#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qfy s SER 3 N 0.00 6.56 0.32 -2.13 0.15 -1.26 -4.99 113.70 112.35 2qfy s SER 3 Ca 0.00 0.29 -0.29 0.00 0.70 0.00 0.00 55.95 56.65 2qfy s SER 3 Cb 0.00 -2.52 -0.12 0.00 -1.71 0.00 0.00 66.02 61.67 2qfy s SER 3 CO 0.00 -1.24 1.44 0.29 1.20 0.00 0.00 173.24 174.93 2qfy n LYS 4 N 7.75 2.40 -2.66 5.44 5.02 -1.26 -4.97 118.16 129.88 2qfy n LYS 4 Ca 0.10 0.85 -0.42 0.00 -2.02 0.00 0.00 58.31 56.81 2qfy n LYS 4 Cb 0.49 -2.53 -0.03 0.00 -0.02 0.00 0.00 35.03 32.94 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 -0.66 4.61 -0.49 -0.18 1.01 0.04 -4.78 121.20 120.75 2qfy s ILE 5 Ca 0.59 1.94 -0.24 0.00 0.00 0.00 0.00 60.65 62.94 2qfy s ILE 5 Cb -0.54 -4.24 0.03 0.00 0.01 0.00 0.00 42.46 37.72 2qfy s ILE 5 CO 0.57 0.19 0.88 -0.75 0.00 0.00 0.00 174.94 175.84 2qfy s LYS 6 N 0.75 3.41 -0.13 2.79 2.47 -1.26 -0.99 119.74 126.78 2qfy s LYS 6 Ca 0.52 -0.10 -0.29 0.00 -1.56 0.00 0.00 55.97 54.54 2qfy s LYS 6 Cb -0.23 -3.98 -0.01 0.00 -1.46 0.00 0.00 37.83 32.15 2qfy s LYS 6 CO 0.29 -1.29 1.00 0.08 0.16 0.00 0.00 175.35 175.59 2qfy s VAL 7 N 3.67 4.77 -0.00 4.02 1.01 -1.11 -4.96 120.40 127.79 2qfy s VAL 7 Ca 0.32 2.02 -0.23 0.00 0.00 0.00 0.00 61.98 64.09 2qfy s VAL 7 Cb -0.12 -4.30 -0.15 0.00 0.00 0.00 0.00 36.38 31.81 2qfy s VAL 7 CO 0.22 -0.02 1.06 0.50 0.00 0.00 0.00 175.10 176.86 2qfy h LYS 8 N 7.16 -0.54 -6.12 2.72 3.64 -1.95 -3.45 116.57 118.04 2qfy h LYS 8 Ca -0.29 0.04 -0.57 0.00 -1.27 0.00 0.00 60.65 58.56 2qfy h LYS 8 Cb 1.13 0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 33.05 2qfy h LYS 8 CO 0.87 -0.23 -0.38 -1.14 -2.27 0.00 0.00 179.45 176.30 2qfy s GLN 9 N -4.30 3.51 0.80 1.90 2.00 -1.26 -5.03 119.66 117.28 2qfy s GLN 9 Ca -0.13 -0.34 -0.11 0.00 -2.00 0.00 0.00 55.36 52.78 2qfy s GLN 9 Cb 0.02 -2.90 0.07 0.00 0.80 0.00 0.00 33.01 31.00 2qfy s GLN 9 CO 0.45 0.48 1.11 -1.25 -0.50 0.00 0.00 175.29 175.58 2qfy s PRO 10 N -2.97 1.97 -0.06 1.67 0.04 -1.26 -4.76 135.00 129.64 2qfy s PRO 10 Ca 0.38 1.31 0.06 0.00 0.04 0.00 0.00 61.00 62.79 2qfy s PRO 10 Cb -0.12 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.56 2qfy s PRO 10 CO 0.28 -1.88 -0.25 0.08 0.04 0.00 0.00 177.00 175.27 2qfy s VAL 11 N -2.75 2.09 -0.16 -0.36 1.01 -0.26 -4.72 120.40 115.26 2qfy s VAL 11 Ca 0.64 -1.06 -0.21 0.00 0.00 0.00 0.00 61.98 61.35 2qfy s VAL 11 Cb -0.19 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.40 2qfy s VAL 11 CO 0.55 0.57 0.61 -0.69 0.00 0.00 0.00 175.10 176.14 2qfy s VAL 12 N -0.20 5.06 -0.15 2.92 1.01 -0.18 -0.37 120.40 128.50 2qfy s VAL 12 Ca -0.02 1.19 -0.00 0.00 0.00 0.00 0.00 61.98 63.14 2qfy s VAL 12 Cb -0.13 -3.94 -0.01 0.00 0.00 0.00 0.00 36.38 32.30 2qfy s VAL 12 CO 0.03 0.18 -0.13 -0.70 0.00 0.00 0.00 175.10 174.49 2qfy s GLU 13 N 1.44 3.33 -0.32 2.72 2.12 -0.16 0.04 118.70 127.88 2qfy s GLU 13 Ca 0.30 -0.70 -0.02 0.00 0.36 0.00 0.00 54.97 54.91 2qfy s GLU 13 Cb -0.16 -2.67 0.06 0.00 0.26 0.00 0.00 34.13 31.61 2qfy s GLU 13 CO 0.12 0.11 0.04 -0.51 -0.54 0.00 0.00 175.26 174.47 2qfy s LEU 14 N 0.62 4.11 0.55 2.70 1.43 -0.01 -0.73 118.68 127.36 2qfy s LEU 14 Ca -0.07 -1.36 -0.18 0.00 -1.03 0.00 0.00 54.13 51.49 2qfy s LEU 14 Cb -0.16 -1.74 -0.06 0.00 0.03 0.00 0.00 46.19 44.27 2qfy s LEU 14 CO 0.03 -0.30 1.05 -0.62 0.23 0.00 0.00 176.35 176.74 2qfy s ASP 15 N 1.33 5.99 0.00 2.29 3.68 -0.01 -0.87 116.67 129.09 2qfy s ASP 15 Ca -0.03 1.88 0.00 0.00 2.13 0.00 0.00 52.55 56.53 2qfy s ASP 15 Cb -0.20 -2.55 0.00 0.00 -1.45 0.00 0.00 42.92 38.72 2qfy s ASP 15 CO -0.01 -1.02 0.00 0.61 0.13 0.00 0.00 175.17 174.88 2qfy n GLY 16 N -0.65 4.70 3.54 2.66 0.00 -1.26 -1.05 105.19 113.13 2qfy n GLY 16 Ca 0.09 -1.70 -0.26 0.00 0.00 0.00 0.00 46.02 44.15 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 0.72 4.07 0.00 1.61 1.01 -0.77 -4.05 116.67 119.27 2qfy s ASP 17 Ca 0.00 -0.68 0.00 0.00 0.71 0.00 0.00 52.55 52.58 2qfy s ASP 17 Cb 0.00 -0.61 0.00 0.00 1.01 0.00 0.00 42.92 43.32 2qfy s ASP 17 CO 0.00 0.09 0.00 -0.62 0.21 0.00 0.00 175.17 174.85 2qfy n GLU 18 N -0.07 0.00 -0.20 8.23 1.02 -1.26 -1.61 120.64 126.75 2qfy n GLU 18 Ca -0.10 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 56.99 2qfy n GLU 18 Cb 0.56 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 32.04 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 0.64 0.00 3.49 4.05 -1.95 -0.82 114.93 120.34 2qfy h MET 19 Ca 0.00 -0.04 -0.05 0.00 -0.28 0.00 0.00 59.70 59.33 2qfy h MET 19 Cb 0.00 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 30.65 2qfy h MET 19 CO 0.00 0.42 -0.25 1.79 0.23 0.00 0.00 176.91 179.11 2qfy h THR 20 N 0.66 1.01 -0.37 -0.77 1.35 -1.83 -1.33 112.91 111.63 2qfy h THR 20 Ca 0.24 -0.89 -0.10 0.00 -0.55 0.00 0.00 66.41 65.10 2qfy h THR 20 Cb 0.06 1.50 -0.01 0.00 -1.73 0.00 0.00 68.15 67.98 2qfy h THR 20 CO -0.12 0.24 -0.17 -0.09 -0.25 0.00 0.00 175.52 175.13 2qfy h ARG 21 N 0.00 0.76 0.09 4.72 2.43 -0.22 0.26 114.38 122.42 2qfy h ARG 21 Ca -0.00 -0.33 -0.00 0.00 -0.81 0.00 0.00 59.98 58.83 2qfy h ARG 21 Cb 0.48 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2qfy h ARG 21 CO 0.03 0.95 -0.04 0.82 -1.51 0.00 0.00 179.97 180.21 2qfy h ILE 22 N 0.56 0.91 -0.78 1.20 1.08 -0.64 -1.71 117.51 118.14 2qfy h ILE 22 Ca 0.08 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.56 2qfy h ILE 22 Cb 0.71 0.91 -0.04 0.00 -3.07 0.00 0.00 36.82 35.33 2qfy h ILE 22 CO 0.05 0.00 0.51 0.40 -0.69 0.00 0.00 178.15 178.43 2qfy h ILE 23 N -0.12 1.19 -0.52 -0.67 2.04 -1.14 -2.76 117.51 115.54 2qfy h ILE 23 Ca -0.01 -0.36 0.05 0.00 1.00 0.00 0.00 64.86 65.54 2qfy h ILE 23 Cb 0.09 0.06 -0.04 0.00 -0.74 0.00 0.00 36.82 36.18 2qfy h ILE 23 CO 0.02 0.19 0.26 -0.25 0.00 0.00 0.00 178.15 178.37 2qfy h TRP 24 N 1.04 0.48 -0.55 1.37 2.91 -0.18 -1.52 115.95 119.51 2qfy h TRP 24 Ca 0.29 0.02 -0.08 0.00 1.13 0.00 0.00 58.89 60.25 2qfy h TRP 24 Cb -0.11 -0.14 -0.02 0.00 -0.51 0.00 0.00 29.16 28.38 2qfy h TRP 24 CO -0.02 0.23 0.04 0.22 -1.03 0.00 0.00 178.44 177.88 2qfy h ASP 25 N 0.51 0.87 -0.44 2.65 1.82 -1.04 -1.84 116.42 118.96 2qfy h ASP 25 Ca 0.23 -0.21 -0.14 0.00 -0.39 0.00 0.00 57.03 56.52 2qfy h ASP 25 Cb 0.14 -0.23 -0.01 0.00 0.68 0.00 0.00 39.33 39.90 2qfy h ASP 25 CO -0.16 0.91 -0.25 0.50 -1.61 0.00 0.00 179.24 178.62 2qfy h LYS 26 N 0.84 0.96 -0.08 0.28 3.64 -1.27 -1.07 116.57 119.88 2qfy h LYS 26 Ca 0.17 -0.43 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 2qfy h LYS 26 Cb 0.45 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.24 2qfy h LYS 26 CO 0.02 1.09 0.05 0.82 -2.27 0.00 0.00 179.45 179.17 2qfy h ILE 27 N 0.82 1.03 -0.08 2.00 2.04 -1.06 0.15 117.51 122.40 2qfy h ILE 27 Ca 0.10 -0.05 0.01 0.00 1.00 0.00 0.00 64.86 65.92 2qfy h ILE 27 Cb 0.83 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 2qfy h ILE 27 CO 0.07 0.02 0.02 0.50 0.00 0.00 0.00 178.15 178.76 2qfy h LYS 28 N 0.11 0.05 -0.15 2.37 3.64 -1.23 0.32 116.57 121.69 2qfy h LYS 28 Ca 0.03 -0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.27 2qfy h LYS 28 Cb -0.01 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2qfy h LYS 28 CO -0.01 0.04 -0.51 0.87 -2.27 0.00 0.00 179.45 177.57 2qfy h LYS 29 N 0.06 0.41 0.00 1.90 1.79 -1.08 -0.52 116.57 119.12 2qfy h LYS 29 Ca 0.04 -0.24 -0.31 0.00 -2.18 0.00 0.00 60.65 57.96 2qfy h LYS 29 Cb 0.03 0.02 -0.06 0.00 -1.58 0.00 0.00 32.23 30.64 2qfy h LYS 29 CO -0.04 0.82 -2.16 1.63 -1.08 0.00 0.00 179.45 178.61 2qfy n LYS 30 N -3.96 1.16 -0.02 3.15 4.76 0.03 -4.32 118.16 118.97 2qfy n LYS 30 Ca -0.02 0.01 0.07 0.00 -2.87 0.00 0.00 58.31 55.49 2qfy n LYS 30 Cb 0.56 -1.43 -0.13 0.00 -1.84 0.00 0.00 35.03 32.19 2qfy n LYS 30 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2qfy n LEU 31 N -2.68 0.00 -0.01 -0.35 4.77 0.11 -4.71 117.00 114.13 2qfy n LEU 31 Ca -0.29 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.67 2qfy n LEU 31 Cb 1.03 0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 42.16 2qfy n LEU 31 CO 0.34 0.04 -0.14 -0.38 -1.33 0.00 0.00 177.39 175.92 2qfy n ILE 32 N -2.16 0.62 -0.27 -0.08 -0.00 -0.97 -4.71 119.36 111.80 2qfy n ILE 32 Ca -0.06 0.25 0.20 0.00 -0.00 0.00 0.00 62.75 63.15 2qfy n ILE 32 Cb 0.52 -1.55 0.51 0.00 -0.00 0.00 0.00 39.64 39.11 2qfy n ILE 32 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.55 176.48 2qfy h LEU 33 N -0.21 0.42 -1.86 1.39 3.38 -1.33 0.12 115.31 117.23 2qfy h LEU 33 Ca 0.00 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2qfy h LEU 33 Cb 0.21 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 2qfy h LEU 33 CO 0.00 0.15 -0.03 -0.65 0.09 0.00 0.00 178.44 178.00 2qfy h PRO 34 N 0.41 0.00 0.00 1.13 0.11 -1.80 -3.22 132.00 128.64 2qfy h PRO 34 Ca 0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.62 2qfy h PRO 34 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2qfy h PRO 34 CO -0.21 0.03 -1.46 0.66 -0.21 0.00 0.00 178.00 176.81 2qfy n TYR 35 N -3.18 0.00 -4.90 0.65 4.02 -0.11 -4.79 117.16 108.85 2qfy n TYR 35 Ca -0.01 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.61 2qfy n TYR 35 Cb 0.25 -0.25 -0.15 0.00 -0.02 0.00 0.00 39.34 39.17 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 -3.72 2.11 -0.83 7.72 1.43 -0.36 -0.78 118.68 124.26 2qfy s LEU 36 Ca -0.04 -0.48 -0.14 0.00 -1.03 0.00 0.00 54.13 52.45 2qfy s LEU 36 Cb 0.08 -1.11 0.21 0.00 0.03 0.00 0.00 46.19 45.41 2qfy s LEU 36 CO 0.49 0.23 0.78 -0.62 0.23 0.00 0.00 176.35 177.46 2qfy s ASP 37 N -0.88 6.75 -0.01 2.29 2.15 -0.16 -4.57 116.67 122.24 2qfy s ASP 37 Ca 0.09 -2.65 0.05 0.00 0.43 0.00 0.00 52.55 50.47 2qfy s ASP 37 Cb -0.09 -2.22 -0.03 0.00 -0.30 0.00 0.00 42.92 40.29 2qfy s ASP 37 CO 0.01 -0.60 -0.17 0.68 -0.17 0.00 0.00 175.17 174.92 2qfy s VAL 38 N 0.29 2.88 -0.54 1.11 -7.23 -1.26 -2.75 120.40 112.90 2qfy s VAL 38 Ca 0.18 -0.92 -0.19 0.00 -1.81 0.00 0.00 61.98 59.25 2qfy s VAL 38 Cb -0.10 -2.15 0.08 0.00 0.56 0.00 0.00 36.38 34.77 2qfy s VAL 38 CO -0.09 0.50 0.64 -0.62 -0.31 0.00 0.00 175.10 175.22 2qfy s ASP 39 N -0.97 6.20 -0.27 4.85 2.15 -1.26 -5.02 116.67 122.35 2qfy s ASP 39 Ca 0.13 -1.18 -0.15 0.00 0.43 0.00 0.00 52.55 51.78 2qfy s ASP 39 Cb -0.11 -2.29 -0.04 0.00 -0.30 0.00 0.00 42.92 40.19 2qfy s ASP 39 CO 0.02 -0.96 0.38 -0.76 -0.17 0.00 0.00 175.17 173.67 2qfy s LEU 40 N 2.56 4.04 -0.69 -1.34 1.43 -1.26 -1.10 118.68 122.31 2qfy s LEU 40 Ca 0.12 0.31 -0.22 0.00 -1.03 0.00 0.00 54.13 53.31 2qfy s LEU 40 Cb -0.22 -2.44 0.08 0.00 0.03 0.00 0.00 46.19 43.65 2qfy s LEU 40 CO 0.09 -0.18 0.98 -0.54 0.23 0.00 0.00 176.35 176.93 2qfy s LYS 41 N 2.03 3.17 -0.05 1.70 -0.14 0.51 -4.91 119.74 122.04 2qfy s LYS 41 Ca 0.15 -0.99 -0.27 0.00 -1.36 0.00 0.00 55.97 53.51 2qfy s LYS 41 Cb -0.16 -4.33 -0.03 0.00 -1.68 0.00 0.00 37.83 31.63 2qfy s LYS 41 CO 0.10 -1.80 0.85 -0.47 -0.76 0.00 0.00 175.35 173.26 2qfy s TYR 42 N 3.82 3.60 -0.14 3.18 5.04 -1.26 -0.98 117.35 130.60 2qfy s TYR 42 Ca 0.23 1.46 -0.01 0.00 -2.44 0.00 0.00 57.07 56.31 2qfy s TYR 42 Cb -0.16 -2.98 0.04 0.00 0.35 0.00 0.00 41.96 39.21 2qfy s TYR 42 CO 0.07 0.00 -0.04 0.71 -1.34 0.00 0.00 175.55 174.95 2qfy s TYR 43 N 1.07 1.38 -0.51 4.97 1.51 0.09 -4.97 117.35 120.89 2qfy s TYR 43 Ca 0.44 -0.79 -0.25 0.00 -1.01 0.00 0.00 57.07 55.46 2qfy s TYR 43 Cb -0.19 -1.17 0.03 0.00 -0.11 0.00 0.00 41.96 40.52 2qfy s TYR 43 CO 0.22 -0.53 0.97 0.34 -1.11 0.00 0.00 175.55 175.43 2qfy s ASP 44 N 1.74 6.44 -0.44 2.29 -1.08 -1.26 -0.83 116.67 123.53 2qfy s ASP 44 Ca 0.03 -0.04 0.04 0.00 -0.52 0.00 0.00 52.55 52.06 2qfy s ASP 44 Cb -0.14 -2.46 0.59 0.00 -1.46 0.00 0.00 42.92 39.45 2qfy s ASP 44 CO -0.07 -1.16 1.81 0.18 0.52 0.00 0.00 175.17 176.44 2qfy n LEU 45 N 7.43 6.22 -4.74 -1.34 4.77 -0.22 -4.52 117.00 124.60 2qfy n LEU 45 Ca 0.05 -3.80 -0.31 0.00 -0.03 0.00 0.00 56.01 51.93 2qfy n LEU 45 Cb 0.48 -0.80 0.11 0.00 -2.33 0.00 0.00 43.42 40.89 2qfy n LEU 45 CO 0.65 1.20 0.69 -0.94 -1.33 0.00 0.00 177.39 177.66 2qfy s SER 46 N -1.75 4.05 0.20 -1.43 1.04 -1.25 -4.72 113.70 109.84 2qfy s SER 46 Ca 0.55 1.77 -0.10 0.00 0.48 0.00 0.00 55.95 58.65 2qfy s SER 46 Cb 0.47 -2.44 0.20 0.00 0.10 0.00 0.00 66.02 64.35 2qfy s SER 46 CO 0.06 -2.32 1.81 0.58 0.98 0.00 0.00 173.24 174.36 2qfy h VAL 47 N -1.33 1.00 -0.83 5.02 2.07 -1.87 -1.21 116.25 119.11 2qfy h VAL 47 Ca -0.45 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 66.86 2qfy h VAL 47 Cb 1.25 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 31.23 2qfy h VAL 47 CO 0.51 0.12 0.54 -0.08 0.02 0.00 0.00 177.57 178.69 2qfy h GLU 48 N 0.68 1.05 -0.41 1.57 4.81 -1.97 0.86 114.58 121.16 2qfy h GLU 48 Ca 0.27 -0.06 -0.13 0.00 -0.13 0.00 0.00 59.36 59.31 2qfy h GLU 48 Cb 0.13 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 2qfy h GLU 48 CO -0.15 0.69 -0.24 1.03 -0.73 0.00 0.00 179.01 179.61 2qfy h SER 49 N 1.08 0.93 -0.35 1.04 0.87 -1.72 -1.17 113.55 114.23 2qfy h SER 49 Ca 0.32 -0.42 -0.12 0.00 -1.23 0.00 0.00 61.79 60.34 2qfy h SER 49 Cb -0.06 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.63 2qfy h SER 49 CO -0.09 1.14 -0.21 0.03 -0.53 0.00 0.00 176.83 177.18 2qfy h ARG 50 N 0.72 0.84 -0.12 2.24 3.08 -0.90 -1.99 114.38 118.25 2qfy h ARG 50 Ca 0.09 -0.34 -0.01 0.00 0.07 0.00 0.00 59.98 59.79 2qfy h ARG 50 Cb 0.81 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.82 2qfy h ARG 50 CO 0.07 0.97 0.02 0.22 -1.07 0.00 0.00 179.97 180.18 2qfy h ASP 51 N 0.74 0.19 -0.41 7.04 3.58 -0.74 1.35 116.42 128.16 2qfy h ASP 51 Ca 0.10 -0.25 0.03 0.00 0.42 0.00 0.00 57.03 57.32 2qfy h ASP 51 Cb 0.74 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.71 2qfy h ASP 51 CO 0.06 0.39 0.27 0.00 -2.88 0.00 0.00 179.24 177.09 2qfy h ALA 52 N 0.80 1.82 -0.71 -0.78 0.00 -1.10 -1.24 119.26 118.04 2qfy h ALA 52 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2qfy h ALA 52 Cb 0.29 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2qfy h ALA 52 CO 0.00 0.14 0.00 0.25 0.00 0.00 0.00 179.25 179.64 2qfy n THR 53 N -4.48 1.08 -3.83 0.00 -2.24 -0.76 -4.94 114.28 99.12 2qfy n THR 53 Ca 0.04 -1.02 -0.28 0.00 -2.27 0.00 0.00 64.05 60.52 2qfy n THR 53 Cb 0.14 0.46 0.04 0.00 -2.10 0.00 0.00 70.33 68.87 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 1.55 -4.72 -0.05 3.42 7.64 -0.22 -1.24 113.62 119.99 2qfy n SER 54 Ca 0.24 -0.74 -0.01 0.00 1.01 0.00 0.00 58.87 59.38 2qfy n SER 54 Cb 0.64 -4.14 -0.00 0.00 -1.01 0.00 0.00 64.21 59.69 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 -2.90 -5.01 0.20 6.43 2.03 0.45 -4.85 116.55 112.90 2qfy n ASP 55 Ca -0.00 0.02 0.06 0.00 0.52 0.00 0.00 54.79 55.39 2qfy n ASP 55 Cb 0.55 -2.57 0.42 0.00 -0.72 0.00 0.00 41.12 38.80 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 0.31 0.00 -0.22 -0.67 1.63 -1.41 -2.80 116.57 113.41 2qfy h LYS 56 Ca -0.01 0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.74 2qfy h LYS 56 Cb 0.69 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.30 2qfy h LYS 56 CO 0.02 0.33 -0.05 0.97 -3.45 0.00 0.00 179.45 177.26 2qfy h ILE 57 N 0.00 1.17 -0.41 2.00 6.09 -1.88 -1.23 117.51 123.25 2qfy h ILE 57 Ca -0.00 -0.71 -0.08 0.00 -1.37 0.00 0.00 64.86 62.70 2qfy h ILE 57 Cb 0.73 1.07 -0.01 0.00 0.47 0.00 0.00 36.82 39.07 2qfy h ILE 57 CO 0.04 0.23 -0.06 0.74 -3.07 0.00 0.00 178.15 176.03 2qfy h THR 58 N 0.33 1.27 -0.28 2.19 2.02 -1.85 -0.69 112.91 115.89 2qfy h THR 58 Ca 0.07 -1.13 -0.03 0.00 0.77 0.00 0.00 66.41 66.10 2qfy h THR 58 Cb 0.31 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.89 2qfy h THR 58 CO 0.01 0.38 0.06 -0.61 0.37 0.00 0.00 175.52 175.73 2qfy h GLN 59 N 0.58 0.46 -0.68 6.66 4.15 -1.51 -1.50 115.11 123.27 2qfy h GLN 59 Ca 0.11 -0.11 0.05 0.00 0.77 0.00 0.00 58.65 59.46 2qfy h GLN 59 Cb 0.57 -0.06 -0.05 0.00 0.21 0.00 0.00 27.48 28.15 2qfy h GLN 59 CO 0.03 0.55 0.40 -0.44 -1.93 0.00 0.00 178.83 177.44 2qfy h ASP 60 N 0.29 0.61 -0.63 -0.69 3.32 -1.06 -1.22 116.42 117.04 2qfy h ASP 60 Ca 0.09 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 2qfy h ASP 60 Cb 0.30 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 2qfy h ASP 60 CO 0.00 0.41 0.27 0.00 -1.72 0.00 0.00 179.24 178.20 2qfy h ALA 61 N 1.33 0.82 -0.32 3.45 0.00 -0.96 0.31 119.26 123.89 2qfy h ALA 61 Ca 0.29 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2qfy h ALA 61 Cb 0.13 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2qfy h ALA 61 CO -0.15 0.42 0.21 0.00 0.00 0.00 0.00 179.25 179.72 2qfy h ALA 62 N 1.11 0.41 -0.29 0.00 0.00 -0.63 -0.93 119.26 118.93 2qfy h ALA 62 Ca 0.21 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 2qfy h ALA 62 Cb 0.18 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2qfy h ALA 62 CO -0.02 -0.14 -0.04 0.93 0.00 0.00 0.00 179.25 179.98 2qfy h GLU 63 N 0.42 0.45 -0.39 0.00 5.08 -0.91 -2.10 114.58 117.13 2qfy h GLU 63 Ca 0.12 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.34 2qfy h GLU 63 Cb -0.03 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 2qfy h GLU 63 CO -0.04 0.51 0.08 0.00 -1.00 0.00 0.00 179.01 178.56 2qfy h ALA 64 N 1.54 0.52 -0.66 3.43 0.00 -0.35 -0.79 119.26 122.95 2qfy h ALA 64 Ca 0.09 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.86 2qfy h ALA 64 Cb 0.34 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.93 2qfy h ALA 64 CO 0.01 0.22 0.36 0.82 0.00 0.00 0.00 179.25 180.67 2qfy h ILE 65 N 0.50 0.95 -0.71 0.00 2.04 -0.61 0.11 117.51 119.80 2qfy h ILE 65 Ca 0.12 -0.23 -0.04 0.00 1.00 0.00 0.00 64.86 65.71 2qfy h ILE 65 Cb 0.34 0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 2qfy h ILE 65 CO 0.01 0.12 0.27 0.50 0.00 0.00 0.00 178.15 179.05 2qfy h LYS 66 N 0.66 1.05 0.18 2.37 1.63 -1.09 0.41 116.57 121.78 2qfy h LYS 66 Ca 0.30 -0.19 -0.01 0.00 -0.85 0.00 0.00 60.65 59.91 2qfy h LYS 66 Cb 0.20 -0.17 0.00 0.00 -0.60 0.00 0.00 32.23 31.66 2qfy h LYS 66 CO -0.19 0.86 -0.09 -0.22 -3.45 0.00 0.00 179.45 176.36 2qfy h LYS 67 N 1.02 -0.23 0.00 1.90 3.64 0.00 -3.35 116.57 119.56 2qfy h LYS 67 Ca 0.24 0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.53 2qfy h LYS 67 Cb 0.21 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 2qfy h LYS 67 CO -0.02 0.10 -0.96 1.88 -2.27 0.00 0.00 179.45 178.19 2qfy h TYR 68 N -0.59 0.00 0.00 1.91 -1.99 -0.78 -3.49 116.97 112.03 2qfy h TYR 68 Ca -0.02 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.71 2qfy h TYR 68 Cb 0.44 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.17 2qfy h TYR 68 CO 0.03 0.40 0.00 0.41 -0.00 0.00 0.00 178.16 179.00 2qfy n GLY 69 N 1.28 2.97 2.91 3.88 0.00 0.14 -4.89 105.19 111.48 2qfy n GLY 69 Ca -0.03 -0.84 -0.25 0.00 0.00 0.00 0.00 46.02 44.91 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 -0.90 0.86 0.02 1.61 1.01 -1.26 0.05 120.40 121.79 2qfy s VAL 70 Ca 0.00 -0.23 0.08 0.00 0.00 0.00 0.00 61.98 61.83 2qfy s VAL 70 Cb 0.00 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.48 2qfy s VAL 70 CO 0.00 0.32 -0.25 -0.83 0.00 0.00 0.00 175.10 174.35 2qfy s GLY 71 N 1.40 1.39 -0.12 4.51 0.00 0.41 -1.01 107.32 113.89 2qfy s GLY 71 Ca -0.02 -1.20 0.01 0.00 0.00 0.00 0.00 44.72 43.52 2qfy s GLY 71 CO -0.04 -1.05 -0.15 -0.42 0.00 0.00 0.00 173.10 171.43 2qfy s ILE 72 N -0.75 1.57 -0.08 0.90 1.01 0.11 0.08 121.20 124.03 2qfy s ILE 72 Ca 0.11 -0.67 0.04 0.00 0.00 0.00 0.00 60.65 60.14 2qfy s ILE 72 Cb -0.10 -1.44 -0.00 0.00 0.01 0.00 0.00 42.46 40.92 2qfy s ILE 72 CO 0.01 0.46 -0.23 -0.75 0.00 0.00 0.00 174.94 174.43 2qfy s LYS 73 N 1.13 2.70 0.48 2.79 2.20 0.12 -0.83 119.74 128.34 2qfy s LYS 73 Ca -0.03 -0.83 -0.18 0.00 -0.36 0.00 0.00 55.97 54.57 2qfy s LYS 73 Cb -0.14 -2.13 -0.09 0.00 -1.51 0.00 0.00 37.83 33.96 2qfy s LYS 73 CO -0.05 0.23 0.98 0.00 -0.36 0.00 0.00 175.35 176.15 2qfy s ALA 75 N -2.43 3.61 0.33 0.00 0.00 -1.26 -4.45 121.76 117.56 2qfy s ALA 75 Ca 0.61 1.55 0.08 0.00 0.00 0.00 0.00 51.96 54.19 2qfy s ALA 75 Cb -0.10 -3.61 -0.06 0.00 0.00 0.00 0.00 23.12 19.35 2qfy s ALA 75 CO 0.24 -1.01 -0.06 0.95 0.00 0.00 0.00 175.76 175.89 2qfy s THR 76 N -0.85 1.91 -0.17 0.00 -4.23 -1.26 -1.85 115.64 109.18 2qfy s THR 76 Ca 0.55 -2.14 -0.06 0.00 -1.18 0.00 0.00 61.69 58.86 2qfy s THR 76 Cb -0.46 -2.62 -0.04 0.00 1.34 0.00 0.00 72.50 70.72 2qfy s THR 76 CO 0.59 -0.20 0.04 -0.63 -0.54 0.00 0.00 174.62 173.87 2qfy s ILE 77 N -2.83 4.58 -0.43 2.99 1.01 -1.26 -4.80 121.20 120.47 2qfy s ILE 77 Ca 0.32 -0.11 -0.14 0.00 0.00 0.00 0.00 60.65 60.72 2qfy s ILE 77 Cb 0.04 -3.05 0.04 0.00 0.01 0.00 0.00 42.46 39.50 2qfy s ILE 77 CO 0.15 0.47 0.32 -0.89 0.00 0.00 0.00 174.94 174.99 2qfy s THR 78 N 0.33 5.11 0.37 2.92 2.01 -1.26 -4.79 115.64 120.33 2qfy s THR 78 Ca 0.02 -0.85 -0.28 0.00 0.31 0.00 0.00 61.69 60.88 2qfy s THR 78 Cb -0.13 -3.93 -0.11 0.00 0.01 0.00 0.00 72.50 68.34 2qfy s THR 78 CO 0.01 -0.40 1.48 -2.16 -0.69 0.00 0.00 174.62 172.86 2qfy s PRO 79 N 1.64 4.12 0.40 4.92 0.04 -1.26 -5.04 135.00 139.81 2qfy s PRO 79 Ca 0.04 2.56 0.05 0.00 0.04 0.00 0.00 61.00 63.69 2qfy s PRO 79 Cb -0.21 -2.97 0.05 0.00 0.04 0.00 0.00 34.50 31.40 2qfy s PRO 79 CO 0.08 -0.53 0.38 -0.40 0.04 0.00 0.00 177.00 176.57 2qfy n ASP 80 N 0.51 2.05 -0.18 6.66 5.68 -1.26 -4.62 116.55 125.39 2qfy n ASP 80 Ca 0.01 -2.29 -0.01 0.00 -0.50 0.00 0.00 54.79 52.00 2qfy n ASP 80 Cb 0.39 -0.11 0.08 0.00 -1.14 0.00 0.00 41.12 40.34 2qfy n ASP 80 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2qfy h GLU 81 N 0.00 0.31 -0.09 0.11 5.08 -2.00 -1.64 114.58 116.35 2qfy h GLU 81 Ca -0.23 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.14 2qfy h GLU 81 Cb 0.91 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 30.05 2qfy h GLU 81 CO 0.36 0.21 -0.18 0.00 -1.00 0.00 0.00 179.01 178.39 2qfy h ALA 82 N 1.39 -0.15 -0.75 3.43 0.00 -2.00 -2.38 119.26 118.80 2qfy h ALA 82 Ca 0.27 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.16 2qfy h ALA 82 Cb 0.34 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 2qfy h ALA 82 CO -0.31 -0.65 0.23 -0.09 0.00 0.00 0.00 179.25 178.44 2qfy h ARG 83 N -0.25 1.17 -0.93 0.00 2.43 -1.85 -0.55 114.38 114.40 2qfy h ARG 83 Ca 0.08 -0.25 0.08 0.00 -0.81 0.00 0.00 59.98 59.08 2qfy h ARG 83 Cb 0.37 -0.17 -0.07 0.00 -0.42 0.00 0.00 29.97 29.68 2qfy h ARG 83 CO -0.24 0.99 0.58 0.28 -1.51 0.00 0.00 179.97 180.07 2qfy h VAL 84 N 1.12 1.00 -0.02 0.20 2.07 -1.04 -0.16 116.25 119.42 2qfy h VAL 84 Ca 0.24 -0.34 -0.16 0.00 0.82 0.00 0.00 66.70 67.25 2qfy h VAL 84 Cb 0.31 -0.09 0.01 0.00 -1.52 0.00 0.00 31.29 30.00 2qfy h VAL 84 CO -0.01 0.18 -0.63 0.11 0.02 0.00 0.00 177.57 177.25 2qfy h LYS 85 N 1.00 0.46 -0.08 1.57 1.57 -1.08 0.20 116.57 120.21 2qfy h LYS 85 Ca 0.42 -0.47 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 2qfy h LYS 85 Cb 0.27 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 2qfy h LYS 85 CO -0.21 1.12 -0.26 1.49 -0.57 0.00 0.00 179.45 181.02 2qfy h GLU 86 N -0.01 0.14 -0.29 3.15 4.81 -0.81 -3.02 114.58 118.56 2qfy h GLU 86 Ca -0.07 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 2qfy h GLU 86 Cb 1.32 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.69 2qfy h GLU 86 CO 0.13 0.40 0.00 1.19 -0.73 0.00 0.00 179.01 179.99 2qfy n PHE 87 N -4.18 0.52 -4.00 0.92 3.01 -0.10 -5.00 117.46 108.64 2qfy n PHE 87 Ca -0.01 -0.60 -0.26 0.00 1.01 0.00 0.00 57.45 57.59 2qfy n PHE 87 Cb 0.35 -0.10 -0.03 0.00 -0.01 0.00 0.00 39.48 39.69 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 0.13 -0.15 -4.81 4.37 3.02 -0.31 -4.94 115.26 112.58 2qfy n ASN 88 Ca 0.13 -1.04 -0.32 0.00 -0.03 0.00 0.00 54.58 53.32 2qfy n ASN 88 Cb 0.52 -2.88 0.02 0.00 -0.61 0.00 0.00 39.78 36.83 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 -7.01 3.37 0.27 3.41 1.43 0.55 -4.97 118.68 115.73 2qfy s LEU 89 Ca 0.00 1.72 -0.00 0.00 -1.03 0.00 0.00 54.13 54.82 2qfy s LEU 89 Cb -0.00 -4.52 0.39 0.00 0.03 0.00 0.00 46.19 42.09 2qfy s LEU 89 CO 0.90 -1.22 1.76 0.45 0.23 0.00 0.00 176.35 178.47 2qfy h HIS 90 N 0.03 0.73 -2.38 0.29 3.86 -1.91 -3.47 115.15 112.31 2qfy h HIS 90 Ca -0.46 -0.11 0.19 0.00 -1.16 0.00 0.00 60.37 58.83 2qfy h HIS 90 Cb 1.21 -0.20 -0.05 0.00 1.06 0.00 0.00 27.41 29.43 2qfy h HIS 90 CO 0.60 0.73 0.59 -1.59 0.86 0.00 0.00 177.93 179.12 2qfy s LYS 91 N -4.86 1.17 -1.20 2.45 -2.85 -1.26 -5.06 119.74 108.13 2qfy s LYS 91 Ca -0.09 -0.73 -0.19 0.00 -1.00 0.00 0.00 55.97 53.97 2qfy s LYS 91 Cb 0.14 0.35 0.08 0.00 -2.06 0.00 0.00 37.83 36.34 2qfy s LYS 91 CO 0.80 -0.55 1.60 1.41 0.10 0.00 0.00 175.35 178.72 2qfy s MET 92 N -2.46 3.87 0.40 1.78 -2.45 -1.26 -4.95 119.30 114.23 2qfy s MET 92 Ca 0.19 -1.79 -0.26 0.00 -1.25 0.00 0.00 55.69 52.58 2qfy s MET 92 Cb -0.02 -5.42 -0.10 0.00 1.25 0.00 0.00 34.83 30.54 2qfy s MET 92 CO 0.04 -2.18 1.26 0.91 1.05 0.00 0.00 175.02 176.10 2qfy n TRP 93 N 8.21 2.11 -1.65 4.11 7.02 -1.26 -4.96 117.44 131.03 2qfy n TRP 93 Ca 0.42 0.51 -0.32 0.00 -1.02 0.00 0.00 57.50 57.09 2qfy n TRP 93 Cb 0.47 -2.38 0.05 0.00 -2.42 0.00 0.00 31.31 27.04 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 -2.13 2.74 -0.08 -0.99 1.02 -1.26 -4.41 119.74 114.62 2qfy s LYS 94 Ca 0.60 1.27 -0.36 0.00 0.02 0.00 0.00 55.97 57.50 2qfy s LYS 94 Cb -0.52 -1.95 -0.14 0.00 -0.52 0.00 0.00 37.83 34.70 2qfy s LYS 94 CO 0.59 -1.28 1.75 0.45 -0.92 0.00 0.00 175.35 175.93 2qfy n SER 95 N -2.73 2.94 -0.17 2.83 2.88 -1.26 -4.85 113.62 113.27 2qfy n SER 95 Ca 0.10 1.03 0.09 0.00 -1.33 0.00 0.00 58.87 58.75 2qfy n SER 95 Cb 0.52 -1.30 0.40 0.00 -0.75 0.00 0.00 64.21 63.08 2qfy n SER 95 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2qfy h PRO 96 N 7.74 0.63 -0.65 -1.46 0.11 -1.91 -1.26 132.00 135.21 2qfy h PRO 96 Ca -0.47 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 2qfy h PRO 96 Cb 1.29 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 2qfy h PRO 96 CO 0.93 0.42 0.37 -0.91 -0.21 0.00 0.00 178.00 178.60 2qfy h ASN 97 N 0.65 0.79 -0.68 -2.05 2.35 -1.99 0.22 115.58 114.88 2qfy h ASN 97 Ca 0.33 -0.08 -0.05 0.00 -0.55 0.00 0.00 56.30 55.95 2qfy h ASN 97 Cb 0.41 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 2qfy h ASN 97 CO -0.11 0.64 0.23 1.23 -1.65 0.00 0.00 177.43 177.77 2qfy h GLY 98 N 0.88 1.14 0.90 2.83 0.00 -1.63 -0.94 103.07 106.26 2qfy h GLY 98 Ca 0.23 -0.65 -0.06 0.00 0.00 0.00 0.00 47.33 46.85 2qfy h GLY 98 CO -0.04 0.61 -0.05 -0.84 0.00 0.00 0.00 176.54 176.21 2qfy h THR 99 N 1.03 1.27 -0.35 4.70 2.02 -0.88 -1.67 112.91 119.03 2qfy h THR 99 Ca 0.23 -1.07 -0.05 0.00 0.77 0.00 0.00 66.41 66.29 2qfy h THR 99 Cb 0.27 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.00 2qfy h THR 99 CO -0.01 0.35 0.03 0.40 0.37 0.00 0.00 175.52 176.65 2qfy h ILE 100 N 0.37 1.25 -0.92 3.11 2.04 -0.76 -2.09 117.51 120.52 2qfy h ILE 100 Ca 0.08 -0.91 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 2qfy h ILE 100 Cb 0.53 1.15 -0.04 0.00 -0.74 0.00 0.00 36.82 37.72 2qfy h ILE 100 CO 0.03 0.30 0.52 0.03 0.00 0.00 0.00 178.15 179.03 2qfy h ARG 101 N 0.42 1.27 -0.68 2.37 3.08 -1.17 -0.02 114.38 119.65 2qfy h ARG 101 Ca 0.10 -0.14 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 2qfy h ARG 101 Cb 0.41 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 2qfy h ARG 101 CO 0.01 0.91 0.26 -0.97 -1.07 0.00 0.00 179.97 179.11 2qfy h ASN 102 N 1.28 0.95 -0.11 7.04 -0.73 -1.12 0.63 115.58 123.51 2qfy h ASN 102 Ca 0.32 -0.18 -0.09 0.00 1.87 0.00 0.00 56.30 58.22 2qfy h ASN 102 Cb 0.00 -0.25 0.00 0.00 0.27 0.00 0.00 38.32 38.35 2qfy h ASN 102 CO -0.06 0.87 -0.28 0.40 -0.37 0.00 0.00 177.43 178.00 2qfy h ILE 103 N 0.97 1.38 0.13 2.57 2.04 -1.02 -3.32 117.51 120.26 2qfy h ILE 103 Ca 0.22 -1.58 -0.27 0.00 1.00 0.00 0.00 64.86 64.23 2qfy h ILE 103 Cb 0.23 2.11 0.01 0.00 -0.74 0.00 0.00 36.82 38.43 2qfy h ILE 103 CO -0.02 0.46 -1.23 -0.07 0.00 0.00 0.00 178.15 177.30 2qfy h LEU 104 N -0.04 0.46 0.00 1.44 3.38 -0.98 -3.50 115.31 116.07 2qfy h LEU 104 Ca -0.00 -0.48 0.12 0.00 0.09 0.00 0.00 57.88 57.61 2qfy h LEU 104 Cb 0.88 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 2qfy h LEU 104 CO 0.06 1.36 -0.16 0.61 0.09 0.00 0.00 178.44 180.41 2qfy n GLY 105 N 1.49 -1.88 0.00 0.83 0.00 0.22 -4.89 105.19 100.96 2qfy n GLY 105 Ca -0.09 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.63 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 -1.60 0.33 2.97 -0.02 0.00 -1.26 -4.58 105.19 101.04 2qfy n GLY 106 Ca 0.00 -1.85 -0.15 0.00 0.00 0.00 0.00 46.02 44.03 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 0.41 -0.29 2.61 2.01 0.06 -1.64 115.64 118.80 2qfy s THR 107 Ca 0.00 -0.39 -0.08 0.00 0.31 0.00 0.00 61.69 61.53 2qfy s THR 107 Cb 0.00 -0.38 -0.01 0.00 0.01 0.00 0.00 72.50 72.13 2qfy s THR 107 CO 0.00 0.00 0.11 -0.69 -0.69 0.00 0.00 174.62 173.35 2qfy s VAL 108 N -0.38 4.31 -0.21 3.82 1.01 0.84 -0.04 120.40 129.76 2qfy s VAL 108 Ca -0.01 -0.47 -0.14 0.00 0.00 0.00 0.00 61.98 61.36 2qfy s VAL 108 Cb -0.04 -3.17 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 2qfy s VAL 108 CO -0.00 0.13 0.34 -0.36 0.00 0.00 0.00 175.10 175.20 2qfy s PHE 109 N 1.57 3.36 -0.04 5.22 0.08 0.03 -0.45 117.98 127.75 2qfy s PHE 109 Ca 0.04 0.52 0.05 0.00 0.12 0.00 0.00 56.93 57.66 2qfy s PHE 109 Cb -0.17 -2.45 -0.01 0.00 -0.57 0.00 0.00 43.02 39.82 2qfy s PHE 109 CO 0.04 0.02 -0.21 1.03 -0.10 0.00 0.00 175.22 176.01 2qfy s ARG 110 N 1.21 2.05 -0.04 0.44 0.52 0.11 -1.60 118.95 121.64 2qfy s ARG 110 Ca 0.16 -0.74 -0.20 0.00 -0.52 0.00 0.00 55.73 54.43 2qfy s ARG 110 Cb -0.14 -1.79 0.04 0.00 0.52 0.00 0.00 34.95 33.58 2qfy s ARG 110 CO 0.07 0.32 0.44 -1.83 0.02 0.00 0.00 175.30 174.32 2qfy s GLU 111 N -0.11 0.79 0.59 3.54 -1.05 -1.06 -0.62 118.70 120.78 2qfy s GLU 111 Ca -0.02 0.01 -0.19 0.00 -0.15 0.00 0.00 54.97 54.62 2qfy s GLU 111 Cb -0.12 0.36 -0.03 0.00 -0.44 0.00 0.00 34.13 33.90 2qfy s GLU 111 CO 0.02 -0.22 1.23 -1.25 0.95 0.00 0.00 175.26 175.99 2qfy s PRO 112 N -1.19 2.94 -0.46 -4.83 0.04 -1.26 -0.65 135.00 129.59 2qfy s PRO 112 Ca -0.12 1.89 -0.16 0.00 0.04 0.00 0.00 61.00 62.66 2qfy s PRO 112 Cb -0.03 -1.95 0.06 0.00 0.04 0.00 0.00 34.50 32.61 2qfy s PRO 112 CO 0.06 -1.25 0.38 0.42 0.04 0.00 0.00 177.00 176.65 2qfy s ILE 113 N -1.53 5.22 -0.15 0.56 1.01 -0.20 -4.79 121.20 121.32 2qfy s ILE 113 Ca 0.78 -0.93 -0.22 0.00 0.00 0.00 0.00 60.65 60.28 2qfy s ILE 113 Cb -0.32 -4.08 -0.03 0.00 0.01 0.00 0.00 42.46 38.04 2qfy s ILE 113 CO 0.35 -0.52 0.67 -0.69 0.00 0.00 0.00 174.94 174.76 2qfy s VAL 114 N 1.70 5.01 -0.28 2.92 1.01 -1.26 -4.77 120.40 124.74 2qfy s VAL 114 Ca 0.05 1.32 0.02 0.00 0.00 0.00 0.00 61.98 63.37 2qfy s VAL 114 Cb -0.23 -4.00 0.08 0.00 0.00 0.00 0.00 36.38 32.23 2qfy s VAL 114 CO 0.08 0.15 -0.03 -0.63 0.00 0.00 0.00 175.10 174.67 2qfy s ILE 115 N 1.56 1.89 0.19 2.22 1.01 -1.26 -5.03 121.20 121.77 2qfy s ILE 115 Ca 0.33 -1.71 -0.05 0.00 0.00 0.00 0.00 60.65 59.22 2qfy s ILE 115 Cb -0.16 -2.20 0.31 0.00 0.01 0.00 0.00 42.46 40.42 2qfy s ILE 115 CO 0.13 -0.28 1.06 -2.65 0.00 0.00 0.00 174.94 173.19 2qfy n PRO 116 N 4.49 -0.06 0.25 2.79 -0.02 -1.26 -0.56 135.00 140.62 2qfy n PRO 116 Ca -0.07 1.06 0.09 0.00 -2.02 0.00 0.00 63.50 62.55 2qfy n PRO 116 Cb 0.43 -1.58 0.64 0.00 -0.02 0.00 0.00 33.50 32.96 2qfy n PRO 116 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 2qfy h ARG 117 N 0.00 0.00 -6.48 -0.52 2.43 -1.96 -3.44 114.38 104.42 2qfy h ARG 117 Ca 0.33 0.00 -0.53 0.00 -0.81 0.00 0.00 59.98 58.96 2qfy h ARG 117 Cb 0.51 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.06 2qfy h ARG 117 CO -0.70 0.09 0.67 0.42 -1.51 0.00 0.00 179.97 178.94 2qfy s ILE 118 N -4.73 3.74 0.23 1.20 -1.09 0.27 -4.94 121.20 115.88 2qfy s ILE 118 Ca -0.04 1.23 -0.30 0.00 -2.23 0.00 0.00 60.65 59.31 2qfy s ILE 118 Cb 0.16 -3.79 -0.09 0.00 -1.58 0.00 0.00 42.46 37.16 2qfy s ILE 118 CO 0.65 0.08 1.31 -2.84 -1.23 0.00 0.00 174.94 172.90 2qfy s PRO 119 N 1.33 4.39 0.06 2.79 0.02 -1.26 -4.93 135.00 137.40 2qfy s PRO 119 Ca 0.61 2.09 -0.24 0.00 0.02 0.00 0.00 61.00 63.48 2qfy s PRO 119 Cb -0.32 -3.16 -0.06 0.00 0.02 0.00 0.00 34.50 30.98 2qfy s PRO 119 CO 0.29 -0.23 0.72 1.03 -0.33 0.00 0.00 177.00 178.48 2qfy s ARG 120 N -0.52 4.45 0.33 5.54 0.52 -1.26 -4.27 118.95 123.74 2qfy s ARG 120 Ca 0.55 1.00 0.25 0.00 -0.52 0.00 0.00 55.73 57.00 2qfy s ARG 120 Cb -0.37 -3.33 0.62 0.00 0.52 0.00 0.00 34.95 32.38 2qfy s ARG 120 CO 0.41 0.38 1.71 -0.07 0.02 0.00 0.00 175.30 177.75 2qfy h LEU 121 N 5.34 0.00 -7.12 2.53 3.38 -0.92 -3.33 115.31 115.20 2qfy h LEU 121 Ca -0.45 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 56.90 2qfy h LEU 121 Cb 1.21 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.55 2qfy h LEU 121 CO 0.69 0.00 -0.68 -0.69 0.09 0.00 0.00 178.44 177.85 2qfy s VAL 122 N -3.18 2.09 0.30 1.22 1.01 -1.02 -5.01 120.40 115.82 2qfy s VAL 122 Ca 0.08 -3.22 -0.01 0.00 0.00 0.00 0.00 61.98 58.84 2qfy s VAL 122 Cb 0.09 -2.44 0.43 0.00 0.00 0.00 0.00 36.38 34.46 2qfy s VAL 122 CO 0.62 -0.90 1.57 -0.65 0.00 0.00 0.00 175.10 175.73 2qfy h PRO 123 N 6.29 0.00 0.00 2.72 0.11 -1.87 -2.05 132.00 137.20 2qfy h PRO 123 Ca 0.01 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.12 2qfy h PRO 123 Cb 0.88 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.99 2qfy h PRO 123 CO 0.60 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.39 2qfy h ARG 124 N 0.00 0.00 -5.72 1.05 3.08 -1.95 -3.40 114.38 107.44 2qfy h ARG 124 Ca 0.57 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 60.27 2qfy h ARG 124 Cb 1.11 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.10 2qfy h ARG 124 CO -0.96 0.00 0.94 -1.58 -1.07 0.00 0.00 179.97 177.30 2qfy s TRP 125 N -3.64 1.96 -0.15 3.04 0.51 -0.77 -4.25 118.94 115.63 2qfy s TRP 125 Ca -0.01 0.34 0.22 0.00 -2.12 0.00 0.00 56.10 54.54 2qfy s TRP 125 Cb 0.09 -4.14 -0.21 0.00 -0.81 0.00 0.00 33.47 28.40 2qfy s TRP 125 CO 0.35 -1.67 0.70 -0.85 -0.51 0.00 0.00 176.95 174.97 2qfy n GLU 126 N 8.73 0.60 -5.29 4.98 0.28 -0.85 -4.91 120.64 124.19 2qfy n GLU 126 Ca 0.40 -0.08 -0.31 0.00 -0.16 0.00 0.00 57.16 57.01 2qfy n GLU 126 Cb 0.47 -1.62 -0.16 0.00 1.43 0.00 0.00 31.44 31.56 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 -3.44 2.14 0.20 3.44 1.02 -0.73 -5.01 119.74 117.36 2qfy s LYS 127 Ca -0.05 -0.92 -0.32 0.00 0.02 0.00 0.00 55.97 54.70 2qfy s LYS 127 Cb 0.13 -2.06 -0.14 0.00 -0.52 0.00 0.00 37.83 35.23 2qfy s LYS 127 CO 0.87 0.56 1.33 -2.30 -0.92 0.00 0.00 175.35 174.88 2qfy n PRO 128 N 2.45 1.67 -3.93 -1.68 -0.02 -1.26 -1.83 135.00 130.40 2qfy n PRO 128 Ca -0.16 0.60 -0.35 0.00 -2.02 0.00 0.00 63.50 61.56 2qfy n PRO 128 Cb 0.51 -2.20 -0.11 0.00 -0.02 0.00 0.00 33.50 31.68 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 -0.01 4.64 -0.19 4.25 1.01 -1.26 -1.85 121.20 127.79 2qfy s ILE 129 Ca 0.72 -0.08 -0.05 0.00 0.00 0.00 0.00 60.65 61.24 2qfy s ILE 129 Cb -0.74 -3.12 -0.03 0.00 0.01 0.00 0.00 42.46 38.58 2qfy s ILE 129 CO 0.50 0.41 0.00 -0.63 0.00 0.00 0.00 174.94 175.22 2qfy s ILE 130 N 0.84 4.06 -0.27 2.92 1.01 -0.49 -4.41 121.20 124.86 2qfy s ILE 130 Ca 0.04 -0.28 -0.12 0.00 0.00 0.00 0.00 60.65 60.28 2qfy s ILE 130 Cb -0.14 -2.82 -0.05 0.00 0.01 0.00 0.00 42.46 39.47 2qfy s ILE 130 CO 0.02 0.45 0.25 -0.63 0.00 0.00 0.00 174.94 175.03 2qfy s ILE 131 N 0.77 5.27 -0.53 2.92 -1.09 0.20 -0.11 121.20 128.65 2qfy s ILE 131 Ca 0.00 0.31 -0.12 0.00 -2.23 0.00 0.00 60.65 58.61 2qfy s ILE 131 Cb -0.14 -3.58 0.13 0.00 -1.58 0.00 0.00 42.46 37.29 2qfy s ILE 131 CO 0.02 0.24 0.44 -0.83 -1.23 0.00 0.00 174.94 173.58 2qfy s GLY 132 N 1.57 2.12 -0.23 6.18 0.00 0.58 -0.71 107.32 116.83 2qfy s GLY 132 Ca 0.10 -2.61 -0.18 0.00 0.00 0.00 0.00 44.72 42.03 2qfy s GLY 132 CO 0.09 1.16 0.49 -1.60 0.00 0.00 0.00 173.10 173.24 2qfy s ARG 133 N 1.33 4.13 0.16 2.90 3.52 0.41 -0.02 118.95 131.38 2qfy s ARG 133 Ca 0.06 0.32 -0.31 0.00 -0.13 0.00 0.00 55.73 55.67 2qfy s ARG 133 Cb -0.27 -3.60 -0.11 0.00 -1.56 0.00 0.00 34.95 29.42 2qfy s ARG 133 CO 0.00 -0.22 1.80 1.58 -0.81 0.00 0.00 175.30 177.66 2qfy n HIS 134 N 5.06 2.69 1.45 5.12 -0.00 -0.32 -0.11 115.22 129.11 2qfy n HIS 134 Ca -0.05 -0.09 0.14 0.00 -0.00 0.00 0.00 57.72 57.72 2qfy n HIS 134 Cb 0.50 -2.72 0.63 0.00 -0.00 0.00 0.00 29.99 28.40 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 5.03 2.74 -2.60 1.57 0.00 -0.65 -3.54 120.51 123.08 2qfy n ALA 135 Ca 0.17 -0.27 -0.21 0.00 0.00 0.00 0.00 53.44 53.13 2qfy n ALA 135 Cb 0.37 -1.34 -0.12 0.00 0.00 0.00 0.00 19.45 18.36 2qfy n ALA 135 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2qfy s HIS 136 N -2.42 1.50 0.00 0.00 5.65 -1.26 -4.44 115.29 114.33 2qfy s HIS 136 Ca 0.30 -0.46 0.00 0.00 0.25 0.00 0.00 55.06 55.16 2qfy s HIS 136 Cb 0.20 -0.82 0.00 0.00 -1.18 0.00 0.00 32.58 30.78 2qfy s HIS 136 CO 0.46 0.14 0.00 0.41 -0.65 0.00 0.00 174.74 175.10 2qfy n GLY 137 N 1.04 -0.04 7.00 1.59 0.00 -1.26 -4.78 105.19 108.74 2qfy n GLY 137 Ca -0.19 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 44.84 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 -1.37 0.00 0.08 1.61 9.92 -0.10 -2.83 116.55 123.86 2qfy n ASP 138 Ca 0.00 0.00 0.18 0.00 -0.53 0.00 0.00 54.79 54.44 2qfy n ASP 138 Cb 0.00 0.00 0.72 0.00 -0.64 0.00 0.00 41.12 41.20 2qfy n ASP 138 CO 0.00 0.00 0.00 1.56 0.13 0.00 0.00 177.20 178.89 2qfy h GLN 139 N 0.00 0.00 0.00 -1.24 7.50 -1.94 -2.14 115.11 117.28 2qfy h GLN 139 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 2qfy h GLN 139 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.53 2qfy h GLN 139 CO 0.00 0.00 0.00 0.66 -1.50 0.00 0.00 178.83 177.99 2qfy n TYR 140 N -4.18 0.03 -1.42 2.96 4.02 -1.13 -2.61 117.16 114.83 2qfy n TYR 140 Ca 0.06 0.01 0.04 0.00 -0.01 0.00 0.00 57.90 58.00 2qfy n TYR 140 Cb 0.50 -0.51 0.06 0.00 -0.02 0.00 0.00 39.34 39.36 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 -1.52 0.72 -1.33 -0.72 4.76 -0.83 -4.95 118.16 114.28 2qfy n LYS 141 Ca 0.05 -1.65 -0.30 0.00 -2.87 0.00 0.00 58.31 53.54 2qfy n LYS 141 Cb 0.23 -0.94 0.11 0.00 -1.84 0.00 0.00 35.03 32.58 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 -1.25 2.01 -0.21 7.82 0.00 -1.07 -4.83 121.76 124.24 2qfy s ALA 142 Ca 0.13 0.01 -0.01 0.00 0.00 0.00 0.00 51.96 52.10 2qfy s ALA 142 Cb 0.12 -3.19 0.02 0.00 0.00 0.00 0.00 23.12 20.06 2qfy s ALA 142 CO 0.01 -1.94 -0.13 0.99 0.00 0.00 0.00 175.76 174.69 2qfy s THR 143 N -2.98 2.54 0.12 0.00 2.01 -0.21 -4.99 115.64 112.14 2qfy s THR 143 Ca 0.62 -0.90 0.06 0.00 0.31 0.00 0.00 61.69 61.77 2qfy s THR 143 Cb -0.17 -2.17 -0.04 0.00 0.01 0.00 0.00 72.50 70.14 2qfy s THR 143 CO 0.56 0.40 -0.15 1.51 -0.69 0.00 0.00 174.62 176.25 2qfy s ASP 144 N 1.33 2.07 0.10 3.53 -4.77 -1.26 -0.30 116.67 117.36 2qfy s ASP 144 Ca 0.03 -0.80 -0.25 0.00 -3.30 0.00 0.00 52.55 48.23 2qfy s ASP 144 Cb -0.15 -0.08 0.07 0.00 -1.09 0.00 0.00 42.92 41.68 2qfy s ASP 144 CO -0.08 -0.12 0.64 0.28 0.70 0.00 0.00 175.17 176.58 2qfy s THR 145 N -2.05 0.00 0.19 2.11 -1.32 0.42 -4.98 115.64 110.02 2qfy s THR 145 Ca 0.09 0.00 -0.24 0.00 -1.21 0.00 0.00 61.69 60.33 2qfy s THR 145 Cb -0.05 -1.00 -0.08 0.00 -1.51 0.00 0.00 72.50 69.85 2qfy s THR 145 CO 0.03 0.00 0.77 -0.76 -2.21 0.00 0.00 174.62 172.45 2qfy s LEU 146 N -2.38 4.51 -0.31 9.08 1.02 -1.26 -1.28 118.68 128.06 2qfy s LEU 146 Ca -0.01 1.60 -0.05 0.00 0.02 0.00 0.00 54.13 55.68 2qfy s LEU 146 Cb -0.01 -3.42 0.03 0.00 0.02 0.00 0.00 46.19 42.82 2qfy s LEU 146 CO -0.08 0.15 0.05 -0.63 0.02 0.00 0.00 176.35 175.86 2qfy s ILE 147 N -1.28 3.51 0.36 -0.59 -1.09 0.65 -4.91 121.20 117.85 2qfy s ILE 147 Ca 0.39 -1.07 0.28 0.00 -2.23 0.00 0.00 60.65 58.01 2qfy s ILE 147 Cb -0.21 -2.93 0.29 0.00 -1.58 0.00 0.00 42.46 38.03 2qfy s ILE 147 CO 0.25 -0.05 2.03 1.55 -1.23 0.00 0.00 174.94 177.49 2qfy h PRO 148 N 8.14 0.00 0.00 2.79 0.13 -1.92 0.93 132.00 142.08 2qfy h PRO 148 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2qfy h PRO 148 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2qfy h PRO 148 CO 0.58 0.13 0.00 0.41 -0.23 0.00 0.00 178.00 178.89 2qfy n GLY 149 N -0.51 0.95 3.59 1.56 0.00 -1.26 -4.34 105.19 105.17 2qfy n GLY 149 Ca -0.01 -0.85 -0.41 0.00 0.00 0.00 0.00 46.02 44.75 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 1.19 0.00 1.61 -0.02 -1.26 -4.63 135.00 131.89 2qfy n PRO 150 Ca 0.00 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2qfy n PRO 150 Cb 0.00 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 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 1.27 1.51 3.90 -1.23 0.00 -1.01 -4.95 105.19 104.68 2qfy n GLY 151 Ca 0.10 -1.20 -0.32 0.00 0.00 0.00 0.00 46.02 44.60 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 6.46 -0.11 1.61 1.04 -1.26 -0.39 113.70 121.05 2qfy s SER 152 Ca 0.00 0.50 0.01 0.00 0.48 0.00 0.00 55.95 56.94 2qfy s SER 152 Cb 0.00 -2.06 0.02 0.00 0.10 0.00 0.00 66.02 64.09 2qfy s SER 152 CO 0.00 0.10 -0.11 -0.22 0.98 0.00 0.00 173.24 173.99 2qfy s LEU 153 N -2.56 1.46 0.12 2.42 0.20 -0.01 -4.96 118.68 115.35 2qfy s LEU 153 Ca 0.39 -0.36 0.06 0.00 0.69 0.00 0.00 54.13 54.90 2qfy s LEU 153 Cb -0.12 -0.95 -0.04 0.00 -0.43 0.00 0.00 46.19 44.65 2qfy s LEU 153 CO 0.25 -0.06 -0.15 -1.61 -0.29 0.00 0.00 176.35 174.49 2qfy s GLU 154 N 1.36 1.02 -0.25 1.98 2.02 -1.26 -0.91 118.70 122.67 2qfy s GLU 154 Ca -0.00 -1.21 -0.05 0.00 0.02 0.00 0.00 54.97 53.73 2qfy s GLU 154 Cb -0.14 -0.96 -0.00 0.00 0.10 0.00 0.00 34.13 33.13 2qfy s GLU 154 CO -0.06 0.19 0.00 -1.17 0.02 0.00 0.00 175.26 174.25 2qfy s LEU 155 N -2.35 3.24 -0.14 1.80 0.20 -0.10 -4.92 118.68 116.41 2qfy s LEU 155 Ca 0.08 -0.48 0.01 0.00 0.69 0.00 0.00 54.13 54.43 2qfy s LEU 155 Cb -0.06 -1.80 -0.00 0.00 -0.43 0.00 0.00 46.19 43.90 2qfy s LEU 155 CO 0.03 -0.07 -0.17 -0.69 -0.29 0.00 0.00 176.35 175.16 2qfy s VAL 156 N 1.49 2.57 -0.10 1.68 1.01 -1.26 -0.78 120.40 125.01 2qfy s VAL 156 Ca 0.05 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.25 2qfy s VAL 156 Cb -0.15 -2.07 -0.01 0.00 0.00 0.00 0.00 36.38 34.15 2qfy s VAL 156 CO -0.01 0.52 -0.20 -0.47 0.00 0.00 0.00 175.10 174.95 2qfy s TYR 157 N 0.71 2.62 -0.23 5.22 5.04 0.11 -4.98 117.35 125.85 2qfy s TYR 157 Ca -0.08 -0.77 -0.00 0.00 -2.44 0.00 0.00 57.07 53.78 2qfy s TYR 157 Cb -0.16 -1.72 0.06 0.00 0.35 0.00 0.00 41.96 40.50 2qfy s TYR 157 CO 0.01 -0.26 -0.02 0.15 -1.34 0.00 0.00 175.55 174.09 2qfy s LYS 158 N 0.14 1.34 0.52 4.97 1.02 -1.26 -0.54 119.74 125.93 2qfy s LYS 158 Ca -0.10 -0.89 -0.22 0.00 0.02 0.00 0.00 55.97 54.78 2qfy s LYS 158 Cb -0.16 -2.46 -0.05 0.00 -0.52 0.00 0.00 37.83 34.63 2qfy s LYS 158 CO 0.06 -0.64 1.33 -1.25 -0.92 0.00 0.00 175.35 173.93 2qfy s PRO 159 N 1.50 3.29 0.51 -1.68 0.04 -1.26 -4.89 135.00 132.51 2qfy s PRO 159 Ca -0.03 2.16 0.29 0.00 0.04 0.00 0.00 61.00 63.46 2qfy s PRO 159 Cb -0.18 -2.31 1.28 0.00 0.04 0.00 0.00 34.50 33.33 2qfy s PRO 159 CO -0.08 -1.05 1.97 0.77 0.04 0.00 0.00 177.00 178.65 2qfy h SER 160 N 1.62 0.00 -3.15 6.66 0.02 -2.00 -3.37 113.55 113.34 2qfy h SER 160 Ca -0.51 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 59.86 2qfy h SER 160 Cb 1.29 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 63.43 2qfy h SER 160 CO 0.58 0.11 -0.76 -0.62 -1.14 0.00 0.00 176.83 175.01 2qfy s ASP 161 N -5.95 3.96 0.51 3.07 -1.08 -1.26 -5.01 116.67 110.91 2qfy s ASP 161 Ca -0.00 -1.71 0.23 0.00 -0.52 0.00 0.00 52.55 50.55 2qfy s ASP 161 Cb 0.11 -0.85 1.33 0.00 -1.46 0.00 0.00 42.92 42.05 2qfy s ASP 161 CO 0.58 -0.40 1.99 -0.65 0.52 0.00 0.00 175.17 177.21 2qfy h PRO 162 N 7.98 0.07 0.00 4.34 0.11 -1.77 -1.72 132.00 141.01 2qfy h PRO 162 Ca -0.12 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.98 2qfy h PRO 162 Cb 1.01 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.10 2qfy h PRO 162 CO 0.47 0.05 0.00 1.79 -0.21 0.00 0.00 178.00 180.09 2qfy h THR 163 N 0.07 0.00 -0.01 -1.15 1.35 -1.96 -3.25 112.91 107.96 2qfy h THR 163 Ca 0.26 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.66 2qfy h THR 163 Cb 0.94 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 2qfy h THR 163 CO -0.02 0.00 -0.22 0.35 -0.25 0.00 0.00 175.52 175.38 2qfy n THR 164 N -2.31 0.00 -3.50 6.82 -2.24 -0.68 -5.03 114.28 107.35 2qfy n THR 164 Ca 0.05 -0.39 -0.16 0.00 -2.27 0.00 0.00 64.05 61.28 2qfy n THR 164 Cb 0.40 1.14 -0.05 0.00 -2.10 0.00 0.00 70.33 69.72 2qfy n THR 164 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qfy s ALA 165 N -1.43 -1.74 0.01 6.98 0.00 -1.03 -5.08 121.76 119.47 2qfy s ALA 165 Ca 0.10 1.13 -0.07 0.00 0.00 0.00 0.00 51.96 53.12 2qfy s ALA 165 Cb 0.09 0.17 -0.05 0.00 0.00 0.00 0.00 23.12 23.34 2qfy s ALA 165 CO 0.27 -0.47 0.28 -0.65 0.00 0.00 0.00 175.76 175.19 2qfy s GLN 166 N -1.87 3.60 0.86 0.00 -1.52 -1.26 -4.40 119.66 115.06 2qfy s GLN 166 Ca -0.07 -0.05 -0.12 0.00 -1.95 0.00 0.00 55.36 53.17 2qfy s GLN 166 Cb -0.00 -3.07 0.11 0.00 -0.22 0.00 0.00 33.01 29.82 2qfy s GLN 166 CO 0.03 0.64 1.10 -1.25 -0.25 0.00 0.00 175.29 175.56 2qfy s PRO 167 N -1.77 1.54 -0.02 2.91 0.04 -1.26 -4.66 135.00 131.78 2qfy s PRO 167 Ca 0.28 0.66 -0.00 0.00 0.04 0.00 0.00 61.00 61.98 2qfy s PRO 167 Cb -0.13 -1.85 0.02 0.00 0.04 0.00 0.00 34.50 32.57 2qfy s PRO 167 CO 0.16 -2.00 0.03 -0.65 0.04 0.00 0.00 177.00 174.58 2qfy s GLN 168 N -5.07 -0.01 -0.26 4.56 -0.21 0.30 -4.98 119.66 113.99 2qfy s GLN 168 Ca 0.62 0.13 -0.02 0.00 0.02 0.00 0.00 55.36 56.12 2qfy s GLN 168 Cb -0.16 -0.14 0.08 0.00 1.00 0.00 0.00 33.01 33.80 2qfy s GLN 168 CO 0.55 -0.10 0.07 0.99 -2.12 0.00 0.00 175.29 174.68 2qfy s THR 169 N 0.63 0.73 -0.16 -0.19 2.01 -1.26 0.06 115.64 117.46 2qfy s THR 169 Ca -0.05 -1.03 -0.06 0.00 0.31 0.00 0.00 61.69 60.86 2qfy s THR 169 Cb -0.07 -1.40 -0.04 0.00 0.01 0.00 0.00 72.50 71.00 2qfy s THR 169 CO -0.02 -0.47 0.04 -0.76 -0.69 0.00 0.00 174.62 172.73 2qfy s LEU 170 N 1.72 3.73 -0.22 4.42 1.43 0.04 -4.95 118.68 124.85 2qfy s LEU 170 Ca 0.05 0.09 -0.29 0.00 -1.03 0.00 0.00 54.13 52.95 2qfy s LEU 170 Cb -0.17 -1.92 0.01 0.00 0.03 0.00 0.00 46.19 44.14 2qfy s LEU 170 CO -0.18 0.23 1.07 -0.54 0.23 0.00 0.00 176.35 177.15 2qfy s LYS 171 N 0.04 4.26 -0.21 1.70 -0.14 -1.26 -0.93 119.74 123.20 2qfy s LYS 171 Ca 0.05 1.40 -0.10 0.00 -1.36 0.00 0.00 55.97 55.95 2qfy s LYS 171 Cb -0.12 -3.65 -0.19 0.00 -1.68 0.00 0.00 37.83 32.18 2qfy s LYS 171 CO 0.01 -0.63 0.05 0.28 -0.76 0.00 0.00 175.35 174.29 2qfy n VAL 172 N 5.32 1.60 -3.63 3.17 0.31 -0.09 -4.95 118.33 120.06 2qfy n VAL 172 Ca 0.12 -0.41 -0.04 0.00 -0.01 0.00 0.00 64.34 64.00 2qfy n VAL 172 Cb 0.46 -1.78 -0.05 0.00 -0.91 0.00 0.00 33.84 31.56 2qfy n VAL 172 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 2qfy s TYR 173 N -2.49 -0.12 -0.38 3.52 5.04 -1.12 -5.02 117.35 116.79 2qfy s TYR 173 Ca -0.30 0.22 -0.06 0.00 -2.44 0.00 0.00 57.07 54.49 2qfy s TYR 173 Cb 0.09 0.48 0.08 0.00 0.35 0.00 0.00 41.96 42.95 2qfy s TYR 173 CO 0.63 -0.10 0.17 -0.51 -1.34 0.00 0.00 175.55 174.39 2qfy s ASP 174 N -0.91 5.35 0.39 4.32 -0.00 -1.26 -0.83 116.67 123.72 2qfy s ASP 174 Ca 0.06 -1.55 -0.25 0.00 -0.00 0.00 0.00 52.55 50.81 2qfy s ASP 174 Cb -0.01 -1.87 -0.09 0.00 -0.00 0.00 0.00 42.92 40.95 2qfy s ASP 174 CO -0.07 -0.46 1.15 -0.31 -0.00 0.00 0.00 175.17 175.48 2qfy s TYR 175 N 1.31 3.14 -0.57 4.23 1.51 0.48 -4.90 117.35 122.55 2qfy s TYR 175 Ca 0.02 1.58 0.05 0.00 -1.01 0.00 0.00 57.07 57.71 2qfy s TYR 175 Cb -0.22 -3.34 0.04 0.00 -0.11 0.00 0.00 41.96 38.32 2qfy s TYR 175 CO -0.00 -1.15 0.64 1.63 -1.11 0.00 0.00 175.55 175.56 2qfy n LYS 176 N 0.14 -0.34 -3.37 -0.62 4.76 -1.26 -2.39 118.16 115.08 2qfy n LYS 176 Ca 0.04 -0.77 -0.04 0.00 -2.87 0.00 0.00 58.31 54.67 2qfy n LYS 176 Cb 0.47 -1.09 0.02 0.00 -1.84 0.00 0.00 35.03 32.59 2qfy n LYS 176 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2qfy n GLY 177 N 0.26 0.89 3.77 0.72 0.00 -1.26 -4.62 105.19 104.95 2qfy n GLY 177 Ca 0.03 -1.15 -0.33 0.00 0.00 0.00 0.00 46.02 44.57 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 -2.88 5.09 0.00 1.61 1.04 -1.26 -4.15 113.70 113.15 2qfy s SER 178 Ca 0.17 2.05 0.00 0.00 0.48 0.00 0.00 55.95 58.65 2qfy s SER 178 Cb -0.03 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.53 2qfy s SER 178 CO 0.06 -1.64 0.00 0.61 0.98 0.00 0.00 173.24 173.25 2qfy n GLY 179 N -0.37 2.03 3.16 7.32 0.00 0.32 -4.96 105.19 112.70 2qfy n GLY 179 Ca 0.11 -0.51 -0.13 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.74 0.84 0.01 1.61 -7.23 -1.26 -0.25 120.40 112.38 2qfy s VAL 180 Ca 0.00 -1.66 -0.11 0.00 -1.81 0.00 0.00 61.98 58.39 2qfy s VAL 180 Cb 0.00 -1.37 0.01 0.00 0.56 0.00 0.00 36.38 35.58 2qfy s VAL 180 CO 0.00 -0.62 0.23 0.00 -0.31 0.00 0.00 175.10 174.40 2qfy s ALA 181 N -2.65 -0.54 0.03 1.32 0.00 -0.41 -4.87 121.76 114.65 2qfy s ALA 181 Ca 0.06 0.01 -0.24 0.00 0.00 0.00 0.00 51.96 51.79 2qfy s ALA 181 Cb -0.01 0.16 0.06 0.00 0.00 0.00 0.00 23.12 23.32 2qfy s ALA 181 CO -0.01 -0.29 0.55 0.00 0.00 0.00 0.00 175.76 176.01 2qfy s MET 182 N -1.78 1.04 0.02 0.00 0.23 -1.26 -0.43 119.30 117.12 2qfy s MET 182 Ca -0.11 -0.15 0.01 0.00 -1.03 0.00 0.00 55.69 54.41 2qfy s MET 182 Cb -0.04 0.48 -0.02 0.00 -1.53 0.00 0.00 34.83 33.72 2qfy s MET 182 CO 0.01 -0.37 -0.04 0.00 -2.03 0.00 0.00 175.02 172.59 2qfy s ALA 183 N -2.23 0.24 0.23 3.16 0.00 0.59 -4.98 121.76 118.76 2qfy s ALA 183 Ca -0.06 -0.58 -0.07 0.00 0.00 0.00 0.00 51.96 51.24 2qfy s ALA 183 Cb -0.01 0.10 -0.02 0.00 0.00 0.00 0.00 23.12 23.19 2qfy s ALA 183 CO 0.00 -0.10 0.31 0.00 0.00 0.00 0.00 175.76 175.97 2qfy s MET 184 N -1.34 1.39 0.27 0.00 0.23 -1.26 -1.04 119.30 117.54 2qfy s MET 184 Ca -0.13 -1.43 -0.08 0.00 -1.03 0.00 0.00 55.69 53.02 2qfy s MET 184 Cb -0.09 0.38 -0.01 0.00 -1.53 0.00 0.00 34.83 33.58 2qfy s MET 184 CO -0.01 -0.53 0.44 1.52 -2.03 0.00 0.00 175.02 174.42 2qfy s TYR 185 N -4.08 0.67 0.24 3.16 -0.85 -1.26 -4.97 117.35 110.26 2qfy s TYR 185 Ca 0.30 -0.98 -0.21 0.00 -0.52 0.00 0.00 57.07 55.66 2qfy s TYR 185 Cb 0.03 0.03 0.03 0.00 0.38 0.00 0.00 41.96 42.43 2qfy s TYR 185 CO 0.11 -1.00 0.67 1.21 -1.52 0.00 0.00 175.55 175.01 2qfy s ASN 186 N -3.10 -0.35 0.16 -0.18 3.84 -1.26 -0.93 114.94 113.12 2qfy s ASN 186 Ca 0.27 -0.43 0.10 0.00 0.21 0.00 0.00 52.86 53.01 2qfy s ASN 186 Cb 0.00 0.68 -0.04 0.00 -0.55 0.00 0.00 41.25 41.34 2qfy s ASN 186 CO 0.13 -1.22 -0.23 0.42 -2.79 0.00 0.00 177.10 173.41 2qfy s THR 187 N -3.87 2.16 0.26 -5.21 -4.23 -1.26 -5.03 115.64 98.46 2qfy s THR 187 Ca 0.08 -1.90 -0.01 0.00 -1.18 0.00 0.00 61.69 58.68 2qfy s THR 187 Cb -0.04 -1.98 0.10 0.00 1.34 0.00 0.00 72.50 71.92 2qfy s THR 187 CO 0.01 -0.10 1.74 0.44 -0.54 0.00 0.00 174.62 176.16 2qfy h ASP 188 N 3.46 0.70 -0.72 3.99 3.32 -2.01 -1.03 116.42 124.12 2qfy h ASP 188 Ca -0.47 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 56.38 2qfy h ASP 188 Cb 1.20 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.53 2qfy h ASP 188 CO 0.46 0.82 0.40 -0.08 -1.72 0.00 0.00 179.24 179.11 2qfy h GLU 189 N 0.66 1.00 -0.23 3.56 4.81 -1.99 0.17 114.58 122.56 2qfy h GLU 189 Ca 0.12 -0.11 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 2qfy h GLU 189 Cb 0.53 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 2qfy h GLU 189 CO 0.03 0.74 -0.14 1.03 -0.73 0.00 0.00 179.01 179.95 2qfy h SER 190 N 0.99 0.52 -0.64 1.04 0.87 -1.90 -1.99 113.55 112.45 2qfy h SER 190 Ca 0.25 -0.42 -0.02 0.00 -1.23 0.00 0.00 61.79 60.37 2qfy h SER 190 Cb 0.03 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 61.81 2qfy h SER 190 CO -0.04 0.83 0.34 0.40 -0.53 0.00 0.00 176.83 177.83 2qfy h ILE 191 N 0.21 1.21 -0.64 2.23 2.04 -0.92 -1.36 117.51 120.28 2qfy h ILE 191 Ca 0.05 -0.55 -0.08 0.00 1.00 0.00 0.00 64.86 65.28 2qfy h ILE 191 Cb 0.65 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 2qfy h ILE 191 CO 0.04 0.24 0.08 -0.08 0.00 0.00 0.00 178.15 178.42 2qfy h GLU 192 N 0.92 1.07 -0.50 2.37 4.81 -0.51 -1.23 114.58 121.52 2qfy h GLU 192 Ca 0.23 -0.30 -0.03 0.00 -0.13 0.00 0.00 59.36 59.13 2qfy h GLU 192 Cb 0.06 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 2qfy h GLU 192 CO -0.03 1.01 0.20 0.78 -0.73 0.00 0.00 179.01 180.23 2qfy h GLY 193 N 0.99 0.80 0.23 1.92 0.00 -0.85 -0.85 103.07 105.31 2qfy h GLY 193 Ca 0.19 -0.44 0.09 0.00 0.00 0.00 0.00 47.33 47.18 2qfy h GLY 193 CO 0.02 0.41 0.04 -2.75 0.00 0.00 0.00 176.54 174.26 2qfy h PHE 194 N 0.67 0.04 -0.19 5.60 -0.00 -0.90 -1.15 116.94 121.01 2qfy h PHE 194 Ca 0.17 0.03 -0.01 0.00 -0.00 0.00 0.00 57.97 58.16 2qfy h PHE 194 Cb 0.20 0.06 -0.01 0.00 -0.00 0.00 0.00 35.95 36.20 2qfy h PHE 194 CO 0.00 -0.08 0.09 0.00 -0.00 0.00 0.00 178.31 178.32 2qfy h ALA 195 N 1.43 0.24 -0.36 2.41 0.00 -0.75 -2.01 119.26 120.22 2qfy h ALA 195 Ca 0.25 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.11 2qfy h ALA 195 Cb 0.37 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2qfy h ALA 195 CO -0.39 -0.19 0.16 0.45 0.00 0.00 0.00 179.25 179.28 2qfy h HIS 196 N 0.17 0.30 -0.52 0.00 3.86 -0.52 -1.41 115.15 117.02 2qfy h HIS 196 Ca 0.06 0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.23 2qfy h HIS 196 Cb 0.13 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.49 2qfy h HIS 196 CO -0.02 0.15 0.08 0.77 0.86 0.00 0.00 177.93 179.76 2qfy h SER 197 N 0.34 0.79 -0.30 2.45 0.02 -1.19 -0.91 113.55 114.74 2qfy h SER 197 Ca 0.16 -0.16 -0.03 0.00 -0.84 0.00 0.00 61.79 60.91 2qfy h SER 197 Cb 0.09 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 2qfy h SER 197 CO -0.13 0.80 0.06 0.28 -1.14 0.00 0.00 176.83 176.71 2qfy h SER 198 N 0.79 0.48 -0.47 3.07 0.02 -0.97 -1.44 113.55 115.03 2qfy h SER 198 Ca 0.17 -0.25 -0.11 0.00 -0.84 0.00 0.00 61.79 60.75 2qfy h SER 198 Cb 0.37 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 2qfy h SER 198 CO 0.01 0.61 -0.15 -0.26 -1.14 0.00 0.00 176.83 175.89 2qfy h PHE 199 N 0.33 1.05 -0.74 3.45 0.04 -1.12 -1.65 116.94 118.30 2qfy h PHE 199 Ca 0.09 -0.24 -0.05 0.00 2.80 0.00 0.00 57.97 60.58 2qfy h PHE 199 Cb 0.33 -0.25 -0.03 0.00 2.20 0.00 0.00 35.95 38.20 2qfy h PHE 199 CO 0.02 1.03 0.27 0.87 -0.60 0.00 0.00 178.31 179.90 2qfy h LYS 200 N 0.77 1.11 -0.39 1.51 1.57 -1.11 -1.30 116.57 118.74 2qfy h LYS 200 Ca 0.11 -0.21 -0.16 0.00 -1.87 0.00 0.00 60.65 58.53 2qfy h LYS 200 Cb 0.71 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.84 2qfy h LYS 200 CO 0.05 0.92 -0.37 1.25 -0.57 0.00 0.00 179.45 180.73 2qfy h LEU 201 N 1.08 0.98 -0.67 2.94 6.46 -1.14 -0.27 115.31 124.69 2qfy h LEU 201 Ca 0.24 -0.44 0.03 0.00 -0.12 0.00 0.00 57.88 57.59 2qfy h LEU 201 Cb 0.24 -0.27 -0.04 0.00 -0.73 0.00 0.00 40.66 39.85 2qfy h LEU 201 CO -0.02 1.23 0.42 0.00 -0.62 0.00 0.00 178.44 179.46 2qfy h ALA 202 N 0.81 0.87 0.56 1.25 0.00 -0.96 0.28 119.26 122.07 2qfy h ALA 202 Ca 0.06 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2qfy h ALA 202 Cb 0.96 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.54 2qfy h ALA 202 CO 0.09 0.19 -0.27 0.82 0.00 0.00 0.00 179.25 180.08 2qfy h ILE 203 N 0.83 0.38 -0.96 0.00 1.08 -1.00 0.19 117.51 118.03 2qfy h ILE 203 Ca 0.26 -0.26 0.13 0.00 -0.39 0.00 0.00 64.86 64.60 2qfy h ILE 203 Cb 0.00 0.48 -0.08 0.00 -3.07 0.00 0.00 36.82 34.15 2qfy h ILE 203 CO -0.10 0.04 0.61 -0.78 -0.69 0.00 0.00 178.15 177.23 2qfy h ASP 204 N -0.93 0.83 0.16 1.72 3.58 -0.87 -1.74 116.42 119.17 2qfy h ASP 204 Ca -0.08 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.42 2qfy h ASP 204 Cb 0.64 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.56 2qfy h ASP 204 CO 0.13 0.44 -0.39 0.29 -2.88 0.00 0.00 179.24 176.82 2qfy n LYS 205 N -4.59 0.85 -3.45 0.28 5.02 0.07 -4.98 118.16 111.36 2qfy n LYS 205 Ca 0.18 -0.59 -0.19 0.00 -2.02 0.00 0.00 58.31 55.68 2qfy n LYS 205 Cb 0.39 -1.49 0.06 0.00 -0.02 0.00 0.00 35.03 33.97 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 -0.56 -3.67 -4.19 1.97 4.01 0.55 -5.02 118.16 111.26 2qfy n LYS 206 Ca 0.10 0.75 -0.17 0.00 -0.51 0.00 0.00 58.31 58.49 2qfy n LYS 206 Cb 0.39 -5.45 -0.11 0.00 -0.51 0.00 0.00 35.03 29.35 2qfy n LYS 206 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2qfy s LEU 207 N -6.05 2.36 0.57 -0.35 1.43 -0.55 -5.02 118.68 111.07 2qfy s LEU 207 Ca 0.26 -0.74 -0.18 0.00 -1.03 0.00 0.00 54.13 52.44 2qfy s LEU 207 Cb -0.05 -0.44 -0.04 0.00 0.03 0.00 0.00 46.19 45.69 2qfy s LEU 207 CO 0.77 -0.16 1.13 0.20 0.23 0.00 0.00 176.35 178.52 2qfy s ASN 208 N -2.18 5.53 -0.11 2.29 0.01 -1.26 -4.67 114.94 114.55 2qfy s ASN 208 Ca 0.03 2.16 0.03 0.00 -0.71 0.00 0.00 52.86 54.38 2qfy s ASN 208 Cb -0.06 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 39.03 2qfy s ASN 208 CO 0.02 -1.35 -0.22 -0.22 -1.51 0.00 0.00 177.10 173.82 2qfy s LEU 209 N -4.05 2.05 -0.13 0.60 0.20 0.50 -1.26 118.68 116.59 2qfy s LEU 209 Ca 0.72 -0.55 0.02 0.00 0.69 0.00 0.00 54.13 55.01 2qfy s LEU 209 Cb -0.24 -1.37 0.01 0.00 -0.43 0.00 0.00 46.19 44.17 2qfy s LEU 209 CO 0.31 0.13 -0.19 -0.36 -0.29 0.00 0.00 176.35 175.94 2qfy s PHE 210 N 0.49 2.37 -0.17 5.38 0.40 0.10 -1.73 117.98 124.82 2qfy s PHE 210 Ca -0.16 -1.17 -0.07 0.00 -0.60 0.00 0.00 56.93 54.94 2qfy s PHE 210 Cb -0.17 -1.65 -0.04 0.00 0.51 0.00 0.00 43.02 41.67 2qfy s PHE 210 CO 0.06 -0.56 0.06 -1.17 0.70 0.00 0.00 175.22 174.30 2qfy s LEU 211 N 0.91 3.80 -0.04 -0.37 0.20 -0.66 0.33 118.68 122.86 2qfy s LEU 211 Ca -0.06 0.11 0.05 0.00 0.69 0.00 0.00 54.13 54.91 2qfy s LEU 211 Cb -0.15 -1.95 -0.01 0.00 -0.43 0.00 0.00 46.19 43.66 2qfy s LEU 211 CO -0.02 0.21 -0.19 -0.44 -0.29 0.00 0.00 176.35 175.62 2qfy s SER 212 N 0.13 2.34 0.20 3.68 0.01 -1.05 -0.08 113.70 118.93 2qfy s SER 212 Ca 0.05 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.93 2qfy s SER 212 Cb -0.12 -0.60 -0.00 0.00 0.21 0.00 0.00 66.02 65.51 2qfy s SER 212 CO 0.01 0.18 0.26 0.35 0.41 0.00 0.00 173.24 174.45 2qfy n THR 213 N 3.03 0.00 -2.34 1.44 -2.24 -0.87 -4.44 114.28 108.87 2qfy n THR 213 Ca -0.18 -1.12 -0.23 0.00 -2.27 0.00 0.00 64.05 60.26 2qfy n THR 213 Cb 0.53 0.65 0.01 0.00 -2.10 0.00 0.00 70.33 69.42 2qfy n THR 213 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2qfy n LYS 214 N -0.34 3.24 0.00 -0.78 3.00 -1.26 -0.17 118.16 121.85 2qfy n LYS 214 Ca 0.01 -4.24 0.03 0.00 -0.00 0.00 0.00 58.31 54.12 2qfy n LYS 214 Cb 0.34 -2.15 0.14 0.00 0.00 0.00 0.00 35.03 33.36 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 -0.54 0.00 0.21 3.14 6.94 -1.26 -0.95 115.26 122.79 2qfy n ASN 215 Ca 0.37 0.37 0.10 0.00 -0.02 0.00 0.00 54.58 55.39 2qfy n ASN 215 Cb 0.80 -0.41 0.25 0.00 -2.36 0.00 0.00 39.78 38.06 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 0.34 0.00 5.53 1.35 -1.95 -3.18 112.91 115.00 2qfy h THR 216 Ca 0.00 -1.30 -0.32 0.00 -0.55 0.00 0.00 66.41 64.24 2qfy h THR 216 Cb 0.09 2.02 -0.05 0.00 -1.73 0.00 0.00 68.15 68.47 2qfy h THR 216 CO 0.00 0.17 -2.08 -0.38 -0.25 0.00 0.00 175.52 172.99 2qfy n ILE 217 N -3.18 1.06 -3.21 6.82 -0.00 -0.12 -4.69 119.36 116.03 2qfy n ILE 217 Ca 0.02 -0.29 -0.44 0.00 -0.00 0.00 0.00 62.75 62.04 2qfy n ILE 217 Cb 0.54 -1.66 0.00 0.00 -0.00 0.00 0.00 39.64 38.52 2qfy n ILE 217 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 2qfy n LEU 218 N -3.73 5.85 -0.08 1.39 4.77 -0.56 -4.88 117.00 119.76 2qfy n LEU 218 Ca -0.37 -5.12 0.07 0.00 -0.03 0.00 0.00 56.01 50.56 2qfy n LEU 218 Cb 0.78 -1.38 0.43 0.00 -2.33 0.00 0.00 43.42 40.92 2qfy n LEU 218 CO 0.05 1.50 1.19 0.11 -1.33 0.00 0.00 177.39 178.90 2qfy h LYS 219 N 6.12 0.55 0.01 3.23 1.57 -1.81 -1.74 116.57 124.50 2qfy h LYS 219 Ca 0.19 -0.03 -0.25 0.00 -1.87 0.00 0.00 60.65 58.68 2qfy h LYS 219 Cb 0.76 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.91 2qfy h LYS 219 CO 1.14 0.37 -1.37 1.63 -0.57 0.00 0.00 179.45 180.64 2qfy n LYS 220 N -4.47 0.58 0.43 3.15 5.02 -1.26 -3.02 118.16 118.58 2qfy n LYS 220 Ca 0.07 0.54 -0.17 0.00 -2.02 0.00 0.00 58.31 56.74 2qfy n LYS 220 Cb 0.20 -1.73 -0.08 0.00 -0.02 0.00 0.00 35.03 33.40 2qfy n LYS 220 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 2qfy h TYR 221 N -0.92 -1.02 -0.03 2.13 5.03 -1.97 -1.51 116.97 118.68 2qfy h TYR 221 Ca -0.37 -0.02 -0.16 0.00 2.58 0.00 0.00 58.73 60.76 2qfy h TYR 221 Cb 1.38 0.34 -0.01 0.00 1.55 0.00 0.00 36.73 39.98 2qfy h TYR 221 CO 0.09 -0.64 -0.70 -0.44 -1.32 0.00 0.00 178.16 175.15 2qfy h ASP 222 N -1.25 0.19 -0.34 -2.11 5.19 -1.58 -2.91 116.42 113.61 2qfy h ASP 222 Ca -0.11 -0.13 0.05 0.00 -0.62 0.00 0.00 57.03 56.22 2qfy h ASP 222 Cb 0.85 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 40.28 2qfy h ASP 222 CO 0.19 0.83 0.23 1.23 -3.12 0.00 0.00 179.24 178.60 2qfy h GLY 223 N 1.73 0.32 1.09 2.75 0.00 -1.42 -1.00 103.07 106.54 2qfy h GLY 223 Ca -0.02 -0.11 -0.07 0.00 0.00 0.00 0.00 47.33 47.14 2qfy h GLY 223 CO 0.10 0.09 0.17 -0.09 0.00 0.00 0.00 176.54 176.81 2qfy h ARG 224 N 0.27 1.13 -0.22 4.80 9.65 -1.06 -0.50 114.38 128.46 2qfy h ARG 224 Ca 0.15 -0.27 -0.01 0.00 -1.10 0.00 0.00 59.98 58.75 2qfy h ARG 224 Cb 0.24 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 28.66 2qfy h ARG 224 CO -0.03 0.99 0.10 0.74 2.80 0.00 0.00 179.97 184.57 2qfy h PHE 225 N 1.07 0.32 -0.50 2.20 -1.00 -1.26 -0.75 116.94 117.02 2qfy h PHE 225 Ca 0.22 -0.02 0.03 0.00 2.81 0.00 0.00 57.97 61.01 2qfy h PHE 225 Cb 0.37 -0.10 -0.04 0.00 3.61 0.00 0.00 35.95 39.80 2qfy h PHE 225 CO 0.03 0.34 0.28 -0.22 -1.61 0.00 0.00 178.31 177.13 2qfy h LYS 226 N 0.21 0.55 -0.39 1.51 3.64 -1.17 -1.20 116.57 119.71 2qfy h LYS 226 Ca 0.07 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.33 2qfy h LYS 226 Cb 0.15 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 2qfy h LYS 226 CO -0.01 0.36 -0.13 -0.44 -2.27 0.00 0.00 179.45 176.97 2qfy h ASP 227 N 0.56 0.79 -0.54 4.20 3.32 -0.95 -1.97 116.42 121.83 2qfy h ASP 227 Ca 0.21 -0.38 -0.05 0.00 0.02 0.00 0.00 57.03 56.83 2qfy h ASP 227 Cb 0.05 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 2qfy h ASP 227 CO -0.11 0.99 0.14 0.40 -1.72 0.00 0.00 179.24 178.94 2qfy h ILE 228 N 0.59 1.24 -0.53 0.35 1.08 -1.00 0.27 117.51 119.51 2qfy h ILE 228 Ca 0.10 -0.84 -0.02 0.00 -0.39 0.00 0.00 64.86 63.70 2qfy h ILE 228 Cb 0.66 0.77 -0.02 0.00 -3.07 0.00 0.00 36.82 35.15 2qfy h ILE 228 CO 0.05 0.31 0.25 -0.26 -0.69 0.00 0.00 178.15 177.80 2qfy h PHE 229 N 0.75 0.77 -0.57 1.37 -1.00 -1.18 -0.15 116.94 116.93 2qfy h PHE 229 Ca 0.17 -0.04 -0.06 0.00 2.81 0.00 0.00 57.97 60.85 2qfy h PHE 229 Cb 0.32 -0.24 -0.02 0.00 3.61 0.00 0.00 35.95 39.62 2qfy h PHE 229 CO 0.02 0.61 0.11 0.37 -1.61 0.00 0.00 178.31 177.81 2qfy h GLN 230 N 0.71 0.93 -0.27 1.51 5.75 -1.15 0.11 115.11 122.70 2qfy h GLN 230 Ca 0.18 -0.24 -0.00 0.00 -0.15 0.00 0.00 58.65 58.44 2qfy h GLN 230 Cb 0.13 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.55 2qfy h GLN 230 CO -0.02 0.88 0.15 1.49 -2.65 0.00 0.00 178.83 178.68 2qfy h GLU 231 N 0.83 0.37 -0.57 1.69 4.81 -0.69 -1.59 114.58 119.43 2qfy h GLU 231 Ca 0.18 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.30 2qfy h GLU 231 Cb 0.39 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 2qfy h GLU 231 CO 0.01 0.31 0.09 0.28 -0.73 0.00 0.00 179.01 178.97 2qfy h VAL 232 N 0.32 1.24 -0.38 0.32 2.07 -0.87 0.34 116.25 119.30 2qfy h VAL 232 Ca 0.09 -0.94 0.03 0.00 0.82 0.00 0.00 66.70 66.71 2qfy h VAL 232 Cb 0.05 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.49 2qfy h VAL 232 CO -0.02 0.35 0.18 0.22 0.02 0.00 0.00 177.57 178.32 2qfy h TYR 233 N 0.87 0.33 0.00 1.57 3.20 -0.65 -1.79 116.97 120.50 2qfy h TYR 233 Ca 0.18 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.06 2qfy h TYR 233 Cb 0.38 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.56 2qfy h TYR 233 CO 0.02 0.17 0.00 0.93 -1.64 0.00 0.00 178.16 177.64 2qfy h GLU 234 N 0.37 0.00 0.17 1.82 5.08 -0.95 0.24 114.58 121.32 2qfy h GLU 234 Ca 0.16 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.19 2qfy h GLU 234 Cb 0.08 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.34 2qfy h GLU 234 CO -0.12 0.00 -1.61 0.00 -1.00 0.00 0.00 179.01 176.28 2qfy h ALA 235 N 2.39 0.14 0.00 3.43 0.00 -0.20 -3.45 119.26 121.58 2qfy h ALA 235 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 54.91 53.84 2qfy h ALA 235 Cb 0.70 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2qfy h ALA 235 CO 0.00 1.01 0.00 1.04 0.00 0.00 0.00 179.25 181.30 2qfy n GLN 236 N -3.56 0.00 0.00 0.00 6.02 -0.74 -4.98 117.38 114.11 2qfy n GLN 236 Ca -0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.79 2qfy n GLN 236 Cb 1.07 -0.23 0.00 0.00 1.02 0.00 0.00 30.24 32.10 2qfy n GLN 236 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2qfy n TYR 237 N 0.00 0.00 -0.09 1.08 4.02 -0.62 -4.80 117.16 116.75 2qfy n TYR 237 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.75 2qfy n TYR 237 Cb 0.13 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.35 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 -0.44 0.00 -0.72 1.63 -0.88 -1.30 116.57 114.86 2qfy h LYS 238 Ca 0.00 0.03 -0.06 0.00 -0.85 0.00 0.00 60.65 59.77 2qfy h LYS 238 Cb 0.00 0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 31.72 2qfy h LYS 238 CO 0.00 -0.30 -0.27 0.66 -3.45 0.00 0.00 179.45 176.09 2qfy h SER 239 N -0.46 0.00 -0.30 4.20 4.64 -1.89 -2.21 113.55 117.52 2qfy h SER 239 Ca 0.06 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.32 2qfy h SER 239 Cb 0.62 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 2qfy h SER 239 CO -0.53 0.27 -0.03 0.11 -0.87 0.00 0.00 176.83 175.79 2qfy h LYS 240 N 0.00 0.55 -0.60 4.77 1.79 -1.70 -0.75 116.57 120.63 2qfy h LYS 240 Ca -0.00 -0.19 -0.03 0.00 -2.18 0.00 0.00 60.65 58.25 2qfy h LYS 240 Cb 0.53 -0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 31.11 2qfy h LYS 240 CO 0.04 0.71 0.24 0.74 -1.08 0.00 0.00 179.45 180.10 2qfy h PHE 241 N 0.33 0.92 -0.74 -1.35 -1.00 -0.97 -1.95 116.94 112.17 2qfy h PHE 241 Ca 0.08 -0.07 -0.03 0.00 2.81 0.00 0.00 57.97 60.76 2qfy h PHE 241 Cb 0.48 -0.27 -0.03 0.00 3.61 0.00 0.00 35.95 39.73 2qfy h PHE 241 CO 0.04 0.73 0.35 0.93 -1.61 0.00 0.00 178.31 178.75 2qfy h GLU 242 N 0.84 1.08 -0.60 1.51 5.08 -1.29 0.19 114.58 121.38 2qfy h GLU 242 Ca 0.20 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2qfy h GLU 242 Cb 0.20 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 2qfy h GLU 242 CO -0.02 0.84 0.23 0.37 -1.00 0.00 0.00 179.01 179.44 2qfy h GLN 243 N 1.05 0.88 0.00 2.33 -0.00 -0.82 -2.45 115.11 116.09 2qfy h GLN 243 Ca 0.25 -0.14 0.00 0.00 -0.00 0.00 0.00 58.65 58.76 2qfy h GLN 243 Cb 0.13 -0.15 0.00 0.00 0.00 0.00 0.00 27.48 27.45 2qfy h GLN 243 CO -0.03 0.72 -0.48 -0.07 0.00 0.00 0.00 178.83 178.97 2qfy h LEU 244 N 0.86 0.00 0.00 -2.39 3.38 -0.94 -3.48 115.31 112.74 2qfy h LEU 244 Ca 0.20 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2qfy h LEU 244 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2qfy h LEU 244 CO -0.02 0.06 0.00 0.61 0.09 0.00 0.00 178.44 179.18 2qfy n GLY 245 N 1.29 0.40 3.90 0.83 0.00 0.57 -5.06 105.19 107.12 2qfy n GLY 245 Ca 0.03 -1.05 -0.20 0.00 0.00 0.00 0.00 46.02 44.80 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 -2.00 3.72 0.07 -0.61 -4.36 -0.67 -5.02 121.20 112.33 2qfy s ILE 246 Ca 0.00 -1.25 0.06 0.00 -0.26 0.00 0.00 60.65 59.20 2qfy s ILE 246 Cb 0.00 -3.26 -0.03 0.00 1.25 0.00 0.00 42.46 40.42 2qfy s ILE 246 CO 0.00 -0.17 -0.16 -1.00 0.24 0.00 0.00 174.94 173.85 2qfy s HIS 247 N -2.26 1.40 -0.08 1.37 3.76 -1.26 -4.44 115.29 113.78 2qfy s HIS 247 Ca 0.42 -0.42 0.03 0.00 -0.15 0.00 0.00 55.06 54.94 2qfy s HIS 247 Cb -0.07 -0.79 -0.02 0.00 1.11 0.00 0.00 32.58 32.81 2qfy s HIS 247 CO 0.28 0.09 -0.17 -0.47 -0.85 0.00 0.00 174.74 173.62 2qfy s TYR 248 N -1.13 2.66 -0.15 1.40 5.04 -1.26 -0.37 117.35 123.54 2qfy s TYR 248 Ca 0.01 -0.49 -0.14 0.00 -2.44 0.00 0.00 57.07 54.02 2qfy s TYR 248 Cb -0.09 -1.69 0.04 0.00 0.35 0.00 0.00 41.96 40.56 2qfy s TYR 248 CO 0.03 -0.07 0.40 -2.00 -1.34 0.00 0.00 175.55 172.57 2qfy s GLU 249 N -0.20 0.46 -0.01 4.97 2.12 -0.71 -4.99 118.70 120.34 2qfy s GLU 249 Ca -0.01 0.57 -0.14 0.00 0.36 0.00 0.00 54.97 55.75 2qfy s GLU 249 Cb -0.13 0.21 -0.05 0.00 0.26 0.00 0.00 34.13 34.41 2qfy s GLU 249 CO 0.03 -0.06 0.38 -1.58 -0.54 0.00 0.00 175.26 173.49 2qfy s HIS 250 N 0.28 3.72 0.08 5.30 5.65 -1.26 -1.65 115.29 127.41 2qfy s HIS 250 Ca -0.01 0.94 0.01 0.00 0.25 0.00 0.00 55.06 56.26 2qfy s HIS 250 Cb -0.03 -2.25 -0.04 0.00 -1.18 0.00 0.00 32.58 29.08 2qfy s HIS 250 CO -0.00 0.66 -0.06 1.03 -0.65 0.00 0.00 174.74 175.72 2qfy s ARG 251 N -1.08 0.76 0.22 2.88 0.52 0.88 -4.92 118.95 118.22 2qfy s ARG 251 Ca 0.23 -1.29 -0.30 0.00 -0.52 0.00 0.00 55.73 53.85 2qfy s ARG 251 Cb -0.16 -0.10 -0.08 0.00 0.52 0.00 0.00 34.95 35.13 2qfy s ARG 251 CO 0.12 -0.04 1.11 -1.17 0.02 0.00 0.00 175.30 175.34 2qfy s LEU 252 N -2.97 4.51 0.28 2.53 2.96 -1.26 -2.05 118.68 122.68 2qfy s LEU 252 Ca 0.10 2.17 0.01 0.00 -0.22 0.00 0.00 54.13 56.19 2qfy s LEU 252 Cb 0.06 -3.61 0.61 0.00 0.50 0.00 0.00 46.19 43.74 2qfy s LEU 252 CO -0.06 -0.20 1.76 -0.29 -1.32 0.00 0.00 176.35 176.24 2qfy h ILE 253 N 3.49 0.70 -0.10 6.68 6.09 -0.85 -0.83 117.51 132.70 2qfy h ILE 253 Ca -0.45 -0.22 0.04 0.00 -1.37 0.00 0.00 64.86 62.86 2qfy h ILE 253 Cb 1.21 -0.00 -0.05 0.00 0.47 0.00 0.00 36.82 38.45 2qfy h ILE 253 CO 0.71 0.12 -0.22 0.44 -3.07 0.00 0.00 178.15 176.12 2qfy h ASP 254 N 0.65 -0.68 -0.48 2.19 5.19 -1.91 -1.85 116.42 119.52 2qfy h ASP 254 Ca 0.50 0.11 -0.08 0.00 -0.62 0.00 0.00 57.03 56.94 2qfy h ASP 254 Cb 0.76 0.30 -0.02 0.00 0.18 0.00 0.00 39.33 40.54 2qfy h ASP 254 CO -0.38 -0.28 0.00 0.44 -3.12 0.00 0.00 179.24 175.90 2qfy h ASP 255 N -0.30 0.87 -0.29 6.45 3.32 -1.74 -3.05 116.42 121.68 2qfy h ASP 255 Ca 0.09 -0.23 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 2qfy h ASP 255 Cb 0.43 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 2qfy h ASP 255 CO -0.27 0.93 0.09 -0.03 -1.72 0.00 0.00 179.24 178.25 2qfy h MET 256 N 0.84 0.45 0.00 3.56 4.05 -0.70 -1.18 114.93 121.93 2qfy h MET 256 Ca 0.16 -0.10 -0.06 0.00 -0.28 0.00 0.00 59.70 59.42 2qfy h MET 256 Cb 0.49 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.22 2qfy h MET 256 CO 0.02 0.50 -0.27 -0.39 0.23 0.00 0.00 176.91 177.00 2qfy h VAL 257 N 0.30 1.10 -0.07 -5.77 -1.51 -1.36 0.30 116.25 109.24 2qfy h VAL 257 Ca 0.09 -0.96 -0.10 0.00 -1.23 0.00 0.00 66.70 64.50 2qfy h VAL 257 Cb 0.24 1.53 0.00 0.00 -2.13 0.00 0.00 31.29 30.93 2qfy h VAL 257 CO -0.00 0.27 -0.35 0.00 -1.23 0.00 0.00 177.57 176.25 2qfy h ALA 258 N 1.73 0.14 -0.26 5.19 0.00 -1.40 -1.80 119.26 122.86 2qfy h ALA 258 Ca -0.00 -0.46 -0.08 0.00 0.00 0.00 0.00 54.91 54.37 2qfy h ALA 258 Cb 0.51 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2qfy h ALA 258 CO 0.04 0.22 -0.17 1.96 0.00 0.00 0.00 179.25 181.29 2qfy h GLN 259 N -0.12 0.45 -0.11 0.00 4.20 -0.87 -2.48 115.11 116.19 2qfy h GLN 259 Ca -0.02 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 58.54 2qfy h GLN 259 Cb 1.01 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.74 2qfy h GLN 259 CO 0.07 0.61 0.06 1.98 -0.67 0.00 0.00 178.83 180.89 2qfy h MET 260 N 0.41 0.14 -0.17 1.46 4.05 -0.35 -1.80 114.93 118.69 2qfy h MET 260 Ca 0.07 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.47 2qfy h MET 260 Cb 0.54 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.30 2qfy h MET 260 CO 0.04 0.15 0.06 0.82 0.23 0.00 0.00 176.91 178.20 2qfy h ILE 261 N 0.10 1.08 -0.10 1.77 1.08 -1.01 -2.56 117.51 117.87 2qfy h ILE 261 Ca 0.04 -0.24 0.00 0.00 -0.39 0.00 0.00 64.86 64.26 2qfy h ILE 261 Cb 0.05 0.89 0.00 0.00 -3.07 0.00 0.00 36.82 34.69 2qfy h ILE 261 CO -0.01 0.09 0.00 2.29 -0.69 0.00 0.00 178.15 179.83 2qfy n LYS 262 N -4.46 2.24 -1.70 2.37 2.85 -0.96 -4.98 118.16 113.52 2qfy n LYS 262 Ca -0.01 -1.81 -0.20 0.00 -1.05 0.00 0.00 58.31 55.24 2qfy n LYS 262 Cb 0.12 -1.47 0.12 0.00 -0.65 0.00 0.00 35.03 33.16 2qfy n LYS 262 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2qfy n SER 263 N 1.16 0.48 -0.88 -5.58 3.41 -0.69 -5.00 113.62 106.52 2qfy n SER 263 Ca 0.16 -1.57 0.08 0.00 -0.26 0.00 0.00 58.87 57.28 2qfy n SER 263 Cb 0.55 -0.64 0.20 0.00 -0.26 0.00 0.00 64.21 64.07 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 -2.78 2.60 0.00 4.33 5.02 -1.26 -4.20 118.16 121.87 2qfy n LYS 264 Ca 0.12 -2.18 0.00 0.00 -2.02 0.00 0.00 58.31 54.24 2qfy n LYS 264 Cb 0.43 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 34.07 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 0.95 -1.61 1.13 0.72 0.00 -1.26 -1.77 105.19 103.35 2qfy n GLY 265 Ca 0.16 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.81 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 3.68 -0.02 0.00 -0.76 -4.77 105.19 103.93 2qfy n GLY 266 Ca 0.00 -0.41 -0.02 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.94 -0.12 -0.11 1.61 -0.12 -1.19 -4.57 117.98 110.53 2qfy s PHE 267 Ca 0.00 -0.09 -0.00 0.00 -0.05 0.00 0.00 56.93 56.78 2qfy s PHE 267 Cb 0.00 0.60 -0.02 0.00 -0.63 0.00 0.00 43.02 42.96 2qfy s PHE 267 CO 0.00 -0.60 -0.09 0.42 -0.05 0.00 0.00 175.22 174.91 2qfy s ILE 268 N -2.96 3.50 -0.31 -4.49 1.01 -0.39 -1.39 121.20 116.17 2qfy s ILE 268 Ca 0.12 -0.52 -0.01 0.00 0.00 0.00 0.00 60.65 60.24 2qfy s ILE 268 Cb 0.01 -2.47 0.06 0.00 0.01 0.00 0.00 42.46 40.07 2qfy s ILE 268 CO -0.01 0.54 0.02 -0.04 0.00 0.00 0.00 174.94 175.45 2qfy s MET 269 N -0.11 2.29 -0.05 2.79 -1.94 0.85 -0.72 119.30 122.39 2qfy s MET 269 Ca 0.00 -1.39 -0.30 0.00 -1.71 0.00 0.00 55.69 52.30 2qfy s MET 269 Cb -0.13 -3.20 -0.02 0.00 2.01 0.00 0.00 34.83 33.48 2qfy s MET 269 CO 0.03 -0.70 1.00 0.00 -0.01 0.00 0.00 175.02 175.34 2qfy s ALA 270 N 1.20 3.29 0.05 3.03 0.00 0.15 -0.31 121.76 129.16 2qfy s ALA 270 Ca -0.03 0.46 0.03 0.00 0.00 0.00 0.00 51.96 52.42 2qfy s ALA 270 Cb -0.20 -3.39 -0.02 0.00 0.00 0.00 0.00 23.12 19.50 2qfy s ALA 270 CO -0.02 -0.42 -0.09 -0.51 0.00 0.00 0.00 175.76 174.71 2qfy s LEU 271 N 1.53 2.25 1.00 0.00 1.43 0.98 -2.52 118.68 123.34 2qfy s LEU 271 Ca 0.50 -0.54 -0.11 0.00 -1.03 0.00 0.00 54.13 52.95 2qfy s LEU 271 Cb -0.20 -0.25 0.19 0.00 0.03 0.00 0.00 46.19 45.97 2qfy s LEU 271 CO 0.23 -0.16 1.09 -0.54 0.23 0.00 0.00 176.35 177.20 2qfy s LYS 272 N -1.54 0.37 0.18 1.70 1.02 -1.26 -1.17 119.74 119.04 2qfy s LYS 272 Ca -0.08 1.18 -0.24 0.00 0.02 0.00 0.00 55.97 56.86 2qfy s LYS 272 Cb -0.10 -1.68 0.08 0.00 -0.52 0.00 0.00 37.83 35.61 2qfy s LYS 272 CO 0.01 -2.96 1.56 -0.97 -0.92 0.00 0.00 175.35 172.07 2qfy h ASN 273 N -2.09 -1.52 -0.24 2.83 -0.73 -1.86 0.10 115.58 112.07 2qfy h ASN 273 Ca -0.51 0.27 -0.04 0.00 1.87 0.00 0.00 56.30 57.89 2qfy h ASN 273 Cb 1.29 0.72 -0.01 0.00 0.27 0.00 0.00 38.32 40.59 2qfy h ASN 273 CO 0.47 -0.31 -0.02 0.22 -0.37 0.00 0.00 177.43 177.42 2qfy h TYR 274 N -0.15 0.47 -0.57 0.67 3.20 -1.90 -2.34 116.97 116.36 2qfy h TYR 274 Ca 0.22 -0.09 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 2qfy h TYR 274 Cb 0.55 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.68 2qfy h TYR 274 CO -0.77 0.62 0.10 -0.44 -1.64 0.00 0.00 178.16 176.03 2qfy h ASP 275 N 0.19 0.86 -0.46 -2.11 3.32 -1.83 -2.12 116.42 114.27 2qfy h ASP 275 Ca 0.06 -0.18 -0.04 0.00 0.02 0.00 0.00 57.03 56.90 2qfy h ASP 275 Cb 0.44 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 2qfy h ASP 275 CO 0.02 0.86 0.15 1.23 -1.72 0.00 0.00 179.24 179.77 2qfy h GLY 276 N 1.00 0.83 0.86 2.75 0.00 -0.72 0.31 103.07 108.10 2qfy h GLY 276 Ca 0.18 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 2qfy h GLY 276 CO 0.01 0.43 -0.19 -1.80 0.00 0.00 0.00 176.54 174.99 2qfy h ASP 277 N 0.75 -0.44 -0.00 0.19 1.82 -0.84 -2.13 116.42 115.78 2qfy h ASP 277 Ca 0.17 -0.06 -0.00 0.00 -0.39 0.00 0.00 57.03 56.75 2qfy h ASP 277 Cb 0.24 0.11 -0.00 0.00 0.68 0.00 0.00 39.33 40.36 2qfy h ASP 277 CO -0.01 -0.20 0.00 0.58 -1.61 0.00 0.00 179.24 178.00 2qfy h VAL 278 N -0.67 1.23 -0.08 2.25 2.07 -1.24 -3.25 116.25 116.57 2qfy h VAL 278 Ca -0.05 -0.68 -0.06 0.00 0.82 0.00 0.00 66.70 66.73 2qfy h VAL 278 Cb 0.48 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 2qfy h VAL 278 CO 0.09 0.18 -0.21 1.56 0.02 0.00 0.00 177.57 179.20 2qfy h GLN 279 N -0.28 0.13 -0.10 1.57 1.08 -1.02 -2.41 115.11 114.08 2qfy h GLN 279 Ca 0.00 -0.03 -0.04 0.00 -1.45 0.00 0.00 58.65 57.12 2qfy h GLN 279 Cb 0.29 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.69 2qfy h GLN 279 CO 0.00 0.34 -0.13 0.66 -0.95 0.00 0.00 178.83 178.75 2qfy h SER 280 N 0.12 0.14 0.27 1.46 4.64 -1.41 0.31 113.55 119.08 2qfy h SER 280 Ca 0.02 -0.02 -0.21 0.00 -0.47 0.00 0.00 61.79 61.10 2qfy h SER 280 Cb 0.45 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2qfy h SER 280 CO 0.03 0.29 -0.86 0.44 -0.87 0.00 0.00 176.83 175.86 2qfy h ASP 281 N 0.14 0.55 -0.30 4.97 3.45 -1.50 0.14 116.42 123.87 2qfy h ASP 281 Ca 0.03 -0.41 -0.03 0.00 0.43 0.00 0.00 57.03 57.06 2qfy h ASP 281 Cb 0.33 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 38.92 2qfy h ASP 281 CO 0.02 1.19 0.09 0.40 -1.57 0.00 0.00 179.24 179.36 2qfy h ILE 282 N 0.27 1.21 -0.13 0.35 2.04 -1.14 -0.88 117.51 119.22 2qfy h ILE 282 Ca -0.06 -0.68 -0.01 0.00 1.00 0.00 0.00 64.86 65.11 2qfy h ILE 282 Cb 1.48 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 38.63 2qfy h ILE 282 CO 0.15 0.23 0.03 0.58 0.00 0.00 0.00 178.15 179.14 2qfy h VAL 283 N 0.33 1.20 -0.41 1.67 2.07 -0.93 0.55 116.25 120.72 2qfy h VAL 283 Ca 0.10 -0.61 0.04 0.00 0.82 0.00 0.00 66.70 67.05 2qfy h VAL 283 Cb 0.26 1.35 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 2qfy h VAL 283 CO -0.00 0.18 0.17 0.00 0.02 0.00 0.00 177.57 177.94 2qfy h ALA 284 N 0.83 0.50 -0.53 1.67 0.00 -0.93 -1.15 119.26 119.65 2qfy h ALA 284 Ca 0.04 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2qfy h ALA 284 Cb 0.25 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2qfy h ALA 284 CO 0.00 -0.20 0.08 0.37 0.00 0.00 0.00 179.25 179.50 2qfy h GLN 285 N 0.36 0.88 -0.55 0.00 5.75 -1.01 -2.82 115.11 117.72 2qfy h GLN 285 Ca 0.19 -0.24 -0.03 0.00 -0.15 0.00 0.00 58.65 58.42 2qfy h GLN 285 Cb 0.14 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.56 2qfy h GLN 285 CO -0.16 0.86 0.24 0.78 -2.65 0.00 0.00 178.83 177.89 2qfy h GLY 286 N 0.76 0.84 2.00 2.39 0.00 -0.48 -1.79 103.07 106.79 2qfy h GLY 286 Ca 0.16 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 47.09 2qfy h GLY 286 CO 0.01 0.38 -0.01 0.74 0.00 0.00 0.00 176.54 177.67 2qfy h PHE 287 N 0.78 0.00 0.00 5.60 -1.00 -1.08 0.15 116.94 121.39 2qfy h PHE 287 Ca 0.19 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.97 2qfy h PHE 287 Cb 0.13 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.69 2qfy h PHE 287 CO 0.01 0.01 0.00 0.41 -1.61 0.00 0.00 178.31 177.13 2qfy n GLY 288 N 0.35 2.85 3.63 -1.45 0.00 -0.67 -4.26 105.19 105.63 2qfy n GLY 288 Ca 0.02 -0.35 -0.10 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.48 0.56 1.61 0.15 -1.08 -4.90 113.70 109.57 2qfy s SER 289 Ca 0.00 0.89 0.28 0.00 0.70 0.00 0.00 55.95 57.82 2qfy s SER 289 Cb 0.00 0.89 1.67 0.00 -1.71 0.00 0.00 66.02 66.87 2qfy s SER 289 CO 0.00 -0.18 2.19 -0.07 1.20 0.00 0.00 173.24 176.38 2qfy h LEU 290 N 4.13 0.00 0.00 3.45 3.38 -1.90 -1.23 115.31 123.14 2qfy h LEU 290 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2qfy h LEU 290 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2qfy h LEU 290 CO 0.12 0.04 0.00 0.61 0.09 0.00 0.00 178.44 179.30 2qfy n GLY 291 N -1.15 -1.13 2.69 0.83 0.00 -1.26 -4.17 105.19 101.00 2qfy n GLY 291 Ca -0.03 -0.15 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.20 4.32 -3.71 0.99 4.77 -0.47 -3.86 117.00 117.85 2qfy n LEU 292 Ca 0.16 -5.33 -0.14 0.00 -0.03 0.00 0.00 56.01 50.67 2qfy n LEU 292 Cb 0.19 -0.87 -0.08 0.00 -2.33 0.00 0.00 43.42 40.33 2qfy n LEU 292 CO 0.20 1.88 0.13 -0.32 -1.33 0.00 0.00 177.39 177.95 2qfy s MET 293 N -2.29 0.69 0.24 3.23 1.75 -1.26 -1.04 119.30 120.63 2qfy s MET 293 Ca 0.35 0.13 0.09 0.00 -1.25 0.00 0.00 55.69 55.01 2qfy s MET 293 Cb 0.08 0.32 -0.04 0.00 2.84 0.00 0.00 34.83 38.02 2qfy s MET 293 CO -0.02 -0.17 -0.00 0.95 -0.65 0.00 0.00 175.02 175.12 2qfy s THR 294 N -0.83 3.52 -0.18 10.11 -4.23 0.17 -4.42 115.64 119.78 2qfy s THR 294 Ca -0.09 -1.79 -0.04 0.00 -1.18 0.00 0.00 61.69 58.59 2qfy s THR 294 Cb -0.04 -2.85 0.09 0.00 1.34 0.00 0.00 72.50 71.04 2qfy s THR 294 CO 0.04 -0.31 0.28 -0.55 -0.54 0.00 0.00 174.62 173.54 2qfy s SER 295 N -3.49 0.63 -0.07 3.99 0.15 -1.25 -2.55 113.70 111.11 2qfy s SER 295 Ca 0.30 0.28 0.00 0.00 0.70 0.00 0.00 55.95 57.24 2qfy s SER 295 Cb -0.07 0.71 0.02 0.00 -1.71 0.00 0.00 66.02 64.97 2qfy s SER 295 CO 0.19 -0.28 -0.06 -0.51 1.20 0.00 0.00 173.24 173.78 2qfy s ILE 296 N 2.42 0.77 -0.04 6.45 2.07 -0.63 -1.26 121.20 130.99 2qfy s ILE 296 Ca 0.05 -0.20 -0.23 0.00 -1.41 0.00 0.00 60.65 58.86 2qfy s ILE 296 Cb -0.14 -0.80 -0.04 0.00 0.13 0.00 0.00 42.46 41.61 2qfy s ILE 296 CO -0.11 0.30 0.68 -0.22 -1.91 0.00 0.00 174.94 173.68 2qfy s LEU 297 N 1.28 4.35 -0.01 8.50 2.96 0.50 -0.79 118.68 135.47 2qfy s LEU 297 Ca -0.04 1.20 0.04 0.00 -0.22 0.00 0.00 54.13 55.11 2qfy s LEU 297 Cb -0.14 -3.05 -0.01 0.00 0.50 0.00 0.00 46.19 43.49 2qfy s LEU 297 CO -0.02 -0.06 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.13 2qfy s VAL 298 N 0.51 1.04 0.13 1.68 1.01 0.95 -1.13 120.40 124.59 2qfy s VAL 298 Ca 0.36 -0.57 -0.08 0.00 0.00 0.00 0.00 61.98 61.69 2qfy s VAL 298 Cb -0.18 -0.87 -0.06 0.00 0.00 0.00 0.00 36.38 35.27 2qfy s VAL 298 CO 0.18 0.29 0.42 0.42 0.00 0.00 0.00 175.10 176.42 2qfy s THR 299 N -0.32 5.08 0.58 3.92 -4.23 -1.03 -0.76 115.64 118.88 2qfy s THR 299 Ca 0.05 0.34 0.28 0.00 -1.18 0.00 0.00 61.69 61.18 2qfy s THR 299 Cb -0.05 -3.64 0.36 0.00 1.34 0.00 0.00 72.50 70.51 2qfy s THR 299 CO -0.00 0.15 2.07 1.55 -0.54 0.00 0.00 174.62 177.84 2qfy h PRO 300 N 3.22 0.00 0.00 3.99 0.13 -1.92 -1.49 132.00 135.94 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 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2qfy h PRO 300 CO 0.69 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.06 2qfy n ASP 301 N -3.88 0.00 -1.07 1.44 5.68 -1.26 -4.81 116.55 112.66 2qfy n ASP 301 Ca 0.03 -0.41 -0.14 0.00 -0.50 0.00 0.00 54.79 53.78 2qfy n ASP 301 Cb 0.38 -0.15 -0.06 0.00 -1.14 0.00 0.00 41.12 40.15 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 0.68 1.37 0.00 6.12 0.00 -0.56 -4.88 105.19 107.92 2qfy n GLY 302 Ca 0.15 -0.38 0.04 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.59 3.54 -4.71 1.61 5.02 -1.26 -5.01 118.16 114.76 2qfy n LYS 303 Ca -0.14 -0.01 -0.24 0.00 -2.02 0.00 0.00 58.31 55.90 2qfy n LYS 303 Cb 0.45 -0.95 -0.16 0.00 -0.02 0.00 0.00 35.03 34.36 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 -1.93 1.23 0.01 -0.18 2.01 -1.26 -4.58 115.64 110.94 2qfy s THR 304 Ca 0.02 -0.62 0.00 0.00 0.31 0.00 0.00 61.69 61.40 2qfy s THR 304 Cb 0.06 -1.05 -0.01 0.00 0.01 0.00 0.00 72.50 71.51 2qfy s THR 304 CO 0.34 0.36 -0.02 -0.36 -0.69 0.00 0.00 174.62 174.25 2qfy s PHE 305 N -0.04 0.20 -0.24 4.92 0.08 0.11 -2.47 117.98 120.53 2qfy s PHE 305 Ca -0.01 -0.23 -0.02 0.00 0.12 0.00 0.00 56.93 56.79 2qfy s PHE 305 Cb -0.09 -0.13 0.08 0.00 -0.57 0.00 0.00 43.02 42.30 2qfy s PHE 305 CO 0.01 -0.07 0.07 -2.00 -0.10 0.00 0.00 175.22 173.13 2qfy s GLU 306 N -0.63 0.59 -0.29 0.44 2.12 -0.28 -0.44 118.70 120.20 2qfy s GLU 306 Ca -0.06 -0.63 -0.18 0.00 0.36 0.00 0.00 54.97 54.46 2qfy s GLU 306 Cb -0.04 -1.92 -0.02 0.00 0.26 0.00 0.00 34.13 32.40 2qfy s GLU 306 CO -0.00 -0.81 0.50 0.45 -0.54 0.00 0.00 175.26 174.86 2qfy s SER 307 N 1.83 6.38 0.05 -1.70 0.15 0.11 -0.37 113.70 120.15 2qfy s SER 307 Ca 0.04 0.35 0.09 0.00 0.70 0.00 0.00 55.95 57.12 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 -0.18 -0.33 -0.25 -1.83 1.20 0.00 0.00 173.24 171.86 2qfy s GLU 308 N 2.31 1.66 -0.27 5.44 -1.05 -0.39 0.15 118.70 126.55 2qfy s GLU 308 Ca 0.20 -1.09 -0.28 0.00 -0.15 0.00 0.00 54.97 53.65 2qfy s GLU 308 Cb -0.16 -1.85 -0.04 0.00 -0.44 0.00 0.00 34.13 31.65 2qfy s GLU 308 CO 0.10 0.47 2.03 0.00 0.95 0.00 0.00 175.26 178.82 2qfy s ALA 309 N -0.83 2.77 -1.64 -0.84 0.00 0.10 -3.95 121.76 117.37 2qfy s ALA 309 Ca 0.11 0.53 0.00 0.00 0.00 0.00 0.00 51.96 52.59 2qfy s ALA 309 Cb -0.10 -4.05 0.00 0.00 0.00 0.00 0.00 23.12 18.97 2qfy s ALA 309 CO 0.02 -2.75 0.74 0.00 0.00 0.00 0.00 175.76 173.78 2qfy n ALA 310 N 11.12 2.38 -3.93 0.00 0.00 -1.26 -4.47 120.51 124.35 2qfy n ALA 310 Ca 0.27 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.42 2qfy n ALA 310 Cb 0.46 -1.00 -0.16 0.00 0.00 0.00 0.00 19.45 18.74 2qfy n ALA 310 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2qfy s HIS 311 N -1.64 1.85 0.75 0.00 2.46 -1.26 -4.93 115.29 112.52 2qfy s HIS 311 Ca 0.00 -1.13 -0.15 0.00 0.47 0.00 0.00 55.06 54.25 2qfy s HIS 311 Cb 0.00 -1.39 0.05 0.00 -0.13 0.00 0.00 32.58 31.11 2qfy s HIS 311 CO 0.00 -0.63 1.22 0.20 -2.47 0.00 0.00 174.74 173.06 2qfy s GLY 312 N 1.59 2.34 0.29 1.59 0.00 -1.26 -4.78 107.32 107.08 2qfy s GLY 312 Ca 0.02 0.92 -0.12 0.00 0.00 0.00 0.00 44.72 45.53 2qfy s GLY 312 CO -0.08 1.33 0.66 -1.08 0.00 0.00 0.00 173.10 173.93 2qfy s THR 313 N -1.97 4.79 -0.22 0.90 -1.32 -1.26 -5.03 115.64 111.53 2qfy s THR 313 Ca 0.75 0.73 -0.05 0.00 -1.21 0.00 0.00 61.69 61.91 2qfy s THR 313 Cb -0.30 -3.62 -0.02 0.00 -1.51 0.00 0.00 72.50 67.05 2qfy s THR 313 CO 0.47 -0.15 -0.00 -0.69 -2.21 0.00 0.00 174.62 172.04 2qfy s VAL 314 N -1.93 3.79 0.53 5.08 1.01 -1.26 -5.00 120.40 122.62 2qfy s VAL 314 Ca 0.51 -0.36 0.19 0.00 0.00 0.00 0.00 61.98 62.32 2qfy s VAL 314 Cb -0.11 -2.73 0.28 0.00 0.00 0.00 0.00 36.38 33.82 2qfy s VAL 314 CO 0.19 0.40 2.16 0.74 0.00 0.00 0.00 175.10 178.60 2qfy h THR 315 N 5.57 0.91 -0.11 3.92 2.02 -2.00 -2.61 112.91 120.62 2qfy h THR 315 Ca -0.39 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 66.75 2qfy h THR 315 Cb 1.17 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 68.60 2qfy h THR 315 CO 0.60 0.01 0.07 0.03 0.37 0.00 0.00 175.52 176.59 2qfy h ARG 316 N 0.00 0.15 -0.77 6.66 3.08 -1.99 0.58 114.38 122.09 2qfy h ARG 316 Ca -0.00 -0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.12 2qfy h ARG 316 Cb 0.02 -0.03 -0.07 0.00 0.08 0.00 0.00 29.97 29.97 2qfy h ARG 316 CO 0.00 0.15 0.43 0.45 -1.07 0.00 0.00 179.97 179.93 2qfy h HIS 317 N 0.11 0.78 -0.54 3.04 3.86 -1.90 -1.02 115.15 119.48 2qfy h HIS 317 Ca 0.04 0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 59.24 2qfy h HIS 317 Cb 0.04 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.25 2qfy h HIS 317 CO -0.05 0.33 0.20 -0.92 0.86 0.00 0.00 177.93 178.35 2qfy h TYR 318 N 0.74 0.84 0.02 2.45 -0.00 -1.36 0.97 116.97 120.63 2qfy h TYR 318 Ca 0.36 -0.07 0.03 0.00 -0.00 0.00 0.00 58.73 59.05 2qfy h TYR 318 Cb 0.31 -0.25 -0.05 0.00 -0.00 0.00 0.00 36.73 36.74 2qfy h TYR 318 CO -0.07 0.70 -0.31 -0.09 -0.00 0.00 0.00 178.16 178.38 2qfy h ARG 319 N 0.74 -0.46 -0.82 1.82 2.43 0.33 0.34 114.38 118.77 2qfy h ARG 319 Ca 0.18 0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.44 2qfy h ARG 319 Cb 0.23 0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 29.83 2qfy h ARG 319 CO -0.01 -0.31 0.53 0.87 -1.51 0.00 0.00 179.97 179.55 2qfy h LYS 320 N -0.48 0.90 -0.51 0.20 1.57 -1.02 -1.30 116.57 115.94 2qfy h LYS 320 Ca 0.06 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 2qfy h LYS 320 Cb 0.55 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.64 2qfy h LYS 320 CO -0.25 0.60 0.18 -0.92 -0.57 0.00 0.00 179.45 178.49 2qfy h TYR 321 N 0.93 0.80 -0.34 -1.35 3.20 0.82 0.10 116.97 121.13 2qfy h TYR 321 Ca 0.34 -0.07 -0.08 0.00 3.14 0.00 0.00 58.73 62.06 2qfy h TYR 321 Cb 0.17 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.19 2qfy h TYR 321 CO -0.00 0.68 -0.13 1.96 -1.64 0.00 0.00 178.16 179.02 2qfy h GLN 322 N 0.69 0.60 0.00 1.82 4.20 0.42 -2.06 115.11 120.78 2qfy h GLN 322 Ca 0.17 -0.19 0.00 0.00 0.06 0.00 0.00 58.65 58.69 2qfy h GLN 322 Cb 0.24 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.96 2qfy h GLN 322 CO -0.01 0.72 0.00 1.63 -0.67 0.00 0.00 178.83 180.50 2qfy n LYS 323 N -4.18 0.76 -0.85 1.46 5.02 -0.57 -4.85 118.16 114.96 2qfy n LYS 323 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 2qfy n LYS 323 Cb 0.35 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 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 0.51 0.78 3.84 0.72 0.00 -0.78 -5.03 105.19 105.23 2qfy n GLY 324 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.15 3.98 0.57 1.61 2.02 0.33 -5.00 118.70 122.07 2qfy s GLU 325 Ca 0.00 0.97 -0.17 0.00 0.02 0.00 0.00 54.97 55.79 2qfy s GLU 325 Cb 0.00 -2.14 -0.05 0.00 0.10 0.00 0.00 34.13 32.04 2qfy s GLU 325 CO 0.00 -0.24 1.06 -1.83 0.02 0.00 0.00 175.26 174.26 2qfy s GLU 326 N -3.96 3.42 0.27 1.61 -1.05 -1.26 -4.05 118.70 113.67 2qfy s GLU 326 Ca 0.59 1.25 0.03 0.00 -0.15 0.00 0.00 54.97 56.70 2qfy s GLU 326 Cb -0.10 -2.04 -0.06 0.00 -0.44 0.00 0.00 34.13 31.49 2qfy s GLU 326 CO 0.29 -0.73 0.03 0.95 0.95 0.00 0.00 175.26 176.75 2qfy s THR 327 N -2.33 1.02 -0.42 1.83 -4.23 -1.26 -4.86 115.64 105.39 2qfy s THR 327 Ca 0.65 -2.02 0.08 0.00 -1.18 0.00 0.00 61.69 59.21 2qfy s THR 327 Cb -0.16 -2.56 0.26 0.00 1.34 0.00 0.00 72.50 71.38 2qfy s THR 327 CO 0.33 -0.15 0.69 -0.24 -0.54 0.00 0.00 174.62 174.71 2qfy n SER 328 N -0.53 -0.92 -4.79 3.99 2.88 -1.26 -0.82 113.62 112.17 2qfy n SER 328 Ca -0.03 -2.97 -0.36 0.00 -1.33 0.00 0.00 58.87 54.18 2qfy n SER 328 Cb 0.65 0.31 -0.07 0.00 -0.75 0.00 0.00 64.21 64.35 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 -0.59 5.39 0.26 2.46 2.01 -1.26 -3.82 115.64 120.08 2qfy s THR 329 Ca 0.34 0.33 -0.30 0.00 0.31 0.00 0.00 61.69 62.38 2qfy s THR 329 Cb 0.21 -3.50 -0.09 0.00 0.01 0.00 0.00 72.50 69.12 2qfy s THR 329 CO -0.15 0.50 1.29 0.21 -0.69 0.00 0.00 174.62 175.79 2qfy s ASN 330 N -0.24 6.89 0.00 3.53 3.84 -1.26 -4.64 114.94 123.06 2qfy s ASN 330 Ca 0.14 2.50 0.10 0.00 0.21 0.00 0.00 52.86 55.81 2qfy s ASN 330 Cb -0.12 -2.63 0.13 0.00 -0.55 0.00 0.00 41.25 38.08 2qfy s ASN 330 CO 0.03 -0.49 0.93 -1.54 -2.79 0.00 0.00 177.10 173.23 2qfy n SER 331 N 1.83 2.11 -0.15 -4.21 3.41 -1.26 -4.71 113.62 110.64 2qfy n SER 331 Ca 0.03 -1.57 -0.05 0.00 -0.26 0.00 0.00 58.87 57.02 2qfy n SER 331 Cb 0.42 -0.05 0.04 0.00 -0.26 0.00 0.00 64.21 64.36 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 2.00 0.98 -0.88 -1.33 2.04 -1.91 -0.55 117.51 117.86 2qfy h ILE 332 Ca 0.00 -0.17 -0.00 0.00 1.00 0.00 0.00 64.86 65.69 2qfy h ILE 332 Cb 0.50 0.45 -0.04 0.00 -0.74 0.00 0.00 36.82 36.99 2qfy h ILE 332 CO 0.00 0.09 0.55 0.00 0.00 0.00 0.00 178.15 178.79 2qfy h ALA 333 N 1.25 1.30 -0.28 1.87 0.00 -1.84 -0.72 119.26 120.83 2qfy h ALA 333 Ca 0.20 -0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.86 2qfy h ALA 333 Cb 0.10 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 2qfy h ALA 333 CO -0.13 0.61 -0.49 0.77 0.00 0.00 0.00 179.25 180.01 2qfy h SER 334 N 1.21 0.85 -0.58 0.00 0.02 -1.77 -2.03 113.55 111.25 2qfy h SER 334 Ca 0.32 -0.43 -0.02 0.00 -0.84 0.00 0.00 61.79 60.82 2qfy h SER 334 Cb -0.08 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.19 2qfy h SER 334 CO -0.06 1.19 0.28 0.40 -1.14 0.00 0.00 176.83 177.50 2qfy h ILE 335 N 0.61 1.21 0.00 3.27 2.04 -0.52 -2.44 117.51 121.68 2qfy h ILE 335 Ca 0.03 -0.58 -0.06 0.00 1.00 0.00 0.00 64.86 65.25 2qfy h ILE 335 Cb 1.06 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 2qfy h ILE 335 CO 0.11 0.23 -0.30 -0.26 0.00 0.00 0.00 178.15 177.93 2qfy h PHE 336 N 0.79 0.00 -0.45 1.37 -1.00 -1.07 -1.05 116.94 115.53 2qfy h PHE 336 Ca 0.20 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.96 2qfy h PHE 336 Cb 0.11 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.65 2qfy h PHE 336 CO -0.00 0.30 0.22 0.00 -1.61 0.00 0.00 178.31 177.21 2qfy h ALA 337 N 1.70 0.58 -0.01 2.45 0.00 -0.89 0.24 119.26 123.34 2qfy h ALA 337 Ca -0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2qfy h ALA 337 Cb 0.67 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2qfy h ALA 337 CO 0.04 0.13 0.00 -1.49 0.00 0.00 0.00 179.25 177.94 2qfy h TRP 338 N 0.58 0.01 -0.50 0.00 4.06 -1.15 -2.18 115.95 116.77 2qfy h TRP 338 Ca 0.15 -0.00 -0.00 0.00 2.06 0.00 0.00 58.89 61.10 2qfy h TRP 338 Cb 0.11 -0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.24 2qfy h TRP 338 CO -0.01 0.20 0.29 0.66 -3.56 0.00 0.00 178.44 176.02 2qfy h SER 339 N -0.18 0.60 0.09 -3.49 4.64 -1.04 -0.15 113.55 114.03 2qfy h SER 339 Ca 0.00 -0.06 -0.09 0.00 -0.47 0.00 0.00 61.79 61.17 2qfy h SER 339 Cb 0.19 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 2qfy h SER 339 CO -0.00 0.48 -0.29 0.03 -0.87 0.00 0.00 176.83 176.19 2qfy h ARG 340 N 0.66 0.31 -0.20 4.77 2.47 -0.98 -0.56 114.38 120.86 2qfy h ARG 340 Ca 0.18 -0.11 -0.09 0.00 -1.26 0.00 0.00 59.98 58.70 2qfy h ARG 340 Cb -0.00 -0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 28.30 2qfy h ARG 340 CO -0.03 0.57 -0.21 0.78 0.56 0.00 0.00 179.97 181.64 2qfy h GLY 341 N 1.04 0.54 1.39 0.04 0.00 -0.99 -2.62 103.07 102.46 2qfy h GLY 341 Ca 0.04 -0.56 -0.03 0.00 0.00 0.00 0.00 47.33 46.78 2qfy h GLY 341 CO 0.05 0.50 0.22 1.41 0.00 0.00 0.00 176.54 178.72 2qfy h LEU 342 N 0.16 0.71 -0.68 3.11 3.38 -0.80 -1.08 115.31 120.12 2qfy h LEU 342 Ca 0.03 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2qfy h LEU 342 Cb 0.77 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 2qfy h LEU 342 CO 0.05 0.64 0.42 -0.07 0.09 0.00 0.00 178.44 179.58 2qfy h LEU 343 N 0.78 0.81 -0.53 1.67 3.38 -1.00 0.17 115.31 120.60 2qfy h LEU 343 Ca 0.19 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 2qfy h LEU 343 Cb 0.15 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2qfy h LEU 343 CO -0.02 0.62 -0.02 0.11 0.09 0.00 0.00 178.44 179.23 2qfy h LYS 344 N 0.93 0.94 -0.30 1.13 1.79 -1.02 -0.83 116.57 119.21 2qfy h LYS 344 Ca 0.25 -0.31 0.01 0.00 -2.18 0.00 0.00 60.65 58.42 2qfy h LYS 344 Cb -0.05 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.50 2qfy h LYS 344 CO -0.05 0.96 0.17 -0.09 -1.08 0.00 0.00 179.45 179.36 2qfy h ARG 345 N 0.81 0.33 -0.47 3.15 9.65 -0.72 0.20 114.38 127.33 2qfy h ARG 345 Ca 0.15 -0.02 0.02 0.00 -1.10 0.00 0.00 59.98 59.03 2qfy h ARG 345 Cb 0.55 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 29.03 2qfy h ARG 345 CO 0.03 0.22 0.28 0.78 2.80 0.00 0.00 179.97 184.08 2qfy h GLY 346 N 0.34 0.66 0.91 2.80 0.00 -0.40 -0.64 103.07 106.74 2qfy h GLY 346 Ca 0.12 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 2qfy h GLY 346 CO -0.06 0.19 -0.05 0.83 0.00 0.00 0.00 176.54 177.44 2qfy h GLU 347 N 0.57 -0.14 -1.00 4.80 5.08 -0.81 0.46 114.58 123.53 2qfy h GLU 347 Ca 0.19 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.58 2qfy h GLU 347 Cb 0.01 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.23 2qfy h GLU 347 CO -0.08 -0.01 0.66 -0.07 -1.00 0.00 0.00 179.01 178.50 2qfy h LEU 348 N -0.24 1.12 -0.42 1.33 3.38 -0.79 -2.50 115.31 117.19 2qfy h LEU 348 Ca -0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2qfy h LEU 348 Cb 0.19 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.68 2qfy h LEU 348 CO 0.02 0.78 -0.30 0.47 0.09 0.00 0.00 178.44 179.50 2qfy n ASP 349 N -4.41 0.96 -3.33 -0.43 8.00 -0.26 -4.97 116.55 112.10 2qfy n ASP 349 Ca 0.13 -0.80 -0.16 0.00 0.71 0.00 0.00 54.79 54.67 2qfy n ASP 349 Cb 0.06 0.17 0.08 0.00 -0.02 0.00 0.00 41.12 41.40 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 -0.78 -4.77 -3.88 -2.24 2.85 0.14 -4.97 115.26 101.60 2qfy n ASN 350 Ca 0.11 -0.68 -0.28 0.00 -0.11 0.00 0.00 54.58 53.62 2qfy n ASN 350 Cb 0.35 -5.15 -0.12 0.00 1.24 0.00 0.00 39.78 36.10 2qfy n ASN 350 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 2qfy s THR 351 N -3.38 2.72 0.44 -0.44 2.01 0.34 -4.97 115.64 112.35 2qfy s THR 351 Ca 0.27 -4.07 0.20 0.00 0.31 0.00 0.00 61.69 58.40 2qfy s THR 351 Cb -0.04 -2.80 0.40 0.00 0.01 0.00 0.00 72.50 70.07 2qfy s THR 351 CO 0.74 -0.99 1.86 1.55 -0.69 0.00 0.00 174.62 177.08 2qfy h PRO 352 N 5.55 0.33 -0.17 4.92 0.13 -1.94 0.40 132.00 141.22 2qfy h PRO 352 Ca 0.12 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 65.19 2qfy h PRO 352 Cb 0.78 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.82 2qfy h PRO 352 CO 0.70 0.22 -0.07 0.00 -0.23 0.00 0.00 178.00 178.61 2qfy h ALA 353 N 1.61 1.57 -0.05 -0.56 0.00 -1.97 -0.17 119.26 119.69 2qfy h ALA 353 Ca 0.47 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 2qfy h ALA 353 Cb 1.26 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2qfy h ALA 353 CO -0.16 0.31 -0.13 1.25 0.00 0.00 0.00 179.25 180.52 2qfy h LEU 354 N 0.25 0.20 -0.96 0.00 6.46 -1.32 -2.35 115.31 117.59 2qfy h LEU 354 Ca 0.05 -0.60 0.04 0.00 -0.12 0.00 0.00 57.88 57.26 2qfy h LEU 354 Cb 0.29 -0.06 -0.06 0.00 -0.73 0.00 0.00 40.66 40.10 2qfy h LEU 354 CO 0.01 0.76 0.62 0.00 -0.62 0.00 0.00 178.44 179.22 2qfy h LYS 356 N 1.19 0.88 -0.13 0.00 1.63 -1.02 -1.71 116.57 117.40 2qfy h LYS 356 Ca 0.39 -0.16 -0.00 0.00 -0.85 0.00 0.00 60.65 60.03 2qfy h LYS 356 Cb 0.04 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 31.52 2qfy h LYS 356 CO -0.13 0.75 0.07 0.35 -3.45 0.00 0.00 179.45 177.04 2qfy h PHE 357 N 0.82 0.18 -0.97 1.91 3.57 -0.80 -1.40 116.94 120.24 2qfy h PHE 357 Ca 0.20 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.79 2qfy h PHE 357 Cb 0.19 -0.06 -0.08 0.00 2.79 0.00 0.00 35.95 38.80 2qfy h PHE 357 CO 0.01 0.20 0.61 0.00 -2.23 0.00 0.00 178.31 176.90 2qfy h ALA 358 N 0.97 1.41 -0.32 2.41 0.00 -0.84 0.96 119.26 123.85 2qfy h ALA 358 Ca 0.05 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 2qfy h ALA 358 Cb 0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2qfy h ALA 358 CO -0.01 0.29 -0.30 -0.91 0.00 0.00 0.00 179.25 178.32 2qfy h ASN 359 N 1.03 0.70 0.51 0.00 2.35 -0.95 -2.22 115.58 117.01 2qfy h ASN 359 Ca 0.46 -0.28 -0.19 0.00 -0.55 0.00 0.00 56.30 55.74 2qfy h ASN 359 Cb 0.35 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 2qfy h ASN 359 CO -0.23 0.96 -0.82 0.16 -1.65 0.00 0.00 177.43 175.85 2qfy h ILE 360 N 0.58 1.46 -0.72 2.81 3.07 -0.40 -1.44 117.51 122.87 2qfy h ILE 360 Ca 0.07 -2.47 0.04 0.00 1.55 0.00 0.00 64.86 64.05 2qfy h ILE 360 Cb 0.81 2.36 -0.05 0.00 -0.27 0.00 0.00 36.82 39.66 2qfy h ILE 360 CO 0.07 0.72 0.44 0.25 -1.05 0.00 0.00 178.15 178.58 2qfy h LEU 361 N 0.14 0.70 -0.24 0.16 6.46 -0.69 0.30 115.31 122.13 2qfy h LEU 361 Ca -0.04 0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 57.69 2qfy h LEU 361 Cb 1.43 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 41.21 2qfy h LEU 361 CO 0.13 0.47 -0.02 -0.33 -0.62 0.00 0.00 178.44 178.07 2qfy h GLU 362 N 0.84 0.44 -0.54 1.25 5.08 -1.20 -2.15 114.58 118.29 2qfy h GLU 362 Ca 0.30 -0.15 -0.10 0.00 -1.00 0.00 0.00 59.36 58.42 2qfy h GLU 362 Cb 0.09 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 2qfy h GLU 362 CO -0.14 0.63 -0.05 0.66 -1.00 0.00 0.00 179.01 179.11 2qfy h SER 363 N 0.20 0.95 -0.52 1.42 4.64 -0.81 -0.60 113.55 118.83 2qfy h SER 363 Ca 0.07 -0.28 -0.03 0.00 -0.47 0.00 0.00 61.79 61.08 2qfy h SER 363 Cb 0.45 -0.26 -0.03 0.00 -0.31 0.00 0.00 62.40 62.26 2qfy h SER 363 CO 0.02 1.04 0.23 0.00 -0.87 0.00 0.00 176.83 177.24 2qfy h ALA 364 N 1.05 1.35 -0.06 5.18 0.00 -0.38 0.18 119.26 126.59 2qfy h ALA 364 Ca 0.15 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2qfy h ALA 364 Cb 0.59 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 2qfy h ALA 364 CO 0.04 0.49 -0.06 1.15 0.00 0.00 0.00 179.25 180.87 2qfy h THR 365 N 0.80 1.37 -0.42 0.00 2.02 -0.95 -2.46 112.91 113.27 2qfy h THR 365 Ca 0.19 -1.20 -0.13 0.00 0.77 0.00 0.00 66.41 66.04 2qfy h THR 365 Cb 0.15 2.04 -0.01 0.00 -1.74 0.00 0.00 68.15 68.59 2qfy h THR 365 CO -0.02 0.33 -0.25 -0.07 0.37 0.00 0.00 175.52 175.88 2qfy h LEU 366 N -0.29 0.90 -1.50 2.58 3.38 -0.87 -2.98 115.31 116.54 2qfy h LEU 366 Ca 0.01 -0.35 -0.05 0.00 0.09 0.00 0.00 57.88 57.58 2qfy h LEU 366 Cb 0.56 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2qfy h LEU 366 CO 0.01 1.11 -0.24 0.78 0.09 0.00 0.00 178.44 180.19 2qfy h ASN 367 N 0.75 0.00 -0.89 -0.43 2.35 -0.69 0.31 115.58 116.98 2qfy h ASN 367 Ca 0.09 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.83 2qfy h ASN 367 Cb 0.80 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.13 2qfy h ASN 367 CO 0.07 0.24 0.49 0.74 -1.65 0.00 0.00 177.43 177.32 2qfy h THR 368 N 0.00 1.26 0.00 2.81 2.02 -1.27 0.25 112.91 117.97 2qfy h THR 368 Ca -0.00 -0.62 -0.00 0.00 0.77 0.00 0.00 66.41 66.55 2qfy h THR 368 Cb 0.54 0.04 -0.00 0.00 -1.74 0.00 0.00 68.15 66.99 2qfy h THR 368 CO 0.03 0.28 -0.02 0.58 0.37 0.00 0.00 175.52 176.77 2qfy h VAL 369 N 1.24 0.46 0.23 3.16 2.07 -1.41 -0.12 116.25 121.88 2qfy h VAL 369 Ca 0.31 -1.35 -0.01 0.00 0.82 0.00 0.00 66.70 66.47 2qfy h VAL 369 Cb 0.02 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 2qfy h VAL 369 CO -0.05 0.16 -0.11 -0.61 0.02 0.00 0.00 177.57 176.98 2qfy h GLN 370 N -1.00 -0.29 0.10 1.57 5.75 -0.41 -2.15 115.11 118.69 2qfy h GLN 370 Ca -0.00 0.02 -0.34 0.00 -0.15 0.00 0.00 58.65 58.17 2qfy h GLN 370 Cb 0.27 0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.87 2qfy h GLN 370 CO -0.00 -0.10 -1.87 0.94 -2.65 0.00 0.00 178.83 175.14 2qfy n GLN 371 N -5.17 0.73 0.00 1.69 7.27 0.70 -4.36 117.38 118.24 2qfy n GLN 371 Ca -0.09 0.32 0.12 0.00 0.07 0.00 0.00 57.00 57.42 2qfy n GLN 371 Cb 0.18 -1.72 0.31 0.00 2.41 0.00 0.00 30.24 31.43 2qfy n GLN 371 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 2qfy n ASP 372 N -3.65 0.66 -0.48 1.69 8.00 -0.18 -4.95 116.55 117.64 2qfy n ASP 372 Ca -0.32 -0.45 -0.06 0.00 0.71 0.00 0.00 54.79 54.66 2qfy n ASP 372 Cb 0.98 0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 42.24 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 1.44 0.73 3.61 0.44 0.00 -0.81 -4.95 105.19 105.66 2qfy n GLY 373 Ca 0.08 -0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.84 5.06 0.24 -0.61 1.01 -0.10 -4.95 121.20 120.01 2qfy s ILE 374 Ca 0.00 0.83 -0.15 0.00 0.00 0.00 0.00 60.65 61.34 2qfy s ILE 374 Cb 0.00 -3.84 0.00 0.00 0.01 0.00 0.00 42.46 38.64 2qfy s ILE 374 CO 0.00 0.06 0.52 0.00 0.00 0.00 0.00 174.94 175.52 2qfy s MET 375 N 2.32 1.56 0.55 2.79 0.23 -1.26 -3.42 119.30 122.07 2qfy s MET 375 Ca 0.21 -1.16 -0.04 0.00 -1.03 0.00 0.00 55.69 53.67 2qfy s MET 375 Cb -0.16 0.50 0.01 0.00 -1.53 0.00 0.00 34.83 33.65 2qfy s MET 375 CO 0.10 -0.66 0.84 0.95 -2.03 0.00 0.00 175.02 174.21 2qfy s THR 376 N -3.98 3.75 0.23 3.16 -4.23 -1.26 -1.22 115.64 112.08 2qfy s THR 376 Ca 0.19 -0.12 -0.14 0.00 -1.18 0.00 0.00 61.69 60.44 2qfy s THR 376 Cb -0.02 -3.46 0.28 0.00 1.34 0.00 0.00 72.50 70.64 2qfy s THR 376 CO 0.07 -0.44 1.59 0.50 -0.54 0.00 0.00 174.62 175.80 2qfy h LYS 377 N -0.03 -0.04 -0.84 3.99 3.64 -1.77 -1.86 116.57 119.66 2qfy h LYS 377 Ca -0.46 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.04 2qfy h LYS 377 Cb 1.25 0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 33.00 2qfy h LYS 377 CO 0.60 -0.02 0.47 0.38 -2.27 0.00 0.00 179.45 178.60 2qfy h ASP 378 N -0.04 0.64 -0.12 4.20 2.03 -1.95 -0.47 116.42 120.72 2qfy h ASP 378 Ca 0.35 0.06 -0.13 0.00 -0.73 0.00 0.00 57.03 56.58 2qfy h ASP 378 Cb 0.59 -0.06 0.00 0.00 -0.83 0.00 0.00 39.33 39.03 2qfy h ASP 378 CO -0.82 0.34 -0.43 -0.07 -1.03 0.00 0.00 179.24 177.22 2qfy h LEU 379 N 0.75 0.59 -0.39 0.15 3.38 -1.74 -1.76 115.31 116.28 2qfy h LEU 379 Ca 0.43 -0.62 0.08 0.00 0.09 0.00 0.00 57.88 57.85 2qfy h LEU 379 Cb 0.47 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 40.98 2qfy h LEU 379 CO -0.29 1.10 -0.04 0.00 0.09 0.00 0.00 178.44 179.30 2qfy h ALA 380 N 0.50 0.32 -0.51 1.53 0.00 -0.99 -0.33 119.26 119.78 2qfy h ALA 380 Ca -0.02 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2qfy h ALA 380 Cb 1.06 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 19.07 2qfy h ALA 380 CO 0.09 -0.42 0.34 -0.07 0.00 0.00 0.00 179.25 179.18 2qfy h LEU 381 N 0.06 0.58 -2.17 0.00 4.07 -1.09 -0.54 115.31 116.21 2qfy h LEU 381 Ca 0.19 -0.01 0.02 0.00 0.08 0.00 0.00 57.88 58.15 2qfy h LEU 381 Cb 0.28 -0.15 -0.00 0.00 1.08 0.00 0.00 40.66 41.88 2qfy h LEU 381 CO -0.36 0.42 0.05 0.00 -1.08 0.00 0.00 178.44 177.48 2qfy h ALA 382 N 1.19 1.87 -0.01 1.53 0.00 -0.43 0.13 119.26 123.55 2qfy h ALA 382 Ca 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2qfy h ALA 382 Cb -0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2qfy h ALA 382 CO -0.04 -0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.12 2qfy n GLY 384 N 1.12 0.68 3.38 0.00 0.00 0.46 -4.97 105.19 105.86 2qfy n GLY 384 Ca 0.21 -0.57 -0.45 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.66 6.27 0.00 1.61 0.01 -0.35 -4.88 114.94 114.95 2qfy s ASN 385 Ca 0.00 -1.60 0.25 0.00 -0.71 0.00 0.00 52.86 50.80 2qfy s ASN 385 Cb 0.00 -2.30 0.68 0.00 0.41 0.00 0.00 41.25 40.04 2qfy s ASN 385 CO 0.00 -1.07 1.53 0.59 -1.51 0.00 0.00 177.10 176.64 2qfy n ASN 386 N 6.16 2.17 -4.77 -1.22 3.02 -1.26 -3.96 115.26 115.40 2qfy n ASN 386 Ca -0.05 -1.74 -0.39 0.00 -0.03 0.00 0.00 54.58 52.38 2qfy n ASN 386 Cb 0.43 -0.05 -0.03 0.00 -0.61 0.00 0.00 39.78 39.52 2qfy n ASN 386 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2qfy s GLU 387 N -1.89 4.21 0.30 3.52 2.56 -1.26 -4.92 118.70 121.21 2qfy s GLU 387 Ca 0.34 1.83 -0.02 0.00 0.00 0.00 0.00 54.97 57.13 2qfy s GLU 387 Cb 0.20 -2.80 0.44 0.00 2.00 0.00 0.00 34.13 33.97 2qfy s GLU 387 CO 0.31 -0.18 1.95 -0.09 -0.56 0.00 0.00 175.26 176.69 2qfy h ARG 388 N 2.92 1.06 0.00 4.30 1.12 -1.96 -0.60 114.38 121.21 2qfy h ARG 388 Ca -0.48 -0.08 0.00 0.00 -1.11 0.00 0.00 59.98 58.31 2qfy h ARG 388 Cb 1.23 -0.23 0.00 0.00 -0.01 0.00 0.00 29.97 30.96 2qfy h ARG 388 CO 0.64 0.72 0.00 -1.13 -3.11 0.00 0.00 179.97 177.09 2qfy n SER 389 N -4.39 0.00 0.19 -3.80 3.41 -1.26 -3.47 113.62 104.29 2qfy n SER 389 Ca 0.09 -0.60 0.14 0.00 -0.26 0.00 0.00 58.87 58.24 2qfy n SER 389 Cb 0.05 -0.05 0.50 0.00 -0.26 0.00 0.00 64.21 64.46 2qfy n SER 389 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qfy h ALA 390 N 3.35 1.00 -2.29 7.33 0.00 -1.43 -3.45 119.26 123.76 2qfy h ALA 390 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.64 2qfy h ALA 390 Cb 0.03 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 17.68 2qfy h ALA 390 CO 0.00 0.00 -0.66 1.52 0.00 0.00 0.00 179.25 180.11 2qfy s TYR 391 N -3.39 1.15 0.40 0.00 -0.85 -1.23 -4.67 117.35 108.77 2qfy s TYR 391 Ca 0.05 -1.03 0.07 0.00 -0.52 0.00 0.00 57.07 55.64 2qfy s TYR 391 Cb 0.09 -0.66 -0.06 0.00 0.38 0.00 0.00 41.96 41.72 2qfy s TYR 391 CO 0.52 -0.24 0.13 0.14 -1.52 0.00 0.00 175.55 174.58 2qfy s VAL 392 N -3.69 2.29 0.90 -3.49 -7.23 -0.35 -4.96 120.40 103.86 2qfy s VAL 392 Ca 0.23 -1.78 -0.12 0.00 -1.81 0.00 0.00 61.98 58.50 2qfy s VAL 392 Cb 0.06 -2.98 0.13 0.00 0.56 0.00 0.00 36.38 34.15 2qfy s VAL 392 CO 0.03 -0.02 1.12 0.42 -0.31 0.00 0.00 175.10 176.34 2qfy s THR 393 N -2.61 2.31 0.18 5.32 -4.23 -1.26 -4.41 115.64 110.94 2qfy s THR 393 Ca 0.39 0.10 -0.14 0.00 -1.18 0.00 0.00 61.69 60.86 2qfy s THR 393 Cb 0.05 -2.79 0.13 0.00 1.34 0.00 0.00 72.50 71.22 2qfy s THR 393 CO 0.21 -0.13 1.67 0.74 -0.54 0.00 0.00 174.62 176.58 2qfy h THR 394 N -1.46 0.58 -0.46 3.99 2.02 -1.24 -0.94 112.91 115.40 2qfy h THR 394 Ca -0.50 -0.03 -0.13 0.00 0.77 0.00 0.00 66.41 66.52 2qfy h THR 394 Cb 1.31 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 2qfy h THR 394 CO 0.60 0.01 -0.24 -0.33 0.37 0.00 0.00 175.52 175.94 2qfy h GLU 395 N 0.08 0.95 -0.77 6.66 3.07 -1.92 -2.93 114.58 119.71 2qfy h GLU 395 Ca 0.24 -0.41 -0.02 0.00 -0.50 0.00 0.00 59.36 58.67 2qfy h GLU 395 Cb 0.37 -0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 28.22 2qfy h GLU 395 CO -0.44 1.08 0.41 0.93 -1.40 0.00 0.00 179.01 179.59 2qfy h GLU 396 N 0.82 1.09 -0.09 2.33 5.08 -1.75 0.10 114.58 122.14 2qfy h GLU 396 Ca 0.10 -0.14 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2qfy h GLU 396 Cb 0.81 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 2qfy h GLU 396 CO 0.07 0.82 0.06 0.35 -1.00 0.00 0.00 179.01 179.30 2qfy h PHE 397 N 1.07 0.12 -0.35 4.33 3.57 -1.13 -0.61 116.94 123.95 2qfy h PHE 397 Ca 0.27 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.73 2qfy h PHE 397 Cb 0.06 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.74 2qfy h PHE 397 CO 0.00 0.12 0.06 -0.07 -2.23 0.00 0.00 178.31 176.20 2qfy h LEU 398 N 0.09 0.48 -0.58 0.59 3.38 -1.31 -0.82 115.31 117.13 2qfy h LEU 398 Ca 0.03 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.82 2qfy h LEU 398 Cb 0.03 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2qfy h LEU 398 CO -0.01 0.50 -0.16 0.44 0.09 0.00 0.00 178.44 179.30 2qfy h ASP 399 N 0.51 0.97 -0.04 -0.43 3.32 -0.59 -1.40 116.42 118.76 2qfy h ASP 399 Ca 0.12 -0.34 -0.00 0.00 0.02 0.00 0.00 57.03 56.83 2qfy h ASP 399 Cb 0.23 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 2qfy h ASP 399 CO -0.00 1.11 0.02 0.00 -1.72 0.00 0.00 179.24 178.66 2qfy h ALA 400 N 0.96 0.05 -0.70 3.45 0.00 -0.26 -1.17 119.26 121.60 2qfy h ALA 400 Ca 0.12 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.06 2qfy h ALA 400 Cb 0.72 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 2qfy h ALA 400 CO 0.06 -0.42 0.40 0.28 0.00 0.00 0.00 179.25 179.56 2qfy h VAL 401 N 0.00 0.98 -0.14 0.00 2.07 -1.04 -0.14 116.25 117.97 2qfy h VAL 401 Ca 0.02 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.31 2qfy h VAL 401 Cb 0.05 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 29.98 2qfy h VAL 401 CO -0.00 0.13 -0.04 -0.08 0.02 0.00 0.00 177.57 177.60 2qfy h GLU 402 N 0.73 -0.00 -0.92 1.57 4.81 -0.88 0.33 114.58 120.22 2qfy h GLU 402 Ca 0.31 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.55 2qfy h GLU 402 Cb 0.18 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.51 2qfy h GLU 402 CO -0.18 -0.00 0.61 -0.22 -0.73 0.00 0.00 179.01 178.49 2qfy h LYS 403 N -0.00 1.19 -0.51 1.92 3.64 -0.62 -1.22 116.57 120.97 2qfy h LYS 403 Ca 0.07 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 2qfy h LYS 403 Cb 0.11 -0.27 -0.02 0.00 -0.41 0.00 0.00 32.23 31.64 2qfy h LYS 403 CO -0.15 0.79 0.06 0.00 -2.27 0.00 0.00 179.45 177.88 2qfy h ARG 404 N 1.23 0.86 -0.76 1.90 2.47 -0.41 -1.69 114.38 117.98 2qfy h ARG 404 Ca 0.34 -0.24 0.01 0.00 -1.26 0.00 0.00 59.98 58.83 2qfy h ARG 404 Cb -0.12 -0.09 -0.04 0.00 -1.65 0.00 0.00 29.97 28.07 2qfy h ARG 404 CO -0.08 0.86 0.50 1.25 0.56 0.00 0.00 179.97 183.06 2qfy h LEU 405 N 0.74 0.87 0.10 3.04 6.46 0.18 0.19 115.31 126.90 2qfy h LEU 405 Ca 0.15 -0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.89 2qfy h LEU 405 Cb 0.43 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 40.15 2qfy h LEU 405 CO 0.01 0.63 -0.05 1.56 -0.62 0.00 0.00 178.44 179.98 2qfy h GLN 406 N 1.03 -0.13 -0.32 1.25 4.20 -1.04 -0.75 115.11 119.35 2qfy h GLN 406 Ca 0.28 0.01 0.03 0.00 0.06 0.00 0.00 58.65 59.02 2qfy h GLN 406 Cb -0.12 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.66 2qfy h GLN 406 CO -0.06 0.04 0.14 -0.22 -0.67 0.00 0.00 178.83 178.06 2qfy h LYS 407 N -0.28 0.30 0.00 1.46 3.64 -0.97 -2.14 116.57 118.58 2qfy h LYS 407 Ca -0.01 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.27 2qfy h LYS 407 Cb 0.23 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 2qfy h LYS 407 CO 0.02 0.20 -0.37 0.93 -2.27 0.00 0.00 179.45 177.96 2qfy h GLU 408 N 0.31 0.00 -0.04 1.90 5.08 -0.58 -2.78 114.58 118.47 2qfy h GLU 408 Ca 0.14 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.34 2qfy h GLU 408 Cb 0.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2qfy h GLU 408 CO -0.11 0.37 -0.68 0.97 -1.00 0.00 0.00 179.01 178.55 2qfy h ILE 409 N 0.00 1.43 -0.21 3.13 2.10 -0.71 -3.13 117.51 120.12 2qfy h ILE 409 Ca -0.00 -2.19 -0.16 0.00 1.08 0.00 0.00 64.86 63.58 2qfy h ILE 409 Cb 0.81 2.15 -0.01 0.00 -1.09 0.00 0.00 36.82 38.69 2qfy h ILE 409 CO 0.05 0.64 -0.53 0.11 -1.08 0.00 0.00 178.15 177.33 2qfy h LYS 410 N 0.13 0.61 -0.37 2.19 1.57 -1.20 -2.98 116.57 116.53 2qfy h LYS 410 Ca -0.02 -0.38 0.11 0.00 -1.87 0.00 0.00 60.65 58.49 2qfy h LYS 410 Cb 1.22 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.56 2qfy h LYS 410 CO 0.10 0.99 0.34 0.77 -0.57 0.00 0.00 179.45 181.09 2qfy h SER 411 N 0.48 0.00 -0.03 0.86 0.02 -1.44 -3.52 113.55 109.92 2qfy h SER 411 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2qfy h SER 411 Cb 1.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.63 2qfy h SER 411 CO 0.10 0.00 0.00 -0.38 -1.14 0.00 0.00 176.83 175.41