83 0.00 -1.08 -4.99 107.32 97.87 2qqk s GLY 102 Ca -0.08 2.80 0.00 0.00 0.00 0.00 0.00 44.72 47.44 2qqk s GLY 102 CO 0.85 1.27 -0.06 1.25 0.00 0.00 0.00 173.10 176.41 2qqk s LYS 103 N -0.80 1.62 0.12 2.90 2.36 -1.26 -1.69 119.74 122.99 2qqk s LYS 103 Ca 0.06 -0.86 0.08 0.00 -2.55 0.00 0.00 55.97 52.70 2qqk s LYS 103 Cb -0.02 -2.44 -0.04 0.00 -1.05 0.00 0.00 37.83 34.28 2qqk s LYS 103 CO -0.07 -0.54 -0.19 -1.01 1.55 0.00 0.00 175.35 175.08 2qqk s HIS 104 N 1.46 1.71 0.00 4.03 3.76 -0.31 -4.97 115.29 120.96 2qqk s HIS 104 Ca -0.04 -0.45 0.00 0.00 -0.15 0.00 0.00 55.06 54.43 2qqk s HIS 104 Cb -0.18 -0.91 0.00 0.00 1.11 0.00 0.00 32.58 32.60 2qqk s HIS 104 CO -0.07 0.22 0.00 0.00 -0.85 0.00 0.00 174.74 174.04 2qqk n GLY 106 N 0.00 -0.22 0.77 0.00 0.00 -1.11 -4.34 105.19 100.30 2qqk n GLY 106 Ca 0.00 -1.02 0.09 0.00 0.00 0.00 0.00 46.02 45.08 2qqk n GLY 106 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2qqk n ASN 107 N -0.53 2.71 -4.35 1.61 5.03 -1.26 -2.24 115.26 116.22 2qqk n ASN 107 Ca 0.00 -1.79 -0.40 0.00 0.87 0.00 0.00 54.58 53.26 2qqk n ASN 107 Cb 0.00 -0.10 -0.11 0.00 -1.02 0.00 0.00 39.78 38.55 2qqk n ASN 107 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2qqk s ILE 108 N -1.32 4.37 0.63 2.41 1.01 -1.26 -4.55 121.20 122.48 2qqk s ILE 108 Ca 0.24 -0.92 -0.19 0.00 0.00 0.00 0.00 60.65 59.79 2qqk s ILE 108 Cb 0.16 -3.44 -0.02 0.00 0.01 0.00 0.00 42.46 39.17 2qqk s ILE 108 CO 0.22 -0.21 1.30 0.00 0.00 0.00 0.00 174.94 176.26 2qqk s ALA 109 N 1.52 2.47 0.84 9.38 0.00 -1.26 -4.82 121.76 129.88 2qqk s ALA 109 Ca 0.01 1.23 -0.14 0.00 0.00 0.00 0.00 51.96 53.07 2qqk s ALA 109 Cb -0.19 -3.55 0.04 0.00 0.00 0.00 0.00 23.12 19.41 2qqk s ALA 109 CO 0.06 -1.54 0.74 -2.30 0.00 0.00 0.00 175.76 172.72 2qqk n PRO 110 N -1.73 0.00 -1.78 0.00 -0.02 -1.26 -5.00 135.00 125.21 2qqk n PRO 110 Ca 0.15 0.06 -0.31 0.00 -2.02 0.00 0.00 63.50 61.38 2qqk n PRO 110 Cb 0.48 -2.07 0.04 0.00 -0.02 0.00 0.00 33.50 31.93 2qqk n PRO 110 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2qqk s PRO 111 N -3.62 2.99 0.17 0.52 0.04 -1.26 -4.60 135.00 129.24 2qqk s PRO 111 Ca 0.65 0.66 -0.32 0.00 0.04 0.00 0.00 61.00 62.03 2qqk s PRO 111 Cb -0.27 -2.02 -0.16 0.00 0.04 0.00 0.00 34.50 32.08 2qqk s PRO 111 CO 0.59 -0.98 0.97 2.41 0.04 0.00 0.00 177.00 180.02 2qqk n THR 112 N -3.01 1.19 -4.65 1.26 -1.04 -1.26 -4.86 114.28 101.91 2qqk n THR 112 Ca 0.07 -0.30 -0.27 0.00 -2.04 0.00 0.00 64.05 61.51 2qqk n THR 112 Cb 0.55 -0.52 -0.17 0.00 -1.82 0.00 0.00 70.33 68.37 2qqk n THR 112 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2qqk s ILE 113 N -0.49 1.41 -0.06 12.58 1.01 -1.04 -4.99 121.20 129.62 2qqk s ILE 113 Ca 0.72 -0.62 0.05 0.00 0.00 0.00 0.00 60.65 60.79 2qqk s ILE 113 Cb -0.91 -1.27 -0.02 0.00 0.01 0.00 0.00 42.46 40.27 2qqk s ILE 113 CO 0.55 0.42 -0.21 -0.63 0.00 0.00 0.00 174.94 175.07 2qqk s ILE 114 N 0.72 2.46 0.52 2.92 1.01 -1.26 -0.82 121.20 126.75 2qqk s ILE 114 Ca -0.13 -0.93 -0.21 0.00 0.00 0.00 0.00 60.65 59.38 2qqk s ILE 114 Cb -0.16 -1.93 -0.06 0.00 0.01 0.00 0.00 42.46 40.33 2qqk s ILE 114 CO 0.03 0.57 1.21 -0.55 0.00 0.00 0.00 174.94 176.20 2qqk s SER 115 N -0.32 5.73 0.02 3.58 0.15 0.12 -4.97 113.70 118.01 2qqk s SER 115 Ca 0.02 2.39 0.14 0.00 0.70 0.00 0.00 55.95 59.20 2qqk s SER 115 Cb -0.13 -2.61 -0.18 0.00 -1.71 0.00 0.00 66.02 61.40 2qqk s SER 115 CO 0.02 -1.23 0.79 0.77 1.20 0.00 0.00 173.24 174.80 2qqk h SER 116 N 1.57 0.00 0.00 5.45 4.64 -1.91 -3.43 113.55 119.87 2qqk h SER 116 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 2qqk h SER 116 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2qqk h SER 116 CO 0.58 0.80 0.00 0.61 -0.87 0.00 0.00 176.83 177.95 2qqk n GLY 117 N 1.46 2.76 0.27 -0.77 0.00 -1.26 -5.05 105.19 102.60 2qqk n GLY 117 Ca -0.12 -1.80 0.09 0.00 0.00 0.00 0.00 46.02 44.19 2qqk n GLY 117 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qqk n SER 118 N 0.00 2.24 -3.82 1.61 3.41 -1.26 -4.22 113.62 111.58 2qqk n SER 118 Ca 0.00 -3.32 -0.13 0.00 -0.26 0.00 0.00 58.87 55.16 2qqk n SER 118 Cb 0.00 -0.47 -0.13 0.00 -0.26 0.00 0.00 64.21 63.35 2qqk n SER 118 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2qqk s MET 119 N -2.98 0.14 0.15 4.33 -1.94 -1.26 -0.66 119.30 117.08 2qqk s MET 119 Ca 0.34 0.20 0.10 0.00 -1.71 0.00 0.00 55.69 54.63 2qqk s MET 119 Cb 0.31 0.04 -0.04 0.00 2.01 0.00 0.00 34.83 37.15 2qqk s MET 119 CO 0.00 -0.04 -0.22 -0.51 -0.01 0.00 0.00 175.02 174.25 2qqk s LEU 120 N 0.20 2.52 -0.13 -0.03 1.43 0.02 -1.99 118.68 120.70 2qqk s LEU 120 Ca -0.01 -0.72 0.01 0.00 -1.03 0.00 0.00 54.13 52.38 2qqk s LEU 120 Cb -0.02 -1.33 -0.01 0.00 0.03 0.00 0.00 46.19 44.86 2qqk s LEU 120 CO -0.01 0.15 -0.17 -0.47 0.23 0.00 0.00 176.35 176.09 2qqk s TYR 121 N -1.32 2.73 -0.06 0.29 5.04 -0.81 -1.55 117.35 121.67 2qqk s TYR 121 Ca 0.18 -0.91 0.05 0.00 -2.44 0.00 0.00 57.07 53.95 2qqk s TYR 121 Cb -0.09 -1.83 -0.01 0.00 0.35 0.00 0.00 41.96 40.38 2qqk s TYR 121 CO 0.09 -0.37 -0.23 0.42 -1.34 0.00 0.00 175.55 174.12 2qqk s ILE 122 N 0.53 1.91 -0.12 3.14 1.01 -0.17 -0.34 121.20 127.15 2qqk s ILE 122 Ca -0.11 -0.98 -0.01 0.00 0.00 0.00 0.00 60.65 59.56 2qqk s ILE 122 Cb -0.16 -1.62 0.03 0.00 0.01 0.00 0.00 42.46 40.71 2qqk s ILE 122 CO 0.04 0.53 -0.07 -0.75 0.00 0.00 0.00 174.94 174.70 2qqk s LYS 123 N -0.05 1.46 -0.18 2.79 2.20 -0.31 -0.53 119.74 125.12 2qqk s LYS 123 Ca -0.06 -0.29 -0.15 0.00 -0.36 0.00 0.00 55.97 55.11 2qqk s LYS 123 Cb -0.14 -1.65 -0.04 0.00 -1.51 0.00 0.00 37.83 34.49 2qqk s LYS 123 CO 0.04 -0.31 0.35 0.12 -0.36 0.00 0.00 175.35 175.19 2qqk s PHE 124 N 1.71 3.42 -0.00 4.03 5.36 -0.65 -1.34 117.98 130.50 2qqk s PHE 124 Ca 0.04 0.60 0.05 0.00 -0.96 0.00 0.00 56.93 56.67 2qqk s PHE 124 Cb -0.13 -2.44 -0.03 0.00 -0.34 0.00 0.00 43.02 40.08 2qqk s PHE 124 CO -0.08 0.11 -0.16 0.99 -1.46 0.00 0.00 175.22 174.62 2qqk s THR 125 N 0.89 2.95 0.02 0.12 2.01 -0.59 -0.68 115.64 120.36 2qqk s THR 125 Ca 0.18 -0.95 0.02 0.00 0.31 0.00 0.00 61.69 61.25 2qqk s THR 125 Cb -0.14 -2.20 -0.02 0.00 0.01 0.00 0.00 72.50 70.15 2qqk s THR 125 CO 0.06 0.46 -0.06 -0.55 -0.69 0.00 0.00 174.62 173.84 2qqk s SER 126 N -1.10 0.66 0.00 3.53 0.15 -1.19 -2.61 113.70 113.14 2qqk s SER 126 Ca 0.13 -0.39 0.00 0.00 0.70 0.00 0.00 55.95 56.40 2qqk s SER 126 Cb -0.11 0.01 0.00 0.00 -1.71 0.00 0.00 66.02 64.22 2qqk s SER 126 CO 0.03 -0.13 0.48 -0.67 1.20 0.00 0.00 173.24 174.15 2qqk n ASP 127 N 1.98 -0.07 -1.21 5.45 -0.08 -1.26 -2.77 116.55 118.59 2qqk n ASP 127 Ca -0.20 -0.97 0.00 0.00 -1.51 0.00 0.00 54.79 52.12 2qqk n ASP 127 Cb 0.56 0.02 0.00 0.00 2.34 0.00 0.00 41.12 44.04 2qqk n ASP 127 CO 0.00 0.00 0.00 1.67 0.12 0.00 0.00 177.20 178.99 2qqk n GLN 131 N 0.00 -3.45 0.00 -0.67 -0.06 -1.26 -3.56 117.38 108.38 2qqk n GLN 131 Ca -0.02 2.56 0.00 0.00 -2.00 0.00 0.00 57.00 57.54 2qqk n GLN 131 Cb 0.46 -2.87 0.00 0.00 -4.06 0.00 0.00 30.24 23.78 2qqk n GLN 131 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2qqk n GLY 132 N -0.72 4.16 0.28 1.69 0.00 -1.26 -4.35 105.19 104.98 2qqk n GLY 132 Ca 0.00 -1.27 0.16 0.00 0.00 0.00 0.00 46.02 44.90 2qqk n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qqk h ALA 133 N 0.00 1.23 0.00 4.61 0.00 -1.83 -2.29 119.26 120.98 2qqk h ALA 133 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2qqk h ALA 133 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2qqk h ALA 133 CO 0.00 0.08 0.00 0.41 0.00 0.00 0.00 179.25 179.74 2qqk n GLY 134 N -0.76 0.20 3.13 0.00 0.00 0.23 -4.48 105.19 103.50 2qqk n GLY 134 Ca -0.02 -1.58 -0.08 0.00 0.00 0.00 0.00 46.02 44.34 2qqk n GLY 134 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qqk s PHE 135 N 0.00 0.57 -0.01 1.61 -0.12 -1.26 -0.13 117.98 118.64 2qqk s PHE 135 Ca 0.00 -1.05 0.00 0.00 -0.05 0.00 0.00 56.93 55.83 2qqk s PHE 135 Cb 0.00 -0.37 0.01 0.00 -0.63 0.00 0.00 43.02 42.03 2qqk s PHE 135 CO 0.00 -0.45 -0.00 0.45 -0.05 0.00 0.00 175.22 175.16 2qqk s SER 136 N -2.95 0.16 0.15 1.98 0.15 -1.26 -1.48 113.70 110.44 2qqk s SER 136 Ca 0.12 -0.01 0.05 0.00 0.70 0.00 0.00 55.95 56.81 2qqk s SER 136 Cb 0.07 -0.05 -0.04 0.00 -1.71 0.00 0.00 66.02 64.29 2qqk s SER 136 CO -0.06 -0.02 -0.10 -1.48 1.20 0.00 0.00 173.24 172.77 2qqk s LEU 137 N 0.25 2.53 -0.07 3.45 0.05 0.56 -0.58 118.68 124.87 2qqk s LEU 137 Ca -0.02 -1.00 -0.01 0.00 0.05 0.00 0.00 54.13 53.15 2qqk s LEU 137 Cb -0.04 -0.37 -0.03 0.00 -2.05 0.00 0.00 46.19 43.70 2qqk s LEU 137 CO -0.01 -0.31 0.00 -0.13 -0.55 0.00 0.00 176.35 175.35 2qqk s ARG 138 N -3.68 2.94 0.16 1.48 0.52 -0.39 -1.34 118.95 118.63 2qqk s ARG 138 Ca 0.16 -0.45 0.10 0.00 -0.52 0.00 0.00 55.73 55.03 2qqk s ARG 138 Cb 0.02 -2.77 -0.04 0.00 0.52 0.00 0.00 34.95 32.68 2qqk s ARG 138 CO 0.01 0.69 -0.23 1.52 0.02 0.00 0.00 175.30 177.30 2qqk s TYR 139 N -0.93 2.14 0.26 -0.53 -0.85 -0.52 -0.70 117.35 116.21 2qqk s TYR 139 Ca 0.15 -0.39 -0.21 0.00 -0.52 0.00 0.00 57.07 56.10 2qqk s TYR 139 Cb -0.11 -1.10 0.05 0.00 0.38 0.00 0.00 41.96 41.17 2qqk s TYR 139 CO 0.04 0.39 0.85 -1.83 -1.52 0.00 0.00 175.55 173.48 2qqk s GLU 140 N -2.43 1.66 0.15 -3.49 -1.05 -0.97 -2.90 118.70 109.67 2qqk s GLU 140 Ca 0.16 -0.98 -0.30 0.00 -0.15 0.00 0.00 54.97 53.70 2qqk s GLU 140 Cb -0.08 0.52 -0.07 0.00 -0.44 0.00 0.00 34.13 34.06 2qqk s GLU 140 CO 0.07 -0.77 0.97 0.96 0.95 0.00 0.00 175.26 177.45 2qqk s ILE 141 N -3.14 4.32 -0.09 1.83 -5.25 -1.25 -1.53 121.20 116.08 2qqk s ILE 141 Ca 0.14 2.02 -0.05 0.00 -0.99 0.00 0.00 60.65 61.76 2qqk s ILE 141 Cb -0.04 -4.29 -0.04 0.00 2.95 0.00 0.00 42.46 41.04 2qqk s ILE 141 CO 0.06 0.36 0.13 0.12 -1.79 0.00 0.00 174.94 173.82 2qqk s PHE 142 N -0.32 3.53 -0.18 1.37 5.36 0.23 -4.76 117.98 123.20 2qqk s PHE 142 Ca 0.46 0.45 -0.01 0.00 -0.96 0.00 0.00 56.93 56.87 2qqk s PHE 142 Cb -0.25 -1.89 0.00 0.00 -0.34 0.00 0.00 43.02 40.54 2qqk s PHE 142 CO 0.31 0.68 -0.14 0.21 -1.46 0.00 0.00 175.22 174.83 2qqk s LYS 143 N -1.20 3.20 0.12 10.12 2.20 -1.26 -1.68 119.74 131.25 2qqk s LYS 143 Ca 0.17 -0.74 0.17 0.00 -0.36 0.00 0.00 55.97 55.21 2qqk s LYS 143 Cb -0.12 -2.70 -0.08 0.00 -1.51 0.00 0.00 37.83 33.42 2qqk s LYS 143 CO 0.07 -0.09 0.99 1.79 -0.36 0.00 0.00 175.35 177.75 2qqk h THR 144 N 5.74 0.53 0.00 3.43 1.35 -1.98 -3.49 112.91 118.50 2qqk h THR 144 Ca -0.38 -1.95 0.00 0.00 -0.55 0.00 0.00 66.41 63.53 2qqk h THR 144 Cb 1.17 2.07 0.00 0.00 -1.73 0.00 0.00 68.15 69.66 2qqk h THR 144 CO 0.59 0.30 0.00 0.61 -0.25 0.00 0.00 175.52 176.78 2qqk n GLY 145 N 1.34 2.60 3.28 5.82 0.00 -1.26 -5.06 105.19 111.91 2qqk n GLY 145 Ca -0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.59 2qqk n GLY 145 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qqk n SER 146 N 0.00 -3.18 -4.65 1.61 3.41 -1.26 -4.95 113.62 104.61 2qqk n SER 146 Ca 0.00 0.50 -0.29 0.00 -0.26 0.00 0.00 58.87 58.83 2qqk n SER 146 Cb 0.00 -0.99 0.18 0.00 -0.26 0.00 0.00 64.21 63.14 2qqk n SER 146 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2qqk s GLU 147 N -2.05 0.37 -0.70 4.33 2.02 -1.26 -4.98 118.70 116.43 2qqk s GLU 147 Ca 0.56 0.42 0.03 0.00 0.02 0.00 0.00 54.97 56.00 2qqk s GLU 147 Cb -0.35 -1.74 0.35 0.00 0.10 0.00 0.00 34.13 32.49 2qqk s GLU 147 CO 0.67 -2.75 1.31 -0.25 0.02 0.00 0.00 175.26 174.26 2qqk n ASP 148 N -4.17 5.56 0.25 -0.19 9.92 -1.26 -4.90 116.55 121.77 2qqk n ASP 148 Ca 0.06 -3.71 0.14 0.00 -0.53 0.00 0.00 54.79 50.75 2qqk n ASP 148 Cb 0.58 -0.75 0.63 0.00 -0.64 0.00 0.00 41.12 40.94 2qqk n ASP 148 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2qqk n SER 150 N -3.00 2.59 -4.46 0.00 7.64 -1.26 -4.93 113.62 110.20 2qqk n SER 150 Ca 0.02 1.06 -0.33 0.00 1.01 0.00 0.00 58.87 60.62 2qqk n SER 150 Cb 0.62 -1.18 -0.13 0.00 -1.01 0.00 0.00 64.21 62.50 2qqk n SER 150 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2qqk s LYS 151 N 3.66 3.08 0.50 1.43 1.02 -1.20 -4.98 119.74 123.25 2qqk s LYS 151 Ca 0.97 -0.64 -0.07 0.00 0.02 0.00 0.00 55.97 56.26 2qqk s LYS 151 Cb -1.00 -2.60 -0.04 0.00 -0.52 0.00 0.00 37.83 33.67 2qqk s LYS 151 CO 0.63 0.41 0.84 -0.80 -0.92 0.00 0.00 175.35 175.51 2qqk s ASN 152 N -0.15 6.28 -0.07 2.83 0.01 -1.26 -2.38 114.94 120.20 2qqk s ASN 152 Ca 0.00 1.05 -0.01 0.00 -0.71 0.00 0.00 52.86 53.19 2qqk s ASN 152 Cb -0.13 -2.30 0.03 0.00 0.41 0.00 0.00 41.25 39.25 2qqk s ASN 152 CO 0.03 -0.63 -0.00 -0.36 -1.51 0.00 0.00 177.10 174.63 2qqk s PHE 153 N -2.80 0.67 -0.18 2.20 0.08 -0.44 -4.93 117.98 112.59 2qqk s PHE 153 Ca 0.49 -0.17 0.09 0.00 0.12 0.00 0.00 56.93 57.46 2qqk s PHE 153 Cb -0.10 -0.78 -0.17 0.00 -0.57 0.00 0.00 43.02 41.39 2qqk s PHE 153 CO 0.46 -0.31 -0.04 2.41 -0.10 0.00 0.00 175.22 177.64 2qqk n THR 154 N 5.02 1.13 -1.74 0.64 -1.04 -1.26 -2.56 114.28 114.48 2qqk n THR 154 Ca -0.09 -0.59 -0.41 0.00 -2.04 0.00 0.00 64.05 60.91 2qqk n THR 154 Cb 0.50 -0.83 0.01 0.00 -1.82 0.00 0.00 70.33 68.18 2qqk n THR 154 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2qqk n SER 155 N -2.79 3.16 0.27 8.00 2.88 -1.26 -4.97 113.62 118.91 2qqk n SER 155 Ca -0.30 1.17 -0.16 0.00 -1.33 0.00 0.00 58.87 58.25 2qqk n SER 155 Cb 0.97 -1.56 -0.08 0.00 -0.75 0.00 0.00 64.21 62.79 2qqk n SER 155 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2qqk h PRO 156 N 2.51 -0.63 -3.08 -1.46 0.11 -1.94 -3.36 132.00 124.16 2qqk h PRO 156 Ca -0.49 0.04 -0.72 0.00 0.11 0.00 0.00 66.00 64.94 2qqk h PRO 156 Cb 1.27 0.14 -0.34 0.00 0.11 0.00 0.00 31.00 32.18 2qqk h PRO 156 CO 0.62 -0.40 0.08 0.27 -0.21 0.00 0.00 178.00 178.36 2qqk n ASN 157 N -5.36 4.75 -4.88 -2.05 6.94 -1.26 -2.38 115.26 111.03 2qqk n ASN 157 Ca -0.12 -3.23 -0.21 0.00 -0.02 0.00 0.00 54.58 51.00 2qqk n ASN 157 Cb 0.28 -1.07 -0.03 0.00 -2.36 0.00 0.00 39.78 36.60 2qqk n ASN 157 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 2qqk s GLY 158 N -0.72 1.66 0.14 4.83 0.00 -1.19 -5.03 107.32 107.03 2qqk s GLY 158 Ca 0.31 -1.56 0.05 0.00 0.00 0.00 0.00 44.72 43.51 2qqk s GLY 158 CO -0.05 -1.51 -0.11 -0.51 0.00 0.00 0.00 173.10 170.92 2qqk s THR 159 N -2.24 1.22 0.01 0.90 -4.23 -1.26 -1.86 115.64 108.18 2qqk s THR 159 Ca 0.40 -1.99 -0.04 0.00 -1.18 0.00 0.00 61.69 58.88 2qqk s THR 159 Cb -0.07 -1.78 -0.01 0.00 1.34 0.00 0.00 72.50 71.99 2qqk s THR 159 CO 0.27 -0.67 0.07 0.27 -0.54 0.00 0.00 174.62 174.02 2qqk s ILE 160 N -3.05 0.08 0.20 2.99 -5.25 -0.96 -4.96 121.20 110.25 2qqk s ILE 160 Ca 0.15 -0.70 -0.23 0.00 -0.99 0.00 0.00 60.65 58.89 2qqk s ILE 160 Cb 0.01 -0.33 0.05 0.00 2.95 0.00 0.00 42.46 45.13 2qqk s ILE 160 CO 0.01 -0.38 0.70 -1.83 -1.79 0.00 0.00 174.94 171.65 2qqk s GLU 161 N -1.25 1.47 -0.17 0.37 -1.05 -1.26 -0.82 118.70 115.98 2qqk s GLU 161 Ca -0.14 -0.70 -0.29 0.00 -0.15 0.00 0.00 54.97 53.69 2qqk s GLU 161 Cb -0.08 0.57 -0.02 0.00 -0.44 0.00 0.00 34.13 34.16 2qqk s GLU 161 CO 0.00 -0.66 1.40 -1.54 0.95 0.00 0.00 175.26 175.41 2qqk s SER 162 N -2.82 6.77 0.23 0.83 1.04 -0.78 -4.94 113.70 114.04 2qqk s SER 162 Ca 0.06 1.71 -0.28 0.00 0.48 0.00 0.00 55.95 57.93 2qqk s SER 162 Cb -0.03 -2.54 -0.16 0.00 0.10 0.00 0.00 66.02 63.39 2qqk s SER 162 CO -0.03 -0.91 0.69 -2.65 0.98 0.00 0.00 173.24 171.32 2qqk n PRO 163 N 6.97 0.49 -0.01 4.02 -0.02 -1.26 -2.11 135.00 143.08 2qqk n PRO 163 Ca 0.15 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 2qqk n PRO 163 Cb 0.45 -1.30 0.00 0.00 -0.02 0.00 0.00 33.50 32.62 2qqk n PRO 163 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qqk n GLY 164 N 1.72 0.76 3.77 -1.23 0.00 -1.26 -4.54 105.19 104.40 2qqk n GLY 164 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 2qqk n GLY 164 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2qqk s PHE 165 N -2.27 2.66 -0.87 1.61 5.36 -0.89 -1.38 117.98 122.20 2qqk s PHE 165 Ca 0.00 1.02 0.27 0.00 -0.96 0.00 0.00 56.93 57.26 2qqk s PHE 165 Cb 0.00 -4.03 1.03 0.00 -0.34 0.00 0.00 43.02 39.67 2qqk s PHE 165 CO 0.00 -3.21 1.85 -0.35 -1.46 0.00 0.00 175.22 172.05 2qqk n PRO 166 N 1.15 0.13 -1.23 10.12 -0.04 -1.26 -5.08 135.00 138.79 2qqk n PRO 166 Ca 0.04 0.11 -0.30 0.00 -0.04 0.00 0.00 63.50 63.31 2qqk n PRO 166 Cb 0.39 -1.65 0.22 0.00 -0.04 0.00 0.00 33.50 32.42 2qqk n PRO 166 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2qqk s GLU 167 N -3.05 -0.78 0.59 0.54 -1.05 -0.48 -4.97 118.70 109.50 2qqk s GLU 167 Ca 0.12 -0.08 -0.20 0.00 -0.15 0.00 0.00 54.97 54.66 2qqk s GLU 167 Cb 0.16 -1.65 -0.03 0.00 -0.44 0.00 0.00 34.13 32.16 2qqk s GLU 167 CO 0.56 -3.42 1.32 1.63 0.95 0.00 0.00 175.26 176.30 2qqk n LYS 168 N -4.55 1.44 -3.01 -4.83 5.02 -1.26 -4.83 118.16 106.14 2qqk n LYS 168 Ca 0.13 0.54 -0.40 0.00 -2.02 0.00 0.00 58.31 56.56 2qqk n LYS 168 Cb 0.59 -2.54 -0.05 0.00 -0.02 0.00 0.00 35.03 33.00 2qqk n LYS 168 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 2qqk s TYR 169 N -1.33 3.80 1.05 2.13 -0.85 -1.26 -4.80 117.35 116.09 2qqk s TYR 169 Ca 0.76 1.51 -0.17 0.00 -0.52 0.00 0.00 57.07 58.65 2qqk s TYR 169 Cb -0.40 -2.77 0.06 0.00 0.38 0.00 0.00 41.96 39.23 2qqk s TYR 169 CO 0.46 0.39 0.08 -2.30 -1.52 0.00 0.00 175.55 172.65 2qqk n PRO 170 N 2.28 -1.00 -1.99 -3.49 -0.02 -1.26 -4.73 135.00 124.79 2qqk n PRO 170 Ca -0.04 -0.27 -0.29 0.00 -2.02 0.00 0.00 63.50 60.87 2qqk n PRO 170 Cb 0.50 -1.71 0.04 0.00 -0.02 0.00 0.00 33.50 32.30 2qqk n PRO 170 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2qqk s HIS 171 N -2.28 3.33 -1.01 6.00 3.76 -1.26 -4.63 115.29 119.19 2qqk s HIS 171 Ca 0.55 0.98 -0.16 0.00 -0.15 0.00 0.00 55.06 56.28 2qqk s HIS 171 Cb -0.15 -2.98 0.01 0.00 1.11 0.00 0.00 32.58 30.57 2qqk s HIS 171 CO 0.67 -1.08 0.68 0.09 -0.85 0.00 0.00 174.74 174.25 2qqk n ASN 172 N -2.91 -5.04 -4.24 1.40 4.13 -1.04 -4.89 115.26 102.67 2qqk n ASN 172 Ca 0.06 -1.00 -0.32 0.00 1.68 0.00 0.00 54.58 55.00 2qqk n ASN 172 Cb 0.57 -2.42 -0.16 0.00 -1.54 0.00 0.00 39.78 36.23 2qqk n ASN 172 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2qqk s LEU 173 N -5.98 2.25 -0.40 3.41 2.96 -1.20 -4.93 118.68 114.79 2qqk s LEU 173 Ca 0.26 -0.52 0.02 0.00 -0.22 0.00 0.00 54.13 53.67 2qqk s LEU 173 Cb -0.12 -1.47 0.12 0.00 0.50 0.00 0.00 46.19 45.21 2qqk s LEU 173 CO 0.90 0.13 0.16 -1.81 -1.32 0.00 0.00 176.35 174.40 2qqk s ASP 174 N 0.54 4.20 0.02 3.68 1.01 -1.25 -1.76 116.67 123.11 2qqk s ASP 174 Ca -0.12 -2.34 0.06 0.00 0.71 0.00 0.00 52.55 50.86 2qqk s ASP 174 Cb -0.17 -1.29 -0.02 0.00 1.01 0.00 0.00 42.92 42.45 2qqk s ASP 174 CO 0.04 -0.33 -0.19 0.00 0.21 0.00 0.00 175.17 174.91 2qqk s THR 176 N -0.66 1.74 -0.24 0.00 -4.23 -1.26 -0.19 115.64 110.81 2qqk s THR 176 Ca 0.06 -0.77 -0.08 0.00 -1.18 0.00 0.00 61.69 59.72 2qqk s THR 176 Cb -0.08 -1.63 -0.03 0.00 1.34 0.00 0.00 72.50 72.10 2qqk s THR 176 CO 0.01 0.46 0.08 -0.36 -0.54 0.00 0.00 174.62 174.26 2qqk s PHE 177 N 1.41 3.11 -0.08 3.99 0.40 -0.27 -3.23 117.98 123.31 2qqk s PHE 177 Ca 0.04 -0.33 0.04 0.00 -0.60 0.00 0.00 56.93 56.09 2qqk s PHE 177 Cb -0.13 -2.23 -0.01 0.00 0.51 0.00 0.00 43.02 41.16 2qqk s PHE 177 CO -0.11 -0.29 -0.22 0.99 0.70 0.00 0.00 175.22 176.28 2qqk s THR 178 N 1.49 2.24 -0.22 0.64 2.01 -1.00 0.35 115.64 121.15 2qqk s THR 178 Ca 0.06 -0.98 -0.05 0.00 0.31 0.00 0.00 61.69 61.03 2qqk s THR 178 Cb -0.15 -1.85 -0.02 0.00 0.01 0.00 0.00 72.50 70.49 2qqk s THR 178 CO 0.04 0.56 0.01 -0.63 -0.69 0.00 0.00 174.62 173.91 2qqk s ILE 179 N 0.07 3.88 -0.08 1.82 1.01 0.13 -1.32 121.20 126.70 2qqk s ILE 179 Ca -0.10 -0.33 -0.02 0.00 0.00 0.00 0.00 60.65 60.21 2qqk s ILE 179 Cb -0.16 -2.77 -0.03 0.00 0.01 0.00 0.00 42.46 39.51 2qqk s ILE 179 CO 0.06 0.40 0.01 -0.76 0.00 0.00 0.00 174.94 174.65 2qqk s LEU 180 N 1.31 3.60 0.06 2.97 1.43 -1.06 -1.52 118.68 125.47 2qqk s LEU 180 Ca 0.04 0.14 0.05 0.00 -1.03 0.00 0.00 54.13 53.33 2qqk s LEU 180 Cb -0.15 -1.84 -0.03 0.00 0.03 0.00 0.00 46.19 44.20 2qqk s LEU 180 CO 0.01 0.37 -0.13 0.00 0.23 0.00 0.00 176.35 176.83 2qqk s ALA 181 N -0.91 1.06 0.56 4.21 0.00 0.25 -4.67 121.76 122.26 2qqk s ALA 181 Ca 0.14 -0.93 -0.17 0.00 0.00 0.00 0.00 51.96 51.00 2qqk s ALA 181 Cb -0.11 -0.08 -0.05 0.00 0.00 0.00 0.00 23.12 22.87 2qqk s ALA 181 CO 0.03 0.14 1.05 0.21 0.00 0.00 0.00 175.76 177.19 2qqk s LYS 182 N -1.63 3.47 0.00 0.00 2.20 -1.26 -4.74 119.74 117.78 2qqk s LYS 182 Ca -0.03 1.23 0.00 0.00 -0.36 0.00 0.00 55.97 56.81 2qqk s LYS 182 Cb -0.10 -2.05 0.00 0.00 -1.51 0.00 0.00 37.83 34.17 2qqk s LYS 182 CO 0.02 -0.69 0.00 -2.30 -0.36 0.00 0.00 175.35 172.02 2qqk n PRO 183 N -1.74 0.00 -1.89 4.03 -0.02 -1.26 -2.58 135.00 131.53 2qqk n PRO 183 Ca 0.09 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.21 2qqk n PRO 183 Cb 0.53 0.00 0.04 0.00 -0.02 0.00 0.00 33.50 34.05 2qqk n PRO 183 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2qqk n LYS 184 N -0.41 2.91 -3.83 -0.52 5.02 -1.26 -4.92 118.16 115.14 2qqk n LYS 184 Ca 0.00 -3.68 -0.25 0.00 -2.02 0.00 0.00 58.31 52.36 2qqk n LYS 184 Cb 0.00 -2.27 -0.17 0.00 -0.02 0.00 0.00 35.03 32.57 2qqk n LYS 184 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2qqk s MET 185 N -3.90 1.03 0.22 1.97 -1.94 -1.07 -1.85 119.30 113.76 2qqk s MET 185 Ca 0.54 -0.08 -0.29 0.00 -1.71 0.00 0.00 55.69 54.16 2qqk s MET 185 Cb 0.45 -1.29 -0.09 0.00 2.01 0.00 0.00 34.83 35.91 2qqk s MET 185 CO -0.26 -0.30 0.90 -1.21 -0.01 0.00 0.00 175.02 174.14 2qqk s GLU 186 N 1.85 4.79 -0.14 2.03 2.02 -0.68 -4.70 118.70 123.87 2qqk s GLU 186 Ca 0.05 1.41 -0.23 0.00 0.02 0.00 0.00 54.97 56.22 2qqk s GLU 186 Cb -0.13 -3.28 -0.03 0.00 0.10 0.00 0.00 34.13 30.80 2qqk s GLU 186 CO -0.07 0.52 0.73 0.42 0.02 0.00 0.00 175.26 176.89 2qqk s ILE 187 N -1.14 4.98 -0.14 -1.63 1.01 -0.55 -2.00 121.20 121.72 2qqk s ILE 187 Ca 0.40 1.45 -0.04 0.00 0.00 0.00 0.00 60.65 62.45 2qqk s ILE 187 Cb -0.25 -4.05 -0.03 0.00 0.01 0.00 0.00 42.46 38.13 2qqk s ILE 187 CO 0.31 0.13 -0.00 -0.63 0.00 0.00 0.00 174.94 174.74 2qqk s ILE 188 N 1.61 4.21 -0.14 2.92 1.01 0.10 -1.84 121.20 129.07 2qqk s ILE 188 Ca 0.35 -0.25 -0.03 0.00 0.00 0.00 0.00 60.65 60.72 2qqk s ILE 188 Cb -0.17 -2.84 0.05 0.00 0.01 0.00 0.00 42.46 39.51 2qqk s ILE 188 CO 0.14 0.51 0.04 -0.22 0.00 0.00 0.00 174.94 175.41 2qqk s LEU 189 N 0.06 0.68 0.28 2.97 2.96 -0.49 -0.87 118.68 124.27 2qqk s LEU 189 Ca 0.02 -0.46 0.06 0.00 -0.22 0.00 0.00 54.13 53.53 2qqk s LEU 189 Cb -0.13 -0.41 -0.06 0.00 0.50 0.00 0.00 46.19 46.09 2qqk s LEU 189 CO 0.02 -0.28 -0.04 0.00 -1.32 0.00 0.00 176.35 174.73 2qqk s GLN 190 N 2.00 1.54 -0.04 1.98 -2.07 -0.45 -1.63 119.66 120.99 2qqk s GLN 190 Ca 0.02 -1.79 0.05 0.00 -1.82 0.00 0.00 55.36 51.83 2qqk s GLN 190 Cb -0.15 -1.07 -0.01 0.00 -1.09 0.00 0.00 33.01 30.69 2qqk s GLN 190 CO -0.07 0.00 -0.19 -0.06 -1.32 0.00 0.00 175.29 173.65 2qqk s PHE 191 N -3.08 1.85 -0.21 9.60 0.40 -1.26 -1.02 117.98 124.26 2qqk s PHE 191 Ca 0.30 -0.49 -0.15 0.00 -0.60 0.00 0.00 56.93 55.99 2qqk s PHE 191 Cb 0.04 -1.23 -0.19 0.00 0.51 0.00 0.00 43.02 42.16 2qqk s PHE 191 CO 0.12 -0.14 0.10 1.28 0.70 0.00 0.00 175.22 177.28 2qqk n LEU 192 N 2.96 2.14 -3.97 -0.37 4.32 -0.75 -4.93 117.00 116.40 2qqk n LEU 192 Ca -0.17 0.32 -0.09 0.00 -0.02 0.00 0.00 56.01 56.05 2qqk n LEU 192 Cb 0.53 -0.97 -0.10 0.00 -1.62 0.00 0.00 43.42 41.26 2qqk n LEU 192 CO 0.25 0.52 -0.26 0.27 -1.22 0.00 0.00 177.39 176.94 2qqk s ILE 193 N -2.45 0.14 -0.30 -0.08 -4.36 -1.16 -5.02 121.20 107.98 2qqk s ILE 193 Ca -0.30 -1.19 -0.01 0.00 -0.26 0.00 0.00 60.65 58.89 2qqk s ILE 193 Cb 0.08 -0.90 0.19 0.00 1.25 0.00 0.00 42.46 43.08 2qqk s ILE 193 CO 0.61 -0.66 0.65 0.12 0.24 0.00 0.00 174.94 175.91 2qqk s PHE 194 N -2.65 -1.53 -0.05 1.37 5.36 -1.26 -1.70 117.98 117.53 2qqk s PHE 194 Ca -0.05 1.42 -0.02 0.00 -0.96 0.00 0.00 56.93 57.33 2qqk s PHE 194 Cb -0.01 0.46 0.03 0.00 -0.34 0.00 0.00 43.02 43.16 2qqk s PHE 194 CO -0.05 -0.85 0.06 -0.51 -1.46 0.00 0.00 175.22 172.41 2qqk s ASP 195 N 2.86 1.20 0.00 6.13 1.11 0.21 -4.28 116.67 123.91 2qqk s ASP 195 Ca 0.17 0.05 0.00 0.00 0.18 0.00 0.00 52.55 52.94 2qqk s ASP 195 Cb -0.13 -0.15 0.00 0.00 1.07 0.00 0.00 42.92 43.71 2qqk s ASP 195 CO -0.21 -0.25 0.00 0.00 1.18 0.00 0.00 175.17 175.88 2qqk n LEU 196 N 5.30 0.00 0.00 1.23 -0.00 -0.70 -1.31 117.00 121.52 2qqk n LEU 196 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.98 2qqk n LEU 196 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.92 2qqk n LEU 196 CO 0.06 0.00 0.00 -1.22 -0.00 0.00 0.00 177.39 176.23 2qqk n TYR 210 N 0.60 0.00 -5.09 1.47 4.01 -1.26 -4.33 117.16 112.56 2qqk n TYR 210 Ca 0.00 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.45 2qqk n TYR 210 Cb 0.00 0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 38.87 2qqk n TYR 210 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2qqk s ASP 211 N -4.00 2.63 0.19 7.72 1.01 -1.26 -3.90 116.67 119.07 2qqk s ASP 211 Ca 0.00 -0.42 -0.20 0.00 0.71 0.00 0.00 52.55 52.64 2qqk s ASP 211 Cb 0.00 -0.51 0.04 0.00 1.01 0.00 0.00 42.92 43.46 2qqk s ASP 211 CO 0.00 0.24 0.57 -1.66 0.21 0.00 0.00 175.17 174.53 2qqk s TRP 212 N -0.29 -0.30 -0.09 4.23 -2.14 0.12 -4.73 118.94 115.74 2qqk s TRP 212 Ca 0.02 -0.01 0.02 0.00 2.66 0.00 0.00 56.10 58.79 2qqk s TRP 212 Cb -0.11 0.50 0.01 0.00 -3.10 0.00 0.00 33.47 30.77 2qqk s TRP 212 CO 0.01 -0.93 -0.14 -1.17 -2.66 0.00 0.00 176.95 172.07 2qqk s LEU 213 N -2.83 1.66 0.04 -4.66 2.96 0.23 -0.49 118.68 115.58 2qqk s LEU 213 Ca 0.06 -0.36 0.06 0.00 -0.22 0.00 0.00 54.13 53.67 2qqk s LEU 213 Cb -0.02 -0.95 -0.02 0.00 0.50 0.00 0.00 46.19 45.70 2qqk s LEU 213 CO -0.06 0.02 -0.18 1.51 -1.32 0.00 0.00 176.35 176.33 2qqk s ASP 214 N 0.84 2.09 -0.10 3.68 1.47 -0.43 0.79 116.67 125.00 2qqk s ASP 214 Ca -0.11 -0.48 -0.03 0.00 1.18 0.00 0.00 52.55 53.11 2qqk s ASP 214 Cb -0.15 -0.16 -0.03 0.00 -0.34 0.00 0.00 42.92 42.23 2qqk s ASP 214 CO 0.01 0.11 0.01 -0.63 0.68 0.00 0.00 175.17 175.35 2qqk s ILE 215 N -0.80 4.40 -0.03 2.11 1.01 -0.27 -0.67 121.20 126.95 2qqk s ILE 215 Ca 0.05 -0.21 0.05 0.00 0.00 0.00 0.00 60.65 60.54 2qqk s ILE 215 Cb -0.08 -2.87 -0.01 0.00 0.01 0.00 0.00 42.46 39.51 2qqk s ILE 215 CO 0.01 0.58 -0.18 0.26 0.00 0.00 0.00 174.94 175.62 2qqk s TRP 216 N -0.67 1.72 -0.68 3.97 0.52 0.13 -1.34 118.94 122.60 2qqk s TRP 216 Ca 0.11 -0.41 -0.07 0.00 0.02 0.00 0.00 56.10 55.74 2qqk s TRP 216 Cb -0.12 -1.13 -0.17 0.00 -1.15 0.00 0.00 33.47 30.90 2qqk s TRP 216 CO 0.02 -0.10 3.29 -3.47 0.02 0.00 0.00 176.95 176.71 2qqk n ASP 217 N 2.88 6.72 0.00 2.95 2.03 0.23 -2.36 116.55 129.01 2qqk n ASP 217 Ca -0.16 -2.59 0.00 0.00 0.52 0.00 0.00 54.79 52.56 2qqk n ASP 217 Cb 0.53 -1.46 0.00 0.00 -0.72 0.00 0.00 41.12 39.48 2qqk n ASP 217 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2qqk n GLY 218 N 2.76 0.50 3.74 0.27 0.00 -1.25 -4.33 105.19 106.88 2qqk n GLY 218 Ca 0.57 -1.49 -0.41 0.00 0.00 0.00 0.00 46.02 44.70 2qqk n GLY 218 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qqk s ILE 219 N -3.74 3.90 0.22 -0.61 1.01 -0.42 -3.79 121.20 117.78 2qqk s ILE 219 Ca 0.00 1.63 -0.32 0.00 0.00 0.00 0.00 60.65 61.96 2qqk s ILE 219 Cb 0.00 -4.04 -0.14 0.00 0.01 0.00 0.00 42.46 38.29 2qqk s ILE 219 CO 0.00 0.27 1.32 -2.65 0.00 0.00 0.00 174.94 173.88 2qqk n PRO 220 N 2.44 1.75 -1.78 2.79 -0.02 -1.26 -0.75 135.00 138.17 2qqk n PRO 220 Ca 0.03 0.62 -0.19 0.00 -2.02 0.00 0.00 63.50 61.95 2qqk n PRO 220 Cb 0.46 -2.22 -0.06 0.00 -0.02 0.00 0.00 33.50 31.66 2qqk n PRO 220 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2qqk n HIS 221 N 1.70 -0.27 0.09 6.00 8.25 -1.26 -4.72 115.22 125.01 2qqk n HIS 221 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.58 2qqk n HIS 221 Cb 0.29 -3.31 0.00 0.00 1.12 0.00 0.00 29.99 28.10 2qqk n HIS 221 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2qqk n VAL 222 N -2.93 0.20 -0.92 1.59 0.31 -0.78 -5.09 118.33 110.70 2qqk n VAL 222 Ca -0.20 0.07 -0.30 0.00 -0.01 0.00 0.00 64.34 63.90 2qqk n VAL 222 Cb 0.63 -0.59 0.15 0.00 -0.91 0.00 0.00 33.84 33.12 2qqk n VAL 222 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2qqk s GLY 223 N -4.44 1.65 0.57 2.92 0.00 0.07 -4.76 107.32 103.33 2qqk s GLY 223 Ca 0.00 0.26 -0.20 0.00 0.00 0.00 0.00 44.72 44.78 2qqk s GLY 223 CO 0.00 0.72 1.26 -4.14 0.00 0.00 0.00 173.10 170.94 2qqk s PRO 224 N -4.75 3.08 0.28 2.90 0.02 -1.26 -4.69 135.00 130.57 2qqk s PRO 224 Ca 0.65 1.97 -0.29 0.00 0.02 0.00 0.00 61.00 63.35 2qqk s PRO 224 Cb -0.21 -2.08 -0.10 0.00 0.02 0.00 0.00 34.50 32.13 2qqk s PRO 224 CO 0.58 -1.16 1.11 -1.17 -0.33 0.00 0.00 177.00 176.03 2qqk s LEU 225 N -3.79 4.54 -0.07 -5.54 2.96 -1.26 -0.60 118.68 114.92 2qqk s LEU 225 Ca 0.74 2.28 0.11 0.00 -0.22 0.00 0.00 54.13 57.05 2qqk s LEU 225 Cb -0.34 -3.63 -0.16 0.00 0.50 0.00 0.00 46.19 42.56 2qqk s LEU 225 CO 0.39 -0.17 0.14 2.30 -1.32 0.00 0.00 176.35 177.69 2qqk n ILE 226 N 1.23 0.42 -3.64 6.68 -5.35 -0.45 -4.85 119.36 113.42 2qqk n ILE 226 Ca -0.01 -0.39 -0.03 0.00 -0.27 0.00 0.00 62.75 62.05 2qqk n ILE 226 Cb 0.45 -0.29 -0.05 0.00 -1.74 0.00 0.00 39.64 38.01 2qqk n ILE 226 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2qqk s GLY 227 N -3.93 0.10 -0.24 3.28 0.00 -1.22 -4.99 107.32 100.32 2qqk s GLY 227 Ca -0.05 2.88 -0.03 0.00 0.00 0.00 0.00 44.72 47.53 2qqk s GLY 227 CO 0.48 1.29 -0.05 1.25 0.00 0.00 0.00 173.10 176.06 2qqk s LYS 228 N -0.78 3.03 -0.07 2.90 2.20 -1.26 -1.11 119.74 124.64 2qqk s LYS 228 Ca 0.07 -0.86 0.03 0.00 -0.36 0.00 0.00 55.97 54.86 2qqk s LYS 228 Cb -0.02 -3.01 -0.02 0.00 -1.51 0.00 0.00 37.83 33.27 2qqk s LYS 228 CO -0.08 -0.33 -0.14 0.71 -0.36 0.00 0.00 175.35 175.14 2qqk s TYR 229 N 1.38 2.72 -0.38 4.03 1.51 0.24 -4.95 117.35 121.89 2qqk s TYR 229 Ca 0.02 -0.27 0.05 0.00 -1.01 0.00 0.00 57.07 55.86 2qqk s TYR 229 Cb -0.16 -1.67 0.28 0.00 -0.11 0.00 0.00 41.96 40.30 2qqk s TYR 229 CO -0.04 0.09 1.23 0.00 -1.11 0.00 0.00 175.55 175.73 2qqk n GLY 231 N -0.13 5.47 0.09 0.00 0.00 -1.26 -4.76 105.19 104.60 2qqk n GLY 231 Ca -0.08 -1.14 -0.07 0.00 0.00 0.00 0.00 46.02 44.74 2qqk n GLY 231 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qqk n THR 232 N 0.00 1.20 -1.94 2.61 -2.24 -1.26 -1.71 114.28 110.93 2qqk n THR 232 Ca 0.00 -0.80 -0.42 0.00 -2.27 0.00 0.00 64.05 60.56 2qqk n THR 232 Cb 0.00 -0.43 -0.03 0.00 -2.10 0.00 0.00 70.33 67.78 2qqk n THR 232 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2qqk s LYS 233 N -2.65 4.20 0.55 -0.78 2.47 -1.26 -4.64 119.74 117.63 2qqk s LYS 233 Ca -0.09 2.32 -0.17 0.00 -1.56 0.00 0.00 55.97 56.46 2qqk s LYS 233 Cb 0.07 -3.59 -0.06 0.00 -1.46 0.00 0.00 37.83 32.80 2qqk s LYS 233 CO 0.84 -0.72 1.03 0.95 0.16 0.00 0.00 175.35 177.61 2qqk s THR 234 N 2.59 4.00 0.03 3.43 -4.23 -1.26 -4.89 115.64 115.30 2qqk s THR 234 Ca 0.73 1.01 -0.30 0.00 -1.18 0.00 0.00 61.69 61.95 2qqk s THR 234 Cb -0.39 -3.48 -0.06 0.00 1.34 0.00 0.00 72.50 69.90 2qqk s THR 234 CO 0.32 -0.50 1.34 -2.84 -0.54 0.00 0.00 174.62 172.40 2qqk s PRO 235 N -3.91 4.33 0.67 3.99 0.02 -1.26 -4.98 135.00 133.86 2qqk s PRO 235 Ca 0.63 1.92 -0.17 0.00 0.02 0.00 0.00 61.00 63.40 2qqk s PRO 235 Cb -0.14 -3.46 0.00 0.00 0.02 0.00 0.00 34.50 30.92 2qqk s PRO 235 CO 0.32 -0.47 1.28 0.43 -0.33 0.00 0.00 177.00 178.22 2qqk n SER 236 N 4.79 1.93 -4.49 2.53 7.64 -1.26 -4.28 113.62 120.48 2qqk n SER 236 Ca 0.12 0.80 -0.40 0.00 1.01 0.00 0.00 58.87 60.39 2qqk n SER 236 Cb 0.44 -1.55 0.02 0.00 -1.01 0.00 0.00 64.21 62.11 2qqk n SER 236 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2qqk n GLU 237 N -2.07 0.71 -4.15 1.43 2.13 -1.26 -4.93 120.64 112.51 2qqk n GLU 237 Ca 0.16 0.26 -0.25 0.00 0.66 0.00 0.00 57.16 57.99 2qqk n GLU 237 Cb 0.48 -1.70 -0.17 0.00 0.27 0.00 0.00 31.44 30.33 2qqk n GLU 237 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2qqk s LEU 238 N 0.84 1.31 -0.10 4.31 1.43 -0.65 -4.96 118.68 120.87 2qqk s LEU 238 Ca 0.65 -0.26 -0.02 0.00 -1.03 0.00 0.00 54.13 53.48 2qqk s LEU 238 Cb -0.54 -0.75 -0.03 0.00 0.03 0.00 0.00 46.19 44.90 2qqk s LEU 238 CO 0.56 -0.07 -0.02 -0.13 0.23 0.00 0.00 176.35 176.93 2qqk s ARG 239 N 1.29 3.07 -0.10 1.70 0.52 -1.26 -1.40 118.95 122.77 2qqk s ARG 239 Ca -0.03 -0.46 -0.05 0.00 -0.52 0.00 0.00 55.73 54.67 2qqk s ARG 239 Cb -0.14 -2.78 0.05 0.00 0.52 0.00 0.00 34.95 32.60 2qqk s ARG 239 CO -0.03 0.61 0.23 0.45 0.02 0.00 0.00 175.30 176.58 2qqk s SER 240 N -0.63 -0.06 -0.26 0.23 0.15 -0.76 -4.98 113.70 107.39 2qqk s SER 240 Ca 0.10 0.49 0.13 0.00 0.70 0.00 0.00 55.95 57.37 2qqk s SER 240 Cb -0.12 0.42 0.69 0.00 -1.71 0.00 0.00 66.02 65.30 2qqk s SER 240 CO 0.02 -0.18 1.66 -1.54 1.20 0.00 0.00 173.24 174.40 2qqk n SER 241 N 4.50 4.65 0.03 5.45 3.41 -1.26 -1.48 113.62 128.92 2qqk n SER 241 Ca -0.21 -3.13 -0.14 0.00 -0.26 0.00 0.00 58.87 55.13 2qqk n SER 241 Cb 0.52 -0.67 -0.03 0.00 -0.26 0.00 0.00 64.21 63.77 2qqk n SER 241 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2qqk h THR 242 N 2.66 1.34 0.00 6.66 2.02 -1.96 -3.47 112.91 120.17 2qqk h THR 242 Ca 0.12 -2.17 0.00 0.00 0.77 0.00 0.00 66.41 65.12 2qqk h THR 242 Cb 1.94 2.17 0.00 0.00 -1.74 0.00 0.00 68.15 70.53 2qqk h THR 242 CO 0.50 0.66 0.00 0.61 0.37 0.00 0.00 175.52 177.67 2qqk n GLY 243 N 0.75 2.27 3.24 2.16 0.00 -1.26 -4.85 105.19 107.50 2qqk n GLY 243 Ca -0.07 -0.48 -0.24 0.00 0.00 0.00 0.00 46.02 45.24 2qqk n GLY 243 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qqk s ILE 244 N -1.21 1.55 -0.19 -0.61 1.01 -1.26 0.86 121.20 121.35 2qqk s ILE 244 Ca 0.00 -1.27 -0.12 0.00 0.00 0.00 0.00 60.65 59.26 2qqk s ILE 244 Cb 0.00 -1.38 0.06 0.00 0.01 0.00 0.00 42.46 41.15 2qqk s ILE 244 CO 0.00 0.07 0.46 -0.22 0.00 0.00 0.00 174.94 175.25 2qqk s LEU 245 N -1.41 -0.15 0.01 2.97 2.96 -0.58 -3.78 118.68 118.71 2qqk s LEU 245 Ca 0.06 0.99 0.01 0.00 -0.22 0.00 0.00 54.13 54.97 2qqk s LEU 245 Cb -0.09 1.55 -0.01 0.00 0.50 0.00 0.00 46.19 48.14 2qqk s LEU 245 CO 0.02 -0.19 -0.03 -0.44 -1.32 0.00 0.00 176.35 174.39 2qqk s SER 246 N 1.18 0.35 0.17 3.68 0.01 -1.00 0.19 113.70 118.29 2qqk s SER 246 Ca -0.08 -0.21 0.07 0.00 1.31 0.00 0.00 55.95 57.05 2qqk s SER 246 Cb -0.07 0.01 -0.04 0.00 0.21 0.00 0.00 66.02 66.13 2qqk s SER 246 CO -0.11 -0.07 -0.01 -0.76 0.41 0.00 0.00 173.24 172.70 2qqk s LEU 247 N -0.55 3.29 -0.22 2.44 1.43 0.15 0.22 118.68 125.44 2qqk s LEU 247 Ca -0.04 -0.40 -0.02 0.00 -1.03 0.00 0.00 54.13 52.64 2qqk s LEU 247 Cb -0.04 -1.95 0.07 0.00 0.03 0.00 0.00 46.19 44.30 2qqk s LEU 247 CO -0.00 0.09 0.03 -0.89 0.23 0.00 0.00 176.35 175.81 2qqk s THR 248 N -1.71 0.79 -0.20 5.49 2.01 0.16 -1.12 115.64 121.06 2qqk s THR 248 Ca 0.27 -0.83 -0.10 0.00 0.31 0.00 0.00 61.69 61.33 2qqk s THR 248 Cb -0.09 -1.30 -0.05 0.00 0.01 0.00 0.00 72.50 71.07 2qqk s THR 248 CO 0.18 -0.26 0.15 0.12 -0.69 0.00 0.00 174.62 174.11 2qqk s PHE 249 N 1.72 3.40 -0.07 4.92 5.36 0.74 -1.32 117.98 132.73 2qqk s PHE 249 Ca -0.00 0.34 0.02 0.00 -0.96 0.00 0.00 56.93 56.32 2qqk s PHE 249 Cb -0.17 -2.19 0.02 0.00 -0.34 0.00 0.00 43.02 40.33 2qqk s PHE 249 CO -0.10 0.25 -0.11 -1.58 -1.46 0.00 0.00 175.22 172.22 2qqk s HIS 250 N 0.47 1.41 0.15 10.12 5.65 0.35 -1.51 115.29 131.94 2qqk s HIS 250 Ca 0.09 -0.56 0.08 0.00 0.25 0.00 0.00 55.06 54.93 2qqk s HIS 250 Cb -0.11 -1.07 -0.04 0.00 -1.18 0.00 0.00 32.58 30.17 2qqk s HIS 250 CO -0.01 -0.32 -0.19 0.95 -0.65 0.00 0.00 174.74 174.52 2qqk s THR 251 N 0.89 1.80 0.55 0.89 -4.23 -0.72 -0.70 115.64 114.12 2qqk s THR 251 Ca -0.10 -1.83 0.06 0.00 -1.18 0.00 0.00 61.69 58.63 2qqk s THR 251 Cb -0.15 -1.78 0.06 0.00 1.34 0.00 0.00 72.50 71.96 2qqk s THR 251 CO 0.01 -0.25 0.48 -0.67 -0.54 0.00 0.00 174.62 173.64 2qqk n ASP 252 N 0.48 2.64 0.19 3.99 -0.08 -1.25 -2.98 116.55 119.53 2qqk n ASP 252 Ca -0.15 -2.82 0.05 0.00 -1.51 0.00 0.00 54.79 50.37 2qqk n ASP 252 Cb 0.56 -0.11 0.34 0.00 2.34 0.00 0.00 41.12 44.26 2qqk n ASP 252 CO 0.00 0.00 0.00 -0.03 0.12 0.00 0.00 177.20 177.29 2qqk h MET 253 N 0.00 0.00 -4.69 -0.67 1.85 -1.93 -2.76 114.93 106.73 2qqk h MET 253 Ca -0.33 0.00 -0.69 0.00 -0.61 0.00 0.00 59.70 58.07 2qqk h MET 253 Cb 1.26 0.00 -0.24 0.00 0.43 0.00 0.00 31.60 33.05 2qqk h MET 253 CO 0.51 0.38 -0.55 0.00 -0.40 0.00 0.00 176.91 176.85 2qqk s ALA 254 N -3.65 3.24 -0.24 0.39 0.00 -1.26 -4.88 121.76 115.36 2qqk s ALA 254 Ca -0.00 -1.57 -0.03 0.00 0.00 0.00 0.00 51.96 50.36 2qqk s ALA 254 Cb 0.11 -2.44 0.00 0.00 0.00 0.00 0.00 23.12 20.79 2qqk s ALA 254 CO 0.69 -1.16 0.07 0.28 0.00 0.00 0.00 175.76 175.64 2qqk n VAL 255 N 4.96 -8.85 -2.39 0.00 0.31 -1.26 -4.95 118.33 106.15 2qqk n VAL 255 Ca -0.13 1.34 -0.36 0.00 -0.01 0.00 0.00 64.34 65.17 2qqk n VAL 255 Cb 0.47 -5.73 -0.02 0.00 -0.91 0.00 0.00 33.84 27.65 2qqk n VAL 255 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qqk s ALA 256 N -1.53 2.98 0.21 3.52 0.00 -1.26 -5.07 121.76 120.62 2qqk s ALA 256 Ca 0.03 0.80 0.00 0.00 0.00 0.00 0.00 51.96 52.80 2qqk s ALA 256 Cb -0.01 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.79 2qqk s ALA 256 CO 0.57 -0.46 0.00 1.63 0.00 0.00 0.00 175.76 177.49 2qqk n LYS 257 N -0.45 2.68 0.16 0.00 4.76 -1.26 -4.93 118.16 119.12 2qqk n LYS 257 Ca 0.07 0.00 0.04 0.00 -2.87 0.00 0.00 58.31 55.55 2qqk n LYS 257 Cb 0.49 0.00 0.13 0.00 -1.84 0.00 0.00 35.03 33.82 2qqk n LYS 257 CO 0.00 0.00 0.00 -0.44 -1.37 0.00 0.00 177.40 175.59 2qqk h ASP 258 N 0.00 0.00 0.00 4.39 3.32 -1.95 -3.36 116.42 118.82 2qqk h ASP 258 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2qqk h ASP 258 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2qqk h ASP 258 CO 0.00 0.45 0.00 0.61 -1.72 0.00 0.00 179.24 178.58 2qqk n GLY 259 N 0.90 0.95 3.33 2.75 0.00 -0.43 -4.73 105.19 107.96 2qqk n GLY 259 Ca 0.01 -1.49 -0.14 0.00 0.00 0.00 0.00 46.02 44.41 2qqk n GLY 259 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qqk s PHE 260 N 0.00 -0.39 -0.01 1.61 -0.71 -1.26 0.64 117.98 117.86 2qqk s PHE 260 Ca 0.00 0.78 0.03 0.00 -1.04 0.00 0.00 56.93 56.70 2qqk s PHE 260 Cb 0.00 0.18 -0.01 0.00 -1.21 0.00 0.00 43.02 41.98 2qqk s PHE 260 CO 0.00 -0.37 -0.10 0.45 -1.34 0.00 0.00 175.22 173.86 2qqk s SER 261 N -0.71 1.18 0.25 1.98 0.15 -0.69 -1.86 113.70 114.00 2qqk s SER 261 Ca -0.08 -0.18 0.01 0.00 0.70 0.00 0.00 55.95 56.39 2qqk s SER 261 Cb -0.04 -0.17 -0.00 0.00 -1.71 0.00 0.00 66.02 64.11 2qqk s SER 261 CO 0.04 0.11 0.31 0.00 1.20 0.00 0.00 173.24 174.90 2qqk n ALA 262 N 2.92 -0.03 -3.51 5.45 0.00 0.00 -1.82 120.51 123.52 2qqk n ALA 262 Ca -0.14 -1.23 -0.17 0.00 0.00 0.00 0.00 53.44 51.89 2qqk n ALA 262 Cb 0.56 1.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.94 2qqk n ALA 262 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2qqk s ARG 263 N -2.69 0.98 0.02 0.00 3.52 -0.19 -2.26 118.95 118.33 2qqk s ARG 263 Ca 0.23 0.37 -0.01 0.00 -0.13 0.00 0.00 55.73 56.19 2qqk s ARG 263 Cb -0.00 0.46 -0.02 0.00 -1.56 0.00 0.00 34.95 33.84 2qqk s ARG 263 CO 0.16 -0.27 -0.01 1.52 -0.81 0.00 0.00 175.30 175.89 2qqk s TYR 264 N -0.89 0.22 0.04 5.12 -0.85 -0.78 -1.34 117.35 118.87 2qqk s TYR 264 Ca -0.09 -0.46 0.05 0.00 -0.52 0.00 0.00 57.07 56.05 2qqk s TYR 264 Cb -0.01 -0.17 -0.02 0.00 0.38 0.00 0.00 41.96 42.14 2qqk s TYR 264 CO 0.08 -0.19 -0.14 0.71 -1.52 0.00 0.00 175.55 174.48 2qqk s TYR 265 N -1.39 1.26 -0.15 -3.49 1.51 -0.04 -3.14 117.35 111.90 2qqk s TYR 265 Ca -0.15 -0.35 -0.04 0.00 -1.01 0.00 0.00 57.07 55.52 2qqk s TYR 265 Cb -0.09 -0.75 -0.03 0.00 -0.11 0.00 0.00 41.96 40.97 2qqk s TYR 265 CO -0.01 0.03 -0.02 -0.51 -1.11 0.00 0.00 175.55 173.94 2qqk s LEU 266 N -1.09 3.39 -0.03 -1.29 1.43 -1.00 0.01 118.68 120.10 2qqk s LEU 266 Ca 0.02 -0.06 0.02 0.00 -1.03 0.00 0.00 54.13 53.08 2qqk s LEU 266 Cb -0.08 -1.82 0.00 0.00 0.03 0.00 0.00 46.19 44.33 2qqk s LEU 266 CO 0.01 0.19 -0.09 -0.69 0.23 0.00 0.00 176.35 176.00 2qqk s VAL 267 N 0.23 0.77 0.40 -1.59 1.01 -0.85 -4.93 120.40 115.45 2qqk s VAL 267 Ca -0.01 -0.36 -0.24 0.00 0.00 0.00 0.00 61.98 61.37 2qqk s VAL 267 Cb -0.14 -0.69 -0.09 0.00 0.00 0.00 0.00 36.38 35.47 2qqk s VAL 267 CO 0.02 0.24 1.06 -2.28 0.00 0.00 0.00 175.10 174.14 2qqk s HIS 268 N 0.19 3.24 -0.18 5.22 2.46 -1.26 -1.69 115.29 123.27 2qqk s HIS 268 Ca -0.03 1.64 -0.04 0.00 0.47 0.00 0.00 55.06 57.10 2qqk s HIS 268 Cb -0.08 -3.14 0.06 0.00 -0.13 0.00 0.00 32.58 29.28 2qqk s HIS 268 CO 0.00 -0.68 0.07 -0.65 -2.47 0.00 0.00 174.74 171.01 2qqk s GLN 269 N -2.51 0.30 -0.51 2.88 -1.52 -0.77 -4.92 119.66 112.61 2qqk s GLN 269 Ca 0.58 -0.21 -0.03 0.00 -1.95 0.00 0.00 55.36 53.76 2qqk s GLN 269 Cb -0.22 -1.91 0.13 0.00 -0.22 0.00 0.00 33.01 30.79 2qqk s GLN 269 CO 0.28 -0.65 0.31 -1.21 -0.25 0.00 0.00 175.29 173.77 2qqk s GLU 270 N 2.02 2.25 0.63 2.91 0.41 -1.26 -4.84 118.70 120.82 2qqk s GLU 270 Ca 0.01 -2.17 -0.15 0.00 -0.41 0.00 0.00 54.97 52.26 2qqk s GLU 270 Cb -0.16 -3.64 -0.02 0.00 -1.78 0.00 0.00 34.13 28.53 2qqk s GLU 270 CO -0.08 -1.12 1.08 -1.25 -0.49 0.00 0.00 175.26 173.39 2qqk s PRO 271 N 0.55 3.08 0.45 0.39 0.04 -1.26 -5.05 135.00 133.20 2qqk s PRO 271 Ca 0.12 1.24 -0.06 0.00 0.04 0.00 0.00 61.00 62.34 2qqk s PRO 271 Cb -0.22 -2.00 0.10 0.00 0.04 0.00 0.00 34.50 32.43 2qqk s PRO 271 CO -0.04 -1.01 0.61 1.28 0.04 0.00 0.00 177.00 177.89 2qqk n LEU 272 N -2.31 0.00 -0.06 -3.56 4.77 -1.26 -4.95 117.00 109.63 2qqk n LEU 272 Ca 0.09 -0.77 -0.06 0.00 -0.03 0.00 0.00 56.01 55.24 2qqk n LEU 272 Cb 0.53 -0.46 -0.05 0.00 -2.33 0.00 0.00 43.42 41.11 2qqk n LEU 272 CO 0.48 -0.92 0.06 -0.33 -1.33 0.00 0.00 177.39 175.36 2qqk h GLU 273 N 0.00 0.00 -5.34 3.23 3.07 -1.97 -3.39 114.58 110.18 2qqk h GLU 273 Ca -0.20 0.00 -0.47 0.00 -0.50 0.00 0.00 59.36 58.19 2qqk h GLU 273 Cb 0.58 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.45 2qqk h GLU 273 CO 0.15 0.35 1.58 -1.71 -1.40 0.00 0.00 179.01 177.98 2qqk n ASN 274 N -4.70 3.43 -3.75 1.42 5.15 -1.26 -4.83 115.26 110.72 2qqk n ASN 274 Ca -0.05 -2.75 -0.16 0.00 -0.60 0.00 0.00 54.58 51.02 2qqk n ASN 274 Cb 0.20 -1.65 -0.16 0.00 -0.53 0.00 0.00 39.78 37.64 2qqk n ASN 274 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 2qqk s PHE 275 N 8.39 0.02 -0.06 1.20 2.19 -1.26 -5.15 117.98 123.30 2qqk s PHE 275 Ca 0.63 0.18 0.03 0.00 0.33 0.00 0.00 56.93 58.11 2qqk s PHE 275 Cb 0.03 -0.27 -0.02 0.00 -1.31 0.00 0.00 43.02 41.45 2qqk s PHE 275 CO 0.11 -0.11 -0.15 -0.65 1.83 0.00 0.00 175.22 176.25 2qqk s GLN 276 N 1.28 2.56 -1.39 10.12 -1.52 -1.26 -5.03 119.66 124.42 2qqk s GLN 276 Ca -0.07 -0.71 -0.07 0.00 -1.95 0.00 0.00 55.36 52.57 2qqk s GLN 276 Cb -0.13 -2.38 0.02 0.00 -0.22 0.00 0.00 33.01 30.30 2qqk s GLN 276 CO -0.03 0.58 2.67 0.00 -0.25 0.00 0.00 175.29 178.26 2qqk n ASN 278 N 2.48 1.19 -4.78 0.00 0.23 -1.22 -4.28 115.26 108.89 2qqk n ASN 278 Ca 0.68 -2.62 -0.37 0.00 -0.53 0.00 0.00 54.58 51.74 2qqk n ASN 278 Cb 0.27 -0.33 -0.04 0.00 -2.08 0.00 0.00 39.78 37.59 2qqk n ASN 278 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 2qqk s VAL 279 N -1.44 3.72 0.33 3.53 1.01 -0.64 -4.53 120.40 122.37 2qqk s VAL 279 Ca 0.20 1.36 -0.29 0.00 0.00 0.00 0.00 61.98 63.26 2qqk s VAL 279 Cb 0.19 -3.73 -0.10 0.00 0.00 0.00 0.00 36.38 32.75 2qqk s VAL 279 CO -0.02 0.05 1.27 -2.84 0.00 0.00 0.00 175.10 173.56 2qqk s PRO 280 N -2.37 4.38 0.07 2.72 0.02 -1.26 0.41 135.00 138.97 2qqk s PRO 280 Ca 0.56 2.14 0.23 0.00 0.02 0.00 0.00 61.00 63.95 2qqk s PRO 280 Cb -0.23 -3.07 0.06 0.00 0.02 0.00 0.00 34.50 31.28 2qqk s PRO 280 CO 0.29 -0.13 1.04 1.28 -0.33 0.00 0.00 177.00 179.14 2qqk n LEU 281 N 0.82 0.62 0.00 -5.54 4.77 0.11 -4.86 117.00 112.92 2qqk n LEU 281 Ca 0.00 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 2qqk n LEU 281 Cb 0.42 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 2qqk n LEU 281 CO 0.58 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 2qqk n GLY 282 N 1.34 -0.86 0.31 -0.72 0.00 -1.26 -4.29 105.19 99.71 2qqk n GLY 282 Ca 0.02 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.87 2qqk n GLY 282 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2qqk h MET 283 N 0.00 -0.71 -0.26 1.61 2.86 -1.86 0.28 114.93 116.85 2qqk h MET 283 Ca 0.00 0.05 -0.15 0.00 -2.06 0.00 0.00 59.70 57.54 2qqk h MET 283 Cb 0.00 0.16 -0.00 0.00 0.06 0.00 0.00 31.60 31.82 2qqk h MET 283 CO 0.00 -0.44 -0.41 1.49 1.06 0.00 0.00 176.91 178.61 2qqk h GLU 284 N -0.82 0.74 0.00 1.72 4.81 -1.83 -3.19 114.58 116.02 2qqk h GLU 284 Ca -0.08 -0.45 -0.04 0.00 -0.13 0.00 0.00 59.36 58.67 2qqk h GLU 284 Cb 0.60 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 2qqk h GLU 284 CO 0.12 1.07 -0.18 0.66 -0.73 0.00 0.00 179.01 179.95 2qqk h SER 285 N 0.48 0.00 0.00 1.04 4.64 -1.95 -3.48 113.55 114.29 2qqk h SER 285 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2qqk h SER 285 Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 2qqk h SER 285 CO 0.09 0.18 0.00 0.61 -0.87 0.00 0.00 176.83 176.84 2qqk n GLY 286 N 0.45 0.76 0.23 -0.77 0.00 0.05 -4.93 105.19 100.98 2qqk n GLY 286 Ca 0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.11 2qqk n GLY 286 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2qqk h ARG 287 N 3.06 0.00 -6.10 1.61 3.08 -1.79 -3.31 114.38 110.93 2qqk h ARG 287 Ca 0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 2qqk h ARG 287 Cb 0.00 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 29.94 2qqk h ARG 287 CO 0.00 0.21 0.56 0.42 -1.07 0.00 0.00 179.97 180.09 2qqk s ILE 288 N -4.24 4.52 0.62 2.04 1.01 -0.97 -4.97 121.20 119.22 2qqk s ILE 288 Ca -0.03 0.81 -0.08 0.00 0.00 0.00 0.00 60.65 61.35 2qqk s ILE 288 Cb 0.14 -4.40 0.00 0.00 0.01 0.00 0.00 42.46 38.21 2qqk s ILE 288 CO 0.65 -0.76 0.97 0.00 0.00 0.00 0.00 174.94 175.80 2qqk s ALA 289 N 3.64 3.15 0.20 9.38 0.00 -1.25 -4.72 121.76 132.17 2qqk s ALA 289 Ca 0.36 -0.50 -0.15 0.00 0.00 0.00 0.00 51.96 51.68 2qqk s ALA 289 Cb -0.11 -2.79 0.19 0.00 0.00 0.00 0.00 23.12 20.42 2qqk s ALA 289 CO 0.24 -0.86 1.64 -0.91 0.00 0.00 0.00 175.76 175.87 2qqk h ASN 290 N -0.31 -0.53 -0.93 0.00 4.21 -1.94 -1.12 115.58 114.95 2qqk h ASN 290 Ca -0.45 0.17 0.26 0.00 1.21 0.00 0.00 56.30 57.48 2qqk h ASN 290 Cb 1.24 0.35 -0.17 0.00 -1.12 0.00 0.00 38.32 38.63 2qqk h ASN 290 CO 0.62 -0.19 0.11 -0.33 -1.29 0.00 0.00 177.43 176.35 2qqk h GLU 291 N -0.00 0.07 0.00 0.81 5.08 -2.00 0.72 114.58 119.26 2qqk h GLU 291 Ca 0.27 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 2qqk h GLU 291 Cb 0.41 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.65 2qqk h GLU 291 CO -0.58 0.05 0.00 1.96 -1.00 0.00 0.00 179.01 179.44 2qqk h GLN 292 N 0.07 0.00 -5.39 2.33 4.20 -1.50 -3.42 115.11 111.39 2qqk h GLN 292 Ca 0.58 0.00 -0.61 0.00 0.06 0.00 0.00 58.65 58.67 2qqk h GLN 292 Cb 1.19 0.00 -0.11 0.00 0.30 0.00 0.00 27.48 28.87 2qqk h GLN 292 CO -0.81 0.00 -0.45 0.42 -0.67 0.00 0.00 178.83 177.32 2qqk s ILE 293 N -3.83 5.40 0.21 2.54 1.01 0.24 -0.84 121.20 125.93 2qqk s ILE 293 Ca -0.02 0.27 -0.11 0.00 0.00 0.00 0.00 60.65 60.80 2qqk s ILE 293 Cb 0.10 -3.49 -0.01 0.00 0.01 0.00 0.00 42.46 39.08 2qqk s ILE 293 CO 0.44 0.47 0.37 -0.94 0.00 0.00 0.00 174.94 175.28 2qqk s SER 294 N 0.08 -0.03 0.10 3.58 1.04 -0.63 -4.77 113.70 113.06 2qqk s SER 294 Ca 0.11 -0.91 -0.08 0.00 0.48 0.00 0.00 55.95 55.54 2qqk s SER 294 Cb -0.12 0.51 -0.00 0.00 0.10 0.00 0.00 66.02 66.51 2qqk s SER 294 CO 0.00 -1.01 0.19 0.00 0.98 0.00 0.00 173.24 173.41 2qqk s ALA 295 N -4.00 -0.17 0.41 5.32 0.00 -1.26 0.02 121.76 122.08 2qqk s ALA 295 Ca 0.21 -0.67 0.15 0.00 0.00 0.00 0.00 51.96 51.65 2qqk s ALA 295 Cb 0.02 0.53 1.02 0.00 0.00 0.00 0.00 23.12 24.68 2qqk s ALA 295 CO 0.05 -0.52 1.90 0.66 0.00 0.00 0.00 175.76 177.85 2qqk h SER 296 N 2.74 0.44 -5.74 0.00 4.64 -1.37 -3.46 113.55 110.79 2qqk h SER 296 Ca -0.34 0.03 0.31 0.00 -0.47 0.00 0.00 61.79 61.33 2qqk h SER 296 Cb 1.20 -0.06 -0.11 0.00 -0.31 0.00 0.00 62.40 63.13 2qqk h SER 296 CO 0.56 0.22 0.81 -0.94 -0.87 0.00 0.00 176.83 176.60 2qqk s SER 297 N -5.85 -0.05 0.03 4.97 1.04 -1.26 -4.99 113.70 107.59 2qqk s SER 297 Ca -0.08 -0.19 -0.09 0.00 0.48 0.00 0.00 55.95 56.07 2qqk s SER 297 Cb 0.22 0.19 0.00 0.00 0.10 0.00 0.00 66.02 66.53 2qqk s SER 297 CO 0.77 -0.36 0.18 0.28 0.98 0.00 0.00 173.24 175.09 2qqk s THR 298 N -2.40 0.10 0.61 2.02 -1.32 -1.26 -4.15 115.64 109.25 2qqk s THR 298 Ca 0.17 -0.85 -0.19 0.00 -1.21 0.00 0.00 61.69 59.60 2qqk s THR 298 Cb 0.03 -0.81 -0.02 0.00 -1.51 0.00 0.00 72.50 70.19 2qqk s THR 298 CO -0.03 -0.47 1.33 -0.47 -2.21 0.00 0.00 174.62 172.77 2qqk s TYR 299 N -2.30 2.14 0.28 9.09 5.04 0.05 -3.33 117.35 128.32 2qqk s TYR 299 Ca -0.07 1.43 -0.03 0.00 -2.44 0.00 0.00 57.07 55.96 2qqk s TYR 299 Cb -0.02 -3.76 0.39 0.00 0.35 0.00 0.00 41.96 38.92 2qqk s TYR 299 CO -0.03 -2.98 1.90 0.66 -1.34 0.00 0.00 175.55 173.77 2qqk h SER 300 N 0.89 0.93 0.42 4.32 4.64 -1.88 -2.87 113.55 120.00 2qqk h SER 300 Ca -0.51 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 60.73 2qqk h SER 300 Cb 1.32 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2qqk h SER 300 CO 0.55 0.75 0.00 -0.90 -0.87 0.00 0.00 176.83 176.35 2qqk n ASP 301 N -4.36 0.00 -0.14 4.97 5.68 -1.26 -4.88 116.55 116.57 2qqk n ASP 301 Ca 0.08 0.13 -0.02 0.00 -0.50 0.00 0.00 54.79 54.48 2qqk n ASP 301 Cb 0.10 -0.34 -0.01 0.00 -1.14 0.00 0.00 41.12 39.74 2qqk n ASP 301 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qqk n GLY 302 N 0.34 0.53 0.85 6.12 0.00 -1.08 -4.91 105.19 107.04 2qqk n GLY 302 Ca 0.08 -0.41 0.10 0.00 0.00 0.00 0.00 46.02 45.79 2qqk n GLY 302 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qqk n ARG 303 N -2.54 1.94 -3.22 1.61 5.12 -1.26 -4.58 116.66 113.73 2qqk n ARG 303 Ca -0.02 -1.78 -0.24 0.00 -1.93 0.00 0.00 57.85 53.89 2qqk n ARG 303 Cb 0.11 -1.41 -0.06 0.00 -1.16 0.00 0.00 32.46 29.94 2qqk n ARG 303 CO 0.00 0.00 0.00 0.91 -1.93 0.00 0.00 177.63 176.61 2qqk n TRP 304 N 1.19 0.68 -2.58 -1.55 7.02 -1.26 -4.66 117.44 116.28 2qqk n TRP 304 Ca 0.13 -3.74 -0.26 0.00 -1.02 0.00 0.00 57.50 52.60 2qqk n TRP 304 Cb 0.53 -0.41 0.01 0.00 -2.42 0.00 0.00 31.31 29.02 2qqk n TRP 304 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 2qqk s THR 305 N -1.80 4.28 0.32 -0.99 -4.23 -1.25 -2.21 115.64 109.75 2qqk s THR 305 Ca 0.37 0.03 0.09 0.00 -1.18 0.00 0.00 61.69 61.01 2qqk s THR 305 Cb 0.20 -3.65 0.31 0.00 1.34 0.00 0.00 72.50 70.70 2qqk s THR 305 CO -0.09 -0.63 1.72 -0.65 -0.54 0.00 0.00 174.62 174.43 2qqk h PRO 306 N 0.08 0.52 0.00 3.99 0.11 -1.91 -1.88 132.00 132.90 2qqk h PRO 306 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2qqk h PRO 306 Cb 1.23 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2qqk h PRO 306 CO 0.61 0.34 0.00 1.04 -0.21 0.00 0.00 178.00 179.78 2qqk n GLN 307 N -4.92 0.13 -0.05 1.05 3.00 -1.26 -1.37 117.38 113.96 2qqk n GLN 307 Ca 0.27 0.20 0.12 0.00 -0.01 0.00 0.00 57.00 57.57 2qqk n GLN 307 Cb 0.75 -1.50 0.13 0.00 0.00 0.00 0.00 30.24 29.62 2qqk n GLN 307 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 2qqk n GLN 308 N -1.36 2.38 -0.16 -1.09 6.02 -0.71 -4.48 117.38 117.99 2qqk n GLN 308 Ca 0.05 -2.03 -0.03 0.00 -0.01 0.00 0.00 57.00 54.98 2qqk n GLN 308 Cb 0.12 -1.48 0.03 0.00 1.02 0.00 0.00 30.24 29.93 2qqk n GLN 308 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2qqk n SER 309 N 1.40 2.96 -4.78 1.08 3.41 -0.47 -4.34 113.62 112.88 2qqk n SER 309 Ca 0.16 -2.21 -0.39 0.00 -0.26 0.00 0.00 58.87 56.17 2qqk n SER 309 Cb 0.60 -0.54 -0.06 0.00 -0.26 0.00 0.00 64.21 63.95 2qqk n SER 309 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2qqk s ARG 310 N -0.52 4.32 0.19 4.33 0.52 -1.26 -0.55 118.95 125.97 2qqk s ARG 310 Ca 0.08 0.82 -0.33 0.00 -0.52 0.00 0.00 55.73 55.77 2qqk s ARG 310 Cb 0.06 -3.30 -0.14 0.00 0.52 0.00 0.00 34.95 32.09 2qqk s ARG 310 CO 0.02 0.47 1.46 -0.11 0.02 0.00 0.00 175.30 177.15 2qqk n LEU 311 N 2.28 2.84 -0.14 2.53 7.94 -0.82 -1.41 117.00 130.23 2qqk n LEU 311 Ca -0.07 1.11 -0.02 0.00 -1.11 0.00 0.00 56.01 55.92 2qqk n LEU 311 Cb 0.51 -1.39 -0.01 0.00 0.53 0.00 0.00 43.42 43.06 2qqk n LEU 311 CO 0.43 -0.52 -0.02 1.41 -1.11 0.00 0.00 177.39 177.59 2qqk n HIS 312 N 2.58 0.00 -1.72 1.96 8.25 -1.26 -4.67 115.22 120.36 2qqk n HIS 312 Ca 0.15 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.19 2qqk n HIS 312 Cb 0.29 -1.30 -0.01 0.00 1.12 0.00 0.00 29.99 30.09 2qqk n HIS 312 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qqk n GLY 313 N -0.84 0.77 0.13 -1.41 0.00 -0.50 -4.91 105.19 98.42 2qqk n GLY 313 Ca -0.02 0.33 0.15 0.00 0.00 0.00 0.00 46.02 46.48 2qqk n GLY 313 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2qqk n ASP 314 N 0.79 0.42 -3.74 1.61 5.75 -1.26 -4.69 116.55 115.42 2qqk n ASP 314 Ca 0.04 -1.01 -0.29 0.00 -0.01 0.00 0.00 54.79 53.52 2qqk n ASP 314 Cb 0.37 -0.03 -0.13 0.00 -1.03 0.00 0.00 41.12 40.30 2qqk n ASP 314 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2qqk s ASP 315 N -2.10 3.72 0.62 -1.12 2.15 -1.26 -4.99 116.67 113.69 2qqk s ASP 315 Ca 0.42 -2.78 0.00 0.00 0.43 0.00 0.00 52.55 50.62 2qqk s ASP 315 Cb 0.21 -1.13 0.00 0.00 -0.30 0.00 0.00 42.92 41.71 2qqk s ASP 315 CO 0.38 -0.24 0.00 0.59 -0.17 0.00 0.00 175.17 175.73 2qqk n ASN 316 N 3.34 0.00 -0.47 -0.34 3.02 -1.26 -4.90 115.26 114.66 2qqk n ASN 316 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 2qqk n ASN 316 Cb 0.35 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.52 2qqk n ASN 316 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qqk n GLY 317 N 0.00 2.06 3.74 7.41 0.00 -1.26 -4.77 105.19 112.37 2qqk n GLY 317 Ca 0.00 -0.83 -0.38 0.00 0.00 0.00 0.00 46.02 44.80 2qqk n GLY 317 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2qqk s TRP 318 N -4.89 3.58 -0.03 1.61 -0.00 -0.73 -3.75 118.94 114.73 2qqk s TRP 318 Ca 0.00 1.03 0.01 0.00 -0.00 0.00 0.00 56.10 57.15 2qqk s TRP 318 Cb 0.00 -2.59 0.01 0.00 -0.00 0.00 0.00 33.47 30.89 2qqk s TRP 318 CO 0.00 0.24 -0.05 0.99 -0.00 0.00 0.00 176.95 178.12 2qqk s THR 319 N 0.33 0.51 0.84 5.86 2.01 -0.94 -1.48 115.64 122.77 2qqk s THR 319 Ca 0.29 -0.17 -0.12 0.00 0.31 0.00 0.00 61.69 62.00 2qqk s THR 319 Cb -0.16 -0.50 0.10 0.00 0.01 0.00 0.00 72.50 71.94 2qqk s THR 319 CO 0.13 0.19 1.14 -2.16 -0.69 0.00 0.00 174.62 173.23 2qqk s PRO 320 N 0.53 1.69 0.45 4.92 0.04 -1.26 -0.77 135.00 140.60 2qqk s PRO 320 Ca -0.07 0.33 0.11 0.00 0.04 0.00 0.00 61.00 61.40 2qqk s PRO 320 Cb -0.10 -1.90 1.01 0.00 0.04 0.00 0.00 34.50 33.54 2qqk s PRO 320 CO 0.00 -1.82 2.08 -0.97 0.04 0.00 0.00 177.00 176.33 2qqk h ASN 321 N -1.23 0.31 -2.99 6.66 -0.73 -1.71 -3.28 115.58 112.61 2qqk h ASN 321 Ca -0.48 -0.01 -0.13 0.00 1.87 0.00 0.00 56.30 57.55 2qqk h ASN 321 Cb 1.31 -0.08 -0.28 0.00 0.27 0.00 0.00 38.32 39.55 2qqk h ASN 321 CO 0.63 0.22 -0.36 -0.22 -0.37 0.00 0.00 177.43 177.33 2qqk s LEU 322 N -9.34 -0.22 -0.13 0.34 0.20 -1.26 -4.81 118.68 103.46 2qqk s LEU 322 Ca -0.07 0.85 -0.29 0.00 0.69 0.00 0.00 54.13 55.31 2qqk s LEU 322 Cb 0.17 1.22 -0.05 0.00 -0.43 0.00 0.00 46.19 47.11 2qqk s LEU 322 CO 0.71 -0.21 1.71 -1.81 -0.29 0.00 0.00 176.35 176.47 2qqk s ASP 323 N 1.84 6.44 0.29 3.68 1.01 -1.26 -4.88 116.67 123.78 2qqk s ASP 323 Ca -0.06 2.00 -0.20 0.00 0.71 0.00 0.00 52.55 55.00 2qqk s ASP 323 Cb -0.10 -2.53 0.03 0.00 1.01 0.00 0.00 42.92 41.33 2qqk s ASP 323 CO -0.12 -1.15 0.77 -0.94 0.21 0.00 0.00 175.17 173.93 2qqk s SER 324 N 4.19 -0.18 -0.04 0.27 1.04 -1.26 -5.05 113.70 112.67 2qqk s SER 324 Ca 0.76 -0.73 0.11 0.00 0.48 0.00 0.00 55.95 56.57 2qqk s SER 324 Cb -0.31 0.74 0.39 0.00 0.10 0.00 0.00 66.02 66.94 2qqk s SER 324 CO 0.31 -1.39 1.26 -0.46 0.98 0.00 0.00 173.24 173.94 2qqk n ASN 325 N -0.72 2.66 -0.57 7.02 0.23 -1.26 -3.53 115.26 119.09 2qqk n ASN 325 Ca -0.05 -2.17 0.05 0.00 -0.53 0.00 0.00 54.58 51.88 2qqk n ASN 325 Cb 0.59 -0.38 0.14 0.00 -2.08 0.00 0.00 39.78 38.05 2qqk n ASN 325 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 2qqk n LYS 326 N 0.58 2.88 -3.15 -3.83 5.02 -1.26 -4.79 118.16 113.60 2qqk n LYS 326 Ca 0.14 -2.04 -0.30 0.00 -2.02 0.00 0.00 58.31 54.09 2qqk n LYS 326 Cb 0.49 -1.27 -0.04 0.00 -0.02 0.00 0.00 35.03 34.18 2qqk n LYS 326 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2qqk s GLU 327 N -1.14 3.78 0.03 1.97 0.41 -1.23 -5.04 118.70 117.49 2qqk s GLU 327 Ca 0.21 0.33 -0.11 0.00 -0.41 0.00 0.00 54.97 55.00 2qqk s GLU 327 Cb 0.12 -2.52 0.01 0.00 -1.78 0.00 0.00 34.13 29.96 2qqk s GLU 327 CO 0.13 0.14 0.22 1.52 -0.49 0.00 0.00 175.26 176.78 2qqk s TYR 328 N -2.11 -0.00 -0.08 1.61 -0.85 -1.26 -4.08 117.35 110.57 2qqk s TYR 328 Ca 0.49 -0.16 -0.02 0.00 -0.52 0.00 0.00 57.07 56.86 2qqk s TYR 328 Cb -0.11 0.00 -0.03 0.00 0.38 0.00 0.00 41.96 42.20 2qqk s TYR 328 CO 0.27 -0.42 0.02 -1.17 -1.52 0.00 0.00 175.55 172.73 2qqk s LEU 329 N -1.92 3.70 0.05 -3.49 2.96 -0.88 -0.84 118.68 118.26 2qqk s LEU 329 Ca -0.07 0.18 0.07 0.00 -0.22 0.00 0.00 54.13 54.09 2qqk s LEU 329 Cb -0.02 -1.88 -0.03 0.00 0.50 0.00 0.00 46.19 44.76 2qqk s LEU 329 CO -0.02 0.37 -0.20 -1.58 -1.32 0.00 0.00 176.35 173.60 2qqk s GLN 330 N -0.98 1.28 -0.09 1.98 0.74 0.10 -1.45 119.66 121.24 2qqk s GLN 330 Ca 0.14 -0.95 0.02 0.00 0.05 0.00 0.00 55.36 54.63 2qqk s GLN 330 Cb -0.11 -1.40 0.01 0.00 1.10 0.00 0.00 33.01 32.61 2qqk s GLN 330 CO 0.04 0.35 -0.16 0.08 -0.55 0.00 0.00 175.29 175.05 2qqk s VAL 331 N -0.87 1.46 -0.56 1.34 1.01 0.01 -1.61 120.40 121.18 2qqk s VAL 331 Ca 0.06 -0.65 -0.16 0.00 0.00 0.00 0.00 61.98 61.24 2qqk s VAL 331 Cb -0.09 -1.31 0.14 0.00 0.00 0.00 0.00 36.38 35.11 2qqk s VAL 331 CO 0.02 0.43 0.52 -0.62 0.00 0.00 0.00 175.10 175.45 2qqk s ASP 332 N 0.72 6.23 0.50 3.32 2.15 -0.02 -1.32 116.67 128.25 2qqk s ASP 332 Ca -0.12 -1.84 0.33 0.00 0.43 0.00 0.00 52.55 51.35 2qqk s ASP 332 Cb -0.16 -2.21 1.70 0.00 -0.30 0.00 0.00 42.92 41.95 2qqk s ASP 332 CO 0.03 -0.85 2.02 -0.07 -0.17 0.00 0.00 175.17 176.13 2qqk h LEU 333 N 8.84 0.00 0.00 -1.34 3.38 -1.38 -3.45 115.31 121.36 2qqk h LEU 333 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2qqk h LEU 333 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 2qqk h LEU 333 CO 1.02 0.00 0.00 0.54 0.09 0.00 0.00 178.44 180.09 2qqk n ARG 334 N -2.74 0.00 -4.38 1.13 1.74 -1.26 -4.93 116.66 106.23 2qqk n ARG 334 Ca -0.01 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.84 2qqk n ARG 334 Cb 0.12 0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 31.45 2qqk n ARG 334 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2qqk s PHE 335 N -0.11 1.98 0.00 -1.55 0.40 -1.26 -4.89 117.98 112.55 2qqk s PHE 335 Ca 0.00 -0.44 -0.32 0.00 -0.60 0.00 0.00 56.93 55.57 2qqk s PHE 335 Cb 0.00 -0.94 -0.10 0.00 0.51 0.00 0.00 43.02 42.49 2qqk s PHE 335 CO 0.00 0.45 1.93 1.28 0.70 0.00 0.00 175.22 179.57 2qqk n LEU 336 N -0.04 3.90 -4.07 -0.37 4.77 -1.26 -4.50 117.00 115.43 2qqk n LEU 336 Ca -0.10 0.94 -0.18 0.00 -0.03 0.00 0.00 56.01 56.63 2qqk n LEU 336 Cb 0.58 -1.47 -0.14 0.00 -2.33 0.00 0.00 43.42 40.06 2qqk n LEU 336 CO 0.32 0.11 -0.44 -0.89 -1.33 0.00 0.00 177.39 175.16 2qqk s THR 337 N 4.11 0.82 0.09 -5.08 2.01 0.16 -4.59 115.64 113.17 2qqk s THR 337 Ca 0.89 -0.66 -0.31 0.00 0.31 0.00 0.00 61.69 61.93 2qqk s THR 337 Cb -0.53 -0.73 -0.06 0.00 0.01 0.00 0.00 72.50 71.18 2qqk s THR 337 CO 0.45 0.08 1.22 -0.32 -0.69 0.00 0.00 174.62 175.36 2qqk s MET 338 N -0.66 4.43 -0.18 4.92 1.75 0.12 -1.22 119.30 128.46 2qqk s MET 338 Ca 0.01 1.83 -0.02 0.00 -1.25 0.00 0.00 55.69 56.26 2qqk s MET 338 Cb -0.06 -3.31 -0.01 0.00 2.84 0.00 0.00 34.83 34.29 2qqk s MET 338 CO 0.00 -0.25 -0.10 -1.17 -0.65 0.00 0.00 175.02 172.85 2qqk s LEU 339 N 0.84 2.73 -0.00 4.11 2.96 0.19 -2.25 118.68 127.26 2qqk s LEU 339 Ca 0.58 -0.40 0.01 0.00 -0.22 0.00 0.00 54.13 54.11 2qqk s LEU 339 Cb -0.31 -1.65 -0.01 0.00 0.50 0.00 0.00 46.19 44.71 2qqk s LEU 339 CO 0.31 0.06 0.02 0.35 -1.32 0.00 0.00 176.35 175.76 2qqk n THR 340 N 4.26 0.00 -3.52 3.68 -2.24 -0.77 -1.56 114.28 114.13 2qqk n THR 340 Ca -0.19 -0.08 -0.18 0.00 -2.27 0.00 0.00 64.05 61.34 2qqk n THR 340 Cb 0.51 0.55 -0.06 0.00 -2.10 0.00 0.00 70.33 69.24 2qqk n THR 340 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qqk s ALA 341 N -1.93 -1.77 -0.05 6.98 0.00 -1.19 -1.62 121.76 122.18 2qqk s ALA 341 Ca -0.00 1.32 0.05 0.00 0.00 0.00 0.00 51.96 53.32 2qqk s ALA 341 Cb 0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 23.12 23.11 2qqk s ALA 341 CO 0.03 -0.37 -0.19 0.42 0.00 0.00 0.00 175.76 175.65 2qqk s ILE 342 N -1.23 1.62 -0.04 0.00 1.01 -0.62 -0.61 121.20 121.33 2qqk s ILE 342 Ca -0.10 -0.82 0.07 0.00 0.00 0.00 0.00 60.65 59.80 2qqk s ILE 342 Cb -0.00 -1.39 -0.01 0.00 0.01 0.00 0.00 42.46 41.07 2qqk s ILE 342 CO 0.09 0.46 -0.25 0.00 0.00 0.00 0.00 174.94 175.24 2qqk s ALA 343 N 0.03 2.11 0.07 9.38 0.00 -0.54 -0.10 121.76 132.71 2qqk s ALA 343 Ca -0.05 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 50.86 2qqk s ALA 343 Cb -0.13 -0.61 -0.04 0.00 0.00 0.00 0.00 23.12 22.35 2qqk s ALA 343 CO 0.03 0.45 -0.05 0.95 0.00 0.00 0.00 175.76 177.14 2qqk s THR 344 N -0.33 0.42 0.06 0.00 -4.23 -0.72 -0.61 115.64 110.22 2qqk s THR 344 Ca 0.02 -1.73 -0.03 0.00 -1.18 0.00 0.00 61.69 58.77 2qqk s THR 344 Cb -0.12 -1.41 -0.03 0.00 1.34 0.00 0.00 72.50 72.28 2qqk s THR 344 CO 0.02 -0.87 0.02 -1.10 -0.54 0.00 0.00 174.62 172.15 2qqk s GLN 345 N -3.52 0.65 0.00 3.99 -0.21 -0.10 -2.08 119.66 118.40 2qqk s GLN 345 Ca 0.06 -1.12 0.00 0.00 0.02 0.00 0.00 55.36 54.32 2qqk s GLN 345 Cb 0.04 0.24 0.00 0.00 1.00 0.00 0.00 33.01 34.29 2qqk s GLN 345 CO -0.07 -0.14 0.00 0.41 -2.12 0.00 0.00 175.29 173.37 2qqk n GLY 346 N 0.16 0.64 3.36 3.09 0.00 -1.18 -2.01 105.19 109.26 2qqk n GLY 346 Ca -0.15 -1.75 -0.15 0.00 0.00 0.00 0.00 46.02 43.98 2qqk n GLY 346 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qqk s ALA 347 N -3.34 -1.19 -0.22 4.61 0.00 0.01 -4.31 121.76 117.32 2qqk s ALA 347 Ca 0.00 0.90 -0.06 0.00 0.00 0.00 0.00 51.96 52.80 2qqk s ALA 347 Cb 0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 23.12 22.92 2qqk s ALA 347 CO 0.00 -0.29 0.02 0.42 0.00 0.00 0.00 175.76 175.91 2qqk s ILE 348 N -0.87 4.03 0.22 0.00 1.01 -1.26 -1.44 121.20 122.88 2qqk s ILE 348 Ca -0.09 -0.28 -0.32 0.00 0.00 0.00 0.00 60.65 59.96 2qqk s ILE 348 Cb -0.03 -2.84 -0.14 0.00 0.01 0.00 0.00 42.46 39.46 2qqk s ILE 348 CO 0.05 0.40 1.42 -0.24 0.00 0.00 0.00 174.94 176.57 2qqk n SER 349 N 4.48 2.66 0.07 3.58 2.88 -0.97 -4.28 113.62 122.05 2qqk n SER 349 Ca -0.17 1.13 -0.04 0.00 -1.33 0.00 0.00 58.87 58.46 2qqk n SER 349 Cb 0.52 -1.40 -0.08 0.00 -0.75 0.00 0.00 64.21 62.49 2qqk n SER 349 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 2qqk h ARG 350 N 4.45 0.00 -0.12 -1.46 2.43 -1.94 -1.21 114.38 116.54 2qqk h ARG 350 Ca -0.45 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 58.61 2qqk h ARG 350 Cb 1.28 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.83 2qqk h ARG 350 CO 0.78 0.80 -0.34 0.93 -1.51 0.00 0.00 179.97 180.62 2qqk h GLU 351 N 0.00 0.45 0.00 0.20 3.07 -2.00 -3.41 114.58 112.89 2qqk h GLU 351 Ca -0.03 -0.32 0.00 0.00 -0.50 0.00 0.00 59.36 58.50 2qqk h GLU 351 Cb 1.68 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.64 2qqk h GLU 351 CO 0.11 0.94 0.00 0.25 -1.40 0.00 0.00 179.01 178.90 2qqk n THR 352 N -4.36 0.00 -1.86 1.13 -2.24 -1.24 -5.03 114.28 100.68 2qqk n THR 352 Ca -0.07 -0.40 -0.20 0.00 -2.27 0.00 0.00 64.05 61.11 2qqk n THR 352 Cb 0.50 1.17 -0.06 0.00 -2.10 0.00 0.00 70.33 69.84 2qqk n THR 352 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qqk n GLN 353 N -0.15 -1.49 -3.47 -0.78 6.02 -0.46 -4.97 117.38 112.08 2qqk n GLN 353 Ca 0.00 1.14 -0.38 0.00 -0.01 0.00 0.00 57.00 57.75 2qqk n GLN 353 Cb 0.04 -5.59 -0.06 0.00 1.02 0.00 0.00 30.24 25.65 2qqk n GLN 353 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2qqk s ASN 354 N -2.55 6.75 -0.09 1.08 0.02 -1.26 -4.80 114.94 114.09 2qqk s ASN 354 Ca 0.00 0.90 -0.22 0.00 -1.02 0.00 0.00 52.86 52.52 2qqk s ASN 354 Cb 0.00 -2.25 -0.04 0.00 0.02 0.00 0.00 41.25 38.98 2qqk s ASN 354 CO 0.00 0.25 0.64 -0.83 0.02 0.00 0.00 177.10 177.17 2qqk s GLY 355 N -0.64 2.54 -0.02 0.66 0.00 -1.26 -2.28 107.32 106.32 2qqk s GLY 355 Ca 0.23 0.03 0.04 0.00 0.00 0.00 0.00 44.72 45.03 2qqk s GLY 355 CO 0.12 1.07 -0.14 -0.19 0.00 0.00 0.00 173.10 173.96 2qqk s TYR 356 N 0.79 1.31 -0.14 1.90 2.02 -0.52 -4.81 117.35 117.90 2qqk s TYR 356 Ca 0.34 -0.28 -0.24 0.00 -0.37 0.00 0.00 57.07 56.52 2qqk s TYR 356 Cb -0.17 -0.86 0.06 0.00 -0.40 0.00 0.00 41.96 40.59 2qqk s TYR 356 CO 0.16 -0.06 0.60 1.52 -1.57 0.00 0.00 175.55 176.20 2qqk s TYR 357 N -0.20 -0.61 0.13 2.71 1.13 -1.19 -0.81 117.35 118.51 2qqk s TYR 357 Ca 0.03 1.30 -0.30 0.00 -1.41 0.00 0.00 57.07 56.68 2qqk s TYR 357 Cb -0.07 0.28 -0.06 0.00 -1.10 0.00 0.00 41.96 41.01 2qqk s TYR 357 CO 0.00 -0.44 1.00 0.08 -2.51 0.00 0.00 175.55 173.69 2qqk s VAL 358 N -0.42 4.33 -0.13 -3.49 1.01 -1.26 -0.95 120.40 119.49 2qqk s VAL 358 Ca -0.06 1.94 0.18 0.00 0.00 0.00 0.00 61.98 64.04 2qqk s VAL 358 Cb -0.03 -4.24 -0.21 0.00 0.00 0.00 0.00 36.38 31.90 2qqk s VAL 358 CO 0.05 0.30 0.52 0.29 0.00 0.00 0.00 175.10 176.26 2qqk n LYS 359 N 2.72 0.65 -3.53 2.72 5.02 0.95 -2.08 118.16 124.61 2qqk n LYS 359 Ca 0.03 0.07 -0.17 0.00 -2.02 0.00 0.00 58.31 56.21 2qqk n LYS 359 Cb 0.48 -1.66 -0.06 0.00 -0.02 0.00 0.00 35.03 33.77 2qqk n LYS 359 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2qqk s SER 360 N -5.44 -0.62 0.18 4.39 1.04 -1.13 -0.11 113.70 112.00 2qqk s SER 360 Ca -0.06 0.61 -0.08 0.00 0.48 0.00 0.00 55.95 56.91 2qqk s SER 360 Cb 0.09 0.53 -0.02 0.00 0.10 0.00 0.00 66.02 66.72 2qqk s SER 360 CO 0.84 -0.63 0.26 -0.72 0.98 0.00 0.00 173.24 173.97 2qqk s TYR 361 N -1.44 0.54 0.37 5.02 -0.85 -0.77 0.45 117.35 120.67 2qqk s TYR 361 Ca -0.10 -0.89 0.08 0.00 -0.52 0.00 0.00 57.07 55.65 2qqk s TYR 361 Cb -0.00 -0.13 -0.05 0.00 0.38 0.00 0.00 41.96 42.15 2qqk s TYR 361 CO 0.08 -0.72 0.09 0.15 -1.52 0.00 0.00 175.55 173.62 2qqk s LYS 362 N -4.01 2.16 -0.12 -3.49 1.02 -0.18 -0.73 119.74 114.38 2qqk s LYS 362 Ca 0.21 -1.78 -0.00 0.00 0.02 0.00 0.00 55.97 54.42 2qqk s LYS 362 Cb 0.04 -1.96 0.03 0.00 -0.52 0.00 0.00 37.83 35.42 2qqk s LYS 362 CO 0.03 0.03 -0.09 -1.17 -0.92 0.00 0.00 175.35 173.24 2qqk s LEU 363 N -3.80 1.32 -0.14 3.17 2.96 -1.26 -1.56 118.68 119.37 2qqk s LEU 363 Ca 0.37 -0.37 -0.03 0.00 -0.22 0.00 0.00 54.13 53.88 2qqk s LEU 363 Cb 0.02 -0.92 -0.03 0.00 0.50 0.00 0.00 46.19 45.76 2qqk s LEU 363 CO 0.21 -0.11 -0.05 -1.61 -1.32 0.00 0.00 176.35 173.47 2qqk s GLU 364 N 1.66 3.55 0.30 1.98 2.02 -0.71 -0.40 118.70 127.10 2qqk s GLU 364 Ca 0.05 -0.53 0.11 0.00 0.02 0.00 0.00 54.97 54.61 2qqk s GLU 364 Cb -0.13 -2.86 -0.06 0.00 0.10 0.00 0.00 34.13 31.19 2qqk s GLU 364 CO -0.09 0.30 -0.15 0.14 0.02 0.00 0.00 175.26 175.48 2qqk s VAL 365 N 0.20 2.34 -0.19 2.63 -7.23 0.35 -0.59 120.40 117.91 2qqk s VAL 365 Ca -0.03 -2.31 -0.27 0.00 -1.81 0.00 0.00 61.98 57.56 2qqk s VAL 365 Cb -0.14 -2.43 0.08 0.00 0.56 0.00 0.00 36.38 34.44 2qqk s VAL 365 CO 0.03 -0.33 0.74 -0.55 -0.31 0.00 0.00 175.10 174.69 2qqk s SER 366 N -3.54 -0.68 0.01 4.85 0.15 -0.84 -0.90 113.70 112.75 2qqk s SER 366 Ca 0.31 1.10 0.26 0.00 0.70 0.00 0.00 55.95 58.32 2qqk s SER 366 Cb -0.02 1.04 0.71 0.00 -1.71 0.00 0.00 66.02 66.04 2qqk s SER 366 CO 0.15 -0.37 1.56 0.35 1.20 0.00 0.00 173.24 176.13 2qqk n THR 367 N 1.93 0.02 0.00 6.45 -2.24 -1.26 -0.59 114.28 118.59 2qqk n THR 367 Ca -0.15 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 2qqk n THR 367 Cb 0.56 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 2qqk n THR 367 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2qqk n ASN 368 N -1.54 0.06 0.00 3.42 0.23 -1.26 -4.76 115.26 111.41 2qqk n ASN 368 Ca 0.06 -0.04 0.00 0.00 -0.53 0.00 0.00 54.58 54.07 2qqk n ASN 368 Cb 0.34 0.09 0.00 0.00 -2.08 0.00 0.00 39.78 38.14 2qqk n ASN 368 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2qqk n GLY 369 N 0.11 0.71 0.26 4.83 0.00 -1.26 -4.85 105.19 104.99 2qqk n GLY 369 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 2qqk n GLY 369 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2qqk n GLU 370 N -2.03 0.02 -3.62 1.61 2.13 -1.26 -4.99 120.64 112.50 2qqk n GLU 370 Ca 0.00 0.01 -0.40 0.00 0.66 0.00 0.00 57.16 57.43 2qqk n GLU 370 Cb 0.00 -0.89 -0.11 0.00 0.27 0.00 0.00 31.44 30.71 2qqk n GLU 370 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2qqk s ASP 371 N -4.36 5.66 0.08 4.31 1.01 -1.26 -5.09 116.67 117.02 2qqk s ASP 371 Ca -0.01 -0.87 0.05 0.00 0.71 0.00 0.00 52.55 52.43 2qqk s ASP 371 Cb 0.00 -2.01 -0.04 0.00 1.01 0.00 0.00 42.92 41.88 2qqk s ASP 371 CO 0.02 -0.33 -0.02 0.26 0.21 0.00 0.00 175.17 175.31 2qqk s TRP 372 N 1.56 2.94 -0.06 4.23 0.52 -1.26 -4.35 118.94 122.53 2qqk s TRP 372 Ca 0.03 -0.04 0.00 0.00 0.02 0.00 0.00 56.10 56.11 2qqk s TRP 372 Cb -0.19 -1.54 0.02 0.00 -1.15 0.00 0.00 33.47 30.62 2qqk s TRP 372 CO 0.06 0.46 -0.04 1.41 0.02 0.00 0.00 176.95 178.86 2qqk s MET 373 N -2.14 0.89 -0.32 4.98 1.75 -0.08 -4.95 119.30 119.42 2qqk s MET 373 Ca 0.24 -0.08 -0.26 0.00 -1.25 0.00 0.00 55.69 54.33 2qqk s MET 373 Cb -0.12 -0.98 0.01 0.00 2.84 0.00 0.00 34.83 36.58 2qqk s MET 373 CO 0.16 -0.15 0.94 0.08 -0.65 0.00 0.00 175.02 175.39 2qqk s VAL 374 N 1.27 4.63 0.35 10.11 1.01 -1.26 -0.49 120.40 136.01 2qqk s VAL 374 Ca -0.05 1.43 -0.25 0.00 0.00 0.00 0.00 61.98 63.10 2qqk s VAL 374 Cb -0.14 -4.30 -0.13 0.00 0.00 0.00 0.00 36.38 31.81 2qqk s VAL 374 CO -0.02 -0.41 0.80 0.00 0.00 0.00 0.00 175.10 175.48 2qqk n TYR 375 N 6.60 0.48 -4.34 5.22 9.36 0.46 -4.87 117.16 130.09 2qqk n TYR 375 Ca 0.08 0.67 -0.23 0.00 3.32 0.00 0.00 57.90 61.74 2qqk n TYR 375 Cb 0.48 -2.13 -0.12 0.00 -0.63 0.00 0.00 39.34 36.94 2qqk n TYR 375 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 2qqk s ARG 376 N -1.59 1.28 -0.65 2.98 0.52 -1.26 -2.28 118.95 117.95 2qqk s ARG 376 Ca 0.62 -1.37 0.05 0.00 -0.52 0.00 0.00 55.73 54.51 2qqk s ARG 376 Cb -0.67 -1.44 0.17 0.00 0.52 0.00 0.00 34.95 33.53 2qqk s ARG 376 CO 0.58 0.31 0.46 -1.58 0.02 0.00 0.00 175.30 175.09 2qqk s HIS 377 N -1.75 3.22 0.00 -0.53 5.65 -0.85 -4.73 115.29 116.30 2qqk s HIS 377 Ca 0.14 -3.19 0.00 0.00 0.25 0.00 0.00 55.06 52.26 2qqk s HIS 377 Cb -0.07 -2.49 0.00 0.00 -1.18 0.00 0.00 32.58 28.84 2qqk s HIS 377 CO 0.07 -0.60 0.00 0.41 -0.65 0.00 0.00 174.74 173.97 2qqk n GLY 378 N 2.18 1.89 0.09 1.59 0.00 -1.26 -4.22 105.19 105.47 2qqk n GLY 378 Ca 0.20 -0.53 -0.12 0.00 0.00 0.00 0.00 46.02 45.56 2qqk n GLY 378 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qqk h LYS 379 N 0.00 -0.08 -6.30 1.61 1.57 -2.03 -3.48 116.57 107.85 2qqk h LYS 379 Ca 0.00 0.01 -0.51 0.00 -1.87 0.00 0.00 60.65 58.28 2qqk h LYS 379 Cb 0.00 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 2qqk h LYS 379 CO 0.00 0.46 -0.24 0.54 -0.57 0.00 0.00 179.45 179.64 2qqk s ASN 380 N -5.68 5.01 0.52 0.86 4.22 -1.26 -5.06 114.94 113.55 2qqk s ASN 380 Ca -0.15 -0.90 -0.23 0.00 -2.14 0.00 0.00 52.86 49.44 2qqk s ASN 380 Cb 0.01 0.05 -0.06 0.00 1.28 0.00 0.00 41.25 42.52 2qqk s ASN 380 CO 0.61 -1.06 1.39 1.41 -2.04 0.00 0.00 177.10 177.41 2qqk n HIS 381 N -1.91 2.45 -3.11 1.54 8.25 -1.26 -2.01 115.22 119.17 2qqk n HIS 381 Ca 0.07 0.43 -0.40 0.00 -0.26 0.00 0.00 57.72 57.56 2qqk n HIS 381 Cb 0.62 -2.40 -0.06 0.00 1.12 0.00 0.00 29.99 29.28 2qqk n HIS 381 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 2qqk s LYS 382 N -2.76 4.23 -0.26 -0.41 2.47 -0.96 -4.57 119.74 117.47 2qqk s LYS 382 Ca 0.68 0.64 -0.10 0.00 -1.56 0.00 0.00 55.97 55.63 2qqk s LYS 382 Cb -0.42 -3.57 -0.04 0.00 -1.46 0.00 0.00 37.83 32.33 2qqk s LYS 382 CO 0.52 -0.21 0.14 0.08 0.16 0.00 0.00 175.35 176.04 2qqk s VAL 383 N 1.82 5.03 0.06 4.02 1.01 -1.26 -4.56 120.40 126.52 2qqk s VAL 383 Ca 0.29 0.07 -0.23 0.00 0.00 0.00 0.00 61.98 62.11 2qqk s VAL 383 Cb -0.16 -3.37 -0.06 0.00 0.00 0.00 0.00 36.38 32.79 2qqk s VAL 383 CO 0.11 0.31 0.69 -0.36 0.00 0.00 0.00 175.10 175.85 2qqk s PHE 384 N 1.47 3.77 -0.13 5.22 0.08 0.09 -4.92 117.98 123.56 2qqk s PHE 384 Ca 0.07 1.41 -0.29 0.00 0.12 0.00 0.00 56.93 58.23 2qqk s PHE 384 Cb -0.15 -2.70 -0.01 0.00 -0.57 0.00 0.00 43.02 39.59 2qqk s PHE 384 CO 0.07 0.40 1.03 -0.65 -0.10 0.00 0.00 175.22 175.97 2qqk s GLN 385 N -0.52 4.39 0.00 0.44 -1.52 -1.26 -1.85 119.66 119.34 2qqk s GLN 385 Ca 0.34 1.40 0.00 0.00 -1.95 0.00 0.00 55.36 55.16 2qqk s GLN 385 Cb -0.20 -3.56 0.00 0.00 -0.22 0.00 0.00 33.01 29.02 2qqk s GLN 385 CO 0.22 -0.39 0.00 0.00 -0.25 0.00 0.00 175.29 174.87 2qqk n ALA 386 N 5.29 0.00 -2.50 6.09 0.00 0.84 -4.95 120.51 125.28 2qqk n ALA 386 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.27 2qqk n ALA 386 Cb 0.48 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.92 2qqk n ALA 386 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2qqk s ASN 387 N -0.63 6.33 -0.02 0.00 -0.87 -0.88 -4.93 114.94 113.94 2qqk s ASN 387 Ca 0.00 0.67 0.03 0.00 -1.57 0.00 0.00 52.86 51.99 2qqk s ASN 387 Cb 0.00 -2.13 0.05 0.00 -0.02 0.00 0.00 41.25 39.15 2qqk s ASN 387 CO 0.00 -0.35 0.92 0.59 -2.57 0.00 0.00 177.10 175.69 2qqk n ASN 388 N -1.69 1.53 -2.48 -1.22 3.02 -1.26 -4.41 115.26 108.74 2qqk n ASN 388 Ca -0.02 -1.96 -0.04 0.00 -0.03 0.00 0.00 54.58 52.52 2qqk n ASN 388 Cb 0.55 -0.08 0.02 0.00 -0.61 0.00 0.00 39.78 39.66 2qqk n ASN 388 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2qqk n ASP 389 N -0.51 -1.43 -0.12 6.41 5.68 -1.26 -5.07 116.55 120.25 2qqk n ASP 389 Ca 0.03 -1.87 0.12 0.00 -0.50 0.00 0.00 54.79 52.56 2qqk n ASP 389 Cb 0.39 2.35 0.24 0.00 -1.14 0.00 0.00 41.12 42.96 2qqk n ASP 389 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2qqk n ALA 390 N -1.33 3.51 0.00 2.12 0.00 -1.26 -4.39 120.51 119.16 2qqk n ALA 390 Ca -0.11 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 52.92 2qqk n ALA 390 Cb 0.42 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2qqk n ALA 390 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2qqk n THR 391 N -1.11 0.00 -1.71 0.00 -2.24 -1.26 -2.97 114.28 105.00 2qqk n THR 391 Ca 0.08 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.50 2qqk n THR 391 Cb 0.35 -0.53 0.07 0.00 -2.10 0.00 0.00 70.33 68.11 2qqk n THR 391 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2qqk s GLU 392 N -1.94 2.52 -0.13 -0.78 -1.05 -1.26 -4.88 118.70 111.17 2qqk s GLU 392 Ca 0.00 1.91 -0.06 0.00 -0.15 0.00 0.00 54.97 56.67 2qqk s GLU 392 Cb 0.00 -1.86 -0.04 0.00 -0.44 0.00 0.00 34.13 31.79 2qqk s GLU 392 CO 0.00 -1.58 0.07 0.08 0.95 0.00 0.00 175.26 174.77 2qqk s VAL 393 N -1.63 4.88 -0.11 1.83 1.01 -1.26 -4.49 120.40 120.61 2qqk s VAL 393 Ca 0.79 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.75 2qqk s VAL 393 Cb -0.33 -3.13 0.02 0.00 0.00 0.00 0.00 36.38 32.94 2qqk s VAL 393 CO 0.40 0.55 -0.12 -0.69 0.00 0.00 0.00 175.10 175.24 2qqk s VAL 394 N -0.45 1.30 -0.21 2.92 1.01 -0.88 -4.95 120.40 119.14 2qqk s VAL 394 Ca 0.10 -0.50 -0.05 0.00 0.00 0.00 0.00 61.98 61.53 2qqk s VAL 394 Cb -0.12 -1.24 -0.02 0.00 0.00 0.00 0.00 36.38 35.00 2qqk s VAL 394 CO 0.02 0.41 0.00 -0.22 0.00 0.00 0.00 175.10 175.31 2qqk s LEU 395 N 1.31 3.24 -0.30 3.92 2.96 -1.26 -1.76 118.68 126.79 2qqk s LEU 395 Ca -0.01 -0.22 -0.05 0.00 -0.22 0.00 0.00 54.13 53.63 2qqk s LEU 395 Cb -0.14 -1.83 0.03 0.00 0.50 0.00 0.00 46.19 44.75 2qqk s LEU 395 CO -0.05 0.05 0.05 0.20 -1.32 0.00 0.00 176.35 175.28 2qqk s ASN 396 N 1.09 5.00 -0.04 3.68 0.01 0.86 -4.99 114.94 120.54 2qqk s ASN 396 Ca 0.02 -0.93 -0.28 0.00 -0.71 0.00 0.00 52.86 50.96 2qqk s ASN 396 Cb -0.14 -1.82 -0.03 0.00 0.41 0.00 0.00 41.25 39.67 2qqk s ASN 396 CO 0.01 -0.23 0.90 -0.54 -1.51 0.00 0.00 177.10 175.74 2qqk s LYS 397 N 1.41 4.49 0.21 -0.60 1.02 -1.26 -1.58 119.74 123.43 2qqk s LYS 397 Ca -0.00 1.25 -0.31 0.00 0.02 0.00 0.00 55.97 56.93 2qqk s LYS 397 Cb -0.18 -3.47 -0.11 0.00 -0.52 0.00 0.00 37.83 33.55 2qqk s LYS 397 CO 0.01 -0.07 1.61 -0.51 -0.92 0.00 0.00 175.35 175.46 2qqk s LEU 398 N 1.16 4.37 0.35 3.17 1.43 -0.64 -4.89 118.68 123.62 2qqk s LEU 398 Ca 0.47 2.76 0.12 0.00 -1.03 0.00 0.00 54.13 56.46 2qqk s LEU 398 Cb -0.20 -3.61 0.64 0.00 0.03 0.00 0.00 46.19 43.06 2qqk s LEU 398 CO 0.23 -0.87 1.78 1.12 0.23 0.00 0.00 176.35 178.83 2qqk h HIS 399 N 6.25 0.00 -3.74 0.29 2.07 -1.95 -3.39 115.15 114.68 2qqk h HIS 399 Ca -0.44 0.00 -0.67 0.00 -2.85 0.00 0.00 60.37 56.41 2qqk h HIS 399 Cb 1.21 0.00 -0.37 0.00 2.57 0.00 0.00 27.41 30.82 2qqk h HIS 399 CO 0.63 0.43 -0.72 0.00 -3.07 0.00 0.00 177.93 175.20 2qqk s ALA 400 N -4.04 2.80 0.42 6.11 0.00 -1.26 -5.11 121.76 120.69 2qqk s ALA 400 Ca -0.02 -2.14 -0.25 0.00 0.00 0.00 0.00 51.96 49.55 2qqk s ALA 400 Cb 0.14 -1.89 -0.10 0.00 0.00 0.00 0.00 23.12 21.27 2qqk s ALA 400 CO 0.73 -1.46 1.24 -2.30 0.00 0.00 0.00 175.76 173.97 2qqk n PRO 401 N 4.42 1.85 -5.25 0.00 -0.02 -1.26 -5.00 135.00 129.75 2qqk n PRO 401 Ca -0.06 0.66 -0.32 0.00 -2.02 0.00 0.00 63.50 61.76 2qqk n PRO 401 Cb 0.42 -2.34 -0.17 0.00 -0.02 0.00 0.00 33.50 31.40 2qqk n PRO 401 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2qqk s LEU 402 N -1.54 2.08 -0.32 2.45 1.43 -0.60 -4.95 118.68 117.22 2qqk s LEU 402 Ca 0.61 -0.53 -0.15 0.00 -1.03 0.00 0.00 54.13 53.03 2qqk s LEU 402 Cb -0.52 -1.39 -0.02 0.00 0.03 0.00 0.00 46.19 44.30 2qqk s LEU 402 CO 0.58 0.21 0.35 -0.22 0.23 0.00 0.00 176.35 177.50 2qqk s LEU 403 N 0.05 4.29 0.34 1.79 2.96 -1.26 0.56 118.68 127.40 2qqk s LEU 403 Ca -0.10 -0.06 -0.14 0.00 -0.22 0.00 0.00 54.13 53.61 2qqk s LEU 403 Cb -0.16 -2.35 0.03 0.00 0.50 0.00 0.00 46.19 44.22 2qqk s LEU 403 CO 0.06 -0.27 0.67 0.28 -1.32 0.00 0.00 176.35 175.76 2qqk s THR 404 N 2.02 0.00 0.00 3.68 -1.32 -0.36 -4.29 115.64 115.37 2qqk s THR 404 Ca 0.12 -1.18 0.00 0.00 -1.21 0.00 0.00 61.69 59.42 2qqk s THR 404 Cb -0.16 -2.56 0.00 0.00 -1.51 0.00 0.00 72.50 68.27 2qqk s THR 404 CO 0.11 0.00 0.00 -1.14 -2.21 0.00 0.00 174.62 171.38 2qqk n ARG 405 N -0.50 0.00 -4.05 7.08 0.63 -0.98 0.38 116.66 119.22 2qqk n ARG 405 Ca -0.05 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.52 2qqk n ARG 405 Cb 0.60 -0.50 -0.07 0.00 0.45 0.00 0.00 32.46 32.94 2qqk n ARG 405 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2qqk s PHE 406 N -1.94 3.43 -0.04 -0.14 0.40 0.24 -1.00 117.98 118.93 2qqk s PHE 406 Ca 0.00 0.39 0.06 0.00 -0.60 0.00 0.00 56.93 56.77 2qqk s PHE 406 Cb 0.00 -1.90 -0.01 0.00 0.51 0.00 0.00 43.02 41.62 2qqk s PHE 406 CO 0.00 0.60 -0.20 0.08 0.70 0.00 0.00 175.22 176.40 2qqk s VAL 407 N -0.86 1.66 -0.12 -0.44 1.01 -0.43 -1.99 120.40 119.23 2qqk s VAL 407 Ca 0.14 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.27 2qqk s VAL 407 Cb -0.12 -1.40 0.01 0.00 0.00 0.00 0.00 36.38 34.87 2qqk s VAL 407 CO 0.03 0.47 -0.19 -0.13 0.00 0.00 0.00 175.10 175.28 2qqk s ARG 408 N -0.21 2.67 -0.19 2.72 0.52 0.24 -0.81 118.95 123.89 2qqk s ARG 408 Ca 0.01 -0.73 -0.15 0.00 -0.52 0.00 0.00 55.73 54.34 2qqk s ARG 408 Cb -0.11 -2.17 -0.04 0.00 0.52 0.00 0.00 34.95 33.15 2qqk s ARG 408 CO 0.01 -0.01 0.34 0.42 0.02 0.00 0.00 175.30 176.09 2qqk s ILE 409 N 0.82 5.25 -0.32 1.52 -1.09 -0.53 -1.73 121.20 125.12 2qqk s ILE 409 Ca -0.08 0.61 0.03 0.00 -2.23 0.00 0.00 60.65 58.98 2qqk s ILE 409 Cb -0.16 -3.68 0.09 0.00 -1.58 0.00 0.00 42.46 37.14 2qqk s ILE 409 CO -0.00 0.31 0.04 -0.13 -1.23 0.00 0.00 174.94 173.92 2qqk s ARG 410 N 0.97 1.44 0.35 2.79 0.52 -0.60 -2.08 118.95 122.35 2qqk s ARG 410 Ca 0.17 -1.68 -0.28 0.00 -0.52 0.00 0.00 55.73 53.42 2qqk s ARG 410 Cb -0.14 -2.99 -0.11 0.00 0.52 0.00 0.00 34.95 32.24 2qqk s ARG 410 CO 0.06 -0.90 1.40 -2.14 0.02 0.00 0.00 175.30 173.74 2qqk s PRO 411 N 1.04 4.23 -0.12 3.54 0.02 -1.26 -1.01 135.00 141.44 2qqk s PRO 411 Ca 0.08 2.39 -0.05 0.00 0.02 0.00 0.00 61.00 63.45 2qqk s PRO 411 Cb -0.19 -3.02 -0.06 0.00 0.02 0.00 0.00 34.50 31.26 2qqk s PRO 411 CO -0.10 -0.36 -0.14 1.04 -0.33 0.00 0.00 177.00 177.11 2qqk n GLN 412 N 0.63 0.26 -4.39 5.54 1.13 0.17 -4.33 117.38 116.40 2qqk n GLN 412 Ca 0.00 0.10 -0.20 0.00 -1.94 0.00 0.00 57.00 54.97 2qqk n GLN 412 Cb 0.40 -1.00 -0.10 0.00 0.11 0.00 0.00 30.24 29.66 2qqk n GLN 412 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 2qqk s THR 413 N -2.22 1.66 0.24 5.09 -4.23 -1.18 -4.78 115.64 110.21 2qqk s THR 413 Ca -0.17 -2.16 -0.22 0.00 -1.18 0.00 0.00 61.69 57.96 2qqk s THR 413 Cb 0.06 -2.26 0.04 0.00 1.34 0.00 0.00 72.50 71.67 2qqk s THR 413 CO 0.22 -0.43 0.77 -1.66 -0.54 0.00 0.00 174.62 172.98 2qqk s TRP 414 N -3.01 -0.21 -0.17 3.99 -2.14 -1.26 -0.03 118.94 116.10 2qqk s TRP 414 Ca 0.26 -0.19 0.01 0.00 2.66 0.00 0.00 56.10 58.84 2qqk s TRP 414 Cb 0.02 0.68 0.01 0.00 -3.10 0.00 0.00 33.47 31.08 2qqk s TRP 414 CO 0.10 -1.10 -0.19 -1.58 -2.66 0.00 0.00 176.95 171.52 2qqk s HIS 415 N -3.74 2.77 0.00 1.66 5.65 -0.12 -4.75 115.29 116.76 2qqk s HIS 415 Ca 0.10 -1.47 0.00 0.00 0.25 0.00 0.00 55.06 53.94 2qqk s HIS 415 Cb -0.04 -1.91 0.00 0.00 -1.18 0.00 0.00 32.58 29.45 2qqk s HIS 415 CO 0.04 -0.72 0.00 0.43 -0.65 0.00 0.00 174.74 173.84 2qqk n SER 416 N 4.46 0.00 0.00 9.88 7.64 -1.26 -3.14 113.62 131.20 2qqk n SER 416 Ca -0.20 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.68 2qqk n SER 416 Cb 0.51 -0.18 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 2qqk n SER 416 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qqk n GLY 417 N -0.46 1.40 3.63 0.23 0.00 -1.26 -5.04 105.19 103.68 2qqk n GLY 417 Ca 0.00 -0.86 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 2qqk n GLY 417 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qqk s ILE 418 N -2.00 4.76 -0.10 -0.61 1.01 -1.26 -3.37 121.20 119.64 2qqk s ILE 418 Ca 0.00 1.48 -0.04 0.00 0.00 0.00 0.00 60.65 62.09 2qqk s ILE 418 Cb 0.00 -4.18 0.05 0.00 0.01 0.00 0.00 42.46 38.34 2qqk s ILE 418 CO 0.00 -0.20 0.20 0.00 0.00 0.00 0.00 174.94 174.94 2qqk s ALA 419 N 3.02 -0.39 0.03 9.38 0.00 -1.26 -4.29 121.76 128.26 2qqk s ALA 419 Ca 0.36 0.80 0.08 0.00 0.00 0.00 0.00 51.96 53.21 2qqk s ALA 419 Cb -0.14 -0.71 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 2qqk s ALA 419 CO 0.10 -0.36 -0.24 -0.51 0.00 0.00 0.00 175.76 174.74 2qqk s LEU 420 N 1.72 2.14 0.10 0.00 1.43 -0.55 -4.01 118.68 119.51 2qqk s LEU 420 Ca -0.04 -0.53 0.06 0.00 -1.03 0.00 0.00 54.13 52.58 2qqk s LEU 420 Cb -0.11 -1.19 -0.03 0.00 0.03 0.00 0.00 46.19 44.88 2qqk s LEU 420 CO -0.07 0.24 -0.14 -0.13 0.23 0.00 0.00 176.35 176.48 2qqk s ARG 421 N -1.05 0.96 -0.08 1.70 0.52 -0.85 -1.77 118.95 118.37 2qqk s ARG 421 Ca 0.10 -1.14 -0.11 0.00 -0.52 0.00 0.00 55.73 54.06 2qqk s ARG 421 Cb -0.09 -0.90 0.02 0.00 0.52 0.00 0.00 34.95 34.50 2qqk s ARG 421 CO 0.01 0.18 0.28 -1.17 0.02 0.00 0.00 175.30 174.63 2qqk s LEU 422 N -2.18 0.94 0.12 2.53 2.96 0.28 -0.92 118.68 122.41 2qqk s LEU 422 Ca 0.05 0.42 0.07 0.00 -0.22 0.00 0.00 54.13 54.45 2qqk s LEU 422 Cb -0.07 1.02 -0.04 0.00 0.50 0.00 0.00 46.19 47.60 2qqk s LEU 422 CO 0.03 -0.19 -0.16 -0.70 -1.32 0.00 0.00 176.35 174.01 2qqk s GLU 423 N -0.25 1.06 0.01 1.98 2.56 0.22 -1.94 118.70 122.32 2qqk s GLU 423 Ca -0.04 -1.22 0.08 0.00 0.00 0.00 0.00 54.97 53.79 2qqk s GLU 423 Cb -0.03 -1.05 -0.02 0.00 2.00 0.00 0.00 34.13 35.03 2qqk s GLU 423 CO 0.01 0.22 -0.23 -0.51 -0.56 0.00 0.00 175.26 174.18 2qqk s LEU 424 N -2.31 2.09 0.14 2.70 1.43 -1.26 -1.46 118.68 120.02 2qqk s LEU 424 Ca 0.08 -0.47 0.11 0.00 -1.03 0.00 0.00 54.13 52.81 2qqk s LEU 424 Cb -0.07 -1.17 -0.04 0.00 0.03 0.00 0.00 46.19 44.95 2qqk s LEU 424 CO 0.04 0.25 -0.24 -0.36 0.23 0.00 0.00 176.35 176.27 2qqk s PHE 425 N -0.65 2.37 -0.72 0.29 0.40 0.22 -0.72 117.98 119.19 2qqk s PHE 425 Ca 0.09 -0.34 0.00 0.00 -0.60 0.00 0.00 56.93 56.08 2qqk s PHE 425 Cb -0.09 -1.25 0.00 0.00 0.51 0.00 0.00 43.02 42.19 2qqk s PHE 425 CO 0.00 0.39 0.00 0.41 0.70 0.00 0.00 175.22 176.72 2qqk n GLY 426 N 0.72 -0.81 3.73 4.36 0.00 0.17 -1.85 105.19 111.51 2qqk n GLY 426 Ca -0.16 -0.23 -0.00 0.00 0.00 0.00 0.00 46.02 45.62 2qqk n GLY 426 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qqk s ARG 428 N -2.61 3.97 0.33 0.00 0.52 -1.26 -0.70 118.95 119.20 2qqk s ARG 428 Ca 0.16 0.48 0.08 0.00 -0.52 0.00 0.00 55.73 55.93 2qqk s ARG 428 Cb 0.02 -2.95 0.95 0.00 0.52 0.00 0.00 34.95 33.49 2qqk s ARG 428 CO -0.01 0.49 1.58 0.28 0.02 0.00 0.00 175.30 177.66 2qqk h VAL 429 N 2.83 0.04 0.00 3.52 2.07 -1.94 0.11 116.25 122.87 2qqk h VAL 429 Ca -0.49 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.02 2qqk h VAL 429 Cb 1.19 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 2qqk h VAL 429 CO 0.66 0.00 0.00 0.35 0.02 0.00 0.00 177.57 178.60 2qqk n THR 430 N -5.39 0.00 0.67 2.57 -2.24 -1.26 -3.36 114.28 105.27 2qqk n THR 430 Ca 0.28 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 62.19 2qqk n THR 430 Cb 0.93 -0.12 0.35 0.00 -2.10 0.00 0.00 70.33 69.38 2qqk n THR 430 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2qqk n ASP 431 N -0.44 0.68 -4.84 3.42 8.00 0.37 -4.81 116.55 118.93 2qqk n ASP 431 Ca 0.00 0.39 -0.35 0.00 0.71 0.00 0.00 54.79 55.54 2qqk n ASP 431 Cb 0.02 -0.42 -0.06 0.00 -0.02 0.00 0.00 41.12 40.64 2qqk n ASP 431 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qqk s ALA 432 N -3.10 3.49 0.45 2.24 0.00 -1.21 -4.75 121.76 118.86 2qqk s ALA 432 Ca 0.10 -0.04 -0.22 0.00 0.00 0.00 0.00 51.96 51.79 2qqk s ALA 432 Cb 0.14 -2.63 -0.11 0.00 0.00 0.00 0.00 23.12 20.51 2qqk s ALA 432 CO 0.63 0.41 0.74 -2.30 0.00 0.00 0.00 175.76 175.24 2qqk n PRO 433 N 0.45 0.86 -2.93 0.00 -0.02 -1.26 -3.55 135.00 128.56 2qqk n PRO 433 Ca -0.02 0.31 -0.19 0.00 -2.02 0.00 0.00 63.50 61.59 2qqk n PRO 433 Cb 0.52 -1.76 0.01 0.00 -0.02 0.00 0.00 33.50 32.25 2qqk n PRO 433 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qqk n SER 435 N -0.63 0.23 -4.79 0.00 2.88 -1.23 -4.46 113.62 105.63 2qqk n SER 435 Ca -0.13 -2.06 -0.36 0.00 -1.33 0.00 0.00 58.87 54.99 2qqk n SER 435 Cb 0.41 -0.02 -0.05 0.00 -0.75 0.00 0.00 64.21 63.80 2qqk n SER 435 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 2qqk s ASN 436 N -2.17 6.84 -0.14 -3.46 0.01 -0.39 -4.28 114.94 111.35 2qqk s ASN 436 Ca 0.20 1.94 -0.29 0.00 -0.71 0.00 0.00 52.86 54.00 2qqk s ASN 436 Cb 0.30 -2.58 -0.02 0.00 0.41 0.00 0.00 41.25 39.37 2qqk s ASN 436 CO -0.09 -0.43 1.22 -0.04 -1.51 0.00 0.00 177.10 176.26 2qqk s MET 437 N -2.58 4.27 0.00 -0.60 -1.94 -1.26 -1.96 119.30 115.22 2qqk s MET 437 Ca 0.58 1.63 0.28 0.00 -1.71 0.00 0.00 55.69 56.47 2qqk s MET 437 Cb -0.19 -3.70 1.16 0.00 2.01 0.00 0.00 34.83 34.11 2qqk s MET 437 CO 0.24 -0.63 1.83 1.28 -0.01 0.00 0.00 175.02 177.73 2qqk n LEU 438 N 6.20 0.39 0.00 -0.03 4.77 -0.57 -4.89 117.00 122.87 2qqk n LEU 438 Ca 0.13 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 2qqk n LEU 438 Cb 0.45 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 2qqk n LEU 438 CO 0.55 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 2qqk n GLY 439 N 1.33 0.49 0.07 -0.72 0.00 -1.26 -4.54 105.19 100.56 2qqk n GLY 439 Ca 0.12 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 2qqk n GLY 439 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2qqk h MET 440 N 0.00 0.11 -0.60 1.61 2.86 -1.86 -1.59 114.93 115.45 2qqk h MET 440 Ca 0.00 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.59 2qqk h MET 440 Cb 0.00 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.62 2qqk h MET 440 CO 0.00 0.36 0.30 1.25 1.06 0.00 0.00 176.91 179.88 2qqk h LEU 441 N -0.17 0.79 0.11 1.22 6.46 -1.83 -3.31 115.31 118.58 2qqk h LEU 441 Ca 0.02 -0.13 -0.29 0.00 -0.12 0.00 0.00 57.88 57.36 2qqk h LEU 441 Cb 0.31 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 40.04 2qqk h LEU 441 CO 0.00 0.69 -1.45 0.77 -0.62 0.00 0.00 178.44 177.84 2qqk h SER 442 N 0.82 0.37 0.00 1.25 4.64 -1.79 -3.38 113.55 115.46 2qqk h SER 442 Ca 0.21 -0.48 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 2qqk h SER 442 Cb 0.11 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 2qqk h SER 442 CO -0.03 1.39 0.00 0.61 -0.87 0.00 0.00 176.83 177.94 2qqk n GLY 443 N 1.62 0.93 0.29 -0.77 0.00 -0.97 -1.30 105.19 104.98 2qqk n GLY 443 Ca -0.14 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.06 2qqk n GLY 443 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2qqk h LEU 444 N 0.00 0.00 -8.05 0.99 5.85 -1.77 -3.32 115.31 109.01 2qqk h LEU 444 Ca 0.00 0.00 -0.74 0.00 0.84 0.00 0.00 57.88 57.98 2qqk h LEU 444 Cb 0.00 0.00 -0.27 0.00 0.37 0.00 0.00 40.66 40.76 2qqk h LEU 444 CO 0.00 0.00 -0.33 -0.63 -0.34 0.00 0.00 178.44 177.14 2qqk s ILE 445 N -3.76 4.67 0.79 4.05 1.01 -0.64 -4.96 121.20 122.36 2qqk s ILE 445 Ca -0.00 -1.58 -0.14 0.00 0.00 0.00 0.00 60.65 58.93 2qqk s ILE 445 Cb 0.10 -4.00 0.07 0.00 0.01 0.00 0.00 42.46 38.64 2qqk s ILE 445 CO 0.50 -0.77 1.22 0.00 0.00 0.00 0.00 174.94 175.90 2qqk s ALA 446 N 1.48 1.91 0.31 9.38 0.00 -1.25 -4.76 121.76 128.83 2qqk s ALA 446 Ca 0.04 0.89 0.05 0.00 0.00 0.00 0.00 51.96 52.95 2qqk s ALA 446 Cb -0.27 -3.50 0.85 0.00 0.00 0.00 0.00 23.12 20.20 2qqk s ALA 446 CO 0.02 -2.20 1.60 -0.44 0.00 0.00 0.00 175.76 174.74 2qqk h ASP 447 N -0.71 -0.14 0.00 0.00 5.19 -1.94 0.14 116.42 118.96 2qqk h ASP 447 Ca -0.47 0.24 0.00 0.00 -0.62 0.00 0.00 57.03 56.19 2qqk h ASP 447 Cb 1.30 0.36 0.00 0.00 0.18 0.00 0.00 39.33 41.17 2qqk h ASP 447 CO 0.47 -0.29 0.00 -1.54 -3.12 0.00 0.00 179.24 174.76 2qqk n SER 448 N -5.34 0.00 -0.29 6.45 3.41 -1.26 -1.96 113.62 114.63 2qqk n SER 448 Ca 0.25 -0.78 0.05 0.00 -0.26 0.00 0.00 58.87 58.13 2qqk n SER 448 Cb 0.83 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.79 2qqk n SER 448 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qqk n GLN 449 N -0.78 1.53 -3.70 4.33 6.02 0.49 -4.95 117.38 120.33 2qqk n GLN 449 Ca 0.07 -0.78 -0.38 0.00 -0.01 0.00 0.00 57.00 55.90 2qqk n GLN 449 Cb 0.03 -1.12 -0.12 0.00 1.02 0.00 0.00 30.24 30.05 2qqk n GLN 449 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2qqk s ILE 450 N -1.19 4.49 0.18 5.09 1.01 -0.83 0.73 121.20 130.69 2qqk s ILE 450 Ca 0.10 -0.29 0.09 0.00 0.00 0.00 0.00 60.65 60.55 2qqk s ILE 450 Cb 0.08 -3.20 -0.04 0.00 0.01 0.00 0.00 42.46 39.31 2qqk s ILE 450 CO 0.21 0.20 -0.14 -0.94 0.00 0.00 0.00 174.94 174.27 2qqk s SER 451 N 1.62 4.03 0.00 3.58 1.04 0.12 -4.93 113.70 119.15 2qqk s SER 451 Ca 0.05 -0.65 0.02 0.00 0.48 0.00 0.00 55.95 55.86 2qqk s SER 451 Cb -0.16 -0.60 -0.01 0.00 0.10 0.00 0.00 66.02 65.36 2qqk s SER 451 CO 0.05 0.11 -0.06 0.00 0.98 0.00 0.00 173.24 174.32 2qqk s ALA 452 N -1.65 0.52 0.26 5.32 0.00 -1.26 0.04 121.76 124.99 2qqk s ALA 452 Ca 0.23 -0.34 -0.02 0.00 0.00 0.00 0.00 51.96 51.83 2qqk s ALA 452 Cb -0.09 -0.10 0.57 0.00 0.00 0.00 0.00 23.12 23.50 2qqk s ALA 452 CO 0.13 0.10 1.67 0.66 0.00 0.00 0.00 175.76 178.33 2qqk h SER 453 N 5.76 0.00 -1.63 0.00 4.64 -1.62 -3.43 113.55 117.28 2qqk h SER 453 Ca -0.30 0.17 0.15 0.00 -0.47 0.00 0.00 61.79 61.34 2qqk h SER 453 Cb 1.19 0.23 -0.25 0.00 -0.31 0.00 0.00 62.40 63.26 2qqk h SER 453 CO 0.49 -0.09 0.26 -0.94 -0.87 0.00 0.00 176.83 175.68 2qqk s SER 454 N -5.18 -0.59 0.54 4.97 1.04 -1.26 -5.02 113.70 108.20 2qqk s SER 454 Ca -0.12 0.85 0.04 0.00 0.48 0.00 0.00 55.95 57.20 2qqk s SER 454 Cb 0.23 1.53 0.05 0.00 0.10 0.00 0.00 66.02 67.93 2qqk s SER 454 CO 0.76 -0.12 0.75 0.42 0.98 0.00 0.00 173.24 176.03 2qqk s THR 455 N 2.08 2.62 -0.54 2.02 -4.23 -1.26 -2.17 115.64 114.15 2qqk s THR 455 Ca -0.05 -0.78 0.02 0.00 -1.18 0.00 0.00 61.69 59.69 2qqk s THR 455 Cb -0.06 -2.83 0.44 0.00 1.34 0.00 0.00 72.50 71.39 2qqk s THR 455 CO -0.17 0.00 1.67 0.00 -0.54 0.00 0.00 174.62 175.58 2qqk n GLN 456 N -2.27 3.08 0.00 3.99 10.64 -1.13 -3.27 117.38 128.42 2qqk n GLN 456 Ca 0.10 -3.72 0.00 0.00 -1.83 0.00 0.00 57.00 51.55 2qqk n GLN 456 Cb 0.60 -2.28 0.00 0.00 -0.86 0.00 0.00 30.24 27.70 2qqk n GLN 456 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 2qqk n GLU 457 N -0.77 0.00 -3.63 2.61 1.02 -1.26 -5.02 120.64 113.60 2qqk n GLU 457 Ca 0.53 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.63 2qqk n GLU 457 Cb 0.72 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 32.09 2qqk n GLU 457 CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 2qqk s TRP 460 N 2.21 -0.12 -0.34 -0.32 -0.00 -1.26 -5.10 118.94 114.01 2qqk s TRP 460 Ca 0.00 0.21 -0.07 0.00 -0.00 0.00 0.00 56.10 56.24 2qqk s TRP 460 Cb 0.00 0.48 0.04 0.00 -0.00 0.00 0.00 33.47 33.99 2qqk s TRP 460 CO 0.00 -0.11 0.11 0.45 -0.00 0.00 0.00 176.95 177.40 2qqk s SER 461 N -1.02 5.32 0.52 5.86 0.15 -1.26 -4.99 113.70 118.29 2qqk s SER 461 Ca 0.06 -1.10 0.25 0.00 0.70 0.00 0.00 55.95 55.87 2qqk s SER 461 Cb -0.01 -1.88 1.45 0.00 -1.71 0.00 0.00 66.02 63.87 2qqk s SER 461 CO -0.06 -0.32 2.10 -0.65 1.20 0.00 0.00 173.24 175.51 2qqk h PRO 462 N 8.23 0.00 0.00 5.44 0.11 -1.92 -2.50 132.00 141.36 2qqk h PRO 462 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2qqk h PRO 462 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2qqk h PRO 462 CO 0.61 0.10 0.13 0.77 -0.21 0.00 0.00 178.00 179.39 2qqk h SER 463 N 0.00 0.00 1.01 -2.05 0.02 -1.94 -1.32 113.55 109.27 2qqk h SER 463 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2qqk h SER 463 Cb 0.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.80 2qqk h SER 463 CO 0.01 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.70 2qqk n ALA 464 N -1.88 1.88 1.05 3.77 0.00 -0.94 -2.94 120.51 121.44 2qqk n ALA 464 Ca -0.02 0.05 0.14 0.00 0.00 0.00 0.00 53.44 53.61 2qqk n ALA 464 Cb 0.17 -1.42 0.62 0.00 0.00 0.00 0.00 19.45 18.82 2qqk n ALA 464 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qqk n ALA 465 N -1.80 2.38 -1.87 0.00 0.00 -0.50 -2.26 120.51 116.47 2qqk n ALA 465 Ca 0.03 -0.11 -0.41 0.00 0.00 0.00 0.00 53.44 52.95 2qqk n ALA 465 Cb 0.31 -1.46 -0.04 0.00 0.00 0.00 0.00 19.45 18.26 2qqk n ALA 465 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2qqk s ARG 466 N -2.95 4.55 0.04 0.00 0.52 -1.15 -0.20 118.95 119.75 2qqk s ARG 466 Ca 0.16 1.89 -0.32 0.00 -0.52 0.00 0.00 55.73 56.94 2qqk s ARG 466 Cb 0.19 -3.19 -0.11 0.00 0.52 0.00 0.00 34.95 32.36 2qqk s ARG 466 CO 0.53 0.05 1.88 -0.11 0.02 0.00 0.00 175.30 177.66 2qqk n LEU 467 N 1.60 3.87 0.00 2.53 7.94 -0.96 -2.89 117.00 129.09 2qqk n LEU 467 Ca 0.01 0.96 0.00 0.00 -1.11 0.00 0.00 56.01 55.87 2qqk n LEU 467 Cb 0.44 -1.49 0.00 0.00 0.53 0.00 0.00 43.42 42.91 2qqk n LEU 467 CO 0.55 0.09 0.00 0.52 -1.11 0.00 0.00 177.39 177.45 2qqk n VAL 468 N 5.02 0.00 -0.14 1.96 0.31 -1.26 -4.40 118.33 119.81 2qqk n VAL 468 Ca 0.20 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.45 2qqk n VAL 468 Cb 0.36 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.26 2qqk n VAL 468 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2qqk h SER 469 N 0.00 -1.25 -2.93 4.52 0.02 -1.83 -3.43 113.55 108.65 2qqk h SER 469 Ca 0.00 0.21 -0.59 0.00 -0.84 0.00 0.00 61.79 60.57 2qqk h SER 469 Cb 0.00 0.57 0.15 0.00 0.14 0.00 0.00 62.40 63.26 2qqk h SER 469 CO 0.00 -0.34 -0.11 -0.24 -1.14 0.00 0.00 176.83 175.00 2qqk n SER 470 N -5.42 0.12 -0.71 3.07 2.88 -1.14 -4.92 113.62 107.51 2qqk n SER 470 Ca 0.01 0.90 0.11 0.00 -1.33 0.00 0.00 58.87 58.56 2qqk n SER 470 Cb 0.35 -1.26 0.05 0.00 -0.75 0.00 0.00 64.21 62.60 2qqk n SER 470 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2qqk n ARG 471 N 0.04 1.76 0.00 -1.46 5.12 -1.26 -4.87 116.66 115.99 2qqk n ARG 471 Ca 0.11 -1.45 0.00 0.00 -1.93 0.00 0.00 57.85 54.58 2qqk n ARG 471 Cb 0.42 -1.42 0.00 0.00 -1.16 0.00 0.00 32.46 30.30 2qqk n ARG 471 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2qqk n SER 472 N 0.71 0.00 0.00 0.55 3.41 -1.26 -4.65 113.62 112.37 2qqk n SER 472 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 2qqk n SER 472 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 2qqk n SER 472 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qqk n GLY 473 N 3.01 4.15 3.66 5.00 0.00 -0.96 -1.32 105.19 118.73 2qqk n GLY 473 Ca 0.00 -1.37 -0.42 0.00 0.00 0.00 0.00 46.02 44.23 2qqk n GLY 473 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2qqk s TRP 474 N -2.00 3.37 -0.02 1.61 -0.00 0.18 -4.73 118.94 117.35 2qqk s TRP 474 Ca 0.00 1.20 0.03 0.00 -0.00 0.00 0.00 56.10 57.33 2qqk s TRP 474 Cb 0.00 -3.03 -0.03 0.00 -0.00 0.00 0.00 33.47 30.41 2qqk s TRP 474 CO 0.00 -0.32 -0.08 -0.06 -0.00 0.00 0.00 176.95 176.49 2qqk s PHE 475 N 2.49 2.86 0.43 5.86 0.40 -1.26 -2.29 117.98 126.47 2qqk s PHE 475 Ca 0.37 -0.05 -0.07 0.00 -0.60 0.00 0.00 56.93 56.58 2qqk s PHE 475 Cb -0.16 -1.63 0.10 0.00 0.51 0.00 0.00 43.02 41.85 2qqk s PHE 475 CO 0.10 0.34 0.44 -0.35 0.70 0.00 0.00 175.22 176.44 2qqk n PRO 476 N 1.81 -1.36 0.08 0.24 -0.04 -1.26 -3.57 135.00 130.90 2qqk n PRO 476 Ca -0.16 -0.69 -0.10 0.00 -0.04 0.00 0.00 63.50 62.50 2qqk n PRO 476 Cb 0.53 -0.58 -0.07 0.00 -0.04 0.00 0.00 33.50 33.34 2qqk n PRO 476 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 2qqk h ARG 477 N 0.00 -0.26 -4.83 0.54 2.43 -1.42 -2.99 114.38 107.86 2qqk h ARG 477 Ca -0.16 0.02 -0.70 0.00 -0.81 0.00 0.00 59.98 58.34 2qqk h ARG 477 Cb 0.46 0.06 -0.19 0.00 -0.42 0.00 0.00 29.97 29.88 2qqk h ARG 477 CO 0.10 0.12 -0.08 0.42 -1.51 0.00 0.00 179.97 179.02 2qqk s ILE 478 N -3.43 4.99 0.30 1.20 1.01 -1.26 -4.62 121.20 119.39 2qqk s ILE 478 Ca -0.12 -0.54 0.04 0.00 0.00 0.00 0.00 60.65 60.03 2qqk s ILE 478 Cb 0.01 -4.20 0.30 0.00 0.01 0.00 0.00 42.46 38.58 2qqk s ILE 478 CO 0.44 -0.66 1.68 -0.65 0.00 0.00 0.00 174.94 175.74 2qqk h PRO 479 N 8.88 0.32 -2.43 2.79 0.11 -1.94 -3.00 132.00 136.72 2qqk h PRO 479 Ca -0.27 -0.02 -0.77 0.00 0.11 0.00 0.00 66.00 65.05 2qqk h PRO 479 Cb 1.10 -0.07 -0.30 0.00 0.11 0.00 0.00 31.00 31.84 2qqk h PRO 479 CO 0.90 0.21 0.65 1.04 -0.21 0.00 0.00 178.00 180.59 2qqk n GLN 480 N -5.10 4.71 0.00 1.05 1.13 -1.26 -2.80 117.38 115.11 2qqk n GLN 480 Ca 0.23 -4.67 0.00 0.00 -1.94 0.00 0.00 57.00 50.62 2qqk n GLN 480 Cb 0.70 -2.44 0.00 0.00 0.11 0.00 0.00 30.24 28.61 2qqk n GLN 480 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2qqk n ALA 481 N 0.35 0.00 -2.74 -1.58 0.00 -1.14 -5.06 120.51 110.35 2qqk n ALA 481 Ca 0.38 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.46 2qqk n ALA 481 Cb 0.31 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.70 2qqk n ALA 481 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2qqk s GLN 482 N -2.97 3.61 0.35 0.00 -0.21 -1.26 -5.07 119.66 114.11 2qqk s GLN 482 Ca 0.00 0.01 -0.28 0.00 0.02 0.00 0.00 55.36 55.11 2qqk s GLN 482 Cb 0.00 -3.13 -0.10 0.00 1.00 0.00 0.00 33.01 30.78 2qqk s GLN 482 CO 0.00 0.69 1.24 -1.25 -2.12 0.00 0.00 175.29 173.85 2qqk s PRO 483 N -1.44 4.29 0.00 2.91 0.04 -1.26 -2.90 135.00 136.63 2qqk s PRO 483 Ca 0.24 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.34 2qqk s PRO 483 Cb -0.14 -2.97 0.00 0.00 0.04 0.00 0.00 34.50 31.44 2qqk s PRO 483 CO 0.12 -0.19 0.00 0.41 0.04 0.00 0.00 177.00 177.38 2qqk n GLY 484 N 0.81 0.51 0.07 0.56 0.00 -1.12 -4.85 105.19 101.18 2qqk n GLY 484 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 2qqk n GLY 484 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2qqk n GLU 485 N -2.01 0.86 -3.47 1.61 2.13 -1.14 -4.99 120.64 113.63 2qqk n GLU 485 Ca 0.00 0.06 -0.35 0.00 0.66 0.00 0.00 57.16 57.54 2qqk n GLU 485 Cb 0.08 -1.32 -0.06 0.00 0.27 0.00 0.00 31.44 30.42 2qqk n GLU 485 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2qqk s GLU 486 N -2.31 3.86 0.12 5.31 0.41 -1.25 -5.06 118.70 119.78 2qqk s GLU 486 Ca -0.17 0.31 -0.13 0.00 -0.41 0.00 0.00 54.97 54.57 2qqk s GLU 486 Cb 0.05 -2.93 0.02 0.00 -1.78 0.00 0.00 34.13 29.49 2qqk s GLU 486 CO 0.41 0.50 0.34 1.67 -0.49 0.00 0.00 175.26 177.68 2qqk s TRP 487 N -1.48 -0.03 -0.02 1.61 1.48 -1.26 -3.95 118.94 115.29 2qqk s TRP 487 Ca 0.37 -0.33 0.02 0.00 -1.06 0.00 0.00 56.10 55.11 2qqk s TRP 487 Cb -0.14 0.15 0.00 0.00 -1.16 0.00 0.00 33.47 32.32 2qqk s TRP 487 CO 0.19 -0.68 -0.08 -1.17 -4.06 0.00 0.00 176.95 171.15 2qqk s LEU 488 N -2.84 1.78 -0.03 -4.66 2.96 -1.02 -1.36 118.68 113.51 2qqk s LEU 488 Ca 0.05 -0.17 0.01 0.00 -0.22 0.00 0.00 54.13 53.81 2qqk s LEU 488 Cb 0.03 -0.52 0.01 0.00 0.50 0.00 0.00 46.19 46.21 2qqk s LEU 488 CO -0.10 0.06 -0.05 -1.58 -1.32 0.00 0.00 176.35 173.36 2qqk s GLN 489 N 0.20 0.71 -0.08 1.98 0.74 0.11 -1.60 119.66 121.71 2qqk s GLN 489 Ca -0.03 -0.15 -0.01 0.00 0.05 0.00 0.00 55.36 55.22 2qqk s GLN 489 Cb -0.08 -0.71 -0.03 0.00 1.10 0.00 0.00 33.01 33.29 2qqk s GLN 489 CO 0.00 0.00 -0.04 0.08 -0.55 0.00 0.00 175.29 174.79 2qqk s VAL 490 N 0.51 3.96 -0.45 1.34 1.01 -0.54 0.10 120.40 126.33 2qqk s VAL 490 Ca -0.07 -0.37 -0.11 0.00 0.00 0.00 0.00 61.98 61.43 2qqk s VAL 490 Cb -0.10 -2.65 0.09 0.00 0.00 0.00 0.00 36.38 33.72 2qqk s VAL 490 CO 0.00 0.59 0.33 -0.62 0.00 0.00 0.00 175.10 175.40 2qqk s ASP 491 N -0.70 5.80 0.58 3.32 2.15 0.22 -2.05 116.67 126.00 2qqk s ASP 491 Ca 0.11 -1.60 0.35 0.00 0.43 0.00 0.00 52.55 51.84 2qqk s ASP 491 Cb -0.11 -2.05 1.75 0.00 -0.30 0.00 0.00 42.92 42.20 2qqk s ASP 491 CO 0.02 -0.63 2.15 -0.07 -0.17 0.00 0.00 175.17 176.47 2qqk h LEU 492 N 8.53 0.00 0.00 -1.34 3.38 -0.10 -3.46 115.31 122.32 2qqk h LEU 492 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2qqk h LEU 492 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 2qqk h LEU 492 CO 0.83 0.05 0.00 0.61 0.09 0.00 0.00 178.44 180.02 2qqk n GLY 493 N -0.61 0.74 3.59 0.83 0.00 -1.25 -4.98 105.19 103.51 2qqk n GLY 493 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 2qqk n GLY 493 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qqk s THR 494 N -2.72 0.00 -0.01 2.61 2.01 -1.26 -5.13 115.64 111.14 2qqk s THR 494 Ca 0.00 0.00 -0.36 0.00 0.31 0.00 0.00 61.69 61.64 2qqk s THR 494 Cb 0.00 -1.00 -0.14 0.00 0.01 0.00 0.00 72.50 71.37 2qqk s THR 494 CO 0.00 0.00 1.66 -0.81 -0.69 0.00 0.00 174.62 174.78 2qqk n PRO 495 N 0.77 1.79 -4.26 4.92 -0.04 -1.26 -4.23 135.00 132.69 2qqk n PRO 495 Ca -0.09 0.65 -0.14 0.00 -0.04 0.00 0.00 63.50 63.87 2qqk n PRO 495 Cb 0.58 -2.41 -0.10 0.00 -0.04 0.00 0.00 33.50 31.53 2qqk n PRO 495 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2qqk s LYS 496 N 2.35 1.12 -0.20 0.54 -0.14 -0.68 -4.61 119.74 118.12 2qqk s LYS 496 Ca 0.88 -1.52 -0.22 0.00 -1.36 0.00 0.00 55.97 53.75 2qqk s LYS 496 Cb -0.81 -0.51 -0.02 0.00 -1.68 0.00 0.00 37.83 34.81 2qqk s LYS 496 CO 0.49 -0.02 0.69 0.99 -0.76 0.00 0.00 175.35 176.74 2qqk s THR 497 N -3.45 4.97 -0.21 2.17 2.01 0.38 -1.84 115.64 119.67 2qqk s THR 497 Ca 0.21 1.32 -0.04 0.00 0.31 0.00 0.00 61.69 63.49 2qqk s THR 497 Cb 0.04 -4.00 -0.01 0.00 0.01 0.00 0.00 72.50 68.54 2qqk s THR 497 CO 0.03 0.07 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.31 2qqk s VAL 498 N 2.05 3.51 -0.24 3.82 1.01 -0.19 -0.48 120.40 129.88 2qqk s VAL 498 Ca 0.31 -0.45 0.11 0.00 0.00 0.00 0.00 61.98 61.95 2qqk s VAL 498 Cb -0.16 -2.59 -0.15 0.00 0.00 0.00 0.00 36.38 33.48 2qqk s VAL 498 CO 0.11 0.42 0.34 1.17 0.00 0.00 0.00 175.10 177.14 2qqk n LYS 499 N 4.63 1.79 -2.81 2.72 4.81 0.88 -2.74 118.16 127.44 2qqk n LYS 499 Ca -0.18 -0.05 0.01 0.00 -0.87 0.00 0.00 58.31 57.21 2qqk n LYS 499 Cb 0.51 -1.14 0.01 0.00 0.02 0.00 0.00 35.03 34.42 2qqk n LYS 499 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2qqk n GLY 500 N 1.58 0.55 3.15 3.14 0.00 -0.72 -0.30 105.19 112.59 2qqk n GLY 500 Ca -0.00 -0.96 -0.09 0.00 0.00 0.00 0.00 46.02 44.97 2qqk n GLY 500 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qqk s VAL 501 N -2.14 0.27 -0.20 1.61 -7.23 -0.54 -0.40 120.40 111.77 2qqk s VAL 501 Ca 0.14 -1.89 0.01 0.00 -1.81 0.00 0.00 61.98 58.42 2qqk s VAL 501 Cb -0.01 -1.86 0.03 0.00 0.56 0.00 0.00 36.38 35.10 2qqk s VAL 501 CO 0.00 -0.67 -0.16 -0.63 -0.31 0.00 0.00 175.10 173.34 2qqk s ILE 502 N -3.92 2.26 -0.08 -0.62 1.01 -0.08 -0.88 121.20 118.89 2qqk s ILE 502 Ca 0.18 -1.04 -0.03 0.00 0.00 0.00 0.00 60.65 59.76 2qqk s ILE 502 Cb 0.07 -2.04 -0.04 0.00 0.01 0.00 0.00 42.46 40.46 2qqk s ILE 502 CO -0.02 0.40 0.05 -0.51 0.00 0.00 0.00 174.94 174.86 2qqk s ILE 503 N 1.27 4.70 0.17 2.92 2.07 -0.28 -1.81 121.20 130.24 2qqk s ILE 503 Ca 0.02 -0.16 0.03 0.00 -1.41 0.00 0.00 60.65 59.13 2qqk s ILE 503 Cb -0.15 -3.03 -0.05 0.00 0.13 0.00 0.00 42.46 39.37 2qqk s ILE 503 CO -0.10 0.56 -0.03 -1.58 -1.91 0.00 0.00 174.94 171.88 2qqk s GLN 504 N -1.08 1.13 0.00 3.50 0.74 -0.70 -1.04 119.66 122.21 2qqk s GLN 504 Ca 0.16 -1.53 0.00 0.00 0.05 0.00 0.00 55.36 54.03 2qqk s GLN 504 Cb -0.12 -0.45 0.00 0.00 1.10 0.00 0.00 33.01 33.54 2qqk s GLN 504 CO 0.05 -0.06 0.00 0.41 -0.55 0.00 0.00 175.29 175.14 2qqk n GLY 505 N -0.26 1.15 3.38 2.59 0.00 -1.14 -2.02 105.19 108.90 2qqk n GLY 505 Ca -0.08 -1.52 -0.15 0.00 0.00 0.00 0.00 46.02 44.27 2qqk n GLY 505 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qqk s ALA 506 N -3.75 -1.25 -0.01 4.61 0.00 -0.94 -2.10 121.76 118.32 2qqk s ALA 506 Ca 0.00 0.96 -0.14 0.00 0.00 0.00 0.00 51.96 52.79 2qqk s ALA 506 Cb 0.00 -0.20 -0.05 0.00 0.00 0.00 0.00 23.12 22.87 2qqk s ALA 506 CO 0.00 -0.29 0.38 0.50 0.00 0.00 0.00 175.76 176.34 2qqk s ARG 507 N -0.85 3.85 -0.28 0.00 3.52 -0.43 -3.16 118.95 121.60 2qqk s ARG 507 Ca -0.09 0.34 -0.21 0.00 -0.13 0.00 0.00 55.73 55.64 2qqk s ARG 507 Cb -0.03 -3.21 0.03 0.00 -1.56 0.00 0.00 34.95 30.18 2qqk s ARG 507 CO 0.05 0.70 0.38 0.00 -0.81 0.00 0.00 175.30 175.62 2qqk n ALA 517 N 1.80 -2.32 -2.56 6.12 0.00 -1.26 -4.48 120.51 117.81 2qqk n ALA 517 Ca -0.14 0.30 -0.41 0.00 0.00 0.00 0.00 53.44 53.18 2qqk n ALA 517 Cb 0.53 -1.67 -0.08 0.00 0.00 0.00 0.00 19.45 18.23 2qqk n ALA 517 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2qqk s ARG 518 N -1.89 3.64 0.16 0.00 0.52 -1.26 -5.04 118.95 115.08 2qqk s ARG 518 Ca 0.21 -0.19 -0.16 0.00 -0.52 0.00 0.00 55.73 55.08 2qqk s ARG 518 Cb -0.03 -3.80 0.03 0.00 0.52 0.00 0.00 34.95 31.68 2qqk s ARG 518 CO 0.55 -0.59 0.45 0.00 0.02 0.00 0.00 175.30 175.72 2qqk s ALA 519 N 2.30 -0.83 -0.11 2.13 0.00 -1.19 -4.60 121.76 119.46 2qqk s ALA 519 Ca 0.17 -0.23 -0.30 0.00 0.00 0.00 0.00 51.96 51.61 2qqk s ALA 519 Cb -0.16 0.79 0.08 0.00 0.00 0.00 0.00 23.12 23.83 2qqk s ALA 519 CO 0.13 -0.72 0.75 -0.59 0.00 0.00 0.00 175.76 175.33 2qqk s PHE 520 N -3.86 -0.63 0.30 0.00 -0.12 -1.26 -2.22 117.98 110.20 2qqk s PHE 520 Ca 0.08 1.18 -0.29 0.00 -0.05 0.00 0.00 56.93 57.84 2qqk s PHE 520 Cb 0.01 0.39 -0.10 0.00 -0.63 0.00 0.00 43.02 42.69 2qqk s PHE 520 CO -0.06 -0.52 1.38 0.08 -0.05 0.00 0.00 175.22 176.04 2qqk s VAL 521 N -0.88 2.65 -0.22 -2.49 1.01 -1.17 -1.28 120.40 118.01 2qqk s VAL 521 Ca -0.07 0.60 0.05 0.00 0.00 0.00 0.00 61.98 62.56 2qqk s VAL 521 Cb -0.01 -3.38 -0.17 0.00 0.00 0.00 0.00 36.38 32.82 2qqk s VAL 521 CO 0.07 0.12 -0.15 0.54 0.00 0.00 0.00 175.10 175.68 2qqk n ARG 522 N 1.43 0.68 -4.04 2.72 1.74 -0.67 -0.81 116.66 117.70 2qqk n ARG 522 Ca 0.03 0.10 -0.09 0.00 -0.77 0.00 0.00 57.85 57.12 2qqk n ARG 522 Cb 0.41 -1.47 -0.11 0.00 -1.02 0.00 0.00 32.46 30.27 2qqk n ARG 522 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2qqk s LYS 523 N -2.46 0.48 0.18 5.56 1.02 -0.98 0.16 119.74 123.70 2qqk s LYS 523 Ca -0.26 -0.90 -0.17 0.00 0.02 0.00 0.00 55.97 54.65 2qqk s LYS 523 Cb 0.08 0.08 0.03 0.00 -0.52 0.00 0.00 37.83 37.49 2qqk s LYS 523 CO 0.59 -0.06 0.48 -0.59 -0.92 0.00 0.00 175.35 174.85 2qqk s PHE 524 N -2.52 -0.10 0.37 3.18 -0.12 -0.93 -0.64 117.98 117.23 2qqk s PHE 524 Ca -0.05 -0.24 0.08 0.00 -0.05 0.00 0.00 56.93 56.67 2qqk s PHE 524 Cb -0.02 0.33 -0.04 0.00 -0.63 0.00 0.00 43.02 42.66 2qqk s PHE 524 CO -0.04 -0.86 0.18 0.15 -0.05 0.00 0.00 175.22 174.60 2qqk s LYS 525 N -3.87 2.35 -0.02 1.99 1.02 -0.06 -0.38 119.74 120.78 2qqk s LYS 525 Ca 0.09 -1.62 0.01 0.00 0.02 0.00 0.00 55.97 54.46 2qqk s LYS 525 Cb -0.00 -2.15 0.01 0.00 -0.52 0.00 0.00 37.83 35.17 2qqk s LYS 525 CO -0.04 0.01 -0.03 0.08 -0.92 0.00 0.00 175.35 174.45 2qqk s VAL 526 N -2.48 0.33 0.25 3.17 1.01 -1.26 -0.76 120.40 120.67 2qqk s VAL 526 Ca 0.40 -0.07 0.09 0.00 0.00 0.00 0.00 61.98 62.39 2qqk s VAL 526 Cb -0.01 -0.36 -0.05 0.00 0.00 0.00 0.00 36.38 35.96 2qqk s VAL 526 CO 0.23 0.15 -0.14 -0.94 0.00 0.00 0.00 175.10 174.40 2qqk s SER 527 N 0.56 2.96 0.07 3.32 1.04 -0.28 -1.82 113.70 119.55 2qqk s SER 527 Ca -0.06 -1.07 -0.06 0.00 0.48 0.00 0.00 55.95 55.23 2qqk s SER 527 Cb -0.09 -0.20 -0.01 0.00 0.10 0.00 0.00 66.02 65.81 2qqk s SER 527 CO -0.01 -0.16 0.12 -0.72 0.98 0.00 0.00 173.24 173.46 2qqk s TYR 528 N -2.84 0.25 -0.04 5.02 -0.85 -0.75 -0.05 117.35 118.09 2qqk s TYR 528 Ca 0.27 -0.68 -0.26 0.00 -0.52 0.00 0.00 57.07 55.88 2qqk s TYR 528 Cb -0.01 -0.15 0.06 0.00 0.38 0.00 0.00 41.96 42.24 2qqk s TYR 528 CO 0.11 -0.47 0.57 0.45 -1.52 0.00 0.00 175.55 174.68 2qqk s SER 529 N -2.73 -0.52 -0.03 -0.18 0.15 -0.39 -2.82 113.70 107.18 2qqk s SER 529 Ca 0.04 0.54 -0.08 0.00 0.70 0.00 0.00 55.95 57.15 2qqk s SER 529 Cb 0.05 0.48 -0.29 0.00 -1.71 0.00 0.00 66.02 64.54 2qqk s SER 529 CO -0.09 -0.55 0.72 -0.07 1.20 0.00 0.00 173.24 174.44 2qqk h LEU 530 N 3.30 0.53 0.00 3.45 3.38 -1.84 0.22 115.31 124.35 2qqk h LEU 530 Ca -0.28 -0.79 0.00 0.00 0.09 0.00 0.00 57.88 56.90 2qqk h LEU 530 Cb 1.15 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.73 2qqk h LEU 530 CO 0.39 1.67 -0.21 0.78 0.09 0.00 0.00 178.44 181.16 2qqk h ASN 531 N 0.09 0.00 0.00 -0.43 2.35 -1.96 -3.43 115.58 112.21 2qqk h ASN 531 Ca -0.32 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.43 2qqk h ASN 531 Cb 2.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.44 2qqk h ASN 531 CO 0.17 0.38 0.00 0.61 -1.65 0.00 0.00 177.43 176.94 2qqk n GLY 532 N 1.72 1.69 0.02 2.83 0.00 -1.26 -4.96 105.19 105.23 2qqk n GLY 532 Ca -0.03 -0.05 0.04 0.00 0.00 0.00 0.00 46.02 45.97 2qqk n GLY 532 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qqk n LYS 533 N 0.00 0.77 -3.44 1.61 5.02 -1.26 -4.98 118.16 115.88 2qqk n LYS 533 Ca 0.00 -0.09 -0.37 0.00 -2.02 0.00 0.00 58.31 55.82 2qqk n LYS 533 Cb 0.00 -1.31 -0.06 0.00 -0.02 0.00 0.00 35.03 33.63 2qqk n LYS 533 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2qqk s ASP 534 N -3.73 6.58 -0.04 4.39 1.11 -1.26 -5.07 116.67 118.65 2qqk s ASP 534 Ca -0.05 0.69 -0.01 0.00 0.18 0.00 0.00 52.55 53.36 2qqk s ASP 534 Cb 0.07 -2.23 0.03 0.00 1.07 0.00 0.00 42.92 41.86 2qqk s ASP 534 CO 0.53 0.08 0.05 0.26 1.18 0.00 0.00 175.17 177.27 2qqk s TRP 535 N 0.36 0.12 -0.04 4.23 0.52 -1.26 -4.40 118.94 118.47 2qqk s TRP 535 Ca 0.21 0.19 -0.00 0.00 0.02 0.00 0.00 56.10 56.52 2qqk s TRP 535 Cb -0.14 -0.46 -0.04 0.00 -1.15 0.00 0.00 33.47 31.68 2qqk s TRP 535 CO 0.08 -0.18 0.01 -1.21 0.02 0.00 0.00 176.95 175.67 2qqk s GLU 536 N 1.91 2.91 0.15 4.98 2.02 -1.13 -4.96 118.70 124.59 2qqk s GLU 536 Ca 0.02 -0.50 -0.08 0.00 0.02 0.00 0.00 54.97 54.43 2qqk s GLU 536 Cb -0.12 -2.75 -0.06 0.00 0.10 0.00 0.00 34.13 31.29 2qqk s GLU 536 CO -0.03 0.66 0.44 0.71 0.02 0.00 0.00 175.26 177.06 2qqk s TYR 537 N -1.02 3.49 0.03 1.61 1.51 -1.26 -1.81 117.35 119.91 2qqk s TYR 537 Ca 0.17 0.73 -0.30 0.00 -1.01 0.00 0.00 57.07 56.66 2qqk s TYR 537 Cb -0.11 -2.14 -0.06 0.00 -0.11 0.00 0.00 41.96 39.53 2qqk s TYR 537 CO 0.07 0.41 1.47 0.42 -1.11 0.00 0.00 175.55 176.82 2qqk s ILE 538 N -1.63 3.48 -0.11 2.71 1.01 -0.75 -4.94 121.20 120.98 2qqk s ILE 538 Ca 0.41 0.91 -0.09 0.00 0.00 0.00 0.00 60.65 61.87 2qqk s ILE 538 Cb -0.12 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.72 2qqk s ILE 538 CO 0.22 0.00 0.19 -1.10 0.00 0.00 0.00 174.94 174.25 2qqk s GLN 539 N 2.38 3.60 -0.23 2.79 -1.52 -1.26 0.00 119.66 125.42 2qqk s GLN 539 Ca 0.67 -0.04 -0.28 0.00 -1.95 0.00 0.00 55.36 53.76 2qqk s GLN 539 Cb -0.34 -3.22 0.01 0.00 -0.22 0.00 0.00 33.01 29.23 2qqk s GLN 539 CO 0.28 0.71 1.00 0.34 -0.25 0.00 0.00 175.29 177.38 2qqk s ASP 540 N -0.89 7.06 0.00 5.90 -1.08 -0.98 -4.68 116.67 122.00 2qqk s ASP 540 Ca 0.16 1.32 0.11 0.00 -0.52 0.00 0.00 52.55 53.63 2qqk s ASP 540 Cb -0.13 -2.52 0.63 0.00 -1.46 0.00 0.00 42.92 39.44 2qqk s ASP 540 CO 0.05 -0.63 1.17 -2.65 0.52 0.00 0.00 175.17 173.63 2qqk n PRO 541 N 6.21 0.28 -0.09 4.34 -0.02 -1.26 -0.65 135.00 143.80 2qqk n PRO 541 Ca 0.11 0.07 -0.15 0.00 -2.02 0.00 0.00 63.50 61.51 2qqk n PRO 541 Cb 0.46 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 32.37 2qqk n PRO 541 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2qqk n ARG 542 N -1.11 0.52 0.07 -0.52 1.74 -1.26 -4.57 116.66 111.54 2qqk n ARG 542 Ca 0.07 0.51 -0.02 0.00 -0.77 0.00 0.00 57.85 57.64 2qqk n ARG 542 Cb 0.06 -1.69 -0.06 0.00 -1.02 0.00 0.00 32.46 29.75 2qqk n ARG 542 CO 0.00 0.00 0.00 1.79 -1.52 0.00 0.00 177.63 177.90 2qqk h THR 543 N -1.00 1.07 -0.38 0.55 1.35 -1.98 -3.47 112.91 109.05 2qqk h THR 543 Ca -0.22 -2.63 -0.16 0.00 -0.55 0.00 0.00 66.41 62.84 2qqk h THR 543 Cb 1.00 2.49 -0.06 0.00 -1.73 0.00 0.00 68.15 69.84 2qqk h THR 543 CO -0.13 0.61 -0.15 0.00 -0.25 0.00 0.00 175.52 175.60 2qqk n GLN 544 N -3.18 -1.53 -3.58 4.72 6.02 0.17 -5.00 117.38 115.00 2qqk n GLN 544 Ca -0.03 0.75 -0.20 0.00 -0.01 0.00 0.00 57.00 57.51 2qqk n GLN 544 Cb 0.86 -5.03 -0.02 0.00 1.02 0.00 0.00 30.24 27.07 2qqk n GLN 544 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2qqk s GLN 545 N -2.53 2.96 0.21 -1.09 -1.52 -1.26 -4.92 119.66 111.50 2qqk s GLN 545 Ca 0.00 -1.13 -0.32 0.00 -1.95 0.00 0.00 55.36 51.96 2qqk s GLN 545 Cb 0.00 -2.68 -0.15 0.00 -0.22 0.00 0.00 33.01 29.96 2qqk s GLN 545 CO 0.00 0.06 1.28 -2.30 -0.25 0.00 0.00 175.29 174.08 2qqk n PRO 546 N -1.55 1.60 -2.24 2.91 -0.02 -1.26 -2.31 135.00 132.13 2qqk n PRO 546 Ca -0.00 0.57 -0.42 0.00 -2.02 0.00 0.00 63.50 61.63 2qqk n PRO 546 Cb 0.59 -2.14 -0.03 0.00 -0.02 0.00 0.00 33.50 31.90 2qqk n PRO 546 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2qqk s LYS 547 N -0.41 4.36 -0.49 -0.52 2.20 0.10 -4.69 119.74 120.30 2qqk s LYS 547 Ca 0.70 2.00 -0.22 0.00 -0.36 0.00 0.00 55.97 58.09 2qqk s LYS 547 Cb -0.75 -3.26 0.04 0.00 -1.51 0.00 0.00 37.83 32.35 2qqk s LYS 547 CO 0.51 -0.35 0.78 -0.51 -0.36 0.00 0.00 175.35 175.42 2qqk s LEU 548 N 0.79 4.40 0.58 5.43 2.01 -1.26 -4.51 118.68 126.12 2qqk s LEU 548 Ca 0.61 -0.40 -0.13 0.00 0.01 0.00 0.00 54.13 54.22 2qqk s LEU 548 Cb -0.35 -2.77 -0.05 0.00 0.01 0.00 0.00 46.19 43.03 2qqk s LEU 548 CO 0.32 -0.99 1.01 -0.36 1.01 0.00 0.00 176.35 177.34 2qqk s PHE 549 N 3.28 3.54 0.15 0.29 0.40 0.49 -4.91 117.98 121.23 2qqk s PHE 549 Ca 0.26 1.37 -0.27 0.00 -0.60 0.00 0.00 56.93 57.68 2qqk s PHE 549 Cb -0.14 -2.76 -0.07 0.00 0.51 0.00 0.00 43.02 40.56 2qqk s PHE 549 CO 0.19 -0.58 0.85 -1.21 0.70 0.00 0.00 175.22 175.17 2qqk s GLU 550 N -4.73 4.66 0.00 0.44 0.41 -1.26 -2.18 118.70 116.03 2qqk s GLU 550 Ca 0.57 1.29 0.00 0.00 -0.41 0.00 0.00 54.97 56.41 2qqk s GLU 550 Cb -0.11 -3.31 0.00 0.00 -1.78 0.00 0.00 34.13 28.93 2qqk s GLU 550 CO 0.45 0.43 0.00 0.41 -0.49 0.00 0.00 175.26 176.06 2qqk n GLY 551 N 1.84 0.67 3.59 -1.39 0.00 0.42 -4.82 105.19 105.51 2qqk n GLY 551 Ca -0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 2qqk n GLY 551 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qqk s ASN 552 N -1.00 3.95 -0.08 1.61 0.02 0.01 -4.82 114.94 114.63 2qqk s ASN 552 Ca 0.00 -1.10 0.12 0.00 -1.02 0.00 0.00 52.86 50.86 2qqk s ASN 552 Cb 0.00 -0.44 0.30 0.00 0.02 0.00 0.00 41.25 41.14 2qqk s ASN 552 CO 0.00 -0.23 1.23 0.23 0.02 0.00 0.00 177.10 178.35 2qqk n MET 553 N -0.87 2.59 -3.58 -0.60 2.81 -1.26 -4.56 117.12 111.65 2qqk n MET 553 Ca -0.05 -2.28 -0.09 0.00 -1.81 0.00 0.00 57.70 53.48 2qqk n MET 553 Cb 0.63 -1.43 -0.04 0.00 -0.71 0.00 0.00 33.22 31.67 2qqk n MET 553 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 2qqk s HIS 554 N -1.92 -0.32 -0.63 2.03 5.65 -1.26 -5.06 115.29 113.77 2qqk s HIS 554 Ca 0.26 0.49 0.26 0.00 0.25 0.00 0.00 55.06 56.31 2qqk s HIS 554 Cb 0.19 0.47 0.81 0.00 -1.18 0.00 0.00 32.58 32.88 2qqk s HIS 554 CO 0.08 -0.33 1.76 0.10 -0.65 0.00 0.00 174.74 175.69 2qqk h TYR 555 N 2.40 0.00 0.00 3.88 -0.00 -1.90 -3.38 116.97 117.98 2qqk h TYR 555 Ca -0.17 0.00 -0.13 0.00 -0.00 0.00 0.00 58.73 58.43 2qqk h TYR 555 Cb 1.17 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 37.88 2qqk h TYR 555 CO 0.28 0.00 -1.45 -3.47 -0.00 0.00 0.00 178.16 173.52 2qqk n ASP 556 N -2.37 1.58 -4.57 0.10 2.03 -1.26 -2.35 116.55 109.71 2qqk n ASP 556 Ca 0.05 0.05 -0.41 0.00 0.52 0.00 0.00 54.79 55.00 2qqk n ASP 556 Cb 0.40 -0.20 -0.03 0.00 -0.72 0.00 0.00 41.12 40.57 2qqk n ASP 556 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2qqk s THR 557 N -2.15 3.48 0.93 5.18 2.01 -1.26 -4.69 115.64 119.15 2qqk s THR 557 Ca -0.11 0.41 -0.12 0.00 0.31 0.00 0.00 61.69 62.18 2qqk s THR 557 Cb 0.04 -3.89 0.15 0.00 0.01 0.00 0.00 72.50 68.81 2qqk s THR 557 CO 0.15 -0.73 1.10 -2.16 -0.69 0.00 0.00 174.62 172.30 2qqk s PRO 558 N 6.21 0.96 -0.00 4.92 0.04 -1.26 -4.73 135.00 141.15 2qqk s PRO 558 Ca 0.70 0.56 0.00 0.00 0.04 0.00 0.00 61.00 62.31 2qqk s PRO 558 Cb -0.16 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.58 2qqk s PRO 558 CO 0.27 -2.38 -0.00 -0.51 0.04 0.00 0.00 177.00 174.42 2qqk s ASP 559 N -3.61 0.05 -0.24 6.66 1.11 -0.20 -4.51 116.67 115.93 2qqk s ASP 559 Ca 0.64 -0.01 -0.07 0.00 0.18 0.00 0.00 52.55 53.30 2qqk s ASP 559 Cb -0.17 -0.01 -0.03 0.00 1.07 0.00 0.00 42.92 43.78 2qqk s ASP 559 CO 0.56 0.00 0.05 -0.51 1.18 0.00 0.00 175.17 176.46 2qqk s ILE 560 N 0.02 4.23 -0.15 0.77 2.07 -1.26 -1.13 121.20 125.74 2qqk s ILE 560 Ca -0.00 -0.20 -0.01 0.00 -1.41 0.00 0.00 60.65 59.02 2qqk s ILE 560 Cb -0.00 -2.96 -0.01 0.00 0.13 0.00 0.00 42.46 39.61 2qqk s ILE 560 CO -0.00 0.36 -0.11 -0.13 -1.91 0.00 0.00 174.94 173.15 2qqk s ARG 561 N 1.45 3.39 0.09 3.50 1.81 -0.06 -5.01 118.95 124.11 2qqk s ARG 561 Ca 0.05 -0.67 0.02 0.00 -1.72 0.00 0.00 55.73 53.42 2qqk s ARG 561 Cb -0.15 -2.72 -0.04 0.00 -0.45 0.00 0.00 34.95 31.59 2qqk s ARG 561 CO 0.03 0.12 0.14 1.03 -0.68 0.00 0.00 175.30 175.94 2qqk s ARG 562 N 0.61 3.09 0.15 3.54 0.52 -1.26 -1.47 118.95 124.13 2qqk s ARG 562 Ca -0.06 -0.64 -0.09 0.00 -0.52 0.00 0.00 55.73 54.42 2qqk s ARG 562 Cb -0.15 -2.82 -0.01 0.00 0.52 0.00 0.00 34.95 32.49 2qqk s ARG 562 CO 0.03 0.56 0.27 -0.59 0.02 0.00 0.00 175.30 175.59 2qqk s PHE 563 N -1.51 0.34 0.54 -0.53 -0.12 0.59 -4.96 117.98 112.33 2qqk s PHE 563 Ca 0.32 -0.72 -0.21 0.00 -0.05 0.00 0.00 56.93 56.27 2qqk s PHE 563 Cb -0.12 -0.05 -0.07 0.00 -0.63 0.00 0.00 43.02 42.15 2qqk s PHE 563 CO 0.24 -0.69 1.00 -0.25 -0.05 0.00 0.00 175.22 175.47 2qqk n ASP 564 N -0.19 1.05 -4.77 1.98 8.00 -1.26 -4.58 116.55 116.79 2qqk n ASP 564 Ca -0.09 0.89 -0.41 0.00 0.71 0.00 0.00 54.79 55.90 2qqk n ASP 564 Cb 0.63 -1.39 -0.02 0.00 -0.02 0.00 0.00 41.12 40.32 2qqk n ASP 564 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 2qqk s PRO 565 N -2.49 4.30 0.03 -0.24 0.02 -1.26 -4.80 135.00 130.55 2qqk s PRO 565 Ca 0.71 2.29 -0.01 0.00 0.02 0.00 0.00 61.00 64.01 2qqk s PRO 565 Cb -0.46 -3.06 -0.02 0.00 0.02 0.00 0.00 34.50 30.98 2qqk s PRO 565 CO 0.51 -0.28 -0.02 0.96 -0.33 0.00 0.00 177.00 177.84 2qqk s ILE 566 N -0.97 0.14 0.05 2.83 -4.36 -1.11 -4.97 121.20 112.81 2qqk s ILE 566 Ca 0.51 -1.17 -0.21 0.00 -0.26 0.00 0.00 60.65 59.51 2qqk s ILE 566 Cb -0.41 -0.66 -0.06 0.00 1.25 0.00 0.00 42.46 42.57 2qqk s ILE 566 CO 0.53 -0.65 0.64 -2.16 0.24 0.00 0.00 174.94 173.55 2qqk s PRO 567 N -2.23 4.34 -0.27 0.37 0.05 -1.26 -1.02 135.00 134.99 2qqk s PRO 567 Ca -0.09 0.84 -0.26 0.00 0.05 0.00 0.00 61.00 61.54 2qqk s PRO 567 Cb -0.04 -3.30 0.15 0.00 0.05 0.00 0.00 34.50 31.35 2qqk s PRO 567 CO -0.04 0.47 1.16 0.00 0.05 0.00 0.00 177.00 178.64 2qqk s ALA 568 N -0.59 -2.04 -0.10 8.56 0.00 -0.77 -4.68 121.76 122.14 2qqk s ALA 568 Ca 0.32 1.78 0.13 0.00 0.00 0.00 0.00 51.96 54.19 2qqk s ALA 568 Cb -0.20 -1.41 -0.19 0.00 0.00 0.00 0.00 23.12 21.32 2qqk s ALA 568 CO 0.20 -0.21 0.13 0.94 0.00 0.00 0.00 175.76 176.82 2qqk n GLN 569 N 1.68 1.36 -5.04 0.00 7.27 -0.07 -1.69 117.38 120.89 2qqk n GLN 569 Ca -0.11 -0.05 -0.32 0.00 0.07 0.00 0.00 57.00 56.60 2qqk n GLN 569 Cb 0.57 -1.35 -0.15 0.00 2.41 0.00 0.00 30.24 31.71 2qqk n GLN 569 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 2qqk s TYR 570 N -2.54 2.63 0.04 3.69 1.51 -0.39 0.63 117.35 122.92 2qqk s TYR 570 Ca -0.06 -0.72 0.06 0.00 -1.01 0.00 0.00 57.07 55.34 2qqk s TYR 570 Cb 0.06 -1.72 -0.02 0.00 -0.11 0.00 0.00 41.96 40.17 2qqk s TYR 570 CO 0.58 -0.22 -0.18 0.08 -1.11 0.00 0.00 175.55 174.69 2qqk s VAL 571 N 0.08 1.47 0.04 0.71 1.01 -0.87 -1.26 120.40 121.59 2qqk s VAL 571 Ca -0.09 -1.10 0.05 0.00 0.00 0.00 0.00 61.98 60.84 2qqk s VAL 571 Cb -0.15 -1.29 -0.02 0.00 0.00 0.00 0.00 36.38 34.92 2qqk s VAL 571 CO 0.05 0.15 -0.14 -0.13 0.00 0.00 0.00 175.10 175.03 2qqk s ARG 572 N -1.12 0.95 -0.11 2.72 0.52 0.93 -1.47 118.95 121.38 2qqk s ARG 572 Ca 0.06 -0.79 0.01 0.00 -0.52 0.00 0.00 55.73 54.49 2qqk s ARG 572 Cb -0.08 -0.96 0.02 0.00 0.52 0.00 0.00 34.95 34.44 2qqk s ARG 572 CO 0.01 0.24 -0.14 0.08 0.02 0.00 0.00 175.30 175.51 2qqk s VAL 573 N -0.89 1.46 -0.42 3.52 1.01 -0.63 -1.13 120.40 123.32 2qqk s VAL 573 Ca 0.02 -0.61 -0.03 0.00 0.00 0.00 0.00 61.98 61.35 2qqk s VAL 573 Cb -0.08 -1.34 0.11 0.00 0.00 0.00 0.00 36.38 35.07 2qqk s VAL 573 CO 0.01 0.43 0.21 -0.31 0.00 0.00 0.00 175.10 175.45 2qqk s TYR 574 N 1.07 3.58 0.21 5.22 1.51 0.06 -2.44 117.35 126.56 2qqk s TYR 574 Ca -0.05 -2.43 -0.32 0.00 -1.01 0.00 0.00 57.07 53.26 2qqk s TYR 574 Cb -0.15 -3.23 -0.14 0.00 -0.11 0.00 0.00 41.96 38.33 2qqk s TYR 574 CO -0.03 -0.97 1.29 -2.30 -1.11 0.00 0.00 175.55 172.44 2qqk n PRO 575 N 4.56 1.65 -0.04 -1.71 -0.02 -1.25 -0.88 135.00 137.31 2qqk n PRO 575 Ca -0.02 0.59 -0.08 0.00 -2.02 0.00 0.00 63.50 61.97 2qqk n PRO 575 Cb 0.41 -2.17 -0.03 0.00 -0.02 0.00 0.00 33.50 31.69 2qqk n PRO 575 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2qqk n GLU 576 N 1.88 0.16 -4.55 -0.52 -0.58 0.19 -2.77 120.64 114.46 2qqk n GLU 576 Ca 0.13 0.07 -0.26 0.00 -0.42 0.00 0.00 57.16 56.68 2qqk n GLU 576 Cb 0.29 -0.77 -0.11 0.00 -0.57 0.00 0.00 31.44 30.28 2qqk n GLU 576 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2qqk s ARG 577 N -2.15 1.82 0.21 3.49 3.00 -1.21 -4.66 118.95 119.45 2qqk s ARG 577 Ca -0.11 -1.95 -0.14 0.00 0.00 0.00 0.00 55.73 53.53 2qqk s ARG 577 Cb 0.04 -1.65 0.05 0.00 0.00 0.00 0.00 34.95 33.39 2qqk s ARG 577 CO 0.13 0.10 0.72 -2.67 0.00 0.00 0.00 175.30 173.59 2qqk n TRP 578 N -0.80 -1.54 -2.71 -0.53 2.14 -1.26 -1.67 117.44 111.07 2qqk n TRP 578 Ca -0.05 -1.17 -0.30 0.00 2.07 0.00 0.00 57.50 58.05 2qqk n TRP 578 Cb 0.64 0.58 -0.03 0.00 -0.81 0.00 0.00 31.31 31.69 2qqk n TRP 578 CO 0.00 0.00 0.00 -1.54 2.07 0.00 0.00 177.69 178.22 2qqk s SER 579 N -2.76 6.49 0.11 -0.67 1.04 -0.40 -4.74 113.70 112.76 2qqk s SER 579 Ca 0.15 1.19 -0.19 0.00 0.48 0.00 0.00 55.95 57.58 2qqk s SER 579 Cb -0.03 -2.35 -0.02 0.00 0.10 0.00 0.00 66.02 63.73 2qqk s SER 579 CO 0.06 -0.47 1.02 -2.65 0.98 0.00 0.00 173.24 172.18 2qqk n PRO 580 N -1.54 -0.27 0.26 4.02 -0.02 -1.26 -1.96 135.00 134.23 2qqk n PRO 580 Ca 0.03 1.00 0.09 0.00 -2.02 0.00 0.00 63.50 62.60 2qqk n PRO 580 Cb 0.54 -1.47 0.65 0.00 -0.02 0.00 0.00 33.50 33.20 2qqk n PRO 580 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qqk h ALA 581 N 0.41 1.78 0.00 3.55 0.00 -1.95 -3.48 119.26 119.58 2qqk h ALA 581 Ca 0.12 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2qqk h ALA 581 Cb 0.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2qqk h ALA 581 CO -0.63 0.08 0.00 0.41 0.00 0.00 0.00 179.25 179.11 2qqk n GLY 582 N -1.28 0.07 3.22 0.00 0.00 -0.83 -4.85 105.19 101.51 2qqk n GLY 582 Ca -0.03 -1.15 -0.41 0.00 0.00 0.00 0.00 46.02 44.43 2qqk n GLY 582 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qqk s ILE 583 N -4.00 4.41 -0.07 -0.61 1.01 -1.12 -3.65 121.20 117.17 2qqk s ILE 583 Ca 0.00 -2.09 -0.05 0.00 0.00 0.00 0.00 60.65 58.51 2qqk s ILE 583 Cb 0.00 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.57 2qqk s ILE 583 CO 0.00 -0.84 0.17 -0.83 0.00 0.00 0.00 174.94 173.43 2qqk s GLY 584 N 2.30 2.17 -0.28 6.18 0.00 -1.26 -4.10 107.32 112.33 2qqk s GLY 584 Ca 0.10 -0.68 -0.16 0.00 0.00 0.00 0.00 44.72 43.98 2qqk s GLY 584 CO -0.02 -0.48 0.75 -0.29 0.00 0.00 0.00 173.10 173.06 2qqk s MET 585 N -1.41 0.63 0.22 2.90 0.00 -0.97 -3.07 119.30 117.60 2qqk s MET 585 Ca 0.20 1.13 0.11 0.00 0.00 0.00 0.00 55.69 57.13 2qqk s MET 585 Cb -0.12 0.18 -0.04 0.00 0.00 0.00 0.00 34.83 34.85 2qqk s MET 585 CO 0.10 -0.14 -0.17 1.03 0.00 0.00 0.00 175.02 175.85 2qqk s ARG 586 N 1.68 1.78 0.04 4.11 0.52 -0.86 0.48 118.95 126.71 2qqk s ARG 586 Ca -0.09 -1.51 -0.19 0.00 -0.52 0.00 0.00 55.73 53.42 2qqk s ARG 586 Cb -0.05 -1.94 0.04 0.00 0.52 0.00 0.00 34.95 33.51 2qqk s ARG 586 CO -0.19 0.39 0.43 -1.17 0.02 0.00 0.00 175.30 174.78 2qqk s LEU 587 N -3.03 0.34 0.02 2.53 2.96 0.72 -1.72 118.68 120.50 2qqk s LEU 587 Ca 0.25 0.05 -0.09 0.00 -0.22 0.00 0.00 54.13 54.12 2qqk s LEU 587 Cb -0.07 1.78 0.00 0.00 0.50 0.00 0.00 46.19 48.40 2qqk s LEU 587 CO 0.14 -0.66 0.18 -0.70 -1.32 0.00 0.00 176.35 173.99 2qqk s GLU 588 N -2.36 0.62 -0.00 1.98 2.56 -0.75 -2.27 118.70 118.48 2qqk s GLU 588 Ca -0.06 -0.52 0.07 0.00 0.00 0.00 0.00 54.97 54.46 2qqk s GLU 588 Cb -0.01 0.26 -0.02 0.00 2.00 0.00 0.00 34.13 36.35 2qqk s GLU 588 CO -0.01 -0.17 -0.23 0.08 -0.56 0.00 0.00 175.26 174.37 2qqk s VAL 589 N -2.07 2.33 -0.08 3.70 1.01 -1.26 -0.90 120.40 123.13 2qqk s VAL 589 Ca -0.09 -1.13 0.04 0.00 0.00 0.00 0.00 61.98 60.80 2qqk s VAL 589 Cb -0.04 -1.87 -0.01 0.00 0.00 0.00 0.00 36.38 34.46 2qqk s VAL 589 CO -0.01 0.50 -0.19 -0.76 0.00 0.00 0.00 175.10 174.64 2qqk s LEU 590 N -0.89 2.42 0.00 3.92 1.43 0.47 -1.51 118.68 124.51 2qqk s LEU 590 Ca 0.11 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.83 2qqk s LEU 590 Cb -0.10 -1.49 0.00 0.00 0.03 0.00 0.00 46.19 44.63 2qqk s LEU 590 CO 0.01 0.24 0.00 0.61 0.23 0.00 0.00 176.35 177.44 2qqk n GLY 591 N 3.01 -0.80 2.66 -3.19 0.00 -0.83 -0.08 105.19 105.95 2qqk n GLY 591 Ca -0.18 -0.28 -0.06 0.00 0.00 0.00 0.00 46.02 45.51 2qqk n GLY 591 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qqk s ASP 593 N -2.49 6.27 0.00 0.00 1.01 -1.26 -0.47 116.67 119.73 2qqk s ASP 593 Ca 0.12 1.34 0.04 0.00 0.71 0.00 0.00 52.55 54.76 2qqk s ASP 593 Cb -0.03 -2.43 0.25 0.00 1.01 0.00 0.00 42.92 41.72 2qqk s ASP 593 CO 0.08 -0.79 0.73 0.79 0.21 0.00 0.00 175.17 176.19