#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qfy h PHE 2 N 0.00 0.55 -3.63 0.00 -1.00 -1.96 -3.39 116.94 107.52 2qfy h PHE 2 Ca 0.00 -0.14 -0.69 0.00 2.81 0.00 0.00 57.97 59.95 2qfy h PHE 2 Cb 0.00 -0.12 -0.19 0.00 3.61 0.00 0.00 35.95 39.24 2qfy h PHE 2 CO 0.00 0.76 -0.43 -1.12 -1.61 0.00 0.00 178.31 175.91 2qfy s SER 3 N -6.16 6.10 0.15 2.17 0.01 -1.26 -5.03 113.70 109.68 2qfy s SER 3 Ca -0.14 -0.58 -0.32 0.00 1.31 0.00 0.00 55.95 56.22 2qfy s SER 3 Cb 0.07 -2.16 -0.17 0.00 0.21 0.00 0.00 66.02 63.97 2qfy s SER 3 CO 0.77 -0.34 0.88 0.29 0.41 0.00 0.00 173.24 175.25 2qfy n LYS 4 N 5.18 0.44 -2.47 12.44 5.02 -1.26 -4.87 118.16 132.64 2qfy n LYS 4 Ca -0.11 0.16 -0.42 0.00 -2.02 0.00 0.00 58.31 55.91 2qfy n LYS 4 Cb 0.49 -1.46 -0.03 0.00 -0.02 0.00 0.00 35.03 34.01 2qfy n LYS 4 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2qfy s ILE 5 N -0.52 4.23 -0.29 -0.18 1.01 -0.51 -4.75 121.20 120.18 2qfy s ILE 5 Ca 0.73 1.58 -0.25 0.00 0.00 0.00 0.00 60.65 62.71 2qfy s ILE 5 Cb -0.97 -4.02 0.00 0.00 0.01 0.00 0.00 42.46 37.48 2qfy s ILE 5 CO 0.56 0.07 0.86 -0.75 0.00 0.00 0.00 174.94 175.68 2qfy s LYS 6 N 1.53 4.04 -0.33 2.79 2.47 -1.26 -1.21 119.74 127.76 2qfy s LYS 6 Ca 0.57 0.78 -0.22 0.00 -1.56 0.00 0.00 55.97 55.54 2qfy s LYS 6 Cb -0.26 -3.71 0.00 0.00 -1.46 0.00 0.00 37.83 32.40 2qfy s LYS 6 CO 0.26 -0.69 0.72 0.08 0.16 0.00 0.00 175.35 175.89 2qfy s VAL 7 N 3.07 4.83 0.08 4.02 1.01 -1.00 -4.96 120.40 127.46 2qfy s VAL 7 Ca 0.36 0.95 -0.32 0.00 0.00 0.00 0.00 61.98 62.96 2qfy s VAL 7 Cb -0.14 -4.11 -0.16 0.00 0.00 0.00 0.00 36.38 31.97 2qfy s VAL 7 CO 0.12 -0.27 1.61 0.50 0.00 0.00 0.00 175.10 177.06 2qfy h LYS 8 N 8.26 -0.82 -6.06 2.72 3.64 -1.94 -3.44 116.57 118.93 2qfy h LYS 8 Ca -0.25 0.06 -0.59 0.00 -1.27 0.00 0.00 60.65 58.59 2qfy h LYS 8 Cb 1.10 0.19 -0.04 0.00 -0.41 0.00 0.00 32.23 33.07 2qfy h LYS 8 CO 0.86 -0.55 -0.40 -1.14 -2.27 0.00 0.00 179.45 175.96 2qfy s GLN 9 N -6.01 3.53 0.61 1.90 2.00 -1.26 -5.02 119.66 115.42 2qfy s GLN 9 Ca -0.17 -0.28 -0.19 0.00 -2.00 0.00 0.00 55.36 52.73 2qfy s GLN 9 Cb 0.05 -2.93 -0.03 0.00 0.80 0.00 0.00 33.01 30.90 2qfy s GLN 9 CO 0.62 0.52 1.24 -2.14 -0.50 0.00 0.00 175.29 175.04 2qfy s PRO 10 N -2.69 2.81 -0.10 1.67 0.02 -1.26 -4.70 135.00 130.75 2qfy s PRO 10 Ca 0.38 1.93 0.02 0.00 0.02 0.00 0.00 61.00 63.35 2qfy s PRO 10 Cb -0.12 -1.90 -0.02 0.00 0.02 0.00 0.00 34.50 32.48 2qfy s PRO 10 CO 0.27 -1.36 -0.15 0.08 -0.33 0.00 0.00 177.00 175.51 2qfy s VAL 11 N -1.51 2.91 -0.14 3.83 1.01 0.02 -4.73 120.40 121.80 2qfy s VAL 11 Ca 0.79 -0.73 -0.21 0.00 0.00 0.00 0.00 61.98 61.83 2qfy s VAL 11 Cb -0.33 -2.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.83 2qfy s VAL 11 CO 0.36 0.55 0.63 -0.69 0.00 0.00 0.00 175.10 175.95 2qfy s VAL 12 N -0.01 5.06 -0.18 2.92 1.01 -0.26 -0.69 120.40 128.25 2qfy s VAL 12 Ca -0.04 1.23 -0.01 0.00 0.00 0.00 0.00 61.98 63.16 2qfy s VAL 12 Cb -0.14 -3.96 -0.00 0.00 0.00 0.00 0.00 36.38 32.28 2qfy s VAL 12 CO 0.04 0.19 -0.12 -0.70 0.00 0.00 0.00 175.10 174.52 2qfy s GLU 13 N 1.32 3.27 -0.34 2.72 2.12 0.09 -0.43 118.70 127.45 2qfy s GLU 13 Ca 0.31 -0.71 -0.05 0.00 0.36 0.00 0.00 54.97 54.88 2qfy s GLU 13 Cb -0.16 -2.75 0.05 0.00 0.26 0.00 0.00 34.13 31.53 2qfy s GLU 13 CO 0.13 -0.05 0.11 -0.51 -0.54 0.00 0.00 175.26 174.39 2qfy s LEU 14 N 1.02 4.39 0.64 2.70 1.43 -0.48 -0.59 118.68 127.79 2qfy s LEU 14 Ca -0.01 -1.29 -0.13 0.00 -1.03 0.00 0.00 54.13 51.68 2qfy s LEU 14 Cb -0.15 -1.84 -0.02 0.00 0.03 0.00 0.00 46.19 44.21 2qfy s LEU 14 CO -0.02 -0.35 1.04 -0.62 0.23 0.00 0.00 176.35 176.63 2qfy s ASP 15 N 1.48 5.78 0.00 2.29 -1.08 -0.27 -0.88 116.67 123.99 2qfy s ASP 15 Ca -0.01 1.61 0.00 0.00 -0.52 0.00 0.00 52.55 53.63 2qfy s ASP 15 Cb -0.20 -2.50 0.00 0.00 -1.46 0.00 0.00 42.92 38.76 2qfy s ASP 15 CO 0.01 -1.17 0.00 0.61 0.52 0.00 0.00 175.17 175.14 2qfy n GLY 16 N -1.88 5.10 3.59 2.66 0.00 -1.26 -1.39 105.19 112.00 2qfy n GLY 16 Ca 0.07 -1.74 -0.25 0.00 0.00 0.00 0.00 46.02 44.11 2qfy n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qfy s ASP 17 N 1.00 4.31 0.00 1.61 1.01 -0.88 -4.05 116.67 119.67 2qfy s ASP 17 Ca 0.00 -0.63 0.00 0.00 0.71 0.00 0.00 52.55 52.63 2qfy s ASP 17 Cb 0.00 -0.74 0.00 0.00 1.01 0.00 0.00 42.92 43.19 2qfy s ASP 17 CO 0.00 0.06 0.00 -0.62 0.21 0.00 0.00 175.17 174.82 2qfy n GLU 18 N -0.34 0.00 -0.34 8.23 1.02 -1.26 -1.80 120.64 126.15 2qfy n GLU 18 Ca -0.09 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.04 2qfy n GLU 18 Cb 0.57 0.00 0.12 0.00 -0.02 0.00 0.00 31.44 32.11 2qfy n GLU 18 CO 0.00 0.00 0.00 1.98 1.18 0.00 0.00 177.13 180.29 2qfy h MET 19 N 0.00 1.15 0.00 3.49 4.05 -1.93 -1.07 114.93 120.63 2qfy h MET 19 Ca 0.00 -0.07 -0.04 0.00 -0.28 0.00 0.00 59.70 59.31 2qfy h MET 19 Cb 0.00 -0.26 -0.01 0.00 -0.80 0.00 0.00 31.60 30.53 2qfy h MET 19 CO 0.00 0.76 -0.21 1.79 0.23 0.00 0.00 176.91 179.48 2qfy h THR 20 N 1.19 0.98 -0.38 -0.77 1.35 -1.85 -1.57 112.91 111.86 2qfy h THR 20 Ca 0.37 -0.78 -0.08 0.00 -0.55 0.00 0.00 66.41 65.37 2qfy h THR 20 Cb -0.02 1.44 -0.01 0.00 -1.73 0.00 0.00 68.15 67.82 2qfy h THR 20 CO -0.11 0.21 -0.07 -0.09 -0.25 0.00 0.00 175.52 175.21 2qfy h ARG 21 N 0.00 0.71 -0.14 4.72 2.43 -0.40 0.07 114.38 121.77 2qfy h ARG 21 Ca -0.00 -0.26 -0.01 0.00 -0.81 0.00 0.00 59.98 58.90 2qfy h ARG 21 Cb 0.42 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 2qfy h ARG 21 CO 0.03 0.85 0.06 0.82 -1.51 0.00 0.00 179.97 180.21 2qfy h ILE 22 N 0.51 1.15 -0.62 1.20 2.04 -0.88 -1.44 117.51 119.48 2qfy h ILE 22 Ca 0.10 -0.46 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 2qfy h ILE 22 Cb 0.57 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 2qfy h ILE 22 CO 0.03 0.14 0.35 0.40 0.00 0.00 0.00 178.15 179.07 2qfy h ILE 23 N 0.08 1.20 -0.70 -0.67 2.04 -1.27 -2.47 117.51 115.71 2qfy h ILE 23 Ca 0.05 -0.49 0.08 0.00 1.00 0.00 0.00 64.86 65.50 2qfy h ILE 23 Cb 0.17 0.39 -0.07 0.00 -0.74 0.00 0.00 36.82 36.57 2qfy h ILE 23 CO -0.00 0.21 0.37 -0.25 0.00 0.00 0.00 178.15 178.48 2qfy h TRP 24 N 0.85 0.66 -0.35 1.37 2.91 -0.73 0.27 115.95 120.92 2qfy h TRP 24 Ca 0.22 0.03 -0.14 0.00 1.13 0.00 0.00 58.89 60.13 2qfy h TRP 24 Cb 0.03 -0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 28.48 2qfy h TRP 24 CO -0.01 0.26 -0.34 0.22 -1.03 0.00 0.00 178.44 177.54 2qfy h ASP 25 N 0.64 0.83 -0.50 2.65 1.82 -0.98 -1.94 116.42 118.93 2qfy h ASP 25 Ca 0.34 -0.35 -0.12 0.00 -0.39 0.00 0.00 57.03 56.50 2qfy h ASP 25 Cb 0.31 -0.23 -0.02 0.00 0.68 0.00 0.00 39.33 40.08 2qfy h ASP 25 CO -0.24 1.09 -0.16 0.11 -1.61 0.00 0.00 179.24 178.42 2qfy h LYS 26 N 0.66 1.00 -0.08 0.28 1.57 -0.95 -1.48 116.57 117.57 2qfy h LYS 26 Ca 0.07 -0.40 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 2qfy h LYS 26 Cb 0.89 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.14 2qfy h LYS 26 CO 0.08 1.08 0.05 0.82 -0.57 0.00 0.00 179.45 180.91 2qfy h ILE 27 N 0.88 1.02 -0.23 1.86 2.04 -0.84 0.12 117.51 122.36 2qfy h ILE 27 Ca 0.12 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.95 2qfy h ILE 27 Cb 0.74 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 2qfy h ILE 27 CO 0.06 0.02 0.15 0.50 0.00 0.00 0.00 178.15 178.88 2qfy h LYS 28 N 0.11 0.30 0.00 2.37 3.64 -1.23 0.21 116.57 121.97 2qfy h LYS 28 Ca 0.03 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 59.25 2qfy h LYS 28 Cb -0.01 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 2qfy h LYS 28 CO -0.01 0.21 -0.67 0.87 -2.27 0.00 0.00 179.45 177.58 2qfy h LYS 29 N 0.31 0.00 0.01 1.90 1.57 -1.13 0.10 116.57 119.33 2qfy h LYS 29 Ca 0.08 0.00 -0.38 0.00 -1.87 0.00 0.00 60.65 58.48 2qfy h LYS 29 Cb -0.03 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.21 2qfy h LYS 29 CO -0.02 0.67 -2.42 1.63 -0.57 0.00 0.00 179.45 178.74 2qfy n LYS 30 N -3.61 0.67 -0.01 3.15 5.02 0.41 -4.40 118.16 119.39 2qfy n LYS 30 Ca -0.01 0.11 0.07 0.00 -2.02 0.00 0.00 58.31 56.47 2qfy n LYS 30 Cb 0.69 -1.53 -0.11 0.00 -0.02 0.00 0.00 35.03 34.05 2qfy n LYS 30 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2qfy n LEU 31 N -3.13 0.03 -0.03 -0.35 4.77 0.70 -4.71 117.00 114.28 2qfy n LEU 31 Ca -0.41 -0.02 -0.05 0.00 -0.03 0.00 0.00 56.01 55.50 2qfy n LEU 31 Cb 1.04 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 42.11 2qfy n LEU 31 CO 0.32 0.01 -0.35 -0.38 -1.33 0.00 0.00 177.39 175.66 2qfy n ILE 32 N -1.98 1.07 -0.19 -0.08 2.08 -0.95 -4.69 119.36 114.61 2qfy n ILE 32 Ca -0.02 0.25 0.06 0.00 0.56 0.00 0.00 62.75 63.60 2qfy n ILE 32 Cb 0.38 -1.91 0.34 0.00 -0.75 0.00 0.00 39.64 37.69 2qfy n ILE 32 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 2qfy h LEU 33 N -0.51 0.69 -1.92 1.39 3.38 -1.05 -1.21 115.31 116.08 2qfy h LEU 33 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2qfy h LEU 33 Cb 0.51 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2qfy h LEU 33 CO 0.00 0.45 -0.02 -0.65 0.09 0.00 0.00 178.44 178.31 2qfy h PRO 34 N 0.78 0.00 0.00 1.13 0.11 -1.80 -3.20 132.00 129.02 2qfy h PRO 34 Ca 0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.43 2qfy h PRO 34 Cb 0.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.36 2qfy h PRO 34 CO -0.11 0.02 -1.46 0.66 -0.21 0.00 0.00 178.00 176.90 2qfy n TYR 35 N -3.14 0.00 -4.98 0.65 4.02 -0.91 -4.85 117.16 107.96 2qfy n TYR 35 Ca -0.01 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.60 2qfy n TYR 35 Cb 0.24 -0.25 -0.15 0.00 -0.02 0.00 0.00 39.34 39.15 2qfy n TYR 35 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2qfy s LEU 36 N -3.73 2.09 -0.94 7.72 1.43 -0.51 -1.43 118.68 123.33 2qfy s LEU 36 Ca -0.04 -0.47 -0.13 0.00 -1.03 0.00 0.00 54.13 52.47 2qfy s LEU 36 Cb 0.08 -1.15 0.24 0.00 0.03 0.00 0.00 46.19 45.39 2qfy s LEU 36 CO 0.51 0.25 0.91 -0.62 0.23 0.00 0.00 176.35 177.63 2qfy s ASP 37 N -0.80 6.96 -0.05 2.29 2.15 -0.35 -4.61 116.67 122.24 2qfy s ASP 37 Ca 0.09 -2.98 0.01 0.00 0.43 0.00 0.00 52.55 50.11 2qfy s ASP 37 Cb -0.09 -2.22 -0.03 0.00 -0.30 0.00 0.00 42.92 40.28 2qfy s ASP 37 CO 0.00 -0.50 -0.07 -0.69 -0.17 0.00 0.00 175.17 173.74 2qfy s VAL 38 N -0.19 3.67 -0.54 1.11 1.01 -1.26 -2.37 120.40 121.83 2qfy s VAL 38 Ca 0.23 -0.55 -0.19 0.00 0.00 0.00 0.00 61.98 61.48 2qfy s VAL 38 Cb -0.10 -2.52 0.08 0.00 0.00 0.00 0.00 36.38 33.84 2qfy s VAL 38 CO -0.09 0.56 0.63 -0.62 0.00 0.00 0.00 175.10 175.59 2qfy s ASP 39 N -0.93 6.20 -0.38 3.32 -1.08 -1.26 -5.02 116.67 117.52 2qfy s ASP 39 Ca 0.13 -1.17 -0.19 0.00 -0.52 0.00 0.00 52.55 50.81 2qfy s ASP 39 Cb -0.11 -2.28 0.01 0.00 -1.46 0.00 0.00 42.92 39.07 2qfy s ASP 39 CO 0.03 -0.96 0.53 -0.76 0.52 0.00 0.00 175.17 174.53 2qfy s LEU 40 N 2.54 4.46 -0.66 -1.34 1.43 -1.26 -0.80 118.68 123.06 2qfy s LEU 40 Ca 0.12 -0.19 -0.26 0.00 -1.03 0.00 0.00 54.13 52.77 2qfy s LEU 40 Cb -0.22 -2.59 0.04 0.00 0.03 0.00 0.00 46.19 43.45 2qfy s LEU 40 CO 0.09 -0.56 1.14 -0.54 0.23 0.00 0.00 176.35 176.71 2qfy s LYS 41 N 2.45 3.27 -0.13 1.70 -0.14 0.13 -4.90 119.74 122.13 2qfy s LYS 41 Ca 0.19 -0.26 -0.21 0.00 -1.36 0.00 0.00 55.97 54.32 2qfy s LYS 41 Cb -0.15 -4.13 -0.03 0.00 -1.68 0.00 0.00 37.83 31.83 2qfy s LYS 41 CO 0.15 -1.87 0.63 -0.47 -0.76 0.00 0.00 175.35 173.03 2qfy s TYR 42 N 4.92 3.49 -0.17 3.18 5.04 -1.26 -0.73 117.35 131.81 2qfy s TYR 42 Ca 0.33 1.06 -0.00 0.00 -2.44 0.00 0.00 57.07 56.02 2qfy s TYR 42 Cb -0.10 -2.76 0.04 0.00 0.35 0.00 0.00 41.96 39.49 2qfy s TYR 42 CO 0.17 0.00 -0.05 0.71 -1.34 0.00 0.00 175.55 175.04 2qfy s TYR 43 N 1.20 1.73 -0.45 4.97 1.51 0.24 -4.98 117.35 121.58 2qfy s TYR 43 Ca 0.32 -1.13 -0.28 0.00 -1.01 0.00 0.00 57.07 54.97 2qfy s TYR 43 Cb -0.16 -1.33 0.03 0.00 -0.11 0.00 0.00 41.96 40.39 2qfy s TYR 43 CO 0.13 -0.63 1.09 0.34 -1.11 0.00 0.00 175.55 175.38 2qfy s ASP 44 N 1.62 6.66 -0.40 2.29 -1.08 -1.26 -1.11 116.67 123.39 2qfy s ASP 44 Ca 0.00 0.52 0.05 0.00 -0.52 0.00 0.00 52.55 52.60 2qfy s ASP 44 Cb -0.16 -2.53 0.56 0.00 -1.46 0.00 0.00 42.92 39.33 2qfy s ASP 44 CO -0.08 -1.15 1.69 0.18 0.52 0.00 0.00 175.17 176.33 2qfy n LEU 45 N 7.56 5.64 -4.71 -1.34 4.77 -0.49 -4.51 117.00 123.92 2qfy n LEU 45 Ca 0.11 -3.87 -0.30 0.00 -0.03 0.00 0.00 56.01 51.92 2qfy n LEU 45 Cb 0.49 -0.74 0.13 0.00 -2.33 0.00 0.00 43.42 40.97 2qfy n LEU 45 CO 0.68 1.28 0.67 -0.94 -1.33 0.00 0.00 177.39 177.76 2qfy s SER 46 N -2.07 3.61 0.16 -1.43 1.04 -1.25 -4.69 113.70 109.06 2qfy s SER 46 Ca 0.52 1.79 -0.16 0.00 0.48 0.00 0.00 55.95 58.59 2qfy s SER 46 Cb 0.45 -2.42 0.06 0.00 0.10 0.00 0.00 66.02 64.21 2qfy s SER 46 CO 0.04 -2.60 1.77 0.58 0.98 0.00 0.00 173.24 174.01 2qfy h VAL 47 N -1.52 0.95 -0.98 5.02 2.07 -1.88 -0.77 116.25 119.14 2qfy h VAL 47 Ca -0.46 -0.12 0.01 0.00 0.82 0.00 0.00 66.70 66.94 2qfy h VAL 47 Cb 1.26 0.56 -0.05 0.00 -1.52 0.00 0.00 31.29 31.54 2qfy h VAL 47 CO 0.50 0.07 0.65 -0.08 0.02 0.00 0.00 177.57 178.72 2qfy h GLU 48 N 0.36 1.29 -0.26 1.57 4.22 -1.98 0.15 114.58 119.93 2qfy h GLU 48 Ca 0.17 -0.08 -0.04 0.00 0.08 0.00 0.00 59.36 59.49 2qfy h GLU 48 Cb 0.10 -0.29 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 2qfy h GLU 48 CO -0.13 0.85 0.00 1.03 -2.18 0.00 0.00 179.01 178.58 2qfy h SER 49 N 1.33 0.45 -0.60 1.04 0.87 -1.72 0.26 113.55 115.18 2qfy h SER 49 Ca 0.36 -0.30 -0.02 0.00 -1.23 0.00 0.00 61.79 60.59 2qfy h SER 49 Cb -0.15 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 61.66 2qfy h SER 49 CO -0.08 0.65 0.28 0.03 -0.53 0.00 0.00 176.83 177.18 2qfy h ARG 50 N 0.25 0.87 -0.10 2.24 3.08 -0.81 -1.73 114.38 118.19 2qfy h ARG 50 Ca 0.08 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 2qfy h ARG 50 Cb 0.41 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 2qfy h ARG 50 CO 0.01 0.71 0.06 0.22 -1.07 0.00 0.00 179.97 179.90 2qfy h ASP 51 N 0.82 0.12 -0.66 7.04 3.58 -0.52 0.83 116.42 127.64 2qfy h ASP 51 Ca 0.21 -0.04 0.06 0.00 0.42 0.00 0.00 57.03 57.68 2qfy h ASP 51 Cb 0.13 -0.03 -0.04 0.00 1.72 0.00 0.00 39.33 41.12 2qfy h ASP 51 CO -0.02 0.13 0.43 0.00 -2.88 0.00 0.00 179.24 176.89 2qfy h ALA 52 N 1.00 1.78 -0.50 -0.78 0.00 -0.73 -1.01 119.26 119.02 2qfy h ALA 52 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2qfy h ALA 52 Cb 0.03 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2qfy h ALA 52 CO -0.01 0.12 0.00 0.25 0.00 0.00 0.00 179.25 179.61 2qfy n THR 53 N -4.48 0.66 -3.72 0.00 -2.24 -0.67 -4.93 114.28 98.90 2qfy n THR 53 Ca 0.09 -0.78 -0.26 0.00 -2.27 0.00 0.00 64.05 60.83 2qfy n THR 53 Cb 0.24 0.67 0.06 0.00 -2.10 0.00 0.00 70.33 69.20 2qfy n THR 53 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2qfy n SER 54 N 1.36 -5.71 0.00 3.42 7.64 0.11 -1.51 113.62 118.93 2qfy n SER 54 Ca 0.20 -0.64 0.00 0.00 1.01 0.00 0.00 58.87 59.45 2qfy n SER 54 Cb 0.56 -4.58 0.00 0.00 -1.01 0.00 0.00 64.21 59.18 2qfy n SER 54 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2qfy n ASP 55 N -2.95 -4.82 -0.09 6.43 2.03 0.27 -4.86 116.55 112.56 2qfy n ASP 55 Ca 0.02 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.27 2qfy n ASP 55 Cb 0.55 -2.52 0.14 0.00 -0.72 0.00 0.00 41.12 38.56 2qfy n ASP 55 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 2qfy h LYS 56 N 0.34 0.75 -0.99 -0.67 3.11 -1.51 -2.88 116.57 114.72 2qfy h LYS 56 Ca 0.00 -0.24 0.10 0.00 -2.81 0.00 0.00 60.65 57.70 2qfy h LYS 56 Cb 0.66 -0.06 -0.08 0.00 -1.00 0.00 0.00 32.23 31.74 2qfy h LYS 56 CO 0.00 0.83 0.63 0.97 -2.81 0.00 0.00 179.45 179.07 2qfy h ILE 57 N 0.68 0.97 -0.52 2.00 6.09 -1.89 -0.05 117.51 124.79 2qfy h ILE 57 Ca 0.12 -0.35 -0.01 0.00 -1.37 0.00 0.00 64.86 63.25 2qfy h ILE 57 Cb 0.58 -0.15 -0.02 0.00 0.47 0.00 0.00 36.82 37.70 2qfy h ILE 57 CO 0.04 0.19 0.30 0.74 -3.07 0.00 0.00 178.15 176.35 2qfy h THR 58 N 1.03 1.17 -0.67 2.19 2.02 -1.86 0.02 112.91 116.80 2qfy h THR 58 Ca 0.47 -0.40 -0.08 0.00 0.77 0.00 0.00 66.41 67.17 2qfy h THR 58 Cb 0.39 0.48 -0.03 0.00 -1.74 0.00 0.00 68.15 67.26 2qfy h THR 58 CO -0.23 0.17 0.10 -0.61 0.37 0.00 0.00 175.52 175.33 2qfy h GLN 59 N 0.70 1.11 -0.48 6.66 4.15 -1.35 -2.02 115.11 123.89 2qfy h GLN 59 Ca 0.19 -0.30 0.01 0.00 0.77 0.00 0.00 58.65 59.31 2qfy h GLN 59 Cb 0.01 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.55 2qfy h GLN 59 CO -0.03 1.02 0.31 -0.44 -1.93 0.00 0.00 178.83 177.76 2qfy h ASP 60 N 1.04 0.52 -0.64 -0.69 3.32 -0.46 -1.61 116.42 117.90 2qfy h ASP 60 Ca 0.20 -0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.25 2qfy h ASP 60 Cb 0.46 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 2qfy h ASP 60 CO 0.01 0.38 0.42 0.00 -1.72 0.00 0.00 179.24 178.33 2qfy h ALA 61 N 1.18 0.81 -0.69 3.45 0.00 -0.77 -0.28 119.26 122.97 2qfy h ALA 61 Ca 0.18 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2qfy h ALA 61 Cb -0.05 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 2qfy h ALA 61 CO -0.05 0.23 0.45 0.00 0.00 0.00 0.00 179.25 179.88 2qfy h ALA 62 N 1.24 0.87 0.00 0.00 0.00 -0.97 0.08 119.26 120.47 2qfy h ALA 62 Ca 0.24 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 2qfy h ALA 62 Cb -0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 2qfy h ALA 62 CO -0.06 0.29 -0.40 0.93 0.00 0.00 0.00 179.25 180.01 2qfy h GLU 63 N 0.93 0.00 -0.29 0.00 5.08 -0.81 -2.30 114.58 117.19 2qfy h GLU 63 Ca 0.25 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.52 2qfy h GLU 63 Cb -0.11 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 2qfy h GLU 63 CO -0.06 0.40 -0.16 0.00 -1.00 0.00 0.00 179.01 178.19 2qfy h ALA 64 N 1.60 0.41 -0.52 3.43 0.00 0.01 -1.72 119.26 122.48 2qfy h ALA 64 Ca -0.00 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.58 2qfy h ALA 64 Cb 0.74 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 2qfy h ALA 64 CO 0.05 0.32 0.32 0.82 0.00 0.00 0.00 179.25 180.77 2qfy h ILE 65 N 0.37 1.09 -0.19 0.00 2.04 -0.72 -0.57 117.51 119.53 2qfy h ILE 65 Ca 0.06 -0.22 -0.06 0.00 1.00 0.00 0.00 64.86 65.64 2qfy h ILE 65 Cb 0.69 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 2qfy h ILE 65 CO 0.05 0.12 -0.16 0.50 0.00 0.00 0.00 178.15 178.66 2qfy h LYS 66 N 0.65 0.31 -0.09 2.37 3.64 -1.33 0.27 116.57 122.39 2qfy h LYS 66 Ca 0.20 -0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.45 2qfy h LYS 66 Cb -0.02 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.76 2qfy h LYS 66 CO -0.07 0.47 -0.12 -0.22 -2.27 0.00 0.00 179.45 177.24 2qfy h LYS 67 N 0.29 0.24 0.00 1.90 3.64 -0.59 -3.35 116.57 118.70 2qfy h LYS 67 Ca 0.05 -0.14 -0.02 0.00 -1.27 0.00 0.00 60.65 59.28 2qfy h LYS 67 Cb 0.46 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.29 2qfy h LYS 67 CO 0.03 0.69 -1.30 0.66 -2.27 0.00 0.00 179.45 177.26 2qfy n TYR 68 N -4.63 0.72 0.00 1.91 4.02 -0.29 -5.02 117.16 113.88 2qfy n TYR 68 Ca -0.07 0.21 0.00 0.00 -0.01 0.00 0.00 57.90 58.03 2qfy n TYR 68 Cb 0.35 -0.86 0.00 0.00 -0.02 0.00 0.00 39.34 38.81 2qfy n TYR 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2qfy n GLY 69 N 1.22 3.10 3.10 2.72 0.00 0.96 -4.89 105.19 111.41 2qfy n GLY 69 Ca -0.02 -0.94 -0.25 0.00 0.00 0.00 0.00 46.02 44.81 2qfy n GLY 69 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qfy s VAL 70 N -0.41 1.31 0.03 1.61 1.01 -1.26 -0.06 120.40 122.64 2qfy s VAL 70 Ca 0.00 -0.63 0.05 0.00 0.00 0.00 0.00 61.98 61.40 2qfy s VAL 70 Cb 0.00 -1.14 -0.02 0.00 0.00 0.00 0.00 36.38 35.22 2qfy s VAL 70 CO 0.00 0.38 -0.15 -0.83 0.00 0.00 0.00 175.10 174.50 2qfy s GLY 71 N 0.20 0.84 -0.14 4.51 0.00 0.03 -1.10 107.32 111.66 2qfy s GLY 71 Ca -0.07 -0.84 -0.00 0.00 0.00 0.00 0.00 44.72 43.81 2qfy s GLY 71 CO 0.03 -0.80 -0.10 -0.42 0.00 0.00 0.00 173.10 171.81 2qfy s ILE 72 N -0.78 1.31 -0.09 0.90 1.01 0.43 0.25 121.20 124.23 2qfy s ILE 72 Ca 0.03 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 60.16 2qfy s ILE 72 Cb -0.08 -1.32 -0.02 0.00 0.01 0.00 0.00 42.46 41.06 2qfy s ILE 72 CO 0.01 0.34 -0.16 -0.75 0.00 0.00 0.00 174.94 174.38 2qfy s LYS 73 N 1.58 2.90 0.43 2.79 2.20 0.12 -1.38 119.74 128.38 2qfy s LYS 73 Ca 0.04 -0.73 -0.14 0.00 -0.36 0.00 0.00 55.97 54.78 2qfy s LYS 73 Cb -0.13 -2.45 -0.08 0.00 -1.51 0.00 0.00 37.83 33.66 2qfy s LYS 73 CO -0.09 0.40 0.85 0.00 -0.36 0.00 0.00 175.35 176.15 2qfy s ALA 75 N -2.38 3.60 0.36 0.00 0.00 -1.25 -4.49 121.76 117.59 2qfy s ALA 75 Ca 0.55 1.53 0.09 0.00 0.00 0.00 0.00 51.96 54.13 2qfy s ALA 75 Cb -0.10 -3.60 -0.07 0.00 0.00 0.00 0.00 23.12 19.35 2qfy s ALA 75 CO 0.28 -0.98 -0.07 0.95 0.00 0.00 0.00 175.76 175.94 2qfy s THR 76 N -0.89 2.20 -0.17 0.00 -4.23 -1.26 -2.07 115.64 109.22 2qfy s THR 76 Ca 0.54 -2.15 -0.08 0.00 -1.18 0.00 0.00 61.69 58.83 2qfy s THR 76 Cb -0.46 -2.74 -0.04 0.00 1.34 0.00 0.00 72.50 70.60 2qfy s THR 76 CO 0.59 -0.15 0.09 -0.63 -0.54 0.00 0.00 174.62 173.98 2qfy s ILE 77 N -2.63 5.09 -0.41 2.99 1.01 -1.26 -4.76 121.20 121.24 2qfy s ILE 77 Ca 0.33 0.07 -0.17 0.00 0.00 0.00 0.00 60.65 60.88 2qfy s ILE 77 Cb 0.04 -3.29 0.02 0.00 0.01 0.00 0.00 42.46 39.24 2qfy s ILE 77 CO 0.17 0.49 0.42 -0.89 0.00 0.00 0.00 174.94 175.12 2qfy s THR 78 N 0.07 5.11 0.19 2.92 2.01 -1.26 -4.85 115.64 119.83 2qfy s THR 78 Ca 0.07 -0.33 -0.33 0.00 0.31 0.00 0.00 61.69 61.41 2qfy s THR 78 Cb -0.12 -4.01 -0.13 0.00 0.01 0.00 0.00 72.50 68.25 2qfy s THR 78 CO 0.00 -0.38 1.59 -0.81 -0.69 0.00 0.00 174.62 174.33 2qfy n PRO 79 N 5.54 2.28 -4.03 4.92 -0.04 -1.26 -5.02 135.00 137.40 2qfy n PRO 79 Ca -0.08 0.82 -0.26 0.00 -0.04 0.00 0.00 63.50 63.95 2qfy n PRO 79 Cb 0.48 -2.59 -0.04 0.00 -0.04 0.00 0.00 33.50 31.30 2qfy n PRO 79 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2qfy n ASP 80 N 3.31 3.00 -0.24 3.54 5.75 -1.26 -4.64 116.55 126.01 2qfy n ASP 80 Ca 0.16 -2.77 0.04 0.00 -0.01 0.00 0.00 54.79 52.21 2qfy n ASP 80 Cb 0.31 0.22 0.16 0.00 -1.03 0.00 0.00 41.12 40.77 2qfy n ASP 80 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 2qfy h GLU 81 N 0.00 0.21 -0.29 0.11 3.07 -1.99 0.23 114.58 115.92 2qfy h GLU 81 Ca -0.33 -0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 58.49 2qfy h GLU 81 Cb 1.05 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.90 2qfy h GLU 81 CO 0.55 0.14 0.07 0.00 -1.40 0.00 0.00 179.01 178.36 2qfy h ALA 82 N 1.60 0.38 0.04 3.43 0.00 -1.99 -2.37 119.26 120.35 2qfy h ALA 82 Ca 0.39 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2qfy h ALA 82 Cb 0.65 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2qfy h ALA 82 CO -0.52 0.04 -0.02 0.00 0.00 0.00 0.00 179.25 178.75 2qfy h ARG 83 N 0.30 -0.05 -0.89 0.00 2.47 -1.70 -1.66 114.38 112.85 2qfy h ARG 83 Ca 0.09 0.00 0.05 0.00 -1.26 0.00 0.00 59.98 58.87 2qfy h ARG 83 Cb 0.29 0.01 -0.06 0.00 -1.65 0.00 0.00 29.97 28.56 2qfy h ARG 83 CO 0.00 -0.02 0.56 0.28 0.56 0.00 0.00 179.97 181.36 2qfy h VAL 84 N -0.07 1.08 0.00 2.04 2.07 -0.97 -0.20 116.25 120.20 2qfy h VAL 84 Ca -0.01 -0.36 -0.13 0.00 0.82 0.00 0.00 66.70 67.03 2qfy h VAL 84 Cb 0.06 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 29.75 2qfy h VAL 84 CO 0.01 0.19 -0.61 0.50 0.02 0.00 0.00 177.57 177.68 2qfy h LYS 85 N 1.04 0.00 -0.00 1.57 3.64 -1.32 0.06 116.57 121.56 2qfy h LYS 85 Ca 0.38 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.76 2qfy h LYS 85 Cb 0.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 2qfy h LYS 85 CO -0.16 0.61 -0.58 -1.91 -2.27 0.00 0.00 179.45 175.15 2qfy n GLU 86 N -3.29 0.02 0.00 1.90 2.13 -0.63 -3.91 120.64 116.86 2qfy n GLU 86 Ca 0.01 -0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2qfy n GLU 86 Cb 0.77 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.98 2qfy n GLU 86 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2qfy n PHE 87 N -1.48 0.00 -3.65 4.31 3.01 -0.12 -5.01 117.46 114.52 2qfy n PHE 87 Ca 0.05 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.25 2qfy n PHE 87 Cb 0.33 0.00 0.06 0.00 -0.01 0.00 0.00 39.48 39.86 2qfy n PHE 87 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2qfy n ASN 88 N -0.11 -5.82 -4.76 4.37 3.02 -0.14 -4.95 115.26 106.87 2qfy n ASN 88 Ca 0.00 -0.59 -0.36 0.00 -0.03 0.00 0.00 54.58 53.60 2qfy n ASN 88 Cb 0.00 -4.61 0.02 0.00 -0.61 0.00 0.00 39.78 34.58 2qfy n ASN 88 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2qfy s LEU 89 N -7.24 3.69 0.39 3.41 1.43 -0.36 -4.92 118.68 115.08 2qfy s LEU 89 Ca 0.59 2.32 0.26 0.00 -1.03 0.00 0.00 54.13 56.27 2qfy s LEU 89 Cb -0.27 -4.59 0.76 0.00 0.03 0.00 0.00 46.19 42.11 2qfy s LEU 89 CO 0.73 -1.48 1.75 0.45 0.23 0.00 0.00 176.35 178.03 2qfy h HIS 90 N 0.97 0.00 -2.71 0.29 3.86 -1.91 -3.47 115.15 112.18 2qfy h HIS 90 Ca -0.50 0.00 0.06 0.00 -1.16 0.00 0.00 60.37 58.77 2qfy h HIS 90 Cb 1.29 0.00 -0.11 0.00 1.06 0.00 0.00 27.41 29.65 2qfy h HIS 90 CO 0.48 0.00 0.33 0.21 0.86 0.00 0.00 177.93 179.81 2qfy s LYS 91 N -3.30 1.24 -1.27 2.45 2.20 -1.26 -5.06 119.74 114.74 2qfy s LYS 91 Ca 0.06 -0.56 -0.14 0.00 -0.36 0.00 0.00 55.97 54.98 2qfy s LYS 91 Cb 0.08 0.51 0.13 0.00 -1.51 0.00 0.00 37.83 37.04 2qfy s LYS 91 CO 0.59 -0.56 1.67 -0.12 -0.36 0.00 0.00 175.35 176.58 2qfy n MET 92 N -0.37 3.33 -1.55 4.03 0.00 -1.26 -4.95 117.12 116.34 2qfy n MET 92 Ca -0.11 -3.53 -0.45 0.00 -0.00 0.00 0.00 57.70 53.62 2qfy n MET 92 Cb 0.62 -3.16 -0.02 0.00 0.00 0.00 0.00 33.22 30.67 2qfy n MET 92 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 175.97 176.88 2qfy n TRP 93 N 6.03 0.90 -1.83 1.12 7.02 -1.26 -4.94 117.44 124.48 2qfy n TRP 93 Ca 0.42 0.74 -0.33 0.00 -1.02 0.00 0.00 57.50 57.31 2qfy n TRP 93 Cb 0.42 -2.19 0.04 0.00 -2.42 0.00 0.00 31.31 27.16 2qfy n TRP 93 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 2qfy s LYS 94 N -1.49 2.91 -0.03 -0.99 1.02 -1.26 -4.28 119.74 115.63 2qfy s LYS 94 Ca 0.60 1.37 -0.38 0.00 0.02 0.00 0.00 55.97 57.58 2qfy s LYS 94 Cb -0.73 -1.97 -0.16 0.00 -0.52 0.00 0.00 37.83 34.46 2qfy s LYS 94 CO 0.59 -1.16 1.49 0.45 -0.92 0.00 0.00 175.35 175.80 2qfy n SER 95 N -2.30 1.99 0.07 2.83 2.88 -1.26 -4.84 113.62 112.98 2qfy n SER 95 Ca 0.10 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.74 2qfy n SER 95 Cb 0.52 -1.19 0.32 0.00 -0.75 0.00 0.00 64.21 63.11 2qfy n SER 95 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2qfy h PRO 96 N 5.57 0.36 -0.60 -1.46 0.13 -1.91 -2.44 132.00 131.65 2qfy h PRO 96 Ca -0.47 -0.09 -0.06 0.00 -0.87 0.00 0.00 66.00 64.50 2qfy h PRO 96 Cb 1.32 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 32.39 2qfy h PRO 96 CO 0.84 0.50 0.14 -0.91 -0.23 0.00 0.00 178.00 178.34 2qfy h ASN 97 N 0.33 0.88 -0.54 1.44 2.35 -1.99 -0.88 115.58 117.16 2qfy h ASN 97 Ca 0.06 -0.17 -0.08 0.00 -0.55 0.00 0.00 56.30 55.57 2qfy h ASN 97 Cb 0.45 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.57 2qfy h ASN 97 CO 0.03 0.86 0.04 1.23 -1.65 0.00 0.00 177.43 177.94 2qfy h GLY 98 N 1.02 1.00 0.90 2.83 0.00 -1.82 -0.66 103.07 106.34 2qfy h GLY 98 Ca 0.19 -0.70 -0.02 0.00 0.00 0.00 0.00 47.33 46.79 2qfy h GLY 98 CO 0.00 0.65 0.09 -0.84 0.00 0.00 0.00 176.54 176.44 2qfy h THR 99 N 0.81 1.20 -0.24 4.70 2.02 -1.12 -1.23 112.91 119.06 2qfy h THR 99 Ca 0.16 -0.66 -0.01 0.00 0.77 0.00 0.00 66.41 66.67 2qfy h THR 99 Cb 0.47 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 2qfy h THR 99 CO 0.02 0.22 0.11 0.40 0.37 0.00 0.00 175.52 176.64 2qfy h ILE 100 N 0.30 1.15 -0.84 3.11 2.04 -1.06 -1.93 117.51 120.28 2qfy h ILE 100 Ca 0.09 -0.44 -0.02 0.00 1.00 0.00 0.00 64.86 65.50 2qfy h ILE 100 Cb 0.25 1.00 -0.04 0.00 -0.74 0.00 0.00 36.82 37.30 2qfy h ILE 100 CO -0.00 0.15 0.46 0.03 0.00 0.00 0.00 178.15 178.79 2qfy h ARG 101 N 0.24 1.17 -0.57 2.37 3.08 -1.05 -0.29 114.38 119.33 2qfy h ARG 101 Ca 0.08 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 59.93 2qfy h ARG 101 Cb 0.14 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 29.93 2qfy h ARG 101 CO -0.01 0.86 0.11 -0.97 -1.07 0.00 0.00 179.97 178.89 2qfy h ASN 102 N 1.17 0.85 -0.15 7.04 -0.73 -1.03 0.79 115.58 123.52 2qfy h ASN 102 Ca 0.30 -0.17 -0.13 0.00 1.87 0.00 0.00 56.30 58.17 2qfy h ASN 102 Cb 0.03 -0.22 0.00 0.00 0.27 0.00 0.00 38.32 38.40 2qfy h ASN 102 CO -0.05 0.85 -0.40 0.40 -0.37 0.00 0.00 177.43 177.86 2qfy h ILE 103 N 0.86 1.35 0.16 2.57 2.04 -0.92 -3.33 117.51 120.24 2qfy h ILE 103 Ca 0.18 -1.68 -0.32 0.00 1.00 0.00 0.00 64.86 64.04 2qfy h ILE 103 Cb 0.36 2.03 0.01 0.00 -0.74 0.00 0.00 36.82 38.47 2qfy h ILE 103 CO 0.00 0.51 -1.55 -0.07 0.00 0.00 0.00 178.15 177.05 2qfy h LEU 104 N 0.16 0.54 0.00 1.44 3.38 -0.96 -3.51 115.31 116.36 2qfy h LEU 104 Ca -0.01 -0.70 0.00 0.00 0.09 0.00 0.00 57.88 57.26 2qfy h LEU 104 Cb 1.02 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.59 2qfy h LEU 104 CO 0.09 1.57 0.00 0.61 0.09 0.00 0.00 178.44 180.80 2qfy n GLY 105 N 1.71 -1.63 0.17 0.83 0.00 0.27 -4.91 105.19 101.63 2qfy n GLY 105 Ca -0.18 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.56 2qfy n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qfy n GLY 106 N 0.00 -0.53 3.09 -0.02 0.00 -1.26 -4.64 105.19 101.84 2qfy n GLY 106 Ca 0.00 -1.85 -0.19 0.00 0.00 0.00 0.00 46.02 43.98 2qfy n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qfy s THR 107 N 0.00 0.90 -0.33 2.61 2.01 0.12 -1.69 115.64 119.27 2qfy s THR 107 Ca 0.00 -0.82 -0.07 0.00 0.31 0.00 0.00 61.69 61.11 2qfy s THR 107 Cb 0.00 -0.82 0.03 0.00 0.01 0.00 0.00 72.50 71.72 2qfy s THR 107 CO 0.00 0.01 0.12 -0.69 -0.69 0.00 0.00 174.62 173.36 2qfy s VAL 108 N -0.73 3.99 -0.22 3.82 1.01 0.28 -0.17 120.40 128.38 2qfy s VAL 108 Ca 0.00 -0.94 -0.18 0.00 0.00 0.00 0.00 61.98 60.87 2qfy s VAL 108 Cb -0.07 -3.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 2qfy s VAL 108 CO 0.01 -0.10 0.49 -0.36 0.00 0.00 0.00 175.10 175.13 2qfy s PHE 109 N 1.46 3.33 -0.12 5.22 0.08 -0.44 -0.83 117.98 126.68 2qfy s PHE 109 Ca 0.00 0.68 0.01 0.00 0.12 0.00 0.00 56.93 57.74 2qfy s PHE 109 Cb -0.19 -2.65 -0.01 0.00 -0.57 0.00 0.00 43.02 39.60 2qfy s PHE 109 CO 0.03 -0.15 -0.17 1.03 -0.10 0.00 0.00 175.22 175.87 2qfy s ARG 110 N 1.82 3.26 -0.00 0.44 0.52 -0.07 -1.72 118.95 123.19 2qfy s ARG 110 Ca 0.22 -0.75 0.00 0.00 -0.52 0.00 0.00 55.73 54.67 2qfy s ARG 110 Cb -0.15 -2.53 -0.00 0.00 0.52 0.00 0.00 34.95 32.79 2qfy s ARG 110 CO 0.09 0.17 -0.01 -2.00 0.02 0.00 0.00 175.30 173.58 2qfy s GLU 111 N 0.42 0.07 0.58 3.54 2.12 -0.98 -1.16 118.70 123.28 2qfy s GLU 111 Ca -0.13 -0.03 -0.19 0.00 0.36 0.00 0.00 54.97 54.99 2qfy s GLU 111 Cb -0.16 -0.07 -0.04 0.00 0.26 0.00 0.00 34.13 34.11 2qfy s GLU 111 CO 0.06 0.02 1.15 -1.25 -0.54 0.00 0.00 175.26 174.69 2qfy s PRO 112 N -0.01 3.15 -0.49 4.30 0.04 -1.26 0.12 135.00 140.85 2qfy s PRO 112 Ca 0.00 1.64 -0.16 0.00 0.04 0.00 0.00 61.00 62.52 2qfy s PRO 112 Cb -0.00 -1.97 0.08 0.00 0.04 0.00 0.00 34.50 32.64 2qfy s PRO 112 CO -0.00 -1.02 0.46 0.42 0.04 0.00 0.00 177.00 176.90 2qfy s ILE 113 N -1.80 5.17 -0.27 0.56 1.01 -0.90 -4.77 121.20 120.19 2qfy s ILE 113 Ca 0.73 -1.07 -0.29 0.00 0.00 0.00 0.00 60.65 60.02 2qfy s ILE 113 Cb -0.25 -4.20 0.00 0.00 0.01 0.00 0.00 42.46 38.02 2qfy s ILE 113 CO 0.31 -0.68 1.22 -0.69 0.00 0.00 0.00 174.94 175.09 2qfy s VAL 114 N 1.81 4.30 -0.56 2.92 1.01 -1.26 -4.82 120.40 123.80 2qfy s VAL 114 Ca 0.06 1.51 0.04 0.00 0.00 0.00 0.00 61.98 63.59 2qfy s VAL 114 Cb -0.25 -4.19 0.15 0.00 0.00 0.00 0.00 36.38 32.09 2qfy s VAL 114 CO 0.07 -0.37 0.37 -0.63 0.00 0.00 0.00 175.10 174.53 2qfy s ILE 115 N 3.91 2.05 0.56 2.22 1.01 -1.26 -4.99 121.20 124.70 2qfy s ILE 115 Ca 0.52 -3.43 0.23 0.00 0.00 0.00 0.00 60.65 57.98 2qfy s ILE 115 Cb -0.17 -2.39 0.33 0.00 0.01 0.00 0.00 42.46 40.25 2qfy s ILE 115 CO 0.18 -0.98 1.16 -0.81 0.00 0.00 0.00 174.94 174.49 2qfy n PRO 116 N 2.69 0.01 0.30 2.79 -0.04 -1.26 -0.58 135.00 138.91 2qfy n PRO 116 Ca 0.16 0.93 -0.16 0.00 -0.04 0.00 0.00 63.50 64.39 2qfy n PRO 116 Cb 0.36 -2.32 -0.08 0.00 -0.04 0.00 0.00 33.50 31.43 2qfy n PRO 116 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qfy h ARG 117 N 0.00 -0.72 -6.40 0.54 3.08 -2.01 -3.44 114.38 105.43 2qfy h ARG 117 Ca 0.42 0.05 -0.63 0.00 0.07 0.00 0.00 59.98 59.89 2qfy h ARG 117 Cb 2.63 0.16 0.07 0.00 0.08 0.00 0.00 29.97 32.92 2qfy h ARG 117 CO -0.00 -0.43 0.47 -0.89 -1.07 0.00 0.00 179.97 178.05 2qfy n ILE 118 N -5.36 0.54 -2.28 2.04 2.08 0.25 -4.92 119.36 111.72 2qfy n ILE 118 Ca -0.12 -0.14 -0.41 0.00 0.56 0.00 0.00 62.75 62.64 2qfy n ILE 118 Cb 0.33 -1.09 -0.03 0.00 -0.75 0.00 0.00 39.64 38.10 2qfy n ILE 118 CO 0.00 0.00 0.00 -2.84 0.56 0.00 0.00 176.55 174.27 2qfy s PRO 119 N 0.03 4.41 -0.05 0.38 0.02 -1.26 -4.95 135.00 133.57 2qfy s PRO 119 Ca 0.76 1.98 -0.21 0.00 0.02 0.00 0.00 61.00 63.55 2qfy s PRO 119 Cb -0.81 -3.23 -0.05 0.00 0.02 0.00 0.00 34.50 30.44 2qfy s PRO 119 CO 0.48 -0.24 0.59 1.03 -0.33 0.00 0.00 177.00 178.54 2qfy s ARG 120 N 0.18 4.35 0.49 5.54 0.52 -1.26 -4.35 118.95 124.42 2qfy s ARG 120 Ca 0.57 0.70 0.27 0.00 -0.52 0.00 0.00 55.73 56.75 2qfy s ARG 120 Cb -0.35 -3.39 1.25 0.00 0.52 0.00 0.00 34.95 32.98 2qfy s ARG 120 CO 0.35 0.23 1.97 -0.07 0.02 0.00 0.00 175.30 177.81 2qfy h LEU 121 N 6.22 0.00 -7.14 2.53 3.38 -0.95 -3.24 115.31 116.11 2qfy h LEU 121 Ca -0.43 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 56.90 2qfy h LEU 121 Cb 1.19 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.54 2qfy h LEU 121 CO 0.73 0.16 -0.50 -0.69 0.09 0.00 0.00 178.44 178.22 2qfy s VAL 122 N -3.91 3.12 0.21 1.22 1.01 -0.92 -5.01 120.40 116.12 2qfy s VAL 122 Ca -0.01 -4.16 -0.03 0.00 0.00 0.00 0.00 61.98 57.78 2qfy s VAL 122 Cb 0.12 -3.03 0.32 0.00 0.00 0.00 0.00 36.38 33.79 2qfy s VAL 122 CO 0.60 -1.01 1.12 -2.65 0.00 0.00 0.00 175.10 173.17 2qfy n PRO 123 N 2.09 -0.06 0.00 2.72 -0.02 -1.22 -1.18 135.00 137.32 2qfy n PRO 123 Ca 0.19 1.10 0.05 0.00 -2.02 0.00 0.00 63.50 62.82 2qfy n PRO 123 Cb 0.35 -1.69 0.22 0.00 -0.02 0.00 0.00 33.50 32.36 2qfy n PRO 123 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2qfy n ARG 124 N -5.09 0.01 -2.45 -0.52 1.74 -1.26 -4.53 116.66 104.55 2qfy n ARG 124 Ca 0.14 0.32 -0.40 0.00 -0.77 0.00 0.00 57.85 57.14 2qfy n ARG 124 Cb 0.45 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.35 2qfy n ARG 124 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 2qfy s TRP 125 N -2.99 2.22 -0.06 -1.55 0.52 -0.33 -4.14 118.94 112.61 2qfy s TRP 125 Ca 0.05 -0.06 0.12 0.00 0.02 0.00 0.00 56.10 56.22 2qfy s TRP 125 Cb 0.07 -4.53 -0.18 0.00 -1.15 0.00 0.00 33.47 27.68 2qfy s TRP 125 CO 0.19 -2.06 0.28 -0.85 0.02 0.00 0.00 176.95 174.52 2qfy n GLU 126 N 9.21 0.59 -4.79 4.98 0.28 -0.59 -4.96 120.64 125.36 2qfy n GLU 126 Ca 0.15 -0.10 -0.33 0.00 -0.16 0.00 0.00 57.16 56.72 2qfy n GLU 126 Cb 0.50 -1.26 -0.13 0.00 1.43 0.00 0.00 31.44 31.98 2qfy n GLU 126 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2qfy s LYS 127 N -2.76 2.77 0.35 3.44 1.02 -0.71 -5.01 119.74 118.84 2qfy s LYS 127 Ca -0.04 -0.65 -0.26 0.00 0.02 0.00 0.00 55.97 55.04 2qfy s LYS 127 Cb 0.08 -2.49 -0.12 0.00 -0.52 0.00 0.00 37.83 34.77 2qfy s LYS 127 CO 0.49 0.54 1.04 -2.30 -0.92 0.00 0.00 175.35 174.20 2qfy n PRO 128 N 2.56 1.46 -4.64 -1.68 -0.02 -1.26 -2.05 135.00 129.38 2qfy n PRO 128 Ca -0.18 0.52 -0.33 0.00 -2.02 0.00 0.00 63.50 61.49 2qfy n PRO 128 Cb 0.52 -1.99 -0.14 0.00 -0.02 0.00 0.00 33.50 31.88 2qfy n PRO 128 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2qfy s ILE 129 N -1.16 3.25 -0.13 4.25 1.01 -1.26 -1.42 121.20 125.75 2qfy s ILE 129 Ca 0.60 -0.59 -0.01 0.00 0.00 0.00 0.00 60.65 60.65 2qfy s ILE 129 Cb -0.62 -2.39 -0.02 0.00 0.01 0.00 0.00 42.46 39.44 2qfy s ILE 129 CO 0.59 0.51 -0.09 -0.63 0.00 0.00 0.00 174.94 175.33 2qfy s ILE 130 N 0.42 3.47 -0.22 2.92 1.01 -0.69 -4.36 121.20 123.76 2qfy s ILE 130 Ca -0.08 -0.52 -0.07 0.00 0.00 0.00 0.00 60.65 59.98 2qfy s ILE 130 Cb -0.15 -2.47 -0.03 0.00 0.01 0.00 0.00 42.46 39.81 2qfy s ILE 130 CO 0.04 0.53 0.05 -0.63 0.00 0.00 0.00 174.94 174.93 2qfy s ILE 131 N 0.12 4.39 -0.50 2.92 -1.09 -0.31 -0.30 121.20 126.43 2qfy s ILE 131 Ca -0.04 -0.16 -0.14 0.00 -2.23 0.00 0.00 60.65 58.08 2qfy s ILE 131 Cb -0.14 -3.01 0.11 0.00 -1.58 0.00 0.00 42.46 37.83 2qfy s ILE 131 CO 0.04 0.39 0.42 -0.83 -1.23 0.00 0.00 174.94 173.73 2qfy s GLY 132 N 1.10 2.06 -0.32 6.18 0.00 0.33 -0.90 107.32 115.78 2qfy s GLY 132 Ca 0.04 -2.37 -0.13 0.00 0.00 0.00 0.00 44.72 42.25 2qfy s GLY 132 CO 0.03 1.12 0.28 -1.60 0.00 0.00 0.00 173.10 172.93 2qfy s ARG 133 N 1.56 3.70 0.09 2.90 3.52 -0.01 -0.36 118.95 130.35 2qfy s ARG 133 Ca 0.04 -0.39 -0.32 0.00 -0.13 0.00 0.00 55.73 54.92 2qfy s ARG 133 Cb -0.27 -3.75 -0.12 0.00 -1.56 0.00 0.00 34.95 29.26 2qfy s ARG 133 CO 0.03 -0.38 1.79 1.58 -0.81 0.00 0.00 175.30 177.52 2qfy n HIS 134 N 5.21 2.49 0.85 5.12 -0.00 -0.67 -0.55 115.22 127.66 2qfy n HIS 134 Ca -0.11 -0.03 0.11 0.00 -0.00 0.00 0.00 57.72 57.69 2qfy n HIS 134 Cb 0.50 -2.68 0.29 0.00 -0.00 0.00 0.00 29.99 28.11 2qfy n HIS 134 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2qfy n ALA 135 N 5.36 2.48 -1.43 1.57 0.00 -0.68 -3.11 120.51 124.69 2qfy n ALA 135 Ca 0.19 -0.72 0.00 0.00 0.00 0.00 0.00 53.44 52.91 2qfy n ALA 135 Cb 0.34 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2qfy n ALA 135 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2qfy n HIS 136 N 0.85 0.00 0.00 0.00 -0.00 -1.26 -4.37 115.22 110.44 2qfy n HIS 136 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.89 2qfy n HIS 136 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.45 2qfy n HIS 136 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2qfy n GLY 137 N 5.00 -2.03 7.00 1.57 0.00 -1.26 -4.69 105.19 110.77 2qfy n GLY 137 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.61 2qfy n GLY 137 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qfy n ASP 138 N 0.00 0.00 0.00 1.61 10.43 0.26 -3.20 116.55 125.64 2qfy n ASP 138 Ca 0.00 0.00 0.06 0.00 2.57 0.00 0.00 54.79 57.42 2qfy n ASP 138 Cb 0.00 0.00 0.32 0.00 1.84 0.00 0.00 41.12 43.28 2qfy n ASP 138 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2qfy n GLN 139 N 4.54 0.22 0.00 -1.24 0.00 -1.26 -2.47 117.38 117.16 2qfy n GLN 139 Ca 0.00 0.14 0.14 0.00 0.00 0.00 0.00 57.00 57.28 2qfy n GLN 139 Cb 0.00 -1.50 0.59 0.00 0.00 0.00 0.00 30.24 29.33 2qfy n GLN 139 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 2qfy n TYR 140 N -1.23 0.00 -2.49 2.61 4.02 -1.20 -3.60 117.16 115.28 2qfy n TYR 140 Ca 0.07 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 57.97 2qfy n TYR 140 Cb 0.09 -0.08 0.02 0.00 -0.02 0.00 0.00 39.34 39.34 2qfy n TYR 140 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2qfy n LYS 141 N -0.53 0.32 -2.69 -0.72 4.76 -1.03 -5.03 118.16 113.24 2qfy n LYS 141 Ca 0.17 -2.07 -0.25 0.00 -2.87 0.00 0.00 58.31 53.29 2qfy n LYS 141 Cb 0.29 -0.17 0.02 0.00 -1.84 0.00 0.00 35.03 33.33 2qfy n LYS 141 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qfy s ALA 142 N -0.60 3.49 -0.23 7.82 0.00 -1.18 -4.78 121.76 126.28 2qfy s ALA 142 Ca 0.27 -0.79 -0.04 0.00 0.00 0.00 0.00 51.96 51.40 2qfy s ALA 142 Cb 0.32 -2.42 -0.01 0.00 0.00 0.00 0.00 23.12 21.02 2qfy s ALA 142 CO -0.12 -0.53 -0.03 0.99 0.00 0.00 0.00 175.76 176.07 2qfy s THR 143 N -2.76 3.47 0.07 0.00 2.01 -0.23 -4.97 115.64 113.23 2qfy s THR 143 Ca 0.50 -0.49 0.06 0.00 0.31 0.00 0.00 61.69 62.07 2qfy s THR 143 Cb -0.10 -2.61 -0.03 0.00 0.01 0.00 0.00 72.50 69.77 2qfy s THR 143 CO 0.42 0.39 -0.17 1.51 -0.69 0.00 0.00 174.62 176.08 2qfy s ASP 144 N 1.49 2.06 0.15 3.53 -4.77 -1.26 -0.62 116.67 117.26 2qfy s ASP 144 Ca 0.05 -0.58 -0.15 0.00 -3.30 0.00 0.00 52.55 48.57 2qfy s ASP 144 Cb -0.15 -0.12 0.03 0.00 -1.09 0.00 0.00 42.92 41.59 2qfy s ASP 144 CO -0.02 0.03 0.42 0.28 0.70 0.00 0.00 175.17 176.58 2qfy s THR 145 N -1.05 0.06 -0.02 2.11 -1.32 0.25 -4.98 115.64 110.68 2qfy s THR 145 Ca 0.03 -0.77 -0.15 0.00 -1.21 0.00 0.00 61.69 59.60 2qfy s THR 145 Cb -0.09 -1.40 -0.06 0.00 -1.51 0.00 0.00 72.50 69.45 2qfy s THR 145 CO 0.03 -0.26 0.40 -0.76 -2.21 0.00 0.00 174.62 171.82 2qfy s LEU 146 N -2.85 4.45 -0.33 9.08 1.43 -1.26 -1.42 118.68 127.78 2qfy s LEU 146 Ca 0.07 0.93 -0.10 0.00 -1.03 0.00 0.00 54.13 54.00 2qfy s LEU 146 Cb 0.01 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.66 2qfy s LEU 146 CO -0.07 0.30 0.17 -0.63 0.23 0.00 0.00 176.35 176.34 2qfy s ILE 147 N -0.91 4.58 0.16 -0.59 -1.09 0.90 -4.95 121.20 119.29 2qfy s ILE 147 Ca 0.23 -0.57 -0.16 0.00 -2.23 0.00 0.00 60.65 57.92 2qfy s ILE 147 Cb -0.16 -3.41 0.02 0.00 -1.58 0.00 0.00 42.46 37.33 2qfy s ILE 147 CO 0.13 -0.03 1.76 1.55 -1.23 0.00 0.00 174.94 177.11 2qfy h PRO 148 N 8.38 0.31 0.00 2.79 0.13 -1.91 0.58 132.00 142.28 2qfy h PRO 148 Ca -0.30 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2qfy h PRO 148 Cb 1.13 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.19 2qfy h PRO 148 CO 0.63 0.21 0.00 0.41 -0.23 0.00 0.00 178.00 179.02 2qfy n GLY 149 N -1.22 2.35 3.49 1.56 0.00 -1.26 -4.14 105.19 105.97 2qfy n GLY 149 Ca 0.01 -0.92 -0.39 0.00 0.00 0.00 0.00 46.02 44.72 2qfy n GLY 149 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2qfy n PRO 150 N 0.00 0.64 0.00 1.61 -0.02 -1.25 -4.68 135.00 131.29 2qfy n PRO 150 Ca 0.00 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 2qfy n PRO 150 Cb 0.00 -1.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 2qfy n PRO 150 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qfy n GLY 151 N 1.69 1.09 3.92 -1.23 0.00 -0.89 -4.93 105.19 104.83 2qfy n GLY 151 Ca 0.11 -1.26 -0.31 0.00 0.00 0.00 0.00 46.02 44.56 2qfy n GLY 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qfy s SER 152 N 0.00 6.39 -0.08 1.61 1.04 -1.26 -0.02 113.70 121.38 2qfy s SER 152 Ca 0.00 0.34 0.01 0.00 0.48 0.00 0.00 55.95 56.78 2qfy s SER 152 Cb 0.00 -1.99 0.02 0.00 0.10 0.00 0.00 66.02 64.15 2qfy s SER 152 CO 0.00 0.13 -0.09 -0.22 0.98 0.00 0.00 173.24 174.04 2qfy s LEU 153 N -2.61 1.35 0.12 2.42 1.98 0.05 -4.95 118.68 117.04 2qfy s LEU 153 Ca 0.36 -0.27 0.03 0.00 -2.89 0.00 0.00 54.13 51.37 2qfy s LEU 153 Cb -0.13 -0.76 -0.04 0.00 0.66 0.00 0.00 46.19 45.92 2qfy s LEU 153 CO 0.27 -0.06 -0.08 -1.61 -1.89 0.00 0.00 176.35 172.98 2qfy s GLU 154 N 1.22 0.92 -0.34 1.98 2.02 -1.26 0.03 118.70 123.28 2qfy s GLU 154 Ca -0.05 -1.37 -0.08 0.00 0.02 0.00 0.00 54.97 53.50 2qfy s GLU 154 Cb -0.14 -0.38 0.03 0.00 0.10 0.00 0.00 34.13 33.73 2qfy s GLU 154 CO -0.02 0.02 0.13 -0.51 0.02 0.00 0.00 175.26 174.90 2qfy s LEU 155 N -3.05 4.30 -0.22 1.80 1.43 0.32 -4.88 118.68 118.38 2qfy s LEU 155 Ca 0.13 -0.96 -0.07 0.00 -1.03 0.00 0.00 54.13 52.20 2qfy s LEU 155 Cb 0.04 -1.92 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 2qfy s LEU 155 CO -0.02 -0.30 0.05 -0.69 0.23 0.00 0.00 176.35 175.61 2qfy s VAL 156 N 1.48 4.32 -0.24 -1.59 1.01 -1.26 -1.86 120.40 122.25 2qfy s VAL 156 Ca 0.01 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 61.83 2qfy s VAL 156 Cb -0.19 -2.99 0.05 0.00 0.00 0.00 0.00 36.38 33.26 2qfy s VAL 156 CO 0.04 0.39 -0.12 -0.47 0.00 0.00 0.00 175.10 174.94 2qfy s TYR 157 N 1.15 3.16 -0.48 5.22 5.04 0.49 -4.98 117.35 126.95 2qfy s TYR 157 Ca 0.04 -2.13 -0.10 0.00 -2.44 0.00 0.00 57.07 52.44 2qfy s TYR 157 Cb -0.14 -1.94 0.12 0.00 0.35 0.00 0.00 41.96 40.35 2qfy s TYR 157 CO 0.03 -0.85 0.37 0.15 -1.34 0.00 0.00 175.55 173.91 2qfy s LYS 158 N 1.16 2.56 0.00 4.97 1.02 -1.26 -1.47 119.74 126.72 2qfy s LYS 158 Ca -0.05 -1.76 0.00 0.00 0.02 0.00 0.00 55.97 54.17 2qfy s LYS 158 Cb -0.18 -3.99 0.00 0.00 -0.52 0.00 0.00 37.83 33.14 2qfy s LYS 158 CO -0.06 -1.22 0.40 -0.35 -0.92 0.00 0.00 175.35 173.20 2qfy n PRO 159 N 4.96 0.00 -0.68 -1.68 -0.04 -1.26 -4.73 135.00 131.57 2qfy n PRO 159 Ca -0.09 0.08 -0.03 0.00 -0.04 0.00 0.00 63.50 63.43 2qfy n PRO 159 Cb 0.41 -1.64 -0.01 0.00 -0.04 0.00 0.00 33.50 32.21 2qfy n PRO 159 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2qfy n SER 160 N -0.90 -2.77 -2.73 3.54 3.41 -1.26 -4.64 113.62 108.27 2qfy n SER 160 Ca 0.00 0.06 -0.06 0.00 -0.26 0.00 0.00 58.87 58.61 2qfy n SER 160 Cb 0.14 -2.08 0.04 0.00 -0.26 0.00 0.00 64.21 62.06 2qfy n SER 160 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2qfy n ASP 161 N 0.80 -2.67 -1.06 4.04 2.03 -1.26 -5.03 116.55 113.39 2qfy n ASP 161 Ca -0.03 -2.81 0.00 0.00 0.52 0.00 0.00 54.79 52.47 2qfy n ASP 161 Cb 0.26 1.56 0.00 0.00 -0.72 0.00 0.00 41.12 42.22 2qfy n ASP 161 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 2qfy n PRO 162 N 1.99 0.00 -0.03 -0.67 -0.02 -1.26 -2.69 135.00 132.31 2qfy n PRO 162 Ca 0.10 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.53 2qfy n PRO 162 Cb 0.63 -1.43 -0.02 0.00 -0.02 0.00 0.00 33.50 32.65 2qfy n PRO 162 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2qfy n THR 163 N 0.99 0.31 -0.01 3.45 -1.04 -1.26 -4.83 114.28 111.90 2qfy n THR 163 Ca 0.00 -0.10 -0.20 0.00 -2.04 0.00 0.00 64.05 61.70 2qfy n THR 163 Cb 0.00 -1.07 -0.14 0.00 -1.82 0.00 0.00 70.33 67.30 2qfy n THR 163 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 2qfy h THR 164 N -0.09 1.22 -2.86 12.58 1.35 -1.93 -3.48 112.91 119.69 2qfy h THR 164 Ca -0.13 -2.40 -0.48 0.00 -0.55 0.00 0.00 66.41 62.85 2qfy h THR 164 Cb 1.16 2.84 -0.14 0.00 -1.73 0.00 0.00 68.15 70.29 2qfy h THR 164 CO -0.05 0.65 -0.59 0.00 -0.25 0.00 0.00 175.52 175.28 2qfy s ALA 165 N -2.42 2.42 0.38 6.62 0.00 -1.25 -5.17 121.76 122.34 2qfy s ALA 165 Ca -0.19 -1.88 0.08 0.00 0.00 0.00 0.00 51.96 49.96 2qfy s ALA 165 Cb 0.03 0.71 -0.02 0.00 0.00 0.00 0.00 23.12 23.84 2qfy s ALA 165 CO 0.75 -0.33 0.38 -0.65 0.00 0.00 0.00 175.76 175.91 2qfy s GLN 166 N -3.88 2.68 0.70 0.00 -0.21 -1.26 -4.44 119.66 113.25 2qfy s GLN 166 Ca 0.34 -1.38 -0.07 0.00 0.02 0.00 0.00 55.36 54.27 2qfy s GLN 166 Cb 0.08 -2.49 0.06 0.00 1.00 0.00 0.00 33.01 31.65 2qfy s GLN 166 CO 0.15 -0.08 1.03 -1.25 -2.12 0.00 0.00 175.29 173.02 2qfy s PRO 167 N -4.11 2.28 -0.01 2.91 0.04 -1.26 -4.60 135.00 130.24 2qfy s PRO 167 Ca 0.46 -0.15 0.00 0.00 0.04 0.00 0.00 61.00 61.35 2qfy s PRO 167 Cb -0.05 -2.15 0.02 0.00 0.04 0.00 0.00 34.50 32.36 2qfy s PRO 167 CO 0.28 -1.21 0.01 -0.65 0.04 0.00 0.00 177.00 175.47 2qfy s GLN 168 N -5.26 0.07 -0.50 4.56 -0.21 -0.54 -4.97 119.66 112.80 2qfy s GLN 168 Ca 0.60 0.08 0.05 0.00 0.02 0.00 0.00 55.36 56.11 2qfy s GLN 168 Cb -0.11 -0.22 0.19 0.00 1.00 0.00 0.00 33.01 33.87 2qfy s GLN 168 CO 0.46 -0.09 0.43 2.41 -2.12 0.00 0.00 175.29 176.38 2qfy n THR 169 N 3.74 -0.18 -2.90 -0.19 -1.04 -1.25 -0.38 114.28 112.07 2qfy n THR 169 Ca -0.22 -3.99 -0.41 0.00 -2.04 0.00 0.00 64.05 57.39 2qfy n THR 169 Cb 0.54 -1.86 -0.04 0.00 -1.82 0.00 0.00 70.33 67.15 2qfy n THR 169 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2qfy s LEU 170 N -0.68 4.33 -0.17 -4.42 1.43 -0.78 -4.87 118.68 113.53 2qfy s LEU 170 Ca 0.32 1.38 -0.29 0.00 -1.03 0.00 0.00 54.13 54.50 2qfy s LEU 170 Cb 0.05 -3.29 -0.00 0.00 0.03 0.00 0.00 46.19 42.98 2qfy s LEU 170 CO -0.17 -0.19 1.02 -0.75 0.23 0.00 0.00 176.35 176.50 2qfy s LYS 171 N 0.96 4.34 -0.12 1.70 2.20 -1.26 -0.52 119.74 127.04 2qfy s LYS 171 Ca 0.43 1.38 -0.17 0.00 -0.36 0.00 0.00 55.97 57.25 2qfy s LYS 171 Cb -0.19 -3.59 -0.26 0.00 -1.51 0.00 0.00 37.83 32.28 2qfy s LYS 171 CO 0.22 -0.47 0.52 0.28 -0.36 0.00 0.00 175.35 175.54 2qfy h VAL 172 N 5.27 1.04 -1.37 4.02 2.07 -0.74 -3.48 116.25 123.06 2qfy h VAL 172 Ca -0.25 -2.37 0.21 0.00 0.82 0.00 0.00 66.70 65.11 2qfy h VAL 172 Cb 1.10 2.69 -0.23 0.00 -1.52 0.00 0.00 31.29 33.33 2qfy h VAL 172 CO 0.92 0.66 0.79 -0.47 0.02 0.00 0.00 177.57 179.49 2qfy s TYR 173 N -2.45 -0.16 -0.30 1.57 5.04 -1.08 -5.02 117.35 114.95 2qfy s TYR 173 Ca -0.21 0.20 -0.02 0.00 -2.44 0.00 0.00 57.07 54.61 2qfy s TYR 173 Cb 0.04 0.49 0.05 0.00 0.35 0.00 0.00 41.96 42.90 2qfy s TYR 173 CO 0.74 -0.18 -0.00 -0.51 -1.34 0.00 0.00 175.55 174.26 2qfy s ASP 174 N -1.54 4.89 0.39 4.32 1.11 -1.26 -0.77 116.67 123.81 2qfy s ASP 174 Ca 0.07 -1.28 -0.25 0.00 0.18 0.00 0.00 52.55 51.27 2qfy s ASP 174 Cb -0.01 -1.71 -0.09 0.00 1.07 0.00 0.00 42.92 42.18 2qfy s ASP 174 CO -0.04 -0.26 1.08 -0.31 1.18 0.00 0.00 175.17 176.82 2qfy s TYR 175 N 1.25 3.23 -0.16 4.23 1.51 0.97 -4.88 117.35 123.50 2qfy s TYR 175 Ca -0.05 1.63 0.01 0.00 -1.01 0.00 0.00 57.07 57.65 2qfy s TYR 175 Cb -0.20 -3.21 0.02 0.00 -0.11 0.00 0.00 41.96 38.46 2qfy s TYR 175 CO -0.01 -0.81 0.66 1.63 -1.11 0.00 0.00 175.55 175.91 2qfy n LYS 176 N 0.02 0.07 -2.61 -0.62 5.02 -1.26 -2.09 118.16 116.69 2qfy n LYS 176 Ca 0.05 -0.81 -0.04 0.00 -2.02 0.00 0.00 58.31 55.48 2qfy n LYS 176 Cb 0.49 -1.03 0.02 0.00 -0.02 0.00 0.00 35.03 34.48 2qfy n LYS 176 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qfy n GLY 177 N -0.02 1.31 3.82 0.72 0.00 -1.26 -4.62 105.19 105.13 2qfy n GLY 177 Ca 0.01 -1.13 -0.33 0.00 0.00 0.00 0.00 46.02 44.58 2qfy n GLY 177 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qfy s SER 178 N -2.21 6.36 0.00 1.61 1.04 -1.26 -3.97 113.70 115.27 2qfy s SER 178 Ca 0.10 1.73 0.00 0.00 0.48 0.00 0.00 55.95 58.26 2qfy s SER 178 Cb -0.03 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.56 2qfy s SER 178 CO 0.06 -0.77 0.00 0.61 0.98 0.00 0.00 173.24 174.12 2qfy n GLY 179 N -1.01 1.99 3.14 7.32 0.00 0.19 -4.99 105.19 111.84 2qfy n GLY 179 Ca 0.08 -0.39 -0.11 0.00 0.00 0.00 0.00 46.02 45.61 2qfy n GLY 179 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qfy s VAL 180 N -1.20 0.60 0.01 1.61 -7.23 -1.26 -0.07 120.40 112.86 2qfy s VAL 180 Ca 0.00 -1.75 -0.16 0.00 -1.81 0.00 0.00 61.98 58.26 2qfy s VAL 180 Cb 0.00 -1.45 0.03 0.00 0.56 0.00 0.00 36.38 35.52 2qfy s VAL 180 CO 0.00 -0.80 0.34 0.00 -0.31 0.00 0.00 175.10 174.34 2qfy s ALA 181 N -3.22 -0.83 0.05 1.32 0.00 -0.50 -4.87 121.76 113.70 2qfy s ALA 181 Ca 0.07 0.27 -0.24 0.00 0.00 0.00 0.00 51.96 52.06 2qfy s ALA 181 Cb 0.03 0.19 0.06 0.00 0.00 0.00 0.00 23.12 23.39 2qfy s ALA 181 CO -0.04 -0.34 0.57 0.00 0.00 0.00 0.00 175.76 175.94 2qfy s MET 182 N -1.88 1.10 0.01 0.00 0.23 -1.26 -0.59 119.30 116.92 2qfy s MET 182 Ca -0.10 -0.19 0.01 0.00 -1.03 0.00 0.00 55.69 54.38 2qfy s MET 182 Cb -0.03 0.51 -0.01 0.00 -1.53 0.00 0.00 34.83 33.77 2qfy s MET 182 CO 0.01 -0.41 -0.03 0.00 -2.03 0.00 0.00 175.02 172.57 2qfy s ALA 183 N -2.51 0.19 0.25 3.16 0.00 0.21 -4.98 121.76 118.08 2qfy s ALA 183 Ca -0.05 -0.26 0.01 0.00 0.00 0.00 0.00 51.96 51.66 2qfy s ALA 183 Cb -0.01 0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 2qfy s ALA 183 CO -0.02 -0.01 0.13 0.00 0.00 0.00 0.00 175.76 175.86 2qfy s MET 184 N -0.52 1.37 0.34 0.00 0.23 -1.26 -1.07 119.30 118.40 2qfy s MET 184 Ca -0.04 -1.75 -0.05 0.00 -1.03 0.00 0.00 55.69 52.82 2qfy s MET 184 Cb -0.04 0.00 0.01 0.00 -1.53 0.00 0.00 34.83 33.28 2qfy s MET 184 CO -0.00 -0.37 0.52 1.52 -2.03 0.00 0.00 175.02 174.65 2qfy s TYR 185 N -3.88 0.86 0.09 3.16 -0.85 -1.26 -4.95 117.35 110.51 2qfy s TYR 185 Ca 0.38 -1.17 -0.27 0.00 -0.52 0.00 0.00 57.07 55.50 2qfy s TYR 185 Cb 0.07 0.08 0.08 0.00 0.38 0.00 0.00 41.96 42.57 2qfy s TYR 185 CO 0.14 -1.18 0.96 1.21 -1.52 0.00 0.00 175.55 175.16 2qfy s ASN 186 N -3.19 -0.23 0.13 -0.18 3.84 -1.26 -0.58 114.94 113.47 2qfy s ASN 186 Ca 0.28 -0.25 0.09 0.00 0.21 0.00 0.00 52.86 53.18 2qfy s ASN 186 Cb -0.01 0.43 -0.04 0.00 -0.55 0.00 0.00 41.25 41.08 2qfy s ASN 186 CO 0.18 -0.76 -0.20 0.42 -2.79 0.00 0.00 177.10 173.95 2qfy s THR 187 N -3.16 1.80 0.30 -5.21 -4.23 -1.26 -5.02 115.64 98.86 2qfy s THR 187 Ca 0.10 -1.71 -0.02 0.00 -1.18 0.00 0.00 61.69 58.88 2qfy s THR 187 Cb -0.01 -1.71 0.25 0.00 1.34 0.00 0.00 72.50 72.38 2qfy s THR 187 CO -0.02 -0.15 1.96 0.44 -0.54 0.00 0.00 174.62 176.30 2qfy h ASP 188 N 3.72 0.91 0.04 3.99 5.19 -2.00 -0.34 116.42 127.92 2qfy h ASP 188 Ca -0.45 -0.04 0.02 0.00 -0.62 0.00 0.00 57.03 55.94 2qfy h ASP 188 Cb 1.19 -0.23 -0.03 0.00 0.18 0.00 0.00 39.33 40.45 2qfy h ASP 188 CO 0.44 0.68 -0.15 -0.08 -3.12 0.00 0.00 179.24 177.02 2qfy h GLU 189 N 1.07 -0.25 -0.73 3.56 4.81 -1.99 0.23 114.58 121.27 2qfy h GLU 189 Ca 0.28 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.48 2qfy h GLU 189 Cb -0.08 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.32 2qfy h GLU 189 CO -0.06 -0.17 0.24 1.03 -0.73 0.00 0.00 179.01 179.33 2qfy h SER 190 N -0.26 1.05 -0.51 1.04 0.87 -1.84 -1.90 113.55 112.00 2qfy h SER 190 Ca 0.04 -0.20 -0.07 0.00 -1.23 0.00 0.00 61.79 60.33 2qfy h SER 190 Cb 0.30 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.96 2qfy h SER 190 CO -0.12 0.97 0.08 0.40 -0.53 0.00 0.00 176.83 177.64 2qfy h ILE 191 N 1.08 1.24 -0.32 2.23 2.04 -0.67 -0.25 117.51 122.85 2qfy h ILE 191 Ca 0.24 -0.95 -0.04 0.00 1.00 0.00 0.00 64.86 65.11 2qfy h ILE 191 Cb 0.29 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 2qfy h ILE 191 CO -0.01 0.35 0.06 -0.33 0.00 0.00 0.00 178.15 178.22 2qfy h GLU 192 N 0.86 0.53 -0.77 2.37 5.08 -0.19 -0.68 114.58 121.77 2qfy h GLU 192 Ca 0.18 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2qfy h GLU 192 Cb 0.39 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.54 2qfy h GLU 192 CO 0.01 0.61 0.48 0.78 -1.00 0.00 0.00 179.01 179.89 2qfy h GLY 193 N 0.36 1.11 0.81 -3.84 0.00 -1.10 0.30 103.07 100.72 2qfy h GLY 193 Ca 0.10 -0.44 0.03 0.00 0.00 0.00 0.00 47.33 47.02 2qfy h GLY 193 CO 0.00 0.43 0.19 -2.75 0.00 0.00 0.00 176.54 174.41 2qfy h PHE 194 N 1.06 0.35 0.20 5.60 -0.00 -0.45 -1.96 116.94 121.75 2qfy h PHE 194 Ca 0.28 0.02 -0.01 0.00 -0.00 0.00 0.00 57.97 58.26 2qfy h PHE 194 Cb -0.07 -0.10 0.00 0.00 -0.00 0.00 0.00 35.95 35.78 2qfy h PHE 194 CO 0.00 0.19 -0.10 0.00 -0.00 0.00 0.00 178.31 178.40 2qfy h ALA 195 N 1.20 -0.27 -0.58 2.41 0.00 -0.22 -2.42 119.26 119.38 2qfy h ALA 195 Ca 0.16 -0.15 0.12 0.00 0.00 0.00 0.00 54.91 55.04 2qfy h ALA 195 Cb 0.07 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 17.86 2qfy h ALA 195 CO -0.11 -0.54 -0.06 0.45 0.00 0.00 0.00 179.25 179.00 2qfy h HIS 196 N -0.51 -0.14 -0.53 0.00 3.86 -0.81 -0.15 115.15 116.88 2qfy h HIS 196 Ca -0.03 0.05 -0.09 0.00 -1.16 0.00 0.00 60.37 59.14 2qfy h HIS 196 Cb 0.38 0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.98 2qfy h HIS 196 CO 0.00 -0.19 -0.03 0.77 0.86 0.00 0.00 177.93 179.34 2qfy h SER 197 N 0.07 0.90 0.12 2.45 0.02 -1.38 -1.79 113.55 113.93 2qfy h SER 197 Ca 0.29 -0.25 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 2qfy h SER 197 Cb 0.46 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.76 2qfy h SER 197 CO -0.53 0.98 -0.06 0.28 -1.14 0.00 0.00 176.83 176.36 2qfy h SER 198 N 0.84 -0.13 -0.04 3.07 0.02 -0.73 -1.84 113.55 114.74 2qfy h SER 198 Ca 0.15 -0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2qfy h SER 198 Cb 0.54 0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.11 2qfy h SER 198 CO 0.03 0.06 0.02 -0.26 -1.14 0.00 0.00 176.83 175.54 2qfy h PHE 199 N -0.32 0.05 -0.52 3.45 0.04 -1.03 -1.19 116.94 117.42 2qfy h PHE 199 Ca -0.02 0.00 0.09 0.00 2.80 0.00 0.00 57.97 60.85 2qfy h PHE 199 Cb 0.26 -0.02 -0.07 0.00 2.20 0.00 0.00 35.95 38.32 2qfy h PHE 199 CO -0.02 0.07 0.10 0.87 -0.60 0.00 0.00 178.31 178.73 2qfy h LYS 200 N 0.02 0.22 -0.65 1.51 1.57 -1.31 0.90 116.57 118.83 2qfy h LYS 200 Ca 0.01 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2qfy h LYS 200 Cb 0.03 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.26 2qfy h LYS 200 CO -0.00 0.15 0.33 1.25 -0.57 0.00 0.00 179.45 180.60 2qfy h LEU 201 N 0.23 0.84 -0.39 2.94 7.12 -1.13 0.23 115.31 125.14 2qfy h LEU 201 Ca 0.26 -0.12 0.06 0.00 0.13 0.00 0.00 57.88 58.21 2qfy h LEU 201 Cb 0.37 -0.21 -0.05 0.00 -0.53 0.00 0.00 40.66 40.23 2qfy h LEU 201 CO -0.35 0.72 0.09 0.00 -0.13 0.00 0.00 178.44 178.76 2qfy h ALA 202 N 1.15 0.42 0.90 1.25 0.00 0.08 0.15 119.26 123.22 2qfy h ALA 202 Ca 0.23 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 2qfy h ALA 202 Cb 0.09 0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.98 2qfy h ALA 202 CO -0.03 -0.31 -0.43 0.82 0.00 0.00 0.00 179.25 179.29 2qfy h ILE 203 N 0.22 0.00 -1.00 0.00 2.04 -0.30 0.42 117.51 118.89 2qfy h ILE 203 Ca 0.19 -0.09 0.28 0.00 1.00 0.00 0.00 64.86 66.24 2qfy h ILE 203 Cb 0.21 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.15 2qfy h ILE 203 CO -0.23 0.00 0.58 -0.78 0.00 0.00 0.00 178.15 177.71 2qfy h ASP 204 N -1.30 0.59 0.04 1.72 3.58 -0.28 0.13 116.42 120.90 2qfy h ASP 204 Ca -0.12 0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.49 2qfy h ASP 204 Cb 0.93 0.09 0.00 0.00 1.72 0.00 0.00 39.33 42.06 2qfy h ASP 204 CO 0.20 -0.02 -0.35 0.29 -2.88 0.00 0.00 179.24 176.49 2qfy n LYS 205 N -4.97 1.27 -3.56 0.28 5.02 0.50 -4.99 118.16 111.70 2qfy n LYS 205 Ca 0.29 -0.98 -0.24 0.00 -2.02 0.00 0.00 58.31 55.36 2qfy n LYS 205 Cb 0.86 -1.48 0.05 0.00 -0.02 0.00 0.00 35.03 34.44 2qfy n LYS 205 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2qfy n LYS 206 N -0.01 -2.50 -4.14 1.97 5.02 0.14 -5.02 118.16 113.62 2qfy n LYS 206 Ca 0.11 0.62 -0.15 0.00 -2.02 0.00 0.00 58.31 56.87 2qfy n LYS 206 Cb 0.45 -4.90 -0.11 0.00 -0.02 0.00 0.00 35.03 30.44 2qfy n LYS 206 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2qfy s LEU 207 N -6.21 2.33 0.36 -0.35 1.43 -0.61 -5.01 118.68 110.62 2qfy s LEU 207 Ca 0.35 -0.69 -0.27 0.00 -1.03 0.00 0.00 54.13 52.49 2qfy s LEU 207 Cb -0.09 -0.32 -0.09 0.00 0.03 0.00 0.00 46.19 45.72 2qfy s LEU 207 CO 0.81 -0.20 1.18 0.20 0.23 0.00 0.00 176.35 178.58 2qfy s ASN 208 N -2.01 6.75 -0.16 2.29 0.01 -1.26 -4.67 114.94 115.89 2qfy s ASN 208 Ca -0.01 2.39 -0.04 0.00 -0.71 0.00 0.00 52.86 54.49 2qfy s ASN 208 Cb -0.07 -2.62 -0.03 0.00 0.41 0.00 0.00 41.25 38.94 2qfy s ASN 208 CO 0.01 -0.52 -0.03 -0.22 -1.51 0.00 0.00 177.10 174.83 2qfy s LEU 209 N -2.11 3.27 -0.18 0.60 1.98 -0.28 -1.08 118.68 120.88 2qfy s LEU 209 Ca 0.52 -0.13 0.01 0.00 -2.89 0.00 0.00 54.13 51.64 2qfy s LEU 209 Cb -0.33 -1.79 0.03 0.00 0.66 0.00 0.00 46.19 44.76 2qfy s LEU 209 CO 0.42 0.16 -0.16 -0.36 -1.89 0.00 0.00 176.35 174.51 2qfy s PHE 210 N 0.44 2.56 -0.26 5.38 0.40 -0.22 -1.43 117.98 124.85 2qfy s PHE 210 Ca -0.03 -1.55 -0.12 0.00 -0.60 0.00 0.00 56.93 54.64 2qfy s PHE 210 Cb -0.14 -1.78 -0.05 0.00 0.51 0.00 0.00 43.02 41.57 2qfy s PHE 210 CO 0.03 -0.76 0.21 -1.17 0.70 0.00 0.00 175.22 174.23 2qfy s LEU 211 N 1.36 4.07 -0.11 -0.37 1.98 -0.66 -0.05 118.68 124.89 2qfy s LEU 211 Ca 0.03 0.10 -0.01 0.00 -2.89 0.00 0.00 54.13 51.36 2qfy s LEU 211 Cb -0.14 -2.17 -0.03 0.00 0.66 0.00 0.00 46.19 44.51 2qfy s LEU 211 CO -0.11 -0.02 -0.05 -0.44 -1.89 0.00 0.00 176.35 173.84 2qfy s SER 212 N 1.43 4.75 0.32 3.68 0.01 -0.90 0.05 113.70 123.05 2qfy s SER 212 Ca 0.09 -0.06 -0.01 0.00 1.31 0.00 0.00 55.95 57.28 2qfy s SER 212 Cb -0.15 -1.48 -0.01 0.00 0.21 0.00 0.00 66.02 64.59 2qfy s SER 212 CO 0.08 0.28 0.40 0.28 0.41 0.00 0.00 173.24 174.69 2qfy s THR 213 N -0.28 0.00 -0.40 1.44 -1.32 -0.71 -4.45 115.64 109.92 2qfy s THR 213 Ca 0.04 -1.71 0.06 0.00 -1.21 0.00 0.00 61.69 58.87 2qfy s THR 213 Cb -0.13 -2.57 0.43 0.00 -1.51 0.00 0.00 72.50 68.72 2qfy s THR 213 CO 0.02 0.00 1.13 1.17 -2.21 0.00 0.00 174.62 174.73 2qfy n LYS 214 N -0.55 3.39 0.00 7.08 3.00 -1.26 -0.25 118.16 129.58 2qfy n LYS 214 Ca 0.02 -4.38 0.03 0.00 -0.00 0.00 0.00 58.31 53.99 2qfy n LYS 214 Cb 0.62 -2.22 0.15 0.00 0.00 0.00 0.00 35.03 33.58 2qfy n LYS 214 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 2qfy n ASN 215 N -0.53 0.00 0.08 3.14 6.94 -1.26 -1.27 115.26 122.37 2qfy n ASN 215 Ca 0.39 0.41 -0.08 0.00 -0.02 0.00 0.00 54.58 55.28 2qfy n ASN 215 Cb 0.74 -0.44 0.03 0.00 -2.36 0.00 0.00 39.78 37.76 2qfy n ASN 215 CO 0.00 0.00 0.00 0.71 -1.03 0.00 0.00 177.26 176.94 2qfy h THR 216 N 0.00 1.47 0.02 5.53 1.35 -1.96 -3.13 112.91 116.19 2qfy h THR 216 Ca 0.00 -2.45 -0.39 0.00 -0.55 0.00 0.00 66.41 63.02 2qfy h THR 216 Cb 0.10 2.34 -0.06 0.00 -1.73 0.00 0.00 68.15 68.79 2qfy h THR 216 CO 0.00 0.72 -2.40 -0.38 -0.25 0.00 0.00 175.52 173.21 2qfy n ILE 217 N -3.72 1.54 -3.36 6.82 2.08 -0.52 -4.63 119.36 117.57 2qfy n ILE 217 Ca -0.03 -0.55 -0.35 0.00 0.56 0.00 0.00 62.75 62.38 2qfy n ILE 217 Cb 0.75 -1.53 -0.05 0.00 -0.75 0.00 0.00 39.64 38.06 2qfy n ILE 217 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 2qfy n LEU 218 N -3.44 4.73 -0.30 1.39 4.77 -0.39 -4.92 117.00 118.85 2qfy n LEU 218 Ca -0.45 -5.28 0.10 0.00 -0.03 0.00 0.00 56.01 50.35 2qfy n LEU 218 Cb 0.98 -0.99 0.33 0.00 -2.33 0.00 0.00 43.42 41.41 2qfy n LEU 218 CO 0.25 1.79 1.22 0.11 -1.33 0.00 0.00 177.39 179.44 2qfy h LYS 219 N 5.12 0.77 0.03 3.23 1.57 -1.80 -1.28 116.57 124.22 2qfy h LYS 219 Ca 0.19 -0.05 -0.23 0.00 -1.87 0.00 0.00 60.65 58.69 2qfy h LYS 219 Cb 0.69 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.80 2qfy h LYS 219 CO 1.00 0.51 -1.26 0.87 -0.57 0.00 0.00 179.45 180.00 2qfy h LYS 220 N 0.80 0.06 0.64 3.15 1.57 -1.91 -2.90 116.57 117.97 2qfy h LYS 220 Ca 0.46 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 59.11 2qfy h LYS 220 Cb 0.63 0.04 0.01 0.00 0.08 0.00 0.00 32.23 32.98 2qfy h LYS 220 CO -0.22 1.05 -0.31 -0.92 -0.57 0.00 0.00 179.45 178.47 2qfy h TYR 221 N -0.80 -0.80 0.00 -1.35 5.03 -1.98 -2.34 116.97 114.73 2qfy h TYR 221 Ca -0.33 -0.02 -0.07 0.00 2.58 0.00 0.00 58.73 60.90 2qfy h TYR 221 Cb 1.41 0.27 -0.01 0.00 1.55 0.00 0.00 36.73 39.95 2qfy h TYR 221 CO 0.11 -0.50 -0.32 -0.44 -1.32 0.00 0.00 178.16 175.70 2qfy h ASP 222 N -0.98 0.00 0.49 -2.11 5.19 -1.47 -2.50 116.42 115.03 2qfy h ASP 222 Ca -0.09 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.27 2qfy h ASP 222 Cb 0.66 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.17 2qfy h ASP 222 CO 0.15 0.32 -0.23 1.23 -3.12 0.00 0.00 179.24 177.58 2qfy h GLY 223 N 1.64 0.00 0.95 2.75 0.00 -1.45 -2.48 103.07 104.49 2qfy h GLY 223 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.27 2qfy h GLY 223 CO 0.04 0.00 0.06 -0.09 0.00 0.00 0.00 176.54 176.55 2qfy h ARG 224 N 0.00 0.72 -0.01 4.80 9.65 -0.94 -0.52 114.38 128.08 2qfy h ARG 224 Ca -0.00 -0.20 -0.00 0.00 -1.10 0.00 0.00 59.98 58.68 2qfy h ARG 224 Cb 0.53 -0.08 -0.00 0.00 -1.39 0.00 0.00 29.97 29.03 2qfy h ARG 224 CO 0.03 0.76 0.00 0.74 2.80 0.00 0.00 179.97 184.30 2qfy h PHE 225 N 0.57 0.01 -0.26 2.20 -1.00 -1.52 -0.47 116.94 116.46 2qfy h PHE 225 Ca 0.13 -0.00 0.05 0.00 2.81 0.00 0.00 57.97 60.96 2qfy h PHE 225 Cb 0.40 -0.00 -0.05 0.00 3.61 0.00 0.00 35.95 39.91 2qfy h PHE 225 CO 0.03 0.08 -0.04 -0.22 -1.61 0.00 0.00 178.31 176.55 2qfy h LYS 226 N -0.07 0.03 0.13 1.51 3.64 -1.33 -0.68 116.57 119.82 2qfy h LYS 226 Ca 0.00 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2qfy h LYS 226 Cb 0.07 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 2qfy h LYS 226 CO -0.00 0.02 -0.06 -0.44 -2.27 0.00 0.00 179.45 176.70 2qfy h ASP 227 N 0.04 -0.15 -0.61 4.20 3.32 -0.98 -1.84 116.42 120.40 2qfy h ASP 227 Ca 0.13 -0.19 0.07 0.00 0.02 0.00 0.00 57.03 57.05 2qfy h ASP 227 Cb 0.18 0.04 -0.06 0.00 0.22 0.00 0.00 39.33 39.71 2qfy h ASP 227 CO -0.24 0.11 0.29 0.40 -1.72 0.00 0.00 179.24 178.07 2qfy h ILE 228 N -0.42 0.88 -0.79 0.35 2.04 -1.00 0.71 117.51 119.28 2qfy h ILE 228 Ca -0.02 -0.18 0.03 0.00 1.00 0.00 0.00 64.86 65.69 2qfy h ILE 228 Cb 0.34 0.31 -0.05 0.00 -0.74 0.00 0.00 36.82 36.68 2qfy h ILE 228 CO 0.03 0.10 0.51 -0.26 0.00 0.00 0.00 178.15 178.53 2qfy h PHE 229 N 0.53 0.96 -0.17 1.37 -1.00 -1.05 -0.96 116.94 116.62 2qfy h PHE 229 Ca 0.29 0.02 -0.02 0.00 2.81 0.00 0.00 57.97 61.07 2qfy h PHE 229 Cb 0.26 -0.32 -0.01 0.00 3.61 0.00 0.00 35.95 39.50 2qfy h PHE 229 CO -0.12 0.56 0.01 0.37 -1.61 0.00 0.00 178.31 177.53 2qfy h GLN 230 N 1.01 0.29 -0.28 1.51 5.75 -0.39 -0.97 115.11 122.02 2qfy h GLN 230 Ca 0.31 -0.09 0.04 0.00 -0.15 0.00 0.00 58.65 58.77 2qfy h GLN 230 Cb -0.02 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.46 2qfy h GLN 230 CO -0.10 0.48 0.05 0.93 -2.65 0.00 0.00 178.83 177.54 2qfy h GLU 231 N 0.06 0.15 -0.50 1.69 5.08 -0.62 -0.87 114.58 119.57 2qfy h GLU 231 Ca 0.05 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2qfy h GLU 231 Cb 0.34 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2qfy h GLU 231 CO 0.01 0.10 0.33 0.28 -1.00 0.00 0.00 179.01 178.73 2qfy h VAL 232 N 0.15 1.13 0.13 3.13 2.07 -1.14 0.24 116.25 121.97 2qfy h VAL 232 Ca 0.13 -0.24 0.02 0.00 0.82 0.00 0.00 66.70 67.43 2qfy h VAL 232 Cb 0.14 0.39 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 2qfy h VAL 232 CO -0.18 0.13 -0.37 0.22 0.02 0.00 0.00 177.57 177.39 2qfy h TYR 233 N 0.68 -1.03 -0.54 1.57 3.20 -0.53 -1.12 116.97 119.21 2qfy h TYR 233 Ca 0.18 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 2qfy h TYR 233 Cb -0.07 0.43 -0.02 0.00 1.54 0.00 0.00 36.73 38.61 2qfy h TYR 233 CO -0.04 -0.48 0.22 0.93 -1.64 0.00 0.00 178.16 177.15 2qfy h GLU 234 N -0.61 0.80 -0.63 1.82 5.08 -1.03 0.31 114.58 120.33 2qfy h GLU 234 Ca 0.03 -0.14 0.10 0.00 -1.00 0.00 0.00 59.36 58.34 2qfy h GLU 234 Cb 0.63 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.71 2qfy h GLU 234 CO -0.21 0.70 0.42 0.00 -1.00 0.00 0.00 179.01 178.91 2qfy h ALA 235 N 1.06 1.98 0.00 3.43 0.00 -0.07 -3.41 119.26 122.26 2qfy h ALA 235 Ca 0.18 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2qfy h ALA 235 Cb 0.19 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 2qfy h ALA 235 CO -0.02 -0.12 -0.14 0.00 0.00 0.00 0.00 179.25 178.98 2qfy n GLN 236 N -4.47 0.24 0.00 0.00 10.64 -0.46 -5.02 117.38 118.31 2qfy n GLN 236 Ca 0.10 -0.53 0.00 0.00 -1.83 0.00 0.00 57.00 54.74 2qfy n GLN 236 Cb 0.36 0.40 0.00 0.00 -0.86 0.00 0.00 30.24 30.14 2qfy n GLN 236 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 2qfy n TYR 237 N -0.28 0.00 -0.19 2.61 4.02 -0.23 -4.90 117.16 118.19 2qfy n TYR 237 Ca -0.12 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.73 2qfy n TYR 237 Cb 0.55 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.89 2qfy n TYR 237 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 2qfy h LYS 238 N 0.00 -0.12 0.06 -0.72 3.64 -0.72 -0.47 116.57 118.24 2qfy h LYS 238 Ca 0.00 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.41 2qfy h LYS 238 Cb 0.00 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 2qfy h LYS 238 CO 0.00 -0.08 -0.31 0.77 -2.27 0.00 0.00 179.45 177.56 2qfy h SER 239 N -0.13 -0.90 -0.52 4.20 0.02 -1.90 -2.04 113.55 112.29 2qfy h SER 239 Ca 0.25 0.11 0.07 0.00 -0.84 0.00 0.00 61.79 61.37 2qfy h SER 239 Cb 0.53 0.35 -0.06 0.00 0.14 0.00 0.00 62.40 63.36 2qfy h SER 239 CO -0.65 -0.38 0.22 0.50 -1.14 0.00 0.00 176.83 175.37 2qfy h LYS 240 N -0.49 0.40 -0.13 3.45 1.63 -1.72 0.21 116.57 119.92 2qfy h LYS 240 Ca 0.05 -0.02 0.04 0.00 -0.85 0.00 0.00 60.65 59.86 2qfy h LYS 240 Cb 0.55 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 32.05 2qfy h LYS 240 CO -0.22 0.27 -0.09 0.74 -3.45 0.00 0.00 179.45 176.69 2qfy h PHE 241 N 0.42 -0.23 -0.06 1.91 -1.00 -0.84 0.26 116.94 117.40 2qfy h PHE 241 Ca 0.25 0.02 -0.04 0.00 2.81 0.00 0.00 57.97 61.00 2qfy h PHE 241 Cb 0.24 0.12 -0.01 0.00 3.61 0.00 0.00 35.95 39.91 2qfy h PHE 241 CO -0.14 -0.15 -0.15 0.93 -1.61 0.00 0.00 178.31 177.19 2qfy h GLU 242 N -0.10 0.10 -0.05 1.51 5.08 -0.89 0.35 114.58 120.57 2qfy h GLU 242 Ca 0.08 -0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.31 2qfy h GLU 242 Cb 0.22 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2qfy h GLU 242 CO -0.19 0.26 -0.50 0.37 -1.00 0.00 0.00 179.01 177.95 2qfy h GLN 243 N 0.09 0.13 -0.00 2.33 -0.00 0.90 -3.03 115.11 115.53 2qfy h GLN 243 Ca 0.02 -0.07 0.00 0.00 -0.00 0.00 0.00 58.65 58.60 2qfy h GLN 243 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.82 2qfy h GLN 243 CO 0.02 0.60 -0.80 1.28 0.00 0.00 0.00 178.83 179.93 2qfy n LEU 244 N -3.95 0.83 -0.14 -2.39 4.77 0.76 -4.98 117.00 111.89 2qfy n LEU 244 Ca -0.02 -0.32 -0.00 0.00 -0.03 0.00 0.00 56.01 55.65 2qfy n LEU 244 Cb 0.53 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 2qfy n LEU 244 CO 0.42 0.20 -0.00 0.61 -1.33 0.00 0.00 177.39 177.29 2qfy n GLY 245 N 1.50 0.53 3.36 -0.72 0.00 0.11 -5.07 105.19 104.90 2qfy n GLY 245 Ca 0.05 -0.83 -0.21 0.00 0.00 0.00 0.00 46.02 45.02 2qfy n GLY 245 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2qfy s ILE 246 N -2.28 1.93 0.12 -0.61 -4.36 -0.28 -5.02 121.20 110.70 2qfy s ILE 246 Ca 0.00 -2.10 0.08 0.00 -0.26 0.00 0.00 60.65 58.37 2qfy s ILE 246 Cb -0.00 -2.00 -0.04 0.00 1.25 0.00 0.00 42.46 41.68 2qfy s ILE 246 CO 0.00 -0.41 -0.20 -1.00 0.24 0.00 0.00 174.94 173.58 2qfy s HIS 247 N -2.39 1.76 0.17 1.37 3.76 -1.26 -4.01 115.29 114.68 2qfy s HIS 247 Ca 0.20 -0.44 0.07 0.00 -0.15 0.00 0.00 55.06 54.75 2qfy s HIS 247 Cb -0.04 -0.94 -0.04 0.00 1.11 0.00 0.00 32.58 32.67 2qfy s HIS 247 CO 0.08 0.23 0.03 -0.47 -0.85 0.00 0.00 174.74 173.75 2qfy s TYR 248 N -1.41 2.90 -0.29 1.40 5.04 -1.26 -1.12 117.35 122.61 2qfy s TYR 248 Ca 0.08 -0.11 -0.19 0.00 -2.44 0.00 0.00 57.07 54.41 2qfy s TYR 248 Cb -0.09 -1.40 0.15 0.00 0.35 0.00 0.00 41.96 40.97 2qfy s TYR 248 CO 0.05 0.52 1.07 -2.00 -1.34 0.00 0.00 175.55 173.85 2qfy s GLU 249 N -2.97 0.34 0.08 4.97 2.12 -0.52 -4.95 118.70 117.77 2qfy s GLU 249 Ca 0.28 0.51 -0.24 0.00 0.36 0.00 0.00 54.97 55.89 2qfy s GLU 249 Cb -0.09 0.11 -0.06 0.00 0.26 0.00 0.00 34.13 34.34 2qfy s GLU 249 CO 0.19 -0.06 0.72 -1.58 -0.54 0.00 0.00 175.26 174.00 2qfy s HIS 250 N 0.86 3.79 0.03 5.30 5.65 -1.26 -1.65 115.29 128.01 2qfy s HIS 250 Ca -0.04 1.47 0.02 0.00 0.25 0.00 0.00 55.06 56.76 2qfy s HIS 250 Cb -0.04 -2.74 -0.02 0.00 -1.18 0.00 0.00 32.58 28.60 2qfy s HIS 250 CO -0.12 0.40 -0.08 1.03 -0.65 0.00 0.00 174.74 175.32 2qfy s ARG 251 N -0.55 0.54 0.10 2.88 1.81 0.11 -4.92 118.95 118.91 2qfy s ARG 251 Ca 0.36 -0.64 -0.31 0.00 -1.72 0.00 0.00 55.73 53.42 2qfy s ARG 251 Cb -0.21 -0.37 -0.08 0.00 -0.45 0.00 0.00 34.95 33.84 2qfy s ARG 251 CO 0.23 0.08 1.44 -1.17 -0.68 0.00 0.00 175.30 175.19 2qfy s LEU 252 N -1.24 4.36 0.33 2.53 1.98 -1.26 -1.74 118.68 123.64 2qfy s LEU 252 Ca -0.06 2.34 0.12 0.00 -2.89 0.00 0.00 54.13 53.64 2qfy s LEU 252 Cb -0.08 -3.58 1.01 0.00 0.66 0.00 0.00 46.19 44.20 2qfy s LEU 252 CO 0.00 -0.70 1.67 -0.29 -1.89 0.00 0.00 176.35 175.14 2qfy h ILE 253 N 4.39 0.34 -0.45 6.68 6.09 -0.92 -0.21 117.51 133.44 2qfy h ILE 253 Ca -0.42 -0.12 -0.02 0.00 -1.37 0.00 0.00 64.86 62.93 2qfy h ILE 253 Cb 1.20 -0.05 -0.02 0.00 0.47 0.00 0.00 36.82 38.43 2qfy h ILE 253 CO 0.88 0.07 0.21 0.44 -3.07 0.00 0.00 178.15 176.67 2qfy h ASP 254 N 0.36 0.59 -0.37 2.19 3.32 -1.90 -2.05 116.42 118.56 2qfy h ASP 254 Ca 0.70 -0.14 -0.06 0.00 0.02 0.00 0.00 57.03 57.55 2qfy h ASP 254 Cb 1.54 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.92 2qfy h ASP 254 CO -0.59 0.56 -0.02 0.44 -1.72 0.00 0.00 179.24 177.91 2qfy h ASP 255 N 0.58 0.66 -0.00 6.45 3.32 -1.46 -2.94 116.42 123.02 2qfy h ASP 255 Ca 0.15 -0.32 0.02 0.00 0.02 0.00 0.00 57.03 56.90 2qfy h ASP 255 Cb 0.14 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 2qfy h ASP 255 CO -0.02 0.82 -0.15 -0.03 -1.72 0.00 0.00 179.24 178.14 2qfy h MET 256 N 0.47 -0.24 -0.18 3.56 4.05 -1.10 0.28 114.93 121.77 2qfy h MET 256 Ca 0.10 0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.52 2qfy h MET 256 Cb 0.50 0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.34 2qfy h MET 256 CO 0.02 -0.16 0.01 -0.39 0.23 0.00 0.00 176.91 176.62 2qfy h VAL 257 N -0.25 1.11 -0.06 -5.77 -1.51 -1.41 0.94 116.25 109.30 2qfy h VAL 257 Ca 0.05 -0.41 -0.16 0.00 -1.23 0.00 0.00 66.70 64.96 2qfy h VAL 257 Cb 0.32 0.96 0.01 0.00 -2.13 0.00 0.00 31.29 30.45 2qfy h VAL 257 CO -0.15 0.14 -0.57 0.00 -1.23 0.00 0.00 177.57 175.76 2qfy h ALA 258 N 1.77 0.15 -0.12 5.19 0.00 -1.26 -1.80 119.26 123.18 2qfy h ALA 258 Ca 0.06 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2qfy h ALA 258 Cb 0.15 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2qfy h ALA 258 CO 0.00 0.39 0.08 0.37 0.00 0.00 0.00 179.25 180.09 2qfy h GLN 259 N 0.05 0.16 -0.14 0.00 4.15 0.40 -1.82 115.11 117.92 2qfy h GLN 259 Ca -0.05 -0.01 0.05 0.00 0.77 0.00 0.00 58.65 59.40 2qfy h GLN 259 Cb 1.24 -0.04 -0.07 0.00 0.21 0.00 0.00 27.48 28.83 2qfy h GLN 259 CO 0.12 0.13 -0.37 1.98 -1.93 0.00 0.00 178.83 178.75 2qfy h MET 260 N 0.15 -0.42 -0.14 1.69 4.05 0.89 0.12 114.93 121.27 2qfy h MET 260 Ca 0.04 0.03 0.04 0.00 -0.28 0.00 0.00 59.70 59.53 2qfy h MET 260 Cb -0.00 0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.89 2qfy h MET 260 CO -0.01 -0.28 0.12 0.82 0.23 0.00 0.00 176.91 177.79 2qfy h ILE 261 N -0.44 0.71 0.00 1.77 1.08 -1.10 -1.96 117.51 117.57 2qfy h ILE 261 Ca 0.09 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.56 2qfy h ILE 261 Cb 0.59 0.91 0.00 0.00 -3.07 0.00 0.00 36.82 35.25 2qfy h ILE 261 CO -0.38 0.00 -0.83 1.17 -0.69 0.00 0.00 178.15 177.42 2qfy n LYS 262 N -4.17 0.21 -0.22 2.37 4.81 -0.32 -4.98 118.16 115.87 2qfy n LYS 262 Ca 0.00 0.02 -0.04 0.00 -0.87 0.00 0.00 58.31 57.42 2qfy n LYS 262 Cb 0.24 -1.59 0.03 0.00 0.02 0.00 0.00 35.03 33.73 2qfy n LYS 262 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 2qfy n SER 263 N -1.87 -0.32 -0.36 3.14 3.41 0.28 -5.00 113.62 112.90 2qfy n SER 263 Ca 0.03 -0.93 0.04 0.00 -0.26 0.00 0.00 58.87 57.76 2qfy n SER 263 Cb 0.41 -0.14 0.05 0.00 -0.26 0.00 0.00 64.21 64.27 2qfy n SER 263 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qfy n LYS 264 N -1.54 0.71 0.00 4.33 5.02 -1.26 -4.30 118.16 121.12 2qfy n LYS 264 Ca 0.02 -1.18 0.00 0.00 -2.02 0.00 0.00 58.31 55.13 2qfy n LYS 264 Cb 0.08 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 2qfy n LYS 264 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qfy n GLY 265 N 0.43 -1.85 0.71 0.72 0.00 -1.26 -1.53 105.19 102.40 2qfy n GLY 265 Ca 0.06 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.46 2qfy n GLY 265 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qfy n GLY 266 N 0.00 0.61 3.73 -0.02 0.00 -0.51 -4.75 105.19 104.26 2qfy n GLY 266 Ca 0.00 -0.33 -0.04 0.00 0.00 0.00 0.00 46.02 45.65 2qfy n GLY 266 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qfy s PHE 267 N -2.35 -0.15 -0.08 1.61 -0.12 -1.21 -4.51 117.98 111.17 2qfy s PHE 267 Ca 0.00 -0.14 0.00 0.00 -0.05 0.00 0.00 56.93 56.74 2qfy s PHE 267 Cb 0.00 0.63 -0.03 0.00 -0.63 0.00 0.00 43.02 42.99 2qfy s PHE 267 CO 0.00 -0.79 -0.06 0.42 -0.05 0.00 0.00 175.22 174.73 2qfy s ILE 268 N -3.25 3.73 -0.29 -4.49 1.01 -0.24 -1.70 121.20 115.96 2qfy s ILE 268 Ca 0.12 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.31 2qfy s ILE 268 Cb -0.01 -2.54 0.06 0.00 0.01 0.00 0.00 42.46 39.98 2qfy s ILE 268 CO 0.01 0.58 -0.03 -0.04 0.00 0.00 0.00 174.94 175.46 2qfy s MET 269 N -0.58 2.28 -0.13 2.79 -1.94 0.59 -1.06 119.30 121.24 2qfy s MET 269 Ca 0.09 -1.36 -0.26 0.00 -1.71 0.00 0.00 55.69 52.45 2qfy s MET 269 Cb -0.12 -3.09 -0.02 0.00 2.01 0.00 0.00 34.83 33.61 2qfy s MET 269 CO 0.02 -0.64 0.84 0.00 -0.01 0.00 0.00 175.02 175.22 2qfy s ALA 270 N 1.17 3.45 0.07 3.03 0.00 0.92 -0.51 121.76 129.89 2qfy s ALA 270 Ca -0.05 0.12 0.04 0.00 0.00 0.00 0.00 51.96 52.08 2qfy s ALA 270 Cb -0.20 -3.22 -0.03 0.00 0.00 0.00 0.00 23.12 19.68 2qfy s ALA 270 CO -0.03 -0.53 -0.12 -0.51 0.00 0.00 0.00 175.76 174.57 2qfy s LEU 271 N 1.84 2.28 0.83 0.00 1.43 0.51 -2.11 118.68 123.46 2qfy s LEU 271 Ca 0.40 -0.62 -0.10 0.00 -1.03 0.00 0.00 54.13 52.78 2qfy s LEU 271 Cb -0.17 -0.42 0.09 0.00 0.03 0.00 0.00 46.19 45.72 2qfy s LEU 271 CO 0.15 -0.12 1.11 -0.54 0.23 0.00 0.00 176.35 177.18 2qfy s LYS 272 N -1.79 1.77 0.09 1.70 1.02 -1.26 -1.67 119.74 119.59 2qfy s LYS 272 Ca -0.03 1.32 -0.17 0.00 0.02 0.00 0.00 55.97 57.11 2qfy s LYS 272 Cb -0.09 -1.83 -0.04 0.00 -0.52 0.00 0.00 37.83 35.35 2qfy s LYS 272 CO 0.02 -2.03 1.10 -1.71 -0.92 0.00 0.00 175.35 171.80 2qfy n ASN 273 N -3.79 -0.57 -0.06 2.83 2.85 -1.18 -0.44 115.26 114.89 2qfy n ASN 273 Ca 0.10 1.22 -0.09 0.00 -0.11 0.00 0.00 54.58 55.71 2qfy n ASN 273 Cb 0.53 -0.26 -0.02 0.00 1.24 0.00 0.00 39.78 41.27 2qfy n ASN 273 CO 0.00 0.00 0.00 0.22 -2.11 0.00 0.00 177.26 175.37 2qfy h TYR 274 N 0.00 0.24 -0.50 1.20 3.20 -1.91 -1.64 116.97 117.56 2qfy h TYR 274 Ca 0.09 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.89 2qfy h TYR 274 Cb 0.22 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 2qfy h TYR 274 CO -0.81 0.14 0.01 -0.44 -1.64 0.00 0.00 178.16 175.42 2qfy h ASP 275 N 0.27 0.80 -0.76 -2.11 3.32 -1.75 -1.88 116.42 114.31 2qfy h ASP 275 Ca 0.10 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 56.95 2qfy h ASP 275 Cb 0.02 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.32 2qfy h ASP 275 CO -0.07 0.87 0.44 1.23 -1.72 0.00 0.00 179.24 179.99 2qfy h GLY 276 N 0.98 1.12 1.00 2.75 0.00 -0.46 0.25 103.07 108.71 2qfy h GLY 276 Ca 0.15 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 2qfy h GLY 276 CO 0.02 0.47 -0.06 -1.80 0.00 0.00 0.00 176.54 175.17 2qfy h ASP 277 N 1.05 -0.14 0.12 0.19 1.82 -0.85 -1.35 116.42 117.26 2qfy h ASP 277 Ca 0.27 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.91 2qfy h ASP 277 Cb -0.00 0.04 0.00 0.00 0.68 0.00 0.00 39.33 40.04 2qfy h ASP 277 CO -0.05 -0.09 -0.06 0.58 -1.61 0.00 0.00 179.24 178.01 2qfy h VAL 278 N -0.16 1.05 -0.10 2.25 2.07 -1.07 -3.27 116.25 117.01 2qfy h VAL 278 Ca -0.02 -0.84 -0.03 0.00 0.82 0.00 0.00 66.70 66.64 2qfy h VAL 278 Cb 0.13 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 2qfy h VAL 278 CO 0.03 0.20 -0.06 1.56 0.02 0.00 0.00 177.57 179.31 2qfy h GLN 279 N -0.57 0.15 -0.66 1.57 1.08 -0.55 -2.66 115.11 113.47 2qfy h GLN 279 Ca -0.02 -0.02 0.06 0.00 -1.45 0.00 0.00 58.65 57.22 2qfy h GLN 279 Cb 0.45 -0.03 -0.06 0.00 -0.05 0.00 0.00 27.48 27.80 2qfy h GLN 279 CO 0.03 0.23 0.36 0.77 -0.95 0.00 0.00 178.83 179.26 2qfy h SER 280 N 0.15 0.52 0.01 1.46 0.02 -1.29 -1.15 113.55 113.26 2qfy h SER 280 Ca 0.03 0.03 -0.10 0.00 -0.84 0.00 0.00 61.79 60.92 2qfy h SER 280 Cb 0.21 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 2qfy h SER 280 CO 0.01 0.33 -0.31 0.44 -1.14 0.00 0.00 176.83 176.17 2qfy h ASP 281 N 0.66 0.45 0.21 3.07 3.45 -1.55 -0.47 116.42 122.23 2qfy h ASP 281 Ca 0.30 -0.16 -0.01 0.00 0.43 0.00 0.00 57.03 57.59 2qfy h ASP 281 Cb 0.21 -0.12 0.00 0.00 -0.56 0.00 0.00 39.33 38.86 2qfy h ASP 281 CO -0.19 0.74 -0.10 0.40 -1.57 0.00 0.00 179.24 178.51 2qfy h ILE 282 N 0.38 0.87 -0.73 0.35 2.04 -1.32 -0.93 117.51 118.17 2qfy h ILE 282 Ca 0.05 -0.53 0.03 0.00 1.00 0.00 0.00 64.86 65.41 2qfy h ILE 282 Cb 0.73 1.18 -0.04 0.00 -0.74 0.00 0.00 36.82 37.94 2qfy h ILE 282 CO 0.06 0.12 0.47 0.58 0.00 0.00 0.00 178.15 179.37 2qfy h VAL 283 N -0.55 1.11 -0.65 1.67 2.07 -1.18 0.67 116.25 119.39 2qfy h VAL 283 Ca -0.03 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.18 2qfy h VAL 283 Cb 0.41 0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 2qfy h VAL 283 CO 0.05 0.17 0.42 0.00 0.02 0.00 0.00 177.57 178.22 2qfy h ALA 284 N 1.31 0.83 -0.01 1.67 0.00 -1.01 -1.35 119.26 120.69 2qfy h ALA 284 Ca 0.29 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.98 2qfy h ALA 284 Cb 0.00 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2qfy h ALA 284 CO -0.11 0.27 -0.75 0.37 0.00 0.00 0.00 179.25 179.04 2qfy h GLN 285 N 0.88 0.07 -0.58 0.00 5.75 -0.53 -2.77 115.11 117.93 2qfy h GLN 285 Ca 0.24 -0.07 -0.03 0.00 -0.15 0.00 0.00 58.65 58.64 2qfy h GLN 285 Cb -0.07 0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.47 2qfy h GLN 285 CO -0.05 0.78 0.26 0.78 -2.65 0.00 0.00 178.83 177.96 2qfy h GLY 286 N 2.02 0.91 2.00 2.39 0.00 0.11 -2.39 103.07 108.11 2qfy h GLY 286 Ca -0.02 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 46.85 2qfy h GLY 286 CO 0.10 0.44 0.00 0.69 0.00 0.00 0.00 176.54 177.78 2qfy n PHE 287 N -4.52 0.41 0.00 5.60 3.01 -0.58 -0.43 117.46 120.95 2qfy n PHE 287 Ca 0.03 0.15 0.00 0.00 1.01 0.00 0.00 57.45 58.64 2qfy n PHE 287 Cb 0.14 -0.74 0.00 0.00 -0.01 0.00 0.00 39.48 38.86 2qfy n PHE 287 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qfy n GLY 288 N 0.35 3.12 3.63 1.37 0.00 -0.90 -4.33 105.19 108.43 2qfy n GLY 288 Ca 0.04 -0.45 -0.12 0.00 0.00 0.00 0.00 46.02 45.49 2qfy n GLY 288 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2qfy s SER 289 N 0.00 -0.76 0.46 1.61 0.15 -1.05 -4.89 113.70 109.22 2qfy s SER 289 Ca 0.00 1.40 0.12 0.00 0.70 0.00 0.00 55.95 58.16 2qfy s SER 289 Cb 0.00 1.39 1.05 0.00 -1.71 0.00 0.00 66.02 66.76 2qfy s SER 289 CO 0.00 -0.24 2.09 -0.07 1.20 0.00 0.00 173.24 176.22 2qfy h LEU 290 N 5.36 0.26 0.00 3.45 3.38 -1.90 0.18 115.31 126.04 2qfy h LEU 290 Ca -0.29 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2qfy h LEU 290 Cb 1.18 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2qfy h LEU 290 CO 0.08 0.19 0.00 0.61 0.09 0.00 0.00 178.44 179.41 2qfy n GLY 291 N -1.51 -0.46 2.76 0.83 0.00 -1.26 -3.60 105.19 101.95 2qfy n GLY 291 Ca 0.01 -0.05 -0.28 0.00 0.00 0.00 0.00 46.02 45.71 2qfy n GLY 291 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qfy n LEU 292 N -1.18 2.11 -3.64 0.99 4.77 0.61 -3.99 117.00 116.67 2qfy n LEU 292 Ca 0.05 -5.00 -0.10 0.00 -0.03 0.00 0.00 56.01 50.93 2qfy n LEU 292 Cb 0.05 -0.41 -0.07 0.00 -2.33 0.00 0.00 43.42 40.67 2qfy n LEU 292 CO 0.06 1.79 0.37 -0.32 -1.33 0.00 0.00 177.39 177.97 2qfy s MET 293 N -1.09 0.76 0.30 3.23 1.75 -1.24 -2.11 119.30 120.90 2qfy s MET 293 Ca 0.27 1.12 0.03 0.00 -1.25 0.00 0.00 55.69 55.86 2qfy s MET 293 Cb -0.02 0.25 -0.03 0.00 2.84 0.00 0.00 34.83 37.88 2qfy s MET 293 CO -0.18 -0.13 0.46 0.95 -0.65 0.00 0.00 175.02 175.48 2qfy s THR 294 N 1.09 5.13 -0.14 10.11 -4.23 0.12 -4.63 115.64 123.10 2qfy s THR 294 Ca -0.06 -0.72 -0.05 0.00 -1.18 0.00 0.00 61.69 59.68 2qfy s THR 294 Cb -0.05 -3.84 0.06 0.00 1.34 0.00 0.00 72.50 70.01 2qfy s THR 294 CO -0.11 -0.44 0.29 -0.55 -0.54 0.00 0.00 174.62 173.27 2qfy s SER 295 N -4.02 0.11 -0.03 3.99 0.15 -1.25 -2.32 113.70 110.33 2qfy s SER 295 Ca 0.37 0.66 -0.01 0.00 0.70 0.00 0.00 55.95 57.67 2qfy s SER 295 Cb -0.09 0.75 0.03 0.00 -1.71 0.00 0.00 66.02 65.00 2qfy s SER 295 CO 0.33 -0.22 0.05 -0.51 1.20 0.00 0.00 173.24 174.08 2qfy s ILE 296 N 2.18 -0.09 -0.09 6.45 2.07 -0.70 -1.32 121.20 129.70 2qfy s ILE 296 Ca -0.02 0.34 -0.24 0.00 -1.41 0.00 0.00 60.65 59.33 2qfy s ILE 296 Cb -0.11 -0.13 -0.03 0.00 0.13 0.00 0.00 42.46 42.32 2qfy s ILE 296 CO -0.09 0.14 0.74 -0.22 -1.91 0.00 0.00 174.94 173.60 2qfy s LEU 297 N 1.73 4.28 -0.02 8.50 0.20 0.20 -1.33 118.68 132.23 2qfy s LEU 297 Ca -0.01 1.18 0.05 0.00 0.69 0.00 0.00 54.13 56.04 2qfy s LEU 297 Cb -0.12 -3.12 -0.01 0.00 -0.43 0.00 0.00 46.19 42.50 2qfy s LEU 297 CO -0.03 -0.19 -0.17 -0.69 -0.29 0.00 0.00 176.35 174.98 2qfy s VAL 298 N 1.18 1.33 0.30 1.68 1.01 0.76 -1.05 120.40 125.61 2qfy s VAL 298 Ca 0.38 -0.70 -0.05 0.00 0.00 0.00 0.00 61.98 61.61 2qfy s VAL 298 Cb -0.18 -1.12 -0.05 0.00 0.00 0.00 0.00 36.38 35.03 2qfy s VAL 298 CO 0.17 0.38 0.57 0.42 0.00 0.00 0.00 175.10 176.64 2qfy s THR 299 N -0.22 5.00 0.53 3.92 -4.23 -1.08 -0.70 115.64 118.87 2qfy s THR 299 Ca 0.03 0.10 0.26 0.00 -1.18 0.00 0.00 61.69 60.90 2qfy s THR 299 Cb -0.08 -3.73 0.32 0.00 1.34 0.00 0.00 72.50 70.34 2qfy s THR 299 CO 0.00 -0.34 2.18 1.55 -0.54 0.00 0.00 174.62 177.48 2qfy h PRO 300 N 1.63 0.00 0.00 3.99 0.13 -1.93 -2.49 132.00 133.34 2qfy h PRO 300 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2qfy h PRO 300 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2qfy h PRO 300 CO 0.66 0.04 0.00 -0.40 -0.23 0.00 0.00 178.00 178.07 2qfy n ASP 301 N -3.92 0.00 -0.61 1.44 5.68 -1.26 -4.85 116.55 113.03 2qfy n ASP 301 Ca -0.03 0.08 -0.08 0.00 -0.50 0.00 0.00 54.79 54.27 2qfy n ASP 301 Cb 0.13 -0.34 -0.03 0.00 -1.14 0.00 0.00 41.12 39.73 2qfy n ASP 301 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qfy n GLY 302 N 0.87 0.97 0.01 6.12 0.00 -0.94 -4.89 105.19 107.32 2qfy n GLY 302 Ca 0.10 -0.46 0.06 0.00 0.00 0.00 0.00 46.02 45.72 2qfy n GLY 302 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qfy n LYS 303 N -2.38 0.54 -5.00 1.61 5.02 -1.26 -5.02 118.16 111.67 2qfy n LYS 303 Ca -0.08 -0.11 -0.28 0.00 -2.02 0.00 0.00 58.31 55.82 2qfy n LYS 303 Cb 0.31 -1.28 -0.15 0.00 -0.02 0.00 0.00 35.03 33.89 2qfy n LYS 303 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2qfy s THR 304 N -2.81 1.85 -0.04 -0.18 2.01 -1.26 -4.58 115.64 110.63 2qfy s THR 304 Ca -0.04 -1.11 -0.09 0.00 0.31 0.00 0.00 61.69 60.77 2qfy s THR 304 Cb 0.08 -1.56 0.01 0.00 0.01 0.00 0.00 72.50 71.04 2qfy s THR 304 CO 0.51 0.43 0.20 -0.36 -0.69 0.00 0.00 174.62 174.71 2qfy s PHE 305 N -0.64 -0.12 -0.21 4.92 0.08 0.92 -2.62 117.98 120.30 2qfy s PHE 305 Ca 0.09 0.26 -0.03 0.00 0.12 0.00 0.00 56.93 57.37 2qfy s PHE 305 Cb -0.09 0.03 0.07 0.00 -0.57 0.00 0.00 43.02 42.46 2qfy s PHE 305 CO 0.00 -0.23 0.05 -2.00 -0.10 0.00 0.00 175.22 172.95 2qfy s GLU 306 N -0.70 0.58 -0.24 0.44 2.12 -0.21 -0.78 118.70 119.90 2qfy s GLU 306 Ca -0.08 -0.47 -0.17 0.00 0.36 0.00 0.00 54.97 54.61 2qfy s GLU 306 Cb -0.04 -2.02 -0.03 0.00 0.26 0.00 0.00 34.13 32.29 2qfy s GLU 306 CO 0.01 -0.70 0.49 0.45 -0.54 0.00 0.00 175.26 174.97 2qfy s SER 307 N 1.87 6.44 0.10 -1.70 0.15 0.14 -0.63 113.70 120.07 2qfy s SER 307 Ca 0.01 0.53 0.08 0.00 0.70 0.00 0.00 55.95 57.27 2qfy s SER 307 Cb -0.17 -2.27 -0.03 0.00 -1.71 0.00 0.00 66.02 61.84 2qfy s SER 307 CO -0.12 -0.23 -0.22 -1.83 1.20 0.00 0.00 173.24 172.05 2qfy s GLU 308 N 2.03 1.20 -0.39 5.44 -1.05 -0.43 0.16 118.70 125.66 2qfy s GLU 308 Ca 0.21 -1.16 -0.22 0.00 -0.15 0.00 0.00 54.97 53.66 2qfy s GLU 308 Cb -0.15 -1.48 0.01 0.00 -0.44 0.00 0.00 34.13 32.07 2qfy s GLU 308 CO 0.09 0.35 0.70 0.00 0.95 0.00 0.00 175.26 177.35 2qfy s ALA 309 N -1.10 3.40 0.08 -0.84 0.00 -0.40 -3.90 121.76 119.01 2qfy s ALA 309 Ca 0.08 -0.89 0.01 0.00 0.00 0.00 0.00 51.96 51.16 2qfy s ALA 309 Cb -0.10 -3.29 -0.25 0.00 0.00 0.00 0.00 23.12 19.48 2qfy s ALA 309 CO 0.04 -1.55 1.14 0.00 0.00 0.00 0.00 175.76 175.40 2qfy h ALA 310 N 8.62 0.25 -0.41 0.00 0.00 -1.88 -3.32 119.26 122.52 2qfy h ALA 310 Ca -0.26 -0.95 -0.16 0.00 0.00 0.00 0.00 54.91 53.55 2qfy h ALA 310 Cb 1.10 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 2qfy h ALA 310 CO 0.88 1.13 0.74 1.58 0.00 0.00 0.00 179.25 183.58 2qfy n HIS 311 N -3.43 0.92 -1.09 0.00 -0.00 -1.26 -4.87 115.22 105.49 2qfy n HIS 311 Ca -0.06 0.02 -0.36 0.00 -0.00 0.00 0.00 57.72 57.32 2qfy n HIS 311 Cb 0.99 -2.15 0.07 0.00 -0.00 0.00 0.00 29.99 28.90 2qfy n HIS 311 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2qfy n GLY 312 N 6.41 -2.51 3.74 1.57 0.00 -1.26 -4.83 105.19 108.31 2qfy n GLY 312 Ca 0.51 -0.54 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 2qfy n GLY 312 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2qfy s THR 313 N -2.06 4.18 -0.32 2.61 -1.32 -1.26 -4.99 115.64 112.47 2qfy s THR 313 Ca 0.57 2.03 -0.12 0.00 -1.21 0.00 0.00 61.69 62.96 2qfy s THR 313 Cb -0.30 -4.30 -0.03 0.00 -1.51 0.00 0.00 72.50 66.37 2qfy s THR 313 CO 0.67 0.42 0.22 -0.69 -2.21 0.00 0.00 174.62 173.03 2qfy s VAL 314 N -0.74 5.28 0.54 5.08 1.01 -1.26 -4.96 120.40 125.34 2qfy s VAL 314 Ca 0.44 -0.10 0.28 0.00 0.00 0.00 0.00 61.98 62.60 2qfy s VAL 314 Cb -0.26 -3.65 0.33 0.00 0.00 0.00 0.00 36.38 32.81 2qfy s VAL 314 CO 0.32 0.08 2.20 0.74 0.00 0.00 0.00 175.10 178.43 2qfy h THR 315 N 5.46 0.59 0.09 3.92 2.02 -1.99 -2.87 112.91 120.13 2qfy h THR 315 Ca -0.33 -0.16 0.02 0.00 0.77 0.00 0.00 66.41 66.72 2qfy h THR 315 Cb 1.17 1.10 -0.04 0.00 -1.74 0.00 0.00 68.15 68.64 2qfy h THR 315 CO 0.61 0.04 -0.26 0.03 0.37 0.00 0.00 175.52 176.30 2qfy h ARG 316 N 0.00 -0.44 -0.40 6.66 3.08 -1.99 0.30 114.38 121.59 2qfy h ARG 316 Ca -0.00 0.03 -0.10 0.00 0.07 0.00 0.00 59.98 59.98 2qfy h ARG 316 Cb 0.10 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 2qfy h ARG 316 CO 0.00 -0.29 -0.16 0.45 -1.07 0.00 0.00 179.97 178.90 2qfy h HIS 317 N -0.46 0.82 -0.31 3.04 3.86 -1.95 -2.35 115.15 117.80 2qfy h HIS 317 Ca 0.04 -0.16 -0.04 0.00 -1.16 0.00 0.00 60.37 59.05 2qfy h HIS 317 Cb 0.50 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.75 2qfy h HIS 317 CO -0.25 0.85 0.04 -0.92 0.86 0.00 0.00 177.93 178.51 2qfy h TYR 318 N 0.66 0.56 -0.91 2.45 -0.00 -1.34 0.63 116.97 119.02 2qfy h TYR 318 Ca 0.11 -0.08 0.04 0.00 -0.00 0.00 0.00 58.73 58.79 2qfy h TYR 318 Cb 0.64 -0.15 -0.05 0.00 -0.00 0.00 0.00 36.73 37.16 2qfy h TYR 318 CO 0.03 0.62 0.60 -0.09 -0.00 0.00 0.00 178.16 179.32 2qfy h ARG 319 N 0.35 1.09 -0.10 1.82 2.43 -0.29 -0.13 114.38 119.55 2qfy h ARG 319 Ca 0.09 -0.07 -0.18 0.00 -0.81 0.00 0.00 59.98 59.02 2qfy h ARG 319 Cb 0.37 -0.25 -0.00 0.00 -0.42 0.00 0.00 29.97 29.66 2qfy h ARG 319 CO 0.01 0.72 -0.68 0.87 -1.51 0.00 0.00 179.97 179.38 2qfy h LYS 320 N 1.12 0.44 -0.67 0.20 1.57 -1.13 -2.67 116.57 115.44 2qfy h LYS 320 Ca 0.37 -0.34 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 2qfy h LYS 320 Cb 0.05 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 2qfy h LYS 320 CO -0.12 0.96 0.36 -0.92 -0.57 0.00 0.00 179.45 179.16 2qfy h TYR 321 N 0.31 0.94 -0.98 -1.35 3.20 0.10 0.13 116.97 119.32 2qfy h TYR 321 Ca -0.02 -0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.83 2qfy h TYR 321 Cb 1.24 -0.30 -0.05 0.00 1.54 0.00 0.00 36.73 39.17 2qfy h TYR 321 CO 0.04 0.68 0.65 1.96 -1.64 0.00 0.00 178.16 179.85 2qfy h GLN 322 N 0.92 1.29 0.00 1.82 1.08 -0.94 -1.76 115.11 117.53 2qfy h GLN 322 Ca 0.24 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.36 2qfy h GLN 322 Cb 0.06 -0.29 0.00 0.00 -0.05 0.00 0.00 27.48 27.20 2qfy h GLN 322 CO -0.04 0.86 0.00 1.63 -0.95 0.00 0.00 178.83 180.33 2qfy n LYS 323 N -4.40 0.23 -0.63 1.46 5.02 -0.89 -4.89 118.16 114.07 2qfy n LYS 323 Ca 0.11 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.43 2qfy n LYS 323 Cb 0.01 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.52 2qfy n LYS 323 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qfy n GLY 324 N 1.18 0.65 3.80 0.72 0.00 -0.65 -5.05 105.19 105.84 2qfy n GLY 324 Ca 0.10 -0.29 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 2qfy n GLY 324 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qfy s GLU 325 N -0.74 4.30 0.46 1.61 2.02 0.35 -5.00 118.70 121.70 2qfy s GLU 325 Ca 0.00 0.87 -0.24 0.00 0.02 0.00 0.00 54.97 55.62 2qfy s GLU 325 Cb 0.00 -3.18 -0.07 0.00 0.10 0.00 0.00 34.13 30.98 2qfy s GLU 325 CO 0.00 0.58 1.26 -1.83 0.02 0.00 0.00 175.26 175.28 2qfy s GLU 326 N -1.30 3.67 0.29 1.61 -1.05 -1.26 -4.04 118.70 116.62 2qfy s GLU 326 Ca 0.33 2.01 0.08 0.00 -0.15 0.00 0.00 54.97 57.25 2qfy s GLU 326 Cb -0.20 -2.48 -0.06 0.00 -0.44 0.00 0.00 34.13 30.95 2qfy s GLU 326 CO 0.21 -0.69 -0.10 0.95 0.95 0.00 0.00 175.26 176.59 2qfy s THR 327 N -1.39 1.95 -0.39 1.83 -4.23 -1.26 -4.96 115.64 107.19 2qfy s THR 327 Ca 0.63 -2.20 0.10 0.00 -1.18 0.00 0.00 61.69 59.04 2qfy s THR 327 Cb -0.35 -2.44 0.31 0.00 1.34 0.00 0.00 72.50 71.36 2qfy s THR 327 CO 0.42 -0.32 0.65 -0.24 -0.54 0.00 0.00 174.62 174.60 2qfy n SER 328 N -0.63 0.80 -4.80 3.99 2.88 -1.26 -0.58 113.62 114.02 2qfy n SER 328 Ca -0.06 -2.92 -0.38 0.00 -1.33 0.00 0.00 58.87 54.19 2qfy n SER 328 Cb 0.63 -0.63 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 2qfy n SER 328 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2qfy s THR 329 N -2.01 5.10 0.47 2.46 2.01 -1.26 -3.84 115.64 118.57 2qfy s THR 329 Ca 0.38 0.83 -0.22 0.00 0.31 0.00 0.00 61.69 62.99 2qfy s THR 329 Cb 0.27 -3.72 -0.08 0.00 0.01 0.00 0.00 72.50 68.98 2qfy s THR 329 CO -0.09 0.50 1.11 0.21 -0.69 0.00 0.00 174.62 175.66 2qfy s ASN 330 N -0.52 6.23 -0.01 3.53 2.47 -1.26 -4.63 114.94 120.76 2qfy s ASN 330 Ca 0.23 2.16 0.01 0.00 0.42 0.00 0.00 52.86 55.68 2qfy s ASN 330 Cb -0.16 -2.59 0.02 0.00 -1.45 0.00 0.00 41.25 37.07 2qfy s ASN 330 CO 0.11 -0.86 0.78 -1.54 -3.72 0.00 0.00 177.10 171.87 2qfy n SER 331 N -0.64 1.00 -0.26 -4.21 3.41 -1.26 -4.83 113.62 106.83 2qfy n SER 331 Ca 0.08 -1.60 -0.06 0.00 -0.26 0.00 0.00 58.87 57.02 2qfy n SER 331 Cb 0.50 -0.03 0.05 0.00 -0.26 0.00 0.00 64.21 64.46 2qfy n SER 331 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 2qfy h ILE 332 N 1.75 1.24 -0.74 -1.33 2.04 -1.93 -1.29 117.51 117.26 2qfy h ILE 332 Ca 0.00 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.12 2qfy h ILE 332 Cb 0.80 0.41 -0.04 0.00 -0.74 0.00 0.00 36.82 37.26 2qfy h ILE 332 CO 0.00 0.30 0.43 0.00 0.00 0.00 0.00 178.15 178.87 2qfy h ALA 333 N 1.14 0.94 -0.33 1.87 0.00 -1.88 -1.10 119.26 119.91 2qfy h ALA 333 Ca 0.24 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 2qfy h ALA 333 Cb 0.18 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2qfy h ALA 333 CO -0.02 0.43 -0.04 0.77 0.00 0.00 0.00 179.25 180.39 2qfy h SER 334 N 1.01 0.60 -0.54 0.00 0.02 -1.85 -1.35 113.55 111.44 2qfy h SER 334 Ca 0.26 -0.34 0.06 0.00 -0.84 0.00 0.00 61.79 60.93 2qfy h SER 334 Cb -0.00 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.32 2qfy h SER 334 CO -0.05 0.80 0.25 0.40 -1.14 0.00 0.00 176.83 177.09 2qfy h ILE 335 N 0.40 0.90 0.00 3.27 2.04 -0.96 -1.28 117.51 121.88 2qfy h ILE 335 Ca 0.09 -0.16 -0.07 0.00 1.00 0.00 0.00 64.86 65.72 2qfy h ILE 335 Cb 0.51 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 2qfy h ILE 335 CO 0.02 0.09 -0.31 -0.26 0.00 0.00 0.00 178.15 177.69 2qfy h PHE 336 N 0.48 0.00 -0.56 1.37 -1.00 -1.05 -0.83 116.94 115.35 2qfy h PHE 336 Ca 0.25 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 61.01 2qfy h PHE 336 Cb 0.21 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.74 2qfy h PHE 336 CO -0.12 0.31 0.25 0.00 -1.61 0.00 0.00 178.31 177.14 2qfy h ALA 337 N 1.69 0.72 0.20 2.45 0.00 -0.08 0.13 119.26 124.36 2qfy h ALA 337 Ca -0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2qfy h ALA 337 Cb 0.63 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2qfy h ALA 337 CO 0.04 0.30 -0.09 -1.49 0.00 0.00 0.00 179.25 178.00 2qfy h TRP 338 N 0.75 -0.24 -0.50 0.00 4.06 -0.86 -2.38 115.95 116.78 2qfy h TRP 338 Ca 0.19 -0.01 0.07 0.00 2.06 0.00 0.00 58.89 61.20 2qfy h TRP 338 Cb 0.14 0.08 -0.06 0.00 -1.00 0.00 0.00 29.16 28.33 2qfy h TRP 338 CO 0.00 0.10 0.17 0.66 -3.56 0.00 0.00 178.44 175.82 2qfy h SER 339 N -0.62 0.17 -0.53 -3.49 4.64 -1.10 0.12 113.55 112.75 2qfy h SER 339 Ca -0.03 0.06 -0.06 0.00 -0.47 0.00 0.00 61.79 61.30 2qfy h SER 339 Cb 0.45 0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.56 2qfy h SER 339 CO 0.04 0.13 0.13 0.03 -0.87 0.00 0.00 176.83 176.29 2qfy h ARG 340 N 0.35 0.90 -0.30 4.77 2.47 -1.01 0.15 114.38 121.71 2qfy h ARG 340 Ca 0.24 -0.20 -0.13 0.00 -1.26 0.00 0.00 59.98 58.63 2qfy h ARG 340 Cb 0.26 -0.13 -0.00 0.00 -1.65 0.00 0.00 29.97 28.45 2qfy h ARG 340 CO -0.25 0.81 -0.33 0.78 0.56 0.00 0.00 179.97 181.54 2qfy h GLY 341 N 1.00 0.82 1.27 0.04 0.00 -0.84 -2.45 103.07 102.91 2qfy h GLY 341 Ca 0.18 -0.86 -0.05 0.00 0.00 0.00 0.00 47.33 46.61 2qfy h GLY 341 CO 0.00 0.77 0.18 1.41 0.00 0.00 0.00 176.54 178.91 2qfy h LEU 342 N 0.50 0.85 -0.56 3.11 3.38 -0.50 -0.48 115.31 121.61 2qfy h LEU 342 Ca 0.04 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 57.88 2qfy h LEU 342 Cb 0.92 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 2qfy h LEU 342 CO 0.08 0.81 0.36 0.25 0.09 0.00 0.00 178.44 180.02 2qfy h LEU 343 N 0.89 0.60 -0.56 1.67 6.46 -0.56 0.90 115.31 124.70 2qfy h LEU 343 Ca 0.20 -0.01 -0.07 0.00 -0.12 0.00 0.00 57.88 57.89 2qfy h LEU 343 Cb 0.26 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 40.03 2qfy h LEU 343 CO -0.01 0.43 0.09 0.11 -0.62 0.00 0.00 178.44 178.44 2qfy h LYS 344 N 0.72 0.93 -0.56 1.25 1.79 -0.92 -1.79 116.57 117.99 2qfy h LYS 344 Ca 0.22 -0.25 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 2qfy h LYS 344 Cb -0.03 -0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 30.48 2qfy h LYS 344 CO -0.07 0.90 0.37 -0.09 -1.08 0.00 0.00 179.45 179.47 2qfy h ARG 345 N 0.83 0.75 -0.75 3.15 9.65 -0.53 -1.45 114.38 126.02 2qfy h ARG 345 Ca 0.17 -0.05 -0.00 0.00 -1.10 0.00 0.00 59.98 59.00 2qfy h ARG 345 Cb 0.41 -0.17 -0.04 0.00 -1.39 0.00 0.00 29.97 28.79 2qfy h ARG 345 CO 0.01 0.51 0.46 0.78 2.80 0.00 0.00 179.97 184.53 2qfy h GLY 346 N 0.76 1.08 0.83 2.80 0.00 -0.58 -1.95 103.07 106.03 2qfy h GLY 346 Ca 0.21 -0.44 -0.03 0.00 0.00 0.00 0.00 47.33 47.06 2qfy h GLY 346 CO -0.04 0.43 0.01 0.83 0.00 0.00 0.00 176.54 177.77 2qfy h GLU 347 N 1.02 0.35 -0.41 4.80 5.08 -0.90 0.38 114.58 124.91 2qfy h GLU 347 Ca 0.27 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 2qfy h GLU 347 Cb -0.05 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 2qfy h GLU 347 CO -0.05 0.53 0.11 -0.07 -1.00 0.00 0.00 179.01 178.53 2qfy h LEU 348 N 0.13 0.55 0.00 1.33 3.38 -1.18 -2.59 115.31 116.93 2qfy h LEU 348 Ca 0.06 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2qfy h LEU 348 Cb 0.37 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2qfy h LEU 348 CO 0.01 0.55 -0.61 0.47 0.09 0.00 0.00 178.44 178.95 2qfy n ASP 349 N -4.33 0.58 -3.11 -0.43 8.00 -0.74 -4.98 116.55 111.54 2qfy n ASP 349 Ca 0.03 -0.09 -0.14 0.00 0.71 0.00 0.00 54.79 55.30 2qfy n ASP 349 Cb 0.19 0.27 0.07 0.00 -0.02 0.00 0.00 41.12 41.63 2qfy n ASP 349 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2qfy n ASN 350 N -1.80 -5.22 -3.82 -2.24 5.15 0.12 -4.99 115.26 102.47 2qfy n ASN 350 Ca 0.04 -0.62 -0.29 0.00 -0.60 0.00 0.00 54.58 53.11 2qfy n ASN 350 Cb 0.39 -4.76 -0.12 0.00 -0.53 0.00 0.00 39.78 34.75 2qfy n ASN 350 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2qfy s THR 351 N -3.35 2.23 0.42 -0.44 2.01 -0.09 -4.98 115.64 111.45 2qfy s THR 351 Ca 0.32 -3.51 0.20 0.00 0.31 0.00 0.00 61.69 59.00 2qfy s THR 351 Cb -0.04 -2.50 0.40 0.00 0.01 0.00 0.00 72.50 70.37 2qfy s THR 351 CO 0.67 -0.96 1.82 1.55 -0.69 0.00 0.00 174.62 177.01 2qfy h PRO 352 N 5.96 0.35 -0.43 4.92 0.13 -1.94 -0.39 132.00 140.60 2qfy h PRO 352 Ca 0.07 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 65.14 2qfy h PRO 352 Cb 0.84 -0.08 -0.02 0.00 0.13 0.00 0.00 31.00 31.87 2qfy h PRO 352 CO 0.62 0.23 0.07 0.00 -0.23 0.00 0.00 178.00 178.70 2qfy h ALA 353 N 1.60 1.32 -0.12 -0.56 0.00 -1.97 0.56 119.26 120.10 2qfy h ALA 353 Ca 0.52 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 55.20 2qfy h ALA 353 Cb 1.40 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 2qfy h ALA 353 CO -0.20 0.47 -0.08 1.25 0.00 0.00 0.00 179.25 180.69 2qfy h LEU 354 N 0.64 0.28 -0.81 0.00 6.46 -1.45 -1.30 115.31 119.12 2qfy h LEU 354 Ca 0.14 -0.45 0.03 0.00 -0.12 0.00 0.00 57.88 57.48 2qfy h LEU 354 Cb 0.29 -0.08 -0.05 0.00 -0.73 0.00 0.00 40.66 40.10 2qfy h LEU 354 CO 0.00 0.67 0.52 0.00 -0.62 0.00 0.00 178.44 179.01 2qfy h LYS 356 N 1.03 1.09 -0.34 0.00 1.63 -0.82 -2.25 116.57 116.91 2qfy h LYS 356 Ca 0.32 -0.25 -0.00 0.00 -0.85 0.00 0.00 60.65 59.87 2qfy h LYS 356 Cb -0.03 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 31.43 2qfy h LYS 356 CO -0.10 0.95 0.20 0.35 -3.45 0.00 0.00 179.45 177.40 2qfy h PHE 357 N 1.03 0.45 -0.89 1.91 3.57 -0.36 -1.75 116.94 120.90 2qfy h PHE 357 Ca 0.22 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.77 2qfy h PHE 357 Cb 0.33 -0.15 -0.06 0.00 2.79 0.00 0.00 35.95 38.86 2qfy h PHE 357 CO 0.03 0.34 0.56 0.00 -2.23 0.00 0.00 178.31 177.00 2qfy h ALA 358 N 1.08 1.21 -0.65 2.41 0.00 -0.83 -0.53 119.26 121.95 2qfy h ALA 358 Ca 0.12 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 2qfy h ALA 358 Cb 0.02 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2qfy h ALA 358 CO -0.02 0.34 0.07 -0.91 0.00 0.00 0.00 179.25 178.73 2qfy h ASN 359 N 1.04 1.06 0.29 0.00 2.35 -1.04 -2.23 115.58 117.05 2qfy h ASN 359 Ca 0.38 -0.28 -0.12 0.00 -0.55 0.00 0.00 56.30 55.73 2qfy h ASN 359 Cb 0.13 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 2qfy h ASN 359 CO -0.16 1.08 -0.47 0.16 -1.65 0.00 0.00 177.43 176.38 2qfy h ILE 360 N 1.01 1.34 -0.02 2.81 3.07 -0.76 0.14 117.51 125.10 2qfy h ILE 360 Ca 0.19 -1.67 0.01 0.00 1.55 0.00 0.00 64.86 64.94 2qfy h ILE 360 Cb 0.49 1.80 -0.01 0.00 -0.27 0.00 0.00 36.82 38.83 2qfy h ILE 360 CO 0.02 0.50 -0.04 0.25 -1.05 0.00 0.00 178.15 177.83 2qfy h LEU 361 N 0.18 -0.11 -0.44 0.16 6.46 -0.79 0.64 115.31 121.41 2qfy h LEU 361 Ca 0.01 0.02 -0.03 0.00 -0.12 0.00 0.00 57.88 57.76 2qfy h LEU 361 Cb 0.91 0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.87 2qfy h LEU 361 CO 0.07 -0.05 0.16 -0.33 -0.62 0.00 0.00 178.44 177.67 2qfy h GLU 362 N -0.05 0.67 -0.13 1.25 5.08 -1.19 -2.29 114.58 117.91 2qfy h GLU 362 Ca 0.02 -0.13 0.01 0.00 -1.00 0.00 0.00 59.36 58.26 2qfy h GLU 362 Cb 0.09 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 2qfy h GLU 362 CO -0.06 0.63 0.07 1.03 -1.00 0.00 0.00 179.01 179.69 2qfy h SER 363 N 0.57 0.12 -0.84 1.42 0.87 -0.50 -2.20 113.55 112.99 2qfy h SER 363 Ca 0.14 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 2qfy h SER 363 Cb 0.23 -0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.12 2qfy h SER 363 CO -0.01 0.09 0.54 0.00 -0.53 0.00 0.00 176.83 176.92 2qfy h ALA 364 N 1.06 1.37 -0.01 6.23 0.00 0.36 -0.06 119.26 128.22 2qfy h ALA 364 Ca 0.05 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2qfy h ALA 364 Cb -0.00 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 2qfy h ALA 364 CO -0.03 0.57 0.00 1.15 0.00 0.00 0.00 179.25 180.95 2qfy h THR 365 N 1.15 1.19 -0.49 0.00 2.02 -1.15 -1.06 112.91 114.56 2qfy h THR 365 Ca 0.31 -0.56 -0.09 0.00 0.77 0.00 0.00 66.41 66.84 2qfy h THR 365 Cb -0.10 1.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 2qfy h THR 365 CO -0.06 0.15 -0.06 -0.07 0.37 0.00 0.00 175.52 175.84 2qfy h LEU 366 N -0.22 0.85 -1.02 2.58 3.38 -1.20 -2.60 115.31 117.07 2qfy h LEU 366 Ca 0.00 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.68 2qfy h LEU 366 Cb 0.24 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 2qfy h LEU 366 CO 0.00 0.94 0.13 0.78 0.09 0.00 0.00 178.44 180.39 2qfy h ASN 367 N 0.79 0.78 -0.78 -0.43 -0.26 -0.94 -0.19 115.58 114.55 2qfy h ASN 367 Ca 0.14 -0.14 -0.00 0.00 -0.56 0.00 0.00 56.30 55.74 2qfy h ASN 367 Cb 0.56 -0.20 -0.04 0.00 -1.06 0.00 0.00 38.32 37.57 2qfy h ASN 367 CO 0.03 0.77 0.47 0.74 -1.06 0.00 0.00 177.43 178.38 2qfy h THR 368 N 0.81 1.22 0.02 2.81 2.02 -0.81 0.12 112.91 119.09 2qfy h THR 368 Ca 0.18 -0.47 -0.00 0.00 0.77 0.00 0.00 66.41 66.89 2qfy h THR 368 Cb 0.29 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 66.81 2qfy h THR 368 CO -0.00 0.23 -0.01 0.58 0.37 0.00 0.00 175.52 176.69 2qfy h VAL 369 N 1.08 1.52 0.00 3.16 2.07 -1.19 -0.70 116.25 122.18 2qfy h VAL 369 Ca 0.28 -1.86 0.00 0.00 0.82 0.00 0.00 66.70 65.94 2qfy h VAL 369 Cb -0.05 2.73 0.00 0.00 -1.52 0.00 0.00 31.29 32.45 2qfy h VAL 369 CO -0.05 0.46 -0.11 1.56 0.02 0.00 0.00 177.57 179.45 2qfy h GLN 370 N -0.86 0.00 -0.78 1.57 4.20 -0.98 -2.52 115.11 115.74 2qfy h GLN 370 Ca -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2qfy h GLN 370 Cb 0.78 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.52 2qfy h GLN 370 CO 0.00 0.00 0.46 0.37 -0.67 0.00 0.00 178.83 178.99 2qfy h GLN 371 N -0.66 1.06 0.00 1.46 5.75 -1.00 -3.17 115.11 118.55 2qfy h GLN 371 Ca 0.00 -0.10 0.00 0.00 -0.15 0.00 0.00 58.65 58.40 2qfy h GLN 371 Cb 0.11 -0.22 0.00 0.00 1.07 0.00 0.00 27.48 28.44 2qfy h GLN 371 CO 0.00 0.75 -1.33 -0.25 -2.65 0.00 0.00 178.83 175.35 2qfy n ASP 372 N -4.37 0.75 0.00 -0.69 8.00 -0.53 -4.99 116.55 114.71 2qfy n ASP 372 Ca 0.08 -0.52 0.00 0.00 0.71 0.00 0.00 54.79 55.06 2qfy n ASP 372 Cb 0.07 1.39 0.00 0.00 -0.02 0.00 0.00 41.12 42.56 2qfy n ASP 372 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qfy n GLY 373 N 1.43 0.49 3.63 0.44 0.00 -0.95 -4.98 105.19 105.25 2qfy n GLY 373 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 2qfy n GLY 373 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qfy s ILE 374 N -2.28 4.62 0.32 -0.61 1.01 -0.29 -4.94 121.20 119.03 2qfy s ILE 374 Ca 0.00 1.56 -0.08 0.00 0.00 0.00 0.00 60.65 62.14 2qfy s ILE 374 Cb 0.00 -4.31 0.01 0.00 0.01 0.00 0.00 42.46 38.16 2qfy s ILE 374 CO 0.00 -0.38 0.53 0.00 0.00 0.00 0.00 174.94 175.09 2qfy s MET 375 N 3.37 1.85 0.52 2.79 0.23 -1.26 -3.57 119.30 123.23 2qfy s MET 375 Ca 0.41 -1.55 0.05 0.00 -1.03 0.00 0.00 55.69 53.57 2qfy s MET 375 Cb -0.13 0.48 0.04 0.00 -1.53 0.00 0.00 34.83 33.69 2qfy s MET 375 CO 0.14 -0.79 0.72 0.95 -2.03 0.00 0.00 175.02 174.01 2qfy s THR 376 N -3.23 2.66 0.10 3.16 -4.23 -1.26 0.10 115.64 112.94 2qfy s THR 376 Ca 0.25 -0.84 -0.26 0.00 -1.18 0.00 0.00 61.69 59.66 2qfy s THR 376 Cb -0.01 -2.82 -0.09 0.00 1.34 0.00 0.00 72.50 70.91 2qfy s THR 376 CO 0.15 0.00 1.44 0.50 -0.54 0.00 0.00 174.62 176.17 2qfy h LYS 377 N 0.25 -0.35 -0.93 3.99 3.64 -1.75 -1.99 116.57 119.42 2qfy h LYS 377 Ca -0.39 0.02 0.26 0.00 -1.27 0.00 0.00 60.65 59.28 2qfy h LYS 377 Cb 1.29 0.08 -0.16 0.00 -0.41 0.00 0.00 32.23 33.02 2qfy h LYS 377 CO 0.46 -0.23 0.15 0.38 -2.27 0.00 0.00 179.45 177.94 2qfy h ASP 378 N -0.36 -0.21 0.28 4.20 2.03 -1.97 0.52 116.42 120.91 2qfy h ASP 378 Ca 0.05 0.24 -0.01 0.00 -0.73 0.00 0.00 57.03 56.58 2qfy h ASP 378 Cb 0.49 0.37 0.00 0.00 -0.83 0.00 0.00 39.33 39.37 2qfy h ASP 378 CO -0.44 -0.28 -0.13 -0.07 -1.03 0.00 0.00 179.24 177.29 2qfy h LEU 379 N 0.09 -0.31 -0.32 0.15 3.38 -1.82 -1.18 115.31 115.29 2qfy h LEU 379 Ca 0.59 -0.22 0.06 0.00 0.09 0.00 0.00 57.88 58.41 2qfy h LEU 379 Cb 1.25 0.08 -0.06 0.00 0.09 0.00 0.00 40.66 42.03 2qfy h LEU 379 CO -0.79 0.11 -0.04 0.00 0.09 0.00 0.00 178.44 177.81 2qfy h ALA 380 N -0.30 0.24 0.00 1.53 0.00 -0.58 0.28 119.26 120.43 2qfy h ALA 380 Ca -0.04 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2qfy h ALA 380 Cb 0.51 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 2qfy h ALA 380 CO 0.06 -0.44 -0.00 1.25 0.00 0.00 0.00 179.25 180.12 2qfy h LEU 381 N 0.04 0.00 0.00 0.00 5.85 0.55 0.08 115.31 121.83 2qfy h LEU 381 Ca 0.15 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.77 2qfy h LEU 381 Cb 0.22 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 2qfy h LEU 381 CO -0.30 0.00 -1.03 0.00 -0.34 0.00 0.00 178.44 176.77 2qfy h ALA 382 N 2.00 0.64 -0.52 1.25 0.00 0.73 -3.31 119.26 120.05 2qfy h ALA 382 Ca -0.00 -0.51 -0.21 0.00 0.00 0.00 0.00 54.91 54.19 2qfy h ALA 382 Cb 0.12 0.12 -0.13 0.00 0.00 0.00 0.00 17.79 17.90 2qfy h ALA 382 CO 0.00 0.58 0.27 0.00 0.00 0.00 0.00 179.25 180.10 2qfy n GLY 384 N -0.22 0.52 3.38 0.00 0.00 -1.20 -4.99 105.19 102.67 2qfy n GLY 384 Ca 0.30 -0.20 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 2qfy n GLY 384 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qfy s ASN 385 N -2.27 5.43 -0.05 1.61 0.02 -0.30 -4.93 114.94 114.44 2qfy s ASN 385 Ca 0.00 -0.74 0.21 0.00 -1.02 0.00 0.00 52.86 51.31 2qfy s ASN 385 Cb 0.00 -1.95 -0.28 0.00 0.02 0.00 0.00 41.25 39.03 2qfy s ASN 385 CO 0.00 -0.25 0.44 0.59 0.02 0.00 0.00 177.10 177.90 2qfy n ASN 386 N 4.93 0.11 -4.59 -1.22 4.13 -1.26 -2.12 115.26 115.24 2qfy n ASN 386 Ca -0.13 0.05 -0.36 0.00 1.68 0.00 0.00 54.58 55.81 2qfy n ASN 386 Cb 0.48 1.54 0.08 0.00 -1.54 0.00 0.00 39.78 40.33 2qfy n ASN 386 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 2qfy n GLU 387 N -2.45 0.49 0.06 3.52 0.00 -1.26 -4.93 120.64 116.08 2qfy n GLU 387 Ca -0.11 0.22 -0.21 0.00 0.00 0.00 0.00 57.16 57.06 2qfy n GLU 387 Cb 0.73 -2.15 -0.12 0.00 0.00 0.00 0.00 31.44 29.91 2qfy n GLU 387 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.13 177.04 2qfy h ARG 388 N -0.22 0.64 0.00 3.44 1.12 -1.94 -3.15 114.38 114.26 2qfy h ARG 388 Ca -0.47 -0.77 0.00 0.00 -1.11 0.00 0.00 59.98 57.63 2qfy h ARG 388 Cb 1.34 0.24 0.00 0.00 -0.01 0.00 0.00 29.97 31.54 2qfy h ARG 388 CO 0.46 1.34 0.00 -1.13 -3.11 0.00 0.00 179.97 177.53 2qfy n SER 389 N -3.86 0.00 -0.25 -3.80 3.41 -1.26 -1.25 113.62 106.60 2qfy n SER 389 Ca -0.12 -0.10 0.13 0.00 -0.26 0.00 0.00 58.87 58.52 2qfy n SER 389 Cb 0.91 0.00 0.35 0.00 -0.26 0.00 0.00 64.21 65.21 2qfy n SER 389 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qfy n ALA 390 N -0.99 3.12 -2.45 7.33 0.00 -1.19 -4.94 120.51 121.39 2qfy n ALA 390 Ca 0.02 -0.42 -0.10 0.00 0.00 0.00 0.00 53.44 52.94 2qfy n ALA 390 Cb 0.01 -1.11 -0.09 0.00 0.00 0.00 0.00 19.45 18.26 2qfy n ALA 390 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2qfy s TYR 391 N -2.51 0.71 0.51 0.00 -0.85 -0.38 -4.69 117.35 110.13 2qfy s TYR 391 Ca 0.24 -1.05 0.01 0.00 -0.52 0.00 0.00 57.07 55.75 2qfy s TYR 391 Cb 0.19 -0.29 -0.00 0.00 0.38 0.00 0.00 41.96 42.24 2qfy s TYR 391 CO 0.53 -0.65 0.03 0.14 -1.52 0.00 0.00 175.55 174.08 2qfy s VAL 392 N -4.04 0.90 0.63 -3.49 -7.23 0.12 -4.93 120.40 102.36 2qfy s VAL 392 Ca 0.24 -2.00 -0.15 0.00 -1.81 0.00 0.00 61.98 58.27 2qfy s VAL 392 Cb 0.05 -2.07 -0.02 0.00 0.56 0.00 0.00 36.38 34.90 2qfy s VAL 392 CO 0.04 0.00 1.07 -0.89 -0.31 0.00 0.00 175.10 175.01 2qfy s THR 393 N -2.96 3.70 0.22 5.32 2.01 -1.26 -4.33 115.64 118.32 2qfy s THR 393 Ca 0.05 0.75 -0.08 0.00 0.31 0.00 0.00 61.69 62.72 2qfy s THR 393 Cb 0.00 -3.30 0.17 0.00 0.01 0.00 0.00 72.50 69.38 2qfy s THR 393 CO 0.04 -0.53 1.73 0.74 -0.69 0.00 0.00 174.62 175.90 2qfy h THR 394 N 0.10 0.70 -0.07 -0.82 2.02 -1.10 0.13 112.91 113.86 2qfy h THR 394 Ca -0.46 -0.12 -0.15 0.00 0.77 0.00 0.00 66.41 66.44 2qfy h THR 394 Cb 1.22 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 2qfy h THR 394 CO 0.56 0.07 -0.63 -0.33 0.37 0.00 0.00 175.52 175.56 2qfy h GLU 395 N 0.36 0.27 -0.62 6.66 3.07 -1.92 -2.90 114.58 119.51 2qfy h GLU 395 Ca 0.33 -0.19 -0.09 0.00 -0.50 0.00 0.00 59.36 58.91 2qfy h GLU 395 Cb 0.47 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.38 2qfy h GLU 395 CO -0.36 0.81 0.03 0.93 -1.40 0.00 0.00 179.01 179.02 2qfy h GLU 396 N 0.20 1.06 -0.08 2.33 5.08 -1.47 -0.31 114.58 121.39 2qfy h GLU 396 Ca -0.01 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 58.03 2qfy h GLU 396 Cb 1.15 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.28 2qfy h GLU 396 CO 0.10 1.02 0.04 0.35 -1.00 0.00 0.00 179.01 179.51 2qfy h PHE 397 N 0.98 0.11 -0.93 4.33 3.57 -0.78 -1.24 116.94 122.98 2qfy h PHE 397 Ca 0.18 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.70 2qfy h PHE 397 Cb 0.52 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.17 2qfy h PHE 397 CO 0.04 0.18 0.61 -0.07 -2.23 0.00 0.00 178.31 176.84 2qfy h LEU 398 N 0.00 1.03 -1.21 0.59 3.38 -1.32 -0.72 115.31 117.06 2qfy h LEU 398 Ca 0.03 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2qfy h LEU 398 Cb 0.12 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2qfy h LEU 398 CO -0.00 0.73 -0.14 0.44 0.09 0.00 0.00 178.44 179.55 2qfy h ASP 399 N 1.21 0.35 -0.16 -0.43 3.32 -0.80 -0.20 116.42 119.71 2qfy h ASP 399 Ca 0.35 -0.09 -0.04 0.00 0.02 0.00 0.00 57.03 57.28 2qfy h ASP 399 Cb -0.07 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 2qfy h ASP 399 CO -0.10 0.53 -0.04 0.00 -1.72 0.00 0.00 179.24 177.91 2qfy h ALA 400 N 1.51 0.22 -0.75 3.45 0.00 -0.20 -0.62 119.26 122.87 2qfy h ALA 400 Ca 0.06 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2qfy h ALA 400 Cb 0.46 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 2qfy h ALA 400 CO 0.03 -0.02 0.42 0.28 0.00 0.00 0.00 179.25 179.96 2qfy h VAL 401 N 0.02 1.22 -0.11 0.00 2.07 -0.90 -0.20 116.25 118.34 2qfy h VAL 401 Ca 0.04 -0.54 0.02 0.00 0.82 0.00 0.00 66.70 67.04 2qfy h VAL 401 Cb 0.47 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 2qfy h VAL 401 CO 0.02 0.24 -0.02 -0.08 0.02 0.00 0.00 177.57 177.75 2qfy h GLU 402 N 1.03 0.01 -0.96 1.57 4.81 -0.89 0.45 114.58 120.60 2qfy h GLU 402 Ca 0.26 -0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.59 2qfy h GLU 402 Cb 0.02 -0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.32 2qfy h GLU 402 CO -0.04 0.01 0.61 -0.22 -0.73 0.00 0.00 179.01 178.64 2qfy h LYS 403 N 0.01 0.96 0.00 1.92 3.64 -0.49 -1.24 116.57 121.36 2qfy h LYS 403 Ca 0.05 -0.06 -0.16 0.00 -1.27 0.00 0.00 60.65 59.21 2qfy h LYS 403 Cb 0.08 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.66 2qfy h LYS 403 CO -0.11 0.63 -0.78 -0.09 -2.27 0.00 0.00 179.45 176.84 2qfy h ARG 404 N 0.98 0.00 -0.44 1.90 2.43 -0.28 -2.73 114.38 116.24 2qfy h ARG 404 Ca 0.45 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.59 2qfy h ARG 404 Cb 0.40 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.93 2qfy h ARG 404 CO -0.21 0.75 0.17 1.25 -1.51 0.00 0.00 179.97 180.43 2qfy h LEU 405 N 0.00 0.61 -0.64 3.80 5.85 0.10 0.16 115.31 125.19 2qfy h LEU 405 Ca -0.01 -0.17 -0.10 0.00 0.84 0.00 0.00 57.88 58.44 2qfy h LEU 405 Cb 1.59 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.44 2qfy h LEU 405 CO 0.10 0.61 -0.04 -0.61 -0.34 0.00 0.00 178.44 178.16 2qfy h GLN 406 N 0.57 1.03 0.10 1.25 4.15 -1.38 -0.03 115.11 120.80 2qfy h GLN 406 Ca 0.15 -0.34 -0.00 0.00 0.77 0.00 0.00 58.65 59.22 2qfy h GLN 406 Cb 0.20 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.80 2qfy h GLN 406 CO -0.01 1.03 -0.05 -0.22 -1.93 0.00 0.00 178.83 177.65 2qfy h LYS 407 N 0.93 -0.13 0.00 1.69 3.64 -1.14 -2.22 116.57 119.35 2qfy h LYS 407 Ca 0.16 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 2qfy h LYS 407 Cb 0.59 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.44 2qfy h LYS 407 CO 0.04 0.02 -0.07 0.93 -2.27 0.00 0.00 179.45 178.09 2qfy h GLU 408 N -0.25 0.00 0.00 1.90 5.08 -0.60 -2.46 114.58 118.25 2qfy h GLU 408 Ca -0.01 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2qfy h GLU 408 Cb 0.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 2qfy h GLU 408 CO 0.02 0.07 -0.08 0.82 -1.00 0.00 0.00 179.01 178.84 2qfy h ILE 409 N 0.00 0.14 0.27 3.13 2.04 -0.77 -3.32 117.51 119.00 2qfy h ILE 409 Ca -0.00 -1.15 -0.01 0.00 1.00 0.00 0.00 64.86 64.70 2qfy h ILE 409 Cb 0.60 2.02 0.00 0.00 -0.74 0.00 0.00 36.82 38.71 2qfy h ILE 409 CO 0.01 0.08 -0.13 0.11 0.00 0.00 0.00 178.15 178.22 2qfy h LYS 410 N 0.00 -0.35 0.00 2.37 1.57 -0.91 -3.49 116.57 115.77 2qfy h LYS 410 Ca -0.00 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2qfy h LYS 410 Cb 1.02 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.41 2qfy h LYS 410 CO 0.01 -0.23 0.00 0.45 -0.57 0.00 0.00 179.45 179.11