#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2awi n LYS 3 N 0.00 2.07 -0.35 -4.13 2.85 -1.26 -4.64 118.16 112.70 2awi n LYS 3 Ca 0.00 -1.90 0.27 0.00 -1.05 0.00 0.00 58.31 55.62 2awi n LYS 3 Cb 0.00 -1.85 0.55 0.00 -0.65 0.00 0.00 35.03 33.08 2awi n LYS 3 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 177.40 178.17 2awi h ILE 4 N 1.41 0.41 0.20 0.58 5.03 -1.95 -2.86 117.51 120.35 2awi h ILE 4 Ca 0.34 -0.10 -0.00 0.00 -0.12 0.00 0.00 64.86 64.97 2awi h ILE 4 Cb 0.85 0.09 -0.02 0.00 -3.03 0.00 0.00 36.82 34.70 2awi h ILE 4 CO 0.82 0.06 -0.30 1.23 -0.68 0.00 0.00 178.15 179.27 2awi h GLY 5 N 0.30 -1.10 1.06 5.37 0.00 -1.82 -2.44 103.07 104.44 2awi h GLY 5 Ca 0.65 0.52 0.11 0.00 0.00 0.00 0.00 47.33 48.62 2awi h GLY 5 CO -0.33 -0.34 0.36 1.48 0.00 0.00 0.00 176.54 177.72 2awi h SER 6 N -0.53 0.00 -0.23 0.19 4.64 -1.68 0.29 113.55 116.23 2awi h SER 6 Ca -0.02 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.23 2awi h SER 6 Cb 0.48 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 2awi h SER 6 CO -0.09 0.00 -0.12 0.58 -0.87 0.00 0.00 176.83 176.33 2awi h VAL 7 N 0.00 1.30 -0.36 0.95 2.07 -1.50 -0.80 116.25 117.91 2awi h VAL 7 Ca 0.18 -1.19 0.03 0.00 0.82 0.00 0.00 66.70 66.54 2awi h VAL 7 Cb 0.91 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 32.25 2awi h VAL 7 CO -0.00 0.37 0.15 -0.07 0.02 0.00 0.00 177.57 178.04 2awi h LEU 8 N 0.19 0.20 -0.76 2.57 3.38 -0.49 0.32 115.31 120.72 2awi h LEU 8 Ca 0.05 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2awi h LEU 8 Cb 0.62 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 2awi h LEU 8 CO 0.03 0.15 0.43 0.50 0.09 0.00 0.00 178.44 179.65 2awi h LYS 9 N 0.32 1.06 0.22 1.13 3.64 -1.37 0.44 116.57 122.01 2awi h LYS 9 Ca 0.16 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2awi h LYS 9 Cb 0.10 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 2awi h LYS 9 CO -0.13 0.77 -0.21 0.37 -2.27 0.00 0.00 179.45 177.99 2awi h GLN 10 N 1.05 -0.44 -0.19 1.90 4.15 -0.37 0.65 115.11 121.87 2awi h GLN 10 Ca 0.27 0.03 -0.04 0.00 0.77 0.00 0.00 58.65 59.68 2awi h GLN 10 Cb 0.02 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 2awi h GLN 10 CO -0.05 -0.29 -0.05 0.82 -1.93 0.00 0.00 178.83 177.33 2awi h ILE 11 N -0.45 1.29 -0.54 2.39 2.04 -0.78 -1.57 117.51 119.88 2awi h ILE 11 Ca -0.00 -1.03 0.08 0.00 1.00 0.00 0.00 64.86 64.90 2awi h ILE 11 Cb 0.42 1.59 -0.06 0.00 -0.74 0.00 0.00 36.82 38.02 2awi h ILE 11 CO -0.04 0.31 0.19 -0.09 0.00 0.00 0.00 178.15 178.52 2awi h ARG 12 N 0.08 0.35 0.00 2.37 2.43 0.01 -0.89 114.38 118.72 2awi h ARG 12 Ca 0.05 -0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.09 2awi h ARG 12 Cb 0.50 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 2awi h ARG 12 CO 0.02 0.23 -0.49 1.96 -1.51 0.00 0.00 179.97 180.19 2awi h GLN 13 N 0.36 0.00 -0.38 0.20 4.20 -0.86 0.35 115.11 118.99 2awi h GLN 13 Ca 0.27 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.87 2awi h GLN 13 Cb 0.31 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 2awi h GLN 13 CO -0.28 0.49 -0.20 1.49 -0.67 0.00 0.00 178.83 179.66 2awi h GLU 14 N 0.00 0.81 -0.35 1.46 4.57 -0.41 -2.80 114.58 117.87 2awi h GLU 14 Ca -0.00 -0.36 0.00 0.00 -1.18 0.00 0.00 59.36 57.81 2awi h GLU 14 Cb 1.12 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.69 2awi h GLU 14 CO 0.06 0.99 0.00 1.28 -1.18 0.00 0.00 179.01 180.16 2awi n LEU 15 N -4.25 1.75 -2.82 1.64 4.77 -0.42 -4.93 117.00 112.75 2awi n LEU 15 Ca -0.02 -0.88 -0.22 0.00 -0.03 0.00 0.00 56.01 54.87 2awi n LEU 15 Cb 0.43 -0.23 0.02 0.00 -2.33 0.00 0.00 43.42 41.30 2awi n LEU 15 CO 0.45 0.42 -0.09 0.59 -1.33 0.00 0.00 177.39 177.42 2awi n ASN 16 N 0.41 -5.93 -4.90 -1.43 4.13 -1.06 -5.01 115.26 101.47 2awi n ASN 16 Ca 0.11 -0.19 -0.30 0.00 1.68 0.00 0.00 54.58 55.88 2awi n ASN 16 Cb 0.29 -4.85 -0.04 0.00 -1.54 0.00 0.00 39.78 33.64 2awi n ASN 16 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 2awi s TYR 17 N -3.11 3.47 0.04 3.10 2.02 0.09 -5.01 117.35 117.94 2awi s TYR 17 Ca 0.20 0.59 -0.01 0.00 -0.37 0.00 0.00 57.07 57.48 2awi s TYR 17 Cb -0.09 -2.05 -0.04 0.00 -0.40 0.00 0.00 41.96 39.38 2awi s TYR 17 CO 0.25 0.31 0.21 -1.01 -1.57 0.00 0.00 175.55 173.74 2awi s HIS 18 N -1.87 3.53 0.34 2.71 3.76 -1.26 -4.44 115.29 118.06 2awi s HIS 18 Ca 0.42 0.30 0.13 0.00 -0.15 0.00 0.00 55.06 55.77 2awi s HIS 18 Cb -0.11 -1.79 1.10 0.00 1.11 0.00 0.00 32.58 32.88 2awi s HIS 18 CO 0.27 0.60 1.61 1.96 -0.85 0.00 0.00 174.74 178.32 2awi h GLN 19 N 3.29 0.10 -0.65 1.40 4.20 -1.98 0.26 115.11 121.73 2awi h GLN 19 Ca -0.46 -0.01 0.14 0.00 0.06 0.00 0.00 58.65 58.38 2awi h GLN 19 Cb 1.17 -0.02 -0.10 0.00 0.30 0.00 0.00 27.48 28.82 2awi h GLN 19 CO 0.74 0.07 0.08 0.82 -0.67 0.00 0.00 178.83 179.86 2awi h ILE 20 N 0.10 0.52 0.00 2.54 5.03 -1.99 0.21 117.51 123.92 2awi h ILE 20 Ca 0.74 -0.06 0.00 0.00 -0.12 0.00 0.00 64.86 65.42 2awi h ILE 20 Cb 1.78 0.32 0.00 0.00 -3.03 0.00 0.00 36.82 35.89 2awi h ILE 20 CO -0.75 0.03 0.00 0.44 -0.68 0.00 0.00 178.15 177.20 2awi h ASP 21 N 0.19 0.00 0.00 1.72 3.32 -0.87 -1.28 116.42 119.50 2awi h ASP 21 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 2awi h ASP 21 Cb 0.57 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.12 2awi h ASP 21 CO -0.50 0.00 -0.48 -0.07 -1.72 0.00 0.00 179.24 176.47 2awi h LEU 22 N 0.00 0.00 -0.47 1.55 -0.00 -0.65 -3.42 115.31 112.33 2awi h LEU 22 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 57.88 57.71 2awi h LEU 22 Cb 0.01 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.65 2awi h LEU 22 CO 0.00 0.73 -0.76 0.10 -0.00 0.00 0.00 178.44 178.51 2awi h TYR 23 N -0.98 0.18 0.00 1.13 -0.00 -1.45 -3.44 116.97 112.42 2awi h TYR 23 Ca 0.00 -0.09 -0.32 0.00 -0.00 0.00 0.00 58.73 58.32 2awi h TYR 23 Cb 0.48 -0.03 -0.10 0.00 -0.00 0.00 0.00 36.73 37.08 2awi h TYR 23 CO -0.20 0.84 1.76 -1.13 -0.00 0.00 0.00 178.16 179.42 2awi n SER 24 N -3.71 -1.21 0.00 0.10 3.41 -0.49 0.33 113.62 112.05 2awi n SER 24 Ca -0.02 -0.45 0.00 0.00 -0.26 0.00 0.00 58.87 58.14 2awi n SER 24 Cb 0.73 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 2awi n SER 24 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2awi n GLY 25 N 4.83 0.81 0.00 5.00 0.00 -1.26 -5.03 105.19 109.54 2awi n GLY 25 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.61 2awi n GLY 25 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2awi n ILE 26 N -1.33 0.00 -2.46 -0.61 5.41 0.98 -5.24 119.36 116.11 2awi n ILE 26 Ca 0.00 0.00 -0.27 0.00 1.00 0.00 0.00 62.75 63.48 2awi n ILE 26 Cb 0.00 -0.82 0.02 0.00 -0.71 0.00 0.00 39.64 38.12 2awi n ILE 26 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 2awi s SER 28 N -2.77 5.87 0.05 4.38 1.04 -1.26 -5.09 113.70 115.93 2awi s SER 28 Ca 0.00 0.82 -0.24 0.00 0.48 0.00 0.00 55.95 57.01 2awi s SER 28 Cb 0.00 -1.94 -0.17 0.00 0.10 0.00 0.00 66.02 64.01 2awi s SER 28 CO 0.00 -0.87 1.58 0.50 0.98 0.00 0.00 173.24 175.42 2awi h LYS 29 N -0.03 -0.04 -0.81 4.02 3.64 -1.99 -2.15 116.57 119.20 2awi h LYS 29 Ca -0.46 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.01 2awi h LYS 29 Cb 1.23 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.99 2awi h LYS 29 CO 0.61 0.13 0.47 0.66 -2.27 0.00 0.00 179.45 179.05 2awi h SER 30 N -0.20 0.68 -0.66 4.20 4.64 -2.04 -1.85 113.55 118.32 2awi h SER 30 Ca -0.00 0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.32 2awi h SER 30 Cb 0.18 -0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 62.15 2awi h SER 30 CO 0.01 0.40 0.26 0.58 -0.87 0.00 0.00 176.83 177.20 2awi h VAL 31 N 0.80 1.24 -0.21 0.95 2.07 -1.98 -2.73 116.25 116.40 2awi h VAL 31 Ca 0.38 -0.76 -0.08 0.00 0.82 0.00 0.00 66.70 67.06 2awi h VAL 31 Cb 0.32 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 2awi h VAL 31 CO -0.23 0.30 -0.22 0.22 0.02 0.00 0.00 177.57 177.66 2awi h TYR 32 N 0.93 0.42 -0.88 1.57 5.03 -0.77 -2.06 116.97 121.21 2awi h TYR 32 Ca 0.22 -0.08 0.05 0.00 2.58 0.00 0.00 58.73 61.50 2awi h TYR 32 Cb 0.22 -0.11 -0.05 0.00 1.55 0.00 0.00 36.73 38.34 2awi h TYR 32 CO 0.01 0.58 0.58 0.82 -1.32 0.00 0.00 178.16 178.83 2awi h ILE 33 N 0.35 1.10 -0.09 1.81 1.08 -1.05 -0.81 117.51 119.90 2awi h ILE 33 Ca 0.06 -0.36 -0.08 0.00 -0.39 0.00 0.00 64.86 64.09 2awi h ILE 33 Cb 0.58 -0.04 -0.01 0.00 -3.07 0.00 0.00 36.82 34.28 2awi h ILE 33 CO 0.04 0.19 -0.32 0.11 -0.69 0.00 0.00 178.15 177.48 2awi h LYS 34 N 1.04 0.17 0.11 2.37 1.57 -1.24 -2.82 116.57 117.79 2awi h LYS 34 Ca 0.37 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 59.08 2awi h LYS 34 Cb 0.12 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.43 2awi h LYS 34 CO -0.13 0.48 -0.05 0.28 -0.57 0.00 0.00 179.45 179.46 2awi h VAL 35 N 0.15 1.08 0.00 0.50 2.07 -0.94 -2.58 116.25 116.54 2awi h VAL 35 Ca 0.02 -0.87 0.00 0.00 0.82 0.00 0.00 66.70 66.67 2awi h VAL 35 Cb 0.65 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 32.04 2awi h VAL 35 CO 0.05 0.20 0.00 -0.62 0.02 0.00 0.00 177.57 177.22 2awi n GLU 36 N -4.97 0.50 0.00 1.57 1.02 -0.90 -1.33 120.64 116.53 2awi n GLU 36 Ca -0.09 0.00 0.07 0.00 -0.02 0.00 0.00 57.16 57.12 2awi n GLU 36 Cb 0.24 -1.26 0.04 0.00 -0.02 0.00 0.00 31.44 30.44 2awi n GLU 36 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2awi n ALA 37 N -0.76 2.60 -0.76 0.62 0.00 -1.01 -4.25 120.51 116.95 2awi n ALA 37 Ca 0.06 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.92 2awi n ALA 37 Cb 0.03 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 19.02 2awi n ALA 37 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2awi n ASP 38 N 0.54 -0.66 -3.68 0.00 10.43 -0.44 -4.88 116.55 117.85 2awi n ASP 38 Ca 0.07 0.00 -0.38 0.00 2.57 0.00 0.00 54.79 57.06 2awi n ASP 38 Cb 0.32 -1.50 -0.01 0.00 1.84 0.00 0.00 41.12 41.77 2awi n ASP 38 CO 0.00 0.00 0.00 -1.54 -1.07 0.00 0.00 177.20 174.59 2awi n SER 39 N -0.08 5.98 0.00 -2.24 3.41 -1.00 -4.78 113.62 114.91 2awi n SER 39 Ca 0.00 -3.53 0.00 0.00 -0.26 0.00 0.00 58.87 55.08 2awi n SER 39 Cb 0.04 -1.06 0.00 0.00 -0.26 0.00 0.00 64.21 62.93 2awi n SER 39 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2awi n ARG 40 N 0.69 0.00 -1.66 4.33 3.00 -1.25 -4.68 116.66 117.09 2awi n ARG 40 Ca 0.33 0.00 -0.44 0.00 -0.00 0.00 0.00 57.85 57.74 2awi n ARG 40 Cb 0.33 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.77 2awi n ARG 40 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 2awi n PRO 41 N 0.00 1.91 -3.95 -0.14 -0.02 -1.26 -4.56 135.00 126.98 2awi n PRO 41 Ca 0.00 0.67 -0.31 0.00 -2.02 0.00 0.00 63.50 61.85 2awi n PRO 41 Cb 0.00 -2.25 -0.05 0.00 -0.02 0.00 0.00 33.50 31.18 2awi n PRO 41 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 2awi s ILE 42 N -0.59 5.20 0.26 4.25 2.07 -1.26 -5.07 121.20 126.06 2awi s ILE 42 Ca 0.62 -0.48 -0.03 0.00 -1.41 0.00 0.00 60.65 59.35 2awi s ILE 42 Cb -0.64 -3.53 -0.05 0.00 0.13 0.00 0.00 42.46 38.37 2awi s ILE 42 CO 0.56 0.13 0.49 -0.94 -1.91 0.00 0.00 174.94 173.27 2awi s SER 43 N -2.50 6.42 0.17 4.50 1.04 -1.26 -4.96 113.70 117.10 2awi s SER 43 Ca 0.34 0.58 -0.19 0.00 0.48 0.00 0.00 55.95 57.16 2awi s SER 43 Cb -0.13 -2.09 0.08 0.00 0.10 0.00 0.00 66.02 63.99 2awi s SER 43 CO 0.27 -0.14 1.64 0.58 0.98 0.00 0.00 173.24 176.56 2awi h VAL 44 N 1.41 0.43 -0.79 5.02 2.07 -1.99 -0.78 116.25 121.60 2awi h VAL 44 Ca -0.48 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.06 2awi h VAL 44 Cb 1.19 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 2awi h VAL 44 CO 0.67 0.00 0.52 -0.08 0.02 0.00 0.00 177.57 178.70 2awi h GLU 45 N -0.14 0.99 -0.21 1.57 4.81 -1.99 -0.93 114.58 118.68 2awi h GLU 45 Ca 0.18 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 2awi h GLU 45 Cb 0.42 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 2awi h GLU 45 CO -0.46 0.66 0.08 0.93 -0.73 0.00 0.00 179.01 179.48 2awi h GLU 46 N 1.02 0.32 -0.95 1.92 5.08 -1.58 -1.80 114.58 118.60 2awi h GLU 46 Ca 0.31 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.63 2awi h GLU 46 Cb -0.03 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.12 2awi h GLU 46 CO -0.08 0.40 0.62 1.25 -1.00 0.00 0.00 179.01 180.20 2awi h LEU 47 N 0.18 1.05 -0.67 1.33 5.85 -0.83 0.35 115.31 122.57 2awi h LEU 47 Ca 0.07 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.82 2awi h LEU 47 Cb 0.20 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 40.93 2awi h LEU 47 CO -0.00 0.74 0.38 -1.28 -0.34 0.00 0.00 178.44 177.94 2awi h SER 48 N 1.23 0.59 -0.25 1.25 0.87 -0.84 0.57 113.55 116.97 2awi h SER 48 Ca 0.36 0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.91 2awi h SER 48 Cb -0.06 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 61.79 2awi h SER 48 CO -0.10 0.39 0.00 0.11 -0.53 0.00 0.00 176.83 176.70 2awi h LYS 49 N 0.72 0.44 -0.10 2.24 6.56 -0.37 -2.63 116.57 123.43 2awi h LYS 49 Ca 0.29 -0.14 -0.03 0.00 -1.06 0.00 0.00 60.65 59.72 2awi h LYS 49 Cb 0.15 -0.04 -0.01 0.00 -0.57 0.00 0.00 32.23 31.76 2awi h LYS 49 CO -0.16 0.61 -0.06 0.74 -2.06 0.00 0.00 179.45 178.51 2awi h PHE 50 N 0.22 0.15 0.56 -1.35 0.04 -0.28 -2.24 116.94 114.04 2awi h PHE 50 Ca 0.07 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.81 2awi h PHE 50 Cb 0.41 -0.05 0.00 0.00 2.20 0.00 0.00 35.95 38.52 2awi h PHE 50 CO 0.03 0.22 -0.28 1.03 -0.60 0.00 0.00 178.31 178.72 2awi h SER 51 N 0.15 -0.66 -0.99 2.17 0.87 0.45 -0.62 113.55 114.93 2awi h SER 51 Ca 0.03 0.02 0.03 0.00 -1.23 0.00 0.00 61.79 60.65 2awi h SER 51 Cb 0.21 0.17 -0.06 0.00 -0.44 0.00 0.00 62.40 62.29 2awi h SER 51 CO 0.01 -0.46 0.65 -0.08 -0.53 0.00 0.00 176.83 176.42 2awi h GLU 52 N -0.76 1.24 -0.20 2.24 4.81 -1.20 0.11 114.58 120.82 2awi h GLU 52 Ca -0.08 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.07 2awi h GLU 52 Cb 0.59 -0.28 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 2awi h GLU 52 CO 0.12 0.82 0.09 0.00 -0.73 0.00 0.00 179.01 179.31 2awi h ARG 53 N 1.27 0.28 -0.13 1.92 2.47 -1.23 -2.77 114.38 116.20 2awi h ARG 53 Ca 0.38 -0.04 -0.10 0.00 -1.26 0.00 0.00 59.98 58.96 2awi h ARG 53 Cb -0.04 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.21 2awi h ARG 53 CO -0.11 0.31 -0.35 -0.07 0.56 0.00 0.00 179.97 180.31 2awi h LEU 54 N 0.19 0.28 0.00 3.04 3.38 -0.73 -3.47 115.31 117.99 2awi h LEU 54 Ca 0.07 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2awi h LEU 54 Cb 0.12 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2awi h LEU 54 CO -0.01 0.61 0.00 0.61 0.09 0.00 0.00 178.44 179.74 2awi n GLY 55 N -0.32 0.74 3.32 0.83 0.00 0.34 -5.05 105.19 105.06 2awi n GLY 55 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 2awi n GLY 55 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2awi s VAL 56 N -2.01 3.43 0.05 1.61 1.01 -1.12 -5.02 120.40 118.36 2awi s VAL 56 Ca 0.00 -0.47 -0.27 0.00 0.00 0.00 0.00 61.98 61.24 2awi s VAL 56 Cb 0.00 -2.56 -0.14 0.00 0.00 0.00 0.00 36.38 33.68 2awi s VAL 56 CO 0.00 0.42 0.67 0.59 0.00 0.00 0.00 175.10 176.78 2awi n ASN 57 N 4.74 -0.32 -0.05 3.32 3.02 -1.26 -4.68 115.26 120.02 2awi n ASN 57 Ca -0.18 0.87 -0.09 0.00 -0.03 0.00 0.00 54.58 55.15 2awi n ASN 57 Cb 0.51 -0.70 -0.03 0.00 -0.61 0.00 0.00 39.78 38.95 2awi n ASN 57 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 2awi h PHE 58 N 1.75 -0.80 -0.75 3.10 3.57 -1.94 -2.16 116.94 119.70 2awi h PHE 58 Ca -0.33 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.21 2awi h PHE 58 Cb 1.08 0.39 -0.04 0.00 2.79 0.00 0.00 35.95 40.17 2awi h PHE 58 CO 0.39 -0.36 0.46 0.74 -2.23 0.00 0.00 178.31 177.31 2awi h PHE 59 N -0.31 0.98 -0.60 0.41 0.05 -2.00 -2.17 116.94 113.31 2awi h PHE 59 Ca 0.13 0.00 -0.03 0.00 3.82 0.00 0.00 57.97 61.89 2awi h PHE 59 Cb 0.51 -0.32 -0.03 0.00 2.00 0.00 0.00 35.95 38.11 2awi h PHE 59 CO -0.43 0.65 0.24 1.49 -0.18 0.00 0.00 178.31 180.07 2awi h GLU 60 N 1.03 0.89 -0.63 1.51 4.81 -1.80 -0.13 114.58 120.27 2awi h GLU 60 Ca 0.27 -0.16 0.03 0.00 -0.13 0.00 0.00 59.36 59.37 2awi h GLU 60 Cb -0.06 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.14 2awi h GLU 60 CO -0.05 0.76 0.39 0.82 -0.73 0.00 0.00 179.01 180.20 2awi h ILE 61 N 0.83 1.07 -0.20 2.32 2.04 -0.83 0.11 117.51 122.85 2awi h ILE 61 Ca 0.20 -0.26 -0.02 0.00 1.00 0.00 0.00 64.86 65.78 2awi h ILE 61 Cb 0.20 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 2awi h ILE 61 CO -0.02 0.14 0.06 -0.07 0.00 0.00 0.00 178.15 178.26 2awi h LEU 62 N 0.76 0.28 -0.67 1.44 3.38 -0.98 -0.94 115.31 118.59 2awi h LEU 62 Ca 0.25 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 58.07 2awi h LEU 62 Cb 0.03 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.65 2awi h LEU 62 CO -0.11 0.41 0.39 0.78 0.09 0.00 0.00 178.44 180.01 2awi h ASN 63 N 0.14 0.61 0.51 -0.43 2.35 -0.65 0.21 115.58 118.33 2awi h ASN 63 Ca 0.06 0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 2awi h ASN 63 Cb 0.23 -0.11 -0.00 0.00 0.05 0.00 0.00 38.32 38.48 2awi h ASN 63 CO -0.00 0.41 -0.05 0.03 -1.65 0.00 0.00 177.43 176.17 2awi h ARG 64 N 0.75 0.00 0.00 0.81 3.08 -0.56 -2.02 114.38 116.43 2awi h ARG 64 Ca 0.28 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.18 2awi h ARG 64 Cb 0.10 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 2awi h ARG 64 CO -0.14 0.05 -0.71 0.00 -1.07 0.00 0.00 179.97 178.09 2awi h ALA 65 N 1.95 0.81 0.00 0.04 0.00 0.82 -3.49 119.26 119.39 2awi h ALA 65 Ca -0.00 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2awi h ALA 65 Cb 0.32 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2awi h ALA 65 CO 0.01 0.89 0.00 0.41 0.00 0.00 0.00 179.25 180.56 2awi n GLY 66 N 0.55 2.29 3.93 0.00 0.00 -0.76 -3.63 105.19 107.57 2awi n GLY 66 Ca -0.01 -0.21 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 2awi n GLY 66 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2awi n ASN 68 N 0.00 -4.59 0.00 1.61 2.04 -1.26 -4.85 115.26 108.20 2awi n ASN 68 Ca 0.00 -1.17 0.00 0.00 -0.44 0.00 0.00 54.58 52.97 2awi n ASN 68 Cb 0.00 -2.14 0.00 0.00 -2.53 0.00 0.00 39.78 35.11 2awi n ASN 68 CO 0.00 0.00 0.00 -0.24 -0.44 0.00 0.00 177.26 176.58 2awi n SER 71 N -2.32 0.00 -0.45 0.53 2.88 -1.26 -5.12 113.62 107.88 2awi n SER 71 Ca -0.13 0.00 0.39 0.00 -1.33 0.00 0.00 58.87 57.80 2awi n SER 71 Cb 0.58 0.00 0.67 0.00 -0.75 0.00 0.00 64.21 64.71 2awi n SER 71 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 2awi n VAL 72 N 0.00 -0.28 0.00 2.46 3.14 -1.26 -4.76 118.33 117.63 2awi n VAL 72 Ca 0.00 1.85 0.00 0.00 -2.96 0.00 0.00 64.34 63.23 2awi n VAL 72 Cb 0.00 -3.03 0.00 0.00 -1.06 0.00 0.00 33.84 29.75 2awi n VAL 72 CO 0.00 0.00 0.00 -0.46 -6.46 0.00 0.00 176.83 169.91 2awi n ASN 73 N -4.82 0.00 0.06 6.55 0.23 -1.26 -4.98 115.26 111.03 2awi n ASN 73 Ca 0.40 0.00 0.18 0.00 -0.53 0.00 0.00 54.58 54.63 2awi n ASN 73 Cb 1.53 0.00 0.70 0.00 -2.08 0.00 0.00 39.78 39.92 2awi n ASN 73 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2awi h GLU 74 N 0.00 0.00 0.32 -3.83 4.57 -2.00 -2.51 114.58 111.13 2awi h GLU 74 Ca 0.00 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 2awi h GLU 74 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 2awi h GLU 74 CO 0.00 0.00 -0.16 1.15 -1.18 0.00 0.00 179.01 178.82 2awi h THR 75 N 0.00 0.00 -0.50 0.32 2.02 -1.97 -3.21 112.91 109.57 2awi h THR 75 Ca 0.20 -0.27 0.14 0.00 0.77 0.00 0.00 66.41 67.25 2awi h THR 75 Cb 0.81 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 2awi h THR 75 CO -0.00 0.00 0.65 1.23 0.37 0.00 0.00 175.52 177.77 2awi h GLY 76 N -0.70 0.00 2.00 2.16 0.00 -1.87 0.94 103.07 105.59 2awi h GLY 76 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.29 2awi h GLY 76 CO 0.07 0.00 0.00 0.50 0.00 0.00 0.00 176.54 177.11 2awi h LYS 77 N 0.00 0.00 0.02 4.80 1.57 -1.46 -1.05 116.57 120.45 2awi h LYS 77 Ca 0.24 0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 58.63 2awi h LYS 77 Cb 1.54 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.79 2awi h LYS 77 CO -0.00 0.00 -2.22 0.39 -0.57 0.00 0.00 179.45 177.05 2awi n GLU 78 N -2.79 0.63 0.25 3.15 -0.58 0.32 -3.47 120.64 118.15 2awi n GLU 78 Ca 0.01 0.28 0.09 0.00 -0.42 0.00 0.00 57.16 57.13 2awi n GLU 78 Cb 0.30 -1.58 0.65 0.00 -0.57 0.00 0.00 31.44 30.24 2awi n GLU 78 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 2awi h LYS 79 N -0.53 0.00 -0.08 3.49 3.64 -1.37 0.47 116.57 122.19 2awi h LYS 79 Ca -0.56 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.82 2awi h LYS 79 Cb 1.71 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.53 2awi h LYS 79 CO -0.21 0.10 0.00 1.28 -2.27 0.00 0.00 179.45 178.36 2awi n LEU 80 N -4.12 2.56 0.04 5.20 4.77 -0.40 -3.82 117.00 121.24 2awi n LEU 80 Ca -0.03 -0.90 0.05 0.00 -0.03 0.00 0.00 56.01 55.10 2awi n LEU 80 Cb 0.19 -0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.17 2awi n LEU 80 CO 0.33 0.45 -0.32 -0.11 -1.33 0.00 0.00 177.39 176.41 2awi n LEU 81 N 0.98 0.67 0.08 2.23 7.94 0.12 -4.32 117.00 124.69 2awi n LEU 81 Ca 0.16 0.28 -0.12 0.00 -1.11 0.00 0.00 56.01 55.22 2awi n LEU 81 Cb 0.52 0.05 -0.06 0.00 0.53 0.00 0.00 43.42 44.45 2awi n LEU 81 CO 0.15 0.03 0.82 -0.29 -1.11 0.00 0.00 177.39 176.99 2awi h ILE 82 N 0.00 0.82 0.00 1.96 6.09 -1.55 -0.90 117.51 123.93 2awi h ILE 82 Ca -0.11 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.38 2awi h ILE 82 Cb 1.34 0.82 0.00 0.00 0.47 0.00 0.00 36.82 39.45 2awi h ILE 82 CO 0.02 0.00 0.11 0.77 -3.07 0.00 0.00 178.15 175.98 2awi h SER 83 N -0.17 0.00 0.78 2.19 4.64 -1.79 0.34 113.55 119.54 2awi h SER 83 Ca 0.01 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.08 2awi h SER 83 Cb 0.17 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.22 2awi h SER 83 CO -0.03 0.00 -1.31 0.50 -0.87 0.00 0.00 176.83 175.12 2awi h LYS 84 N 0.00 0.00 0.18 4.77 1.63 -1.39 -3.34 116.57 118.42 2awi h LYS 84 Ca 0.00 0.00 -0.27 0.00 -0.85 0.00 0.00 60.65 59.53 2awi h LYS 84 Cb 0.22 0.00 0.02 0.00 -0.60 0.00 0.00 32.23 31.87 2awi h LYS 84 CO 0.00 0.78 -1.22 0.82 -3.45 0.00 0.00 179.45 176.37 2awi h ILE 85 N 0.00 1.31 -0.25 2.00 2.04 0.22 -3.22 117.51 119.61 2awi h ILE 85 Ca -0.13 -2.58 0.03 0.00 1.00 0.00 0.00 64.86 63.19 2awi h ILE 85 Cb 1.88 3.04 -0.06 0.00 -0.74 0.00 0.00 36.82 40.94 2awi h ILE 85 CO 0.11 0.76 -0.42 0.15 0.00 0.00 0.00 178.15 178.75 2awi h PHE 86 N -0.13 -1.29 0.00 1.37 3.57 -1.31 0.41 116.94 119.55 2awi h PHE 86 Ca -0.22 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.33 2awi h PHE 86 Cb 1.89 0.60 0.00 0.00 2.79 0.00 0.00 35.95 41.23 2awi h PHE 86 CO 0.16 -0.39 0.00 0.25 -2.23 0.00 0.00 178.31 176.10 2awi n THR 87 N -4.74 0.01 -2.92 4.41 -2.24 -1.25 -3.55 114.28 103.99 2awi n THR 87 Ca -0.03 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.61 2awi n THR 87 Cb 0.27 -0.72 0.02 0.00 -2.10 0.00 0.00 70.33 67.79 2awi n THR 87 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2awi n ASN 88 N -1.00 -1.49 0.06 3.42 5.15 0.78 -4.99 115.26 117.18 2awi n ASN 88 Ca 0.13 -3.19 0.04 0.00 -0.60 0.00 0.00 54.58 50.96 2awi n ASN 88 Cb 0.06 0.88 0.20 0.00 -0.53 0.00 0.00 39.78 40.39 2awi n ASN 88 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2awi n PRO 89 N 1.14 0.05 0.00 1.20 -0.04 0.11 -2.22 135.00 135.24 2awi n PRO 89 Ca 0.14 0.50 0.00 0.00 -0.04 0.00 0.00 63.50 64.10 2awi n PRO 89 Cb 0.62 -1.74 0.00 0.00 -0.04 0.00 0.00 33.50 32.34 2awi n PRO 89 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2awi n ASP 90 N -1.72 0.00 -2.01 3.54 8.00 -1.26 -0.79 116.55 122.31 2awi n ASP 90 Ca -0.00 0.49 -0.19 0.00 0.71 0.00 0.00 54.79 55.79 2awi n ASP 90 Cb 0.09 -0.49 0.03 0.00 -0.02 0.00 0.00 41.12 40.74 2awi n ASP 90 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2awi n LEU 91 N -1.49 4.42 -0.06 0.64 4.77 -0.94 -4.83 117.00 119.51 2awi n LEU 91 Ca 0.00 -4.50 -0.03 0.00 -0.03 0.00 0.00 56.01 51.45 2awi n LEU 91 Cb 0.01 -0.27 -0.01 0.00 -2.33 0.00 0.00 43.42 40.82 2awi n LEU 91 CO 0.00 1.94 -0.16 0.15 -1.33 0.00 0.00 177.39 177.99 2awi h PHE 92 N 2.14 0.00 0.00 -1.77 3.57 -1.20 -3.35 116.94 116.34 2awi h PHE 92 Ca 0.29 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.71 2awi h PHE 92 Cb 1.48 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.21 2awi h PHE 92 CO 0.80 0.06 -0.36 -0.44 -2.23 0.00 0.00 178.31 176.14 2awi h ASP 93 N -1.00 0.00 0.38 0.41 3.32 -1.88 1.27 116.42 118.92 2awi h ASP 93 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2awi h ASP 93 Cb 0.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.84 2awi h ASP 93 CO -0.01 0.36 0.00 0.29 -1.72 0.00 0.00 179.24 178.17 2awi n LYS 94 N -3.44 0.21 0.00 3.56 4.01 -1.26 -1.60 118.16 119.64 2awi n LYS 94 Ca 0.00 0.13 0.00 0.00 -0.51 0.00 0.00 58.31 57.93 2awi n LYS 94 Cb 0.53 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 33.55 2awi n LYS 94 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 2awi n ASN 95 N -1.32 3.65 -0.01 4.39 4.13 -0.89 -4.75 115.26 120.45 2awi n ASN 95 Ca 0.08 0.00 -0.09 0.00 1.68 0.00 0.00 54.58 56.25 2awi n ASN 95 Cb 0.15 0.31 0.07 0.00 -1.54 0.00 0.00 39.78 38.78 2awi n ASN 95 CO 0.00 0.00 0.00 0.15 0.28 0.00 0.00 177.26 177.69 2awi h PHE 96 N 0.00 0.72 -0.82 3.10 3.57 0.17 -2.79 116.94 120.89 2awi h PHE 96 Ca 0.00 -0.23 0.12 0.00 3.53 0.00 0.00 57.97 61.39 2awi h PHE 96 Cb 0.76 -0.15 -0.06 0.00 2.79 0.00 0.00 35.95 39.29 2awi h PHE 96 CO 0.00 0.95 0.54 1.96 -2.23 0.00 0.00 178.31 179.52 2awi h GLN 97 N 0.48 0.63 0.18 1.11 7.50 -1.52 0.21 115.11 123.70 2awi h GLN 97 Ca 0.03 -0.04 -0.30 0.00 0.50 0.00 0.00 58.65 58.84 2awi h GLN 97 Cb 0.99 -0.14 0.02 0.00 0.05 0.00 0.00 27.48 28.40 2awi h GLN 97 CO 0.09 0.42 -1.34 -0.09 -1.50 0.00 0.00 178.83 176.41 2awi h ARG 98 N 0.65 0.39 -0.06 1.46 2.43 -1.78 -3.36 114.38 114.11 2awi h ARG 98 Ca 0.40 -0.66 -0.11 0.00 -0.81 0.00 0.00 59.98 58.80 2awi h ARG 98 Cb 0.63 0.25 0.01 0.00 -0.42 0.00 0.00 29.97 30.43 2awi h ARG 98 CO -0.16 1.32 -0.39 0.82 -1.51 0.00 0.00 179.97 180.05 2awi h ILE 99 N 0.11 1.43 -0.89 1.20 1.08 -1.13 -3.26 117.51 116.05 2awi h ILE 99 Ca -0.19 -1.82 0.28 0.00 -0.39 0.00 0.00 64.86 62.75 2awi h ILE 99 Cb 2.06 2.39 -0.16 0.00 -3.07 0.00 0.00 36.82 38.03 2awi h ILE 99 CO 0.24 0.52 0.15 1.21 -0.69 0.00 0.00 178.15 179.58 2awi n GLU 100 N -4.37 -0.07 0.15 2.37 0.00 0.66 -0.64 120.64 118.75 2awi n GLU 100 Ca -0.09 1.30 -0.07 0.00 0.00 0.00 0.00 57.16 58.31 2awi n GLU 100 Cb 0.54 -2.14 -0.03 0.00 0.00 0.00 0.00 31.44 29.81 2awi n GLU 100 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.13 175.78 2awi h PRO 101 N 0.00 -0.42 -0.79 5.31 0.11 -1.72 -3.27 132.00 131.23 2awi h PRO 101 Ca 0.60 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.74 2awi h PRO 101 Cb 1.37 0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.57 2awi h PRO 101 CO -0.79 -0.28 0.00 1.63 -0.21 0.00 0.00 178.00 178.35 2awi n LYS 102 N -4.22 0.66 0.10 1.05 4.01 -0.72 -4.01 118.16 115.03 2awi n LYS 102 Ca -0.05 0.00 0.11 0.00 -0.51 0.00 0.00 58.31 57.85 2awi n LYS 102 Cb 0.17 -1.30 0.45 0.00 -0.51 0.00 0.00 35.03 33.85 2awi n LYS 102 CO 0.00 0.00 0.00 2.89 -1.11 0.00 0.00 177.40 179.18 2awi n ARG 103 N 0.27 0.15 -0.02 1.97 1.85 0.19 -2.81 116.66 118.26 2awi n ARG 103 Ca 0.00 0.40 0.01 0.00 -1.00 0.00 0.00 57.85 57.26 2awi n ARG 103 Cb 0.20 -1.80 0.02 0.00 -1.05 0.00 0.00 32.46 29.83 2awi n ARG 103 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2awi n LEU 104 N -2.08 1.74 0.02 2.89 4.77 -1.26 -2.94 117.00 120.15 2awi n LEU 104 Ca 0.02 -1.52 -0.10 0.00 -0.03 0.00 0.00 56.01 54.37 2awi n LEU 104 Cb 0.21 -0.03 -0.05 0.00 -2.33 0.00 0.00 43.42 41.22 2awi n LEU 104 CO 0.18 0.42 0.81 0.74 -1.33 0.00 0.00 177.39 178.21 2awi h THR 105 N 0.49 0.77 -4.02 -5.08 2.02 -1.82 -3.45 112.91 101.82 2awi h THR 105 Ca 0.00 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.07 2awi h THR 105 Cb 0.34 0.77 -0.14 0.00 -1.74 0.00 0.00 68.15 67.38 2awi h THR 105 CO 0.00 0.00 -0.49 -0.94 0.37 0.00 0.00 175.52 174.46 2awi s SER 106 N -5.10 0.24 0.39 4.18 1.04 -1.26 -5.03 113.70 108.16 2awi s SER 106 Ca -0.14 -0.85 0.07 0.00 0.48 0.00 0.00 55.95 55.52 2awi s SER 106 Cb 0.09 0.30 0.82 0.00 0.10 0.00 0.00 66.02 67.33 2awi s SER 106 CO 0.67 -0.71 2.01 -0.07 0.98 0.00 0.00 173.24 176.11 2awi h LEU 107 N 2.86 0.55 -0.71 2.42 3.38 -1.92 -1.09 115.31 120.80 2awi h LEU 107 Ca -0.34 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.61 2awi h LEU 107 Cb 1.18 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 2awi h LEU 107 CO 0.59 0.38 0.36 1.56 0.09 0.00 0.00 178.44 181.41 2awi h GLN 108 N 0.64 1.01 -0.08 1.13 1.08 -1.96 0.62 115.11 117.55 2awi h GLN 108 Ca 0.24 -0.14 -0.16 0.00 -1.45 0.00 0.00 58.65 57.15 2awi h GLN 108 Cb 0.15 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.38 2awi h GLN 108 CO -0.07 0.78 -0.63 1.88 -0.95 0.00 0.00 178.83 179.84 2awi h TYR 109 N 0.99 0.39 -0.26 2.96 0.05 -1.62 -1.84 116.97 117.63 2awi h TYR 109 Ca 0.25 -0.15 -0.03 0.00 0.05 0.00 0.00 58.73 58.85 2awi h TYR 109 Cb 0.08 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 37.75 2awi h TYR 109 CO 0.00 0.84 0.05 0.35 -1.05 0.00 0.00 178.16 178.36 2awi h PHE 110 N 0.22 0.45 -0.84 4.88 3.57 -0.82 0.35 116.94 124.76 2awi h PHE 110 Ca -0.01 -0.06 0.08 0.00 3.53 0.00 0.00 57.97 61.51 2awi h PHE 110 Cb 1.15 -0.13 -0.07 0.00 2.79 0.00 0.00 35.95 39.70 2awi h PHE 110 CO 0.03 0.53 0.50 1.03 -2.23 0.00 0.00 178.31 178.17 2awi h SER 111 N 0.25 0.75 0.02 0.41 0.87 -0.76 0.28 113.55 115.37 2awi h SER 111 Ca 0.08 0.03 -0.11 0.00 -1.23 0.00 0.00 61.79 60.56 2awi h SER 111 Cb 0.31 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.14 2awi h SER 111 CO 0.00 0.46 -0.36 0.40 -0.53 0.00 0.00 176.83 176.80 2awi h ILE 112 N 0.87 1.29 0.74 2.23 2.04 -0.87 -2.05 117.51 121.77 2awi h ILE 112 Ca 0.39 -1.46 -0.04 0.00 1.00 0.00 0.00 64.86 64.75 2awi h ILE 112 Cb 0.27 1.52 0.01 0.00 -0.74 0.00 0.00 36.82 37.88 2awi h ILE 112 CO -0.21 0.45 -0.35 0.22 0.00 0.00 0.00 178.15 178.26 2awi h TYR 113 N 0.38 -0.92 -0.19 1.37 3.20 0.21 -2.00 116.97 119.02 2awi h TYR 113 Ca 0.04 -0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.95 2awi h TYR 113 Cb 0.80 0.30 -0.01 0.00 1.54 0.00 0.00 36.73 39.37 2awi h TYR 113 CO 0.03 -0.55 0.31 -0.07 -1.64 0.00 0.00 178.16 176.24 2awi h LEU 114 N -1.11 0.00 -0.10 2.82 3.38 -0.54 0.18 115.31 119.94 2awi h LEU 114 Ca -0.10 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2awi h LEU 114 Cb 0.78 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.53 2awi h LEU 114 CO 0.17 0.00 0.03 1.23 0.09 0.00 0.00 178.44 179.96 2awi h GLY 115 N 0.00 0.17 1.02 0.83 0.00 -0.62 -2.76 103.07 101.71 2awi h GLY 115 Ca 0.09 -0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 2awi h GLY 115 CO -0.00 0.10 0.48 -0.97 0.00 0.00 0.00 176.54 176.15 2awi h TYR 116 N -0.03 1.14 -0.70 5.60 -1.99 -0.65 -2.39 116.97 117.96 2awi h TYR 116 Ca 0.03 -0.02 0.15 0.00 2.00 0.00 0.00 58.73 60.89 2awi h TYR 116 Cb 0.23 -0.37 -0.11 0.00 2.00 0.00 0.00 36.73 38.49 2awi h TYR 116 CO 0.00 0.78 0.14 0.82 -0.00 0.00 0.00 178.16 179.90 2awi h ILE 117 N 1.17 0.53 0.31 -2.88 1.08 -1.30 0.77 117.51 117.20 2awi h ILE 117 Ca 0.30 -0.08 0.00 0.00 -0.39 0.00 0.00 64.86 64.69 2awi h ILE 117 Cb -0.00 0.26 -0.03 0.00 -3.07 0.00 0.00 36.82 33.98 2awi h ILE 117 CO -0.05 0.04 -0.39 -1.28 -0.69 0.00 0.00 178.15 175.78 2awi h SER 118 N 0.24 -1.10 -0.68 1.72 0.87 -1.15 0.57 113.55 114.03 2awi h SER 118 Ca 0.38 0.10 0.15 0.00 -1.23 0.00 0.00 61.79 61.19 2awi h SER 118 Cb 0.64 0.38 -0.12 0.00 -0.44 0.00 0.00 62.40 62.86 2awi h SER 118 CO -0.50 -0.52 -0.06 0.40 -0.53 0.00 0.00 176.83 175.62 2awi h ILE 119 N -0.75 0.38 0.10 2.23 2.04 -0.93 1.25 117.51 121.82 2awi h ILE 119 Ca -0.02 -0.02 -0.00 0.00 1.00 0.00 0.00 64.86 65.82 2awi h ILE 119 Cb 0.70 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 2awi h ILE 119 CO -0.11 0.01 -0.05 0.00 0.00 0.00 0.00 178.15 178.00 2awi h ALA 120 N 1.65 -0.13 -0.74 1.87 0.00 -0.25 0.29 119.26 121.96 2awi h ALA 120 Ca 0.35 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.24 2awi h ALA 120 Cb 0.58 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.37 2awi h ALA 120 CO -0.63 -0.53 0.45 0.45 0.00 0.00 0.00 179.25 178.98 2awi h HIS 121 N -0.21 0.83 0.36 0.00 3.86 0.20 0.70 115.15 120.90 2awi h HIS 121 Ca -0.01 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 2awi h HIS 121 Cb 0.17 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 28.38 2awi h HIS 121 CO -0.05 0.44 -0.17 1.25 0.86 0.00 0.00 177.93 180.26 2awi h HIS 122 N 0.85 -0.45 -0.23 2.45 6.17 0.18 -2.29 115.15 121.82 2awi h HIS 122 Ca 0.31 -0.01 -0.06 0.00 0.71 0.00 0.00 60.37 61.32 2awi h HIS 122 Cb 0.10 0.15 -0.04 0.00 2.52 0.00 0.00 27.41 30.14 2awi h HIS 122 CO -0.05 -0.27 0.08 0.66 0.71 0.00 0.00 177.93 179.06 2awi n TYR 123 N -5.29 0.77 -1.85 5.26 4.01 0.10 -4.87 117.16 115.29 2awi n TYR 123 Ca -0.11 -0.49 -0.02 0.00 -0.16 0.00 0.00 57.90 57.12 2awi n TYR 123 Cb 0.22 -0.32 -0.01 0.00 -0.31 0.00 0.00 39.34 38.92 2awi n TYR 123 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2awi n ASN 124 N 0.12 -1.14 -4.78 7.72 0.23 0.12 -4.89 115.26 112.63 2awi n ASN 124 Ca 0.12 0.27 -0.32 0.00 -0.53 0.00 0.00 54.58 54.12 2awi n ASN 124 Cb 0.67 -1.24 0.05 0.00 -2.08 0.00 0.00 39.78 37.18 2awi n ASN 124 CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 2awi s ILE 125 N -1.71 3.45 0.21 1.53 1.01 0.20 -4.95 121.20 120.94 2awi s ILE 125 Ca 0.00 0.62 -0.28 0.00 0.00 0.00 0.00 60.65 60.99 2awi s ILE 125 Cb 0.00 -3.15 -0.08 0.00 0.01 0.00 0.00 42.46 39.23 2awi s ILE 125 CO 0.00 -0.48 0.87 -1.61 0.00 0.00 0.00 174.94 173.73 2awi s GLU 126 N -4.33 4.74 -0.43 2.79 0.41 -1.26 -4.53 118.70 116.08 2awi s GLU 126 Ca 0.64 1.35 0.08 0.00 -0.41 0.00 0.00 54.97 56.63 2awi s GLU 126 Cb -0.18 -3.28 0.34 0.00 -1.78 0.00 0.00 34.13 29.23 2awi s GLU 126 CO 0.45 0.53 1.11 1.33 -0.49 0.00 0.00 175.26 178.19 2awi n VAL 127 N 1.57 0.01 -0.33 2.63 0.24 -1.26 -5.01 118.33 116.18 2awi n VAL 127 Ca -0.03 -1.92 0.22 0.00 -2.04 0.00 0.00 64.34 60.56 2awi n VAL 127 Cb 0.48 1.17 0.48 0.00 -1.47 0.00 0.00 33.84 34.49 2awi n VAL 127 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 2awi h PRO 128 N 2.82 0.43 -0.53 7.34 0.11 -2.03 -1.62 132.00 138.52 2awi h PRO 128 Ca -0.11 -0.03 0.10 0.00 0.11 0.00 0.00 66.00 66.08 2awi h PRO 128 Cb 1.12 -0.10 -0.11 0.00 0.11 0.00 0.00 31.00 32.03 2awi h PRO 128 CO 0.15 0.28 -0.28 1.79 -0.21 0.00 0.00 178.00 179.74 2awi h THR 129 N 0.44 0.25 0.00 -1.15 1.35 -2.01 -3.16 112.91 108.63 2awi h THR 129 Ca 0.61 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.47 2awi h THR 129 Cb 1.45 0.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.12 2awi h THR 129 CO -0.35 0.00 0.00 0.33 -0.25 0.00 0.00 175.52 175.25 2awi n PHE 130 N -5.43 0.00 -0.59 4.73 7.35 -0.61 -1.76 117.46 121.16 2awi n PHE 130 Ca 0.04 0.00 0.47 0.00 -0.76 0.00 0.00 57.45 57.20 2awi n PHE 130 Cb 0.34 -0.38 0.76 0.00 0.35 0.00 0.00 39.48 40.55 2awi n PHE 130 CO 0.00 0.00 0.00 -0.97 -0.76 0.00 0.00 176.76 175.03 2awi h ASN 131 N 0.00 0.08 0.00 -2.13 -0.00 -1.69 -0.54 115.58 111.31 2awi h ASN 131 Ca 0.00 0.06 -0.10 0.00 -0.00 0.00 0.00 56.30 56.25 2awi h ASN 131 Cb 0.00 0.06 -0.02 0.00 -0.00 0.00 0.00 38.32 38.36 2awi h ASN 131 CO 0.00 -0.09 -0.58 0.11 -0.00 0.00 0.00 177.43 176.87 2awi h LYS 132 N 0.02 0.00 0.37 6.67 1.57 -1.51 -3.42 116.57 120.26 2awi h LYS 132 Ca 0.89 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.65 2awi h LYS 132 Cb 3.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 35.61 2awi h LYS 132 CO -0.17 0.93 -0.18 1.79 -0.57 0.00 0.00 179.45 181.25 2awi h THR 133 N -1.00 0.00 0.00 -0.16 1.35 -0.41 -3.37 112.91 109.32 2awi h THR 133 Ca -0.16 -0.16 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 2awi h THR 133 Cb 1.08 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.50 2awi h THR 133 CO -0.10 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.17 2awi n ILE 134 N -3.77 0.00 -0.33 6.82 0.13 -0.32 0.71 119.36 122.60 2awi n ILE 134 Ca -0.06 0.00 -0.04 0.00 -1.10 0.00 0.00 62.75 61.55 2awi n ILE 134 Cb 0.19 0.00 0.09 0.00 -0.84 0.00 0.00 39.64 39.08 2awi n ILE 134 CO 0.00 0.00 0.00 0.74 2.80 0.00 0.00 176.55 180.09 2awi h THR 135 N 0.00 1.25 -0.07 9.51 2.02 -1.82 -2.43 112.91 121.36 2awi h THR 135 Ca 0.00 -0.56 -0.15 0.00 0.77 0.00 0.00 66.41 66.47 2awi h THR 135 Cb 0.00 -0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.40 2awi h THR 135 CO 0.00 0.26 -0.62 0.77 0.37 0.00 0.00 175.52 176.30 2awi h SER 136 N 1.24 0.31 -0.31 4.18 4.64 0.04 -3.19 113.55 120.45 2awi h SER 136 Ca 0.32 -0.18 -0.01 0.00 -0.47 0.00 0.00 61.79 61.46 2awi h SER 136 Cb -0.04 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 61.95 2awi h SER 136 CO -0.06 0.85 0.17 0.44 -0.87 0.00 0.00 176.83 177.36 2awi h ASP 137 N 0.20 0.39 0.22 4.97 5.19 -1.43 0.56 116.42 126.52 2awi h ASP 137 Ca -0.01 -0.08 -0.03 0.00 -0.62 0.00 0.00 57.03 56.28 2awi h ASP 137 Cb 1.14 -0.10 -0.00 0.00 0.18 0.00 0.00 39.33 40.55 2awi h ASP 137 CO 0.10 0.36 -0.16 -0.07 -3.12 0.00 0.00 179.24 176.34 2awi h LEU 138 N 0.39 0.00 0.17 1.55 3.38 -1.45 0.65 115.31 120.00 2awi h LEU 138 Ca 0.11 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.86 2awi h LEU 138 Cb 0.06 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.83 2awi h LEU 138 CO -0.02 0.16 -0.96 0.11 0.09 0.00 0.00 178.44 177.83 2awi h LYS 139 N 0.00 0.35 0.05 1.13 1.57 -1.49 -1.74 116.57 116.45 2awi h LYS 139 Ca -0.00 -0.61 0.03 0.00 -1.87 0.00 0.00 60.65 58.20 2awi h LYS 139 Cb 0.32 0.23 -0.05 0.00 0.08 0.00 0.00 32.23 32.80 2awi h LYS 139 CO 0.02 1.29 -0.36 1.25 -0.57 0.00 0.00 179.45 181.08 2awi h HIS 140 N -0.26 -1.00 -0.03 -1.35 2.76 -0.15 0.50 115.15 115.62 2awi h HIS 140 Ca -0.17 0.03 -0.17 0.00 -2.20 0.00 0.00 60.37 57.86 2awi h HIS 140 Cb 1.76 0.43 -0.01 0.00 1.55 0.00 0.00 27.41 31.14 2awi h HIS 140 CO 0.18 -0.46 -0.73 -0.07 -1.30 0.00 0.00 177.93 175.56 2awi h LEU 141 N -0.55 0.23 -2.69 0.26 3.38 0.18 -3.38 115.31 112.75 2awi h LEU 141 Ca 0.04 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2awi h LEU 141 Cb 0.61 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2awi h LEU 141 CO -0.25 0.88 -0.14 -1.22 0.09 0.00 0.00 178.44 177.80 2awi n TYR 142 N -3.76 0.00 -0.06 1.13 4.01 -0.65 -4.79 117.16 113.04 2awi n TYR 142 Ca -0.03 -0.69 -0.15 0.00 -0.16 0.00 0.00 57.90 56.88 2awi n TYR 142 Cb 0.70 -0.12 -0.04 0.00 -0.31 0.00 0.00 39.34 39.58 2awi n TYR 142 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 2awi h ASP 143 N 0.00 0.94 -1.30 7.72 3.45 -1.03 -3.35 116.42 122.85 2awi h ASP 143 Ca 0.00 -0.54 -0.54 0.00 0.43 0.00 0.00 57.03 56.39 2awi h ASP 143 Cb 1.09 -0.27 -0.42 0.00 -0.56 0.00 0.00 39.33 39.17 2awi h ASP 143 CO 0.00 1.33 -0.83 0.29 -1.57 0.00 0.00 179.24 178.46 2awi n LYS 144 N -3.98 3.03 -4.14 3.56 5.02 -1.26 -5.04 118.16 115.34 2awi n LYS 144 Ca -0.05 -4.23 -0.35 0.00 -2.02 0.00 0.00 58.31 51.66 2awi n LYS 144 Cb 0.66 -2.07 -0.09 0.00 -0.02 0.00 0.00 35.03 33.51 2awi n LYS 144 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2awi s ARG 145 N -3.49 3.59 0.00 1.97 1.81 -1.26 -4.99 118.95 116.58 2awi s ARG 145 Ca 0.44 -0.36 0.00 0.00 -1.72 0.00 0.00 55.73 54.10 2awi s ARG 145 Cb 0.41 -3.05 0.00 0.00 -0.45 0.00 0.00 34.95 31.86 2awi s ARG 145 CO -0.12 0.46 0.00 0.25 -0.68 0.00 0.00 175.30 175.21 2awi n THR 146 N 2.93 0.00 -3.71 0.02 -2.24 -1.26 -5.00 114.28 105.03 2awi n THR 146 Ca -0.18 -0.32 -0.14 0.00 -2.27 0.00 0.00 64.05 61.15 2awi n THR 146 Cb 0.53 0.82 -0.14 0.00 -2.10 0.00 0.00 70.33 69.44 2awi n THR 146 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2awi s THR 147 N -1.35 -0.16 0.30 4.28 -4.23 -1.26 -5.17 115.64 108.05 2awi s THR 147 Ca 0.00 0.23 0.08 0.00 -1.18 0.00 0.00 61.69 60.83 2awi s THR 147 Cb 0.00 -0.32 -0.04 0.00 1.34 0.00 0.00 72.50 73.48 2awi s THR 147 CO 0.00 0.10 0.11 -0.36 -0.54 0.00 0.00 174.62 173.93 2awi s PHE 148 N 1.69 2.79 0.42 3.99 0.40 -1.26 -5.14 117.98 120.87 2awi s PHE 148 Ca -0.04 -0.27 0.06 0.00 -0.60 0.00 0.00 56.93 56.07 2awi s PHE 148 Cb -0.11 -1.45 -0.07 0.00 0.51 0.00 0.00 43.02 41.90 2awi s PHE 148 CO -0.07 0.46 0.01 -0.06 0.70 0.00 0.00 175.22 176.26 2awi s PHE 149 N -2.33 2.37 0.28 0.36 0.40 -1.26 -4.99 117.98 112.81 2awi s PHE 149 Ca 0.35 -0.74 0.03 0.00 -0.60 0.00 0.00 56.93 55.96 2awi s PHE 149 Cb -0.05 -1.72 0.69 0.00 0.51 0.00 0.00 43.02 42.44 2awi s PHE 149 CO 0.22 0.38 1.70 0.78 0.70 0.00 0.00 175.22 179.01 2awi h GLY 150 N 1.71 1.48 1.40 4.36 0.00 -1.98 0.43 103.07 110.47 2awi h GLY 150 Ca -0.44 -0.17 0.04 0.00 0.00 0.00 0.00 47.33 46.76 2awi h GLY 150 CO 0.79 -0.23 0.32 1.19 0.00 0.00 0.00 176.54 178.61 2awi h ILE 151 N 0.42 1.03 -0.30 2.60 6.09 -1.99 -0.28 117.51 125.08 2awi h ILE 151 Ca 0.54 -0.18 -0.10 0.00 -1.37 0.00 0.00 64.86 63.75 2awi h ILE 151 Cb 0.99 0.47 -0.01 0.00 0.47 0.00 0.00 36.82 38.74 2awi h ILE 151 CO -0.51 0.09 -0.20 0.44 -3.07 0.00 0.00 178.15 174.91 2awi h ASP 152 N 0.52 0.69 -0.19 2.19 3.32 -0.54 -1.85 116.42 120.56 2awi h ASP 152 Ca 0.20 -0.43 -0.03 0.00 0.02 0.00 0.00 57.03 56.78 2awi h ASP 152 Cb 0.14 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 2awi h ASP 152 CO -0.05 0.98 0.03 0.00 -1.72 0.00 0.00 179.24 178.47 2awi h GLU 154 N 0.41 0.86 -0.53 0.00 4.81 -0.84 -2.64 114.58 116.66 2awi h GLU 154 Ca 0.10 -0.36 -0.06 0.00 -0.13 0.00 0.00 59.36 58.91 2awi h GLU 154 Cb 0.23 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 2awi h GLU 154 CO 0.00 1.01 0.11 0.82 -0.73 0.00 0.00 179.01 180.21 2awi h ILE 155 N 0.75 1.23 -0.44 2.32 2.04 -0.63 -1.94 117.51 120.84 2awi h ILE 155 Ca 0.10 -0.85 -0.03 0.00 1.00 0.00 0.00 64.86 65.07 2awi h ILE 155 Cb 0.78 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 2awi h ILE 155 CO 0.06 0.31 0.16 0.58 0.00 0.00 0.00 178.15 179.27 2awi h VAL 156 N 0.79 1.21 -0.73 1.67 2.07 -1.22 0.81 116.25 120.86 2awi h VAL 156 Ca 0.17 -0.67 0.01 0.00 0.82 0.00 0.00 66.70 67.04 2awi h VAL 156 Cb 0.33 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 2awi h VAL 156 CO 0.00 0.24 0.49 0.28 0.02 0.00 0.00 177.57 178.60 2awi h SER 157 N 0.56 0.83 -0.43 0.57 0.02 -1.11 0.14 113.55 114.13 2awi h SER 157 Ca 0.14 -0.02 -0.08 0.00 -0.84 0.00 0.00 61.79 60.99 2awi h SER 157 Cb 0.22 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 2awi h SER 157 CO -0.01 0.60 -0.06 0.78 -1.14 0.00 0.00 176.83 177.00 2awi h ASN 158 N 0.98 0.80 0.07 3.07 -0.26 -0.79 -2.94 115.58 116.51 2awi h ASN 158 Ca 0.27 -0.34 -0.00 0.00 -0.56 0.00 0.00 56.30 55.67 2awi h ASN 158 Cb -0.09 -0.22 0.00 0.00 -1.06 0.00 0.00 38.32 36.96 2awi h ASN 158 CO -0.06 0.95 -0.03 -0.07 -1.06 0.00 0.00 177.43 177.16 2awi h LEU 159 N 0.63 -0.08 0.00 1.61 3.38 0.15 -1.15 115.31 119.85 2awi h LEU 159 Ca 0.11 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2awi h LEU 159 Cb 0.58 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2awi h LEU 159 CO 0.03 0.04 0.02 0.18 0.09 0.00 0.00 178.44 178.80 2awi n LEU 160 N -5.08 0.00 -0.01 1.67 4.77 0.41 -0.41 117.00 118.35 2awi n LEU 160 Ca -0.08 0.27 0.10 0.00 -0.03 0.00 0.00 56.01 56.28 2awi n LEU 160 Cb 0.11 -0.27 -0.15 0.00 -2.33 0.00 0.00 43.42 40.78 2awi n LEU 160 CO 0.33 -0.27 -0.51 -3.20 -1.33 0.00 0.00 177.39 172.41 2awi n ASN 161 N -1.26 0.43 0.00 -1.43 5.15 -0.45 -4.54 115.26 113.15 2awi n ASN 161 Ca 0.00 -0.33 0.00 0.00 -0.60 0.00 0.00 54.58 53.65 2awi n ASN 161 Cb 0.02 1.64 0.00 0.00 -0.53 0.00 0.00 39.78 40.91 2awi n ASN 161 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 2awi n VAL 162 N -1.98 0.15 -3.93 3.44 0.24 0.02 -4.90 118.33 111.37 2awi n VAL 162 Ca -0.01 -0.27 -0.12 0.00 -2.04 0.00 0.00 64.34 61.90 2awi n VAL 162 Cb 0.47 1.31 -0.13 0.00 -1.47 0.00 0.00 33.84 34.02 2awi n VAL 162 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2awi s LEU 163 N -0.15 2.07 0.68 1.34 2.96 0.46 -5.06 118.68 120.98 2awi s LEU 163 Ca 0.00 -0.15 -0.17 0.00 -0.22 0.00 0.00 54.13 53.59 2awi s LEU 163 Cb 0.00 -0.01 -0.00 0.00 0.50 0.00 0.00 46.19 46.68 2awi s LEU 163 CO 0.00 -0.07 1.14 -2.65 -1.32 0.00 0.00 176.35 173.45 2awi n PRO 164 N 2.65 0.80 -0.25 0.98 -0.02 -1.26 -4.49 135.00 133.40 2awi n PRO 164 Ca -0.15 0.33 0.05 0.00 -2.02 0.00 0.00 63.50 61.70 2awi n PRO 164 Cb 0.58 -2.38 0.18 0.00 -0.02 0.00 0.00 33.50 31.87 2awi n PRO 164 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 2awi h TYR 165 N 0.13 0.50 -0.09 6.00 3.20 -1.95 -1.49 116.97 123.28 2awi h TYR 165 Ca -0.49 0.04 0.03 0.00 3.14 0.00 0.00 58.73 61.44 2awi h TYR 165 Cb 1.34 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 39.50 2awi h TYR 165 CO 0.41 0.06 0.11 0.93 -1.64 0.00 0.00 178.16 178.03 2awi h GLU 166 N 0.44 0.00 -0.43 1.82 4.39 -2.01 -0.46 114.58 118.33 2awi h GLU 166 Ca 0.41 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.11 2awi h GLU 166 Cb 0.61 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 2awi h GLU 166 CO -0.40 0.00 0.00 0.39 -1.16 0.00 0.00 179.01 177.84 2awi n GLU 167 N -3.75 2.11 0.00 2.33 1.02 -0.56 -4.15 120.64 117.64 2awi n GLU 167 Ca -0.01 -1.72 0.00 0.00 -0.02 0.00 0.00 57.16 55.42 2awi n GLU 167 Cb 0.21 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.23 2awi n GLU 167 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2awi n VAL 168 N 0.90 0.00 -0.33 2.62 0.31 -0.34 -4.84 118.33 116.65 2awi n VAL 168 Ca 0.17 0.00 0.16 0.00 -0.01 0.00 0.00 64.34 64.65 2awi n VAL 168 Cb 0.42 -0.31 0.31 0.00 -0.91 0.00 0.00 33.84 33.36 2awi n VAL 168 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2awi h SER 169 N 0.00 -0.31 -0.34 4.52 4.64 -1.31 -1.18 113.55 119.56 2awi h SER 169 Ca 0.00 0.26 0.01 0.00 -0.47 0.00 0.00 61.79 61.59 2awi h SER 169 Cb 0.42 0.42 -0.02 0.00 -0.31 0.00 0.00 62.40 62.91 2awi h SER 169 CO 0.00 -0.32 0.21 0.77 -0.87 0.00 0.00 176.83 176.62 2awi h SER 170 N 0.05 0.36 -0.03 4.97 4.64 -1.87 -2.66 113.55 119.00 2awi h SER 170 Ca 0.61 -0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.88 2awi h SER 170 Cb 1.29 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.28 2awi h SER 170 CO -0.85 0.26 -0.08 0.40 -0.87 0.00 0.00 176.83 175.69 2awi h ILE 171 N 0.43 1.16 0.21 0.95 5.03 -1.57 -3.32 117.51 120.40 2awi h ILE 171 Ca 0.13 -0.67 -0.01 0.00 -0.12 0.00 0.00 64.86 64.19 2awi h ILE 171 Cb -0.02 1.12 0.00 0.00 -3.03 0.00 0.00 36.82 34.89 2awi h ILE 171 CO -0.05 0.21 -0.10 0.40 -0.68 0.00 0.00 178.15 177.93 2awi h ILE 172 N 0.25 0.16 -0.67 -0.67 2.04 -1.27 -3.38 117.51 113.96 2awi h ILE 172 Ca 0.05 -0.87 0.14 0.00 1.00 0.00 0.00 64.86 65.19 2awi h ILE 172 Cb 0.30 0.28 -0.13 0.00 -0.74 0.00 0.00 36.82 36.53 2awi h ILE 172 CO 0.01 0.05 -0.15 0.29 0.00 0.00 0.00 178.15 178.35 2awi n LYS 173 N -4.96 -0.06 0.00 2.37 4.76 -1.02 -3.73 118.16 115.51 2awi n LYS 173 Ca -0.04 1.04 0.00 0.00 -2.87 0.00 0.00 58.31 56.44 2awi n LYS 173 Cb 0.15 -1.57 0.00 0.00 -1.84 0.00 0.00 35.03 31.77 2awi n LYS 173 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 2awi n PRO 174 N -5.07 0.00 0.00 1.97 -0.02 -1.26 -4.65 135.00 125.97 2awi n PRO 174 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 2awi n PRO 174 Cb 0.36 -1.34 0.00 0.00 -0.02 0.00 0.00 33.50 32.50 2awi n PRO 174 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2awi n TYR 176 N 1.51 0.00 -1.63 6.00 4.02 -1.24 -5.07 117.16 120.75 2awi n TYR 176 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.59 2awi n TYR 176 Cb 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.39 2awi n TYR 176 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 2awi s PRO 177 N 0.00 2.45 0.32 -0.72 0.04 -1.26 -5.15 135.00 130.68 2awi s PRO 177 Ca 0.00 0.67 -0.19 0.00 0.04 0.00 0.00 61.00 61.52 2awi s PRO 177 Cb 0.00 -1.96 -0.09 0.00 0.04 0.00 0.00 34.50 32.49 2awi s PRO 177 CO 0.00 -1.37 0.80 0.42 0.04 0.00 0.00 177.00 176.89 2awi s ILE 178 N -3.18 4.54 -0.00 0.56 -1.09 -1.26 -4.99 121.20 115.78 2awi s ILE 178 Ca 0.60 1.24 0.00 0.00 -2.23 0.00 0.00 60.65 60.26 2awi s ILE 178 Cb -0.14 -3.71 -0.00 0.00 -1.58 0.00 0.00 42.46 37.04 2awi s ILE 178 CO 0.54 -0.09 0.00 0.52 -1.23 0.00 0.00 174.94 174.68 2awi n VAL 179 N -0.08 0.01 -4.18 2.92 0.31 -1.26 -4.93 118.33 111.11 2awi n VAL 179 Ca 0.03 -0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.18 2awi n VAL 179 Cb 0.53 -0.88 -0.12 0.00 -0.91 0.00 0.00 33.84 32.46 2awi n VAL 179 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2awi s ASP 180 N -3.24 1.69 -0.15 4.52 -0.00 -1.26 -4.82 116.67 113.41 2awi s ASP 180 Ca -0.00 -0.68 -0.14 0.00 -0.00 0.00 0.00 52.55 51.73 2awi s ASP 180 Cb 0.00 -0.04 -0.05 0.00 -0.00 0.00 0.00 42.92 42.83 2awi s ASP 180 CO 0.00 -0.12 0.31 -0.55 -0.00 0.00 0.00 175.17 174.82 2awi s SER 181 N -1.96 6.48 -0.36 0.27 0.15 -1.26 -5.00 113.70 112.02 2awi s SER 181 Ca 0.01 0.56 0.10 0.00 0.70 0.00 0.00 55.95 57.32 2awi s SER 181 Cb -0.08 -2.19 0.45 0.00 -1.71 0.00 0.00 66.02 62.49 2awi s SER 181 CO 0.02 0.12 1.10 0.49 1.20 0.00 0.00 173.24 176.17 2awi n PHE 182 N 3.41 2.59 0.00 3.44 3.72 -1.26 -5.06 117.46 124.30 2awi n PHE 182 Ca -0.12 -2.71 0.00 0.00 -0.05 0.00 0.00 57.45 54.57 2awi n PHE 182 Cb 0.52 -0.22 0.00 0.00 -0.94 0.00 0.00 39.48 38.84 2awi n PHE 182 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2awi n GLY 183 N -0.48 2.53 0.36 1.37 0.00 -1.26 -4.41 105.19 103.31 2awi n GLY 183 Ca 0.31 -1.77 0.05 0.00 0.00 0.00 0.00 46.02 44.62 2awi n GLY 183 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2awi h LYS 184 N 0.00 0.87 -0.84 1.61 1.57 -1.96 -0.13 116.57 117.70 2awi h LYS 184 Ca 0.00 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 2awi h LYS 184 Cb 0.00 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.07 2awi h LYS 184 CO 0.00 0.58 0.45 -0.44 -0.57 0.00 0.00 179.45 179.47 2awi h ASP 185 N 0.90 1.06 -0.14 0.86 3.45 -1.99 -1.96 116.42 118.59 2awi h ASP 185 Ca 0.34 -0.11 -0.15 0.00 0.43 0.00 0.00 57.03 57.54 2awi h ASP 185 Cb 0.18 -0.27 0.01 0.00 -0.56 0.00 0.00 39.33 38.69 2awi h ASP 185 CO -0.11 0.86 -0.50 0.22 -1.57 0.00 0.00 179.24 178.13 2awi h TYR 186 N 1.18 0.78 -0.80 4.55 5.03 -1.48 -3.08 116.97 123.15 2awi h TYR 186 Ca 0.29 -0.32 0.03 0.00 2.58 0.00 0.00 58.73 61.31 2awi h TYR 186 Cb 0.05 -0.13 -0.05 0.00 1.55 0.00 0.00 36.73 38.15 2awi h TYR 186 CO 0.01 1.10 0.51 -0.44 -1.32 0.00 0.00 178.16 178.02 2awi h ASP 187 N 0.24 0.85 0.18 -2.11 3.45 -0.91 -2.12 116.42 115.99 2awi h ASP 187 Ca -0.02 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.44 2awi h ASP 187 Cb 1.13 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 39.70 2awi h ASP 187 CO 0.11 0.59 -0.16 0.25 -1.57 0.00 0.00 179.24 178.45 2awi h LEU 188 N 1.00 -0.42 -0.74 1.55 6.46 -1.39 -1.92 115.31 119.84 2awi h LEU 188 Ca 0.32 0.04 0.10 0.00 -0.12 0.00 0.00 57.88 58.22 2awi h LEU 188 Cb 0.01 0.14 -0.07 0.00 -0.73 0.00 0.00 40.66 40.01 2awi h LEU 188 CO -0.11 -0.24 0.38 0.74 -0.62 0.00 0.00 178.44 178.58 2awi h THR 189 N -0.36 0.84 0.00 1.05 2.02 -1.38 0.26 112.91 115.34 2awi h THR 189 Ca -0.00 -0.21 -0.08 0.00 0.77 0.00 0.00 66.41 66.88 2awi h THR 189 Cb 0.33 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.89 2awi h THR 189 CO -0.03 0.11 -0.40 0.16 0.37 0.00 0.00 175.52 175.74 2awi h ILE 190 N 0.63 1.20 0.01 3.11 3.07 -1.18 -2.83 117.51 121.51 2awi h ILE 190 Ca 0.37 -1.40 -0.26 0.00 1.55 0.00 0.00 64.86 65.11 2awi h ILE 190 Cb 0.40 1.78 0.02 0.00 -0.27 0.00 0.00 36.82 38.75 2awi h ILE 190 CO -0.28 0.39 -1.04 1.56 -1.05 0.00 0.00 178.15 177.73 2awi h GLN 191 N 0.00 0.64 0.00 0.16 4.20 -0.35 -3.14 115.11 116.62 2awi h GLN 191 Ca -0.00 -0.71 -0.01 0.00 0.06 0.00 0.00 58.65 58.00 2awi h GLN 191 Cb 0.74 0.20 -0.00 0.00 0.30 0.00 0.00 27.48 28.73 2awi h GLN 191 CO 0.05 1.29 -0.03 1.15 -0.67 0.00 0.00 178.83 180.63 2awi h THR 192 N 0.36 0.58 0.07 -0.54 2.02 -0.32 0.05 112.91 115.13 2awi h THR 192 Ca -0.13 -0.11 -0.20 0.00 0.77 0.00 0.00 66.41 66.74 2awi h THR 192 Cb 1.70 1.07 0.02 0.00 -1.74 0.00 0.00 68.15 69.19 2awi h THR 192 CO 0.20 0.02 -0.84 0.58 0.37 0.00 0.00 175.52 175.85 2awi h VAL 193 N 0.00 1.41 -0.31 3.16 2.07 -1.52 -2.57 116.25 118.50 2awi h VAL 193 Ca -0.00 -2.32 -0.01 0.00 0.82 0.00 0.00 66.70 65.19 2awi h VAL 193 Cb 0.06 2.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.62 2awi h VAL 193 CO 0.00 0.68 0.15 -0.07 0.02 0.00 0.00 177.57 178.35 2awi h LEU 194 N -0.07 0.39 0.27 2.57 3.38 -1.26 0.16 115.31 120.75 2awi h LEU 194 Ca -0.13 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 57.74 2awi h LEU 194 Cb 1.58 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 42.20 2awi h LEU 194 CO 0.16 0.39 -0.36 0.50 0.09 0.00 0.00 178.44 179.23 2awi h LYS 195 N 0.36 -0.66 -0.37 1.13 3.11 -1.09 0.16 116.57 119.21 2awi h LYS 195 Ca 0.11 0.05 -0.01 0.00 -2.81 0.00 0.00 60.65 57.98 2awi h LYS 195 Cb 0.10 0.15 -0.02 0.00 -1.00 0.00 0.00 32.23 31.46 2awi h LYS 195 CO -0.01 -0.44 0.19 -0.91 -2.81 0.00 0.00 179.45 175.46 2awi h ASN 196 N -0.69 0.47 -0.68 4.20 2.35 -1.39 -1.33 115.58 118.51 2awi h ASN 196 Ca -0.00 -0.11 0.05 0.00 -0.55 0.00 0.00 56.30 55.69 2awi h ASN 196 Cb 0.65 -0.12 -0.05 0.00 0.05 0.00 0.00 38.32 38.85 2awi h ASN 196 CO -0.12 0.45 0.40 0.00 -1.65 0.00 0.00 177.43 176.50 2awi h ALA 197 N 1.04 0.91 -0.38 -0.83 0.00 -0.42 -1.37 119.26 118.21 2awi h ALA 197 Ca 0.13 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 2awi h ALA 197 Cb 0.09 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2awi h ALA 197 CO -0.02 0.11 -0.21 1.25 0.00 0.00 0.00 179.25 180.38 2awi h LEU 198 N 0.75 0.74 0.15 0.00 5.85 -0.50 -1.41 115.31 120.89 2awi h LEU 198 Ca 0.30 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 2awi h LEU 198 Cb 0.13 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.96 2awi h LEU 198 CO -0.16 0.93 -0.07 0.74 -0.34 0.00 0.00 178.44 179.54 2awi h THR 199 N 0.64 0.87 -0.55 1.05 2.02 -0.55 -1.25 112.91 115.16 2awi h THR 199 Ca 0.09 -0.08 0.01 0.00 0.77 0.00 0.00 66.41 67.21 2awi h THR 199 Cb 0.70 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 2awi h THR 199 CO 0.05 0.02 0.35 0.40 0.37 0.00 0.00 175.52 176.71 2awi h ILE 200 N -0.24 1.11 -0.28 3.11 2.04 -1.21 -2.58 117.51 119.46 2awi h ILE 200 Ca -0.02 -0.24 0.05 0.00 1.00 0.00 0.00 64.86 65.65 2awi h ILE 200 Cb 0.18 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 36.55 2awi h ILE 200 CO 0.03 0.13 -0.04 0.28 0.00 0.00 0.00 178.15 178.55 2awi h SER 201 N 0.71 -0.20 0.00 1.72 0.02 -1.02 -2.12 113.55 112.66 2awi h SER 201 Ca 0.21 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 2awi h SER 201 Cb -0.04 0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.65 2awi h SER 201 CO -0.07 -0.07 0.00 -0.38 -1.14 0.00 0.00 176.83 175.18 2awi n ILE 202 N -5.21 0.02 0.00 3.27 2.08 -0.49 -1.27 119.36 117.75 2awi n ILE 202 Ca -0.01 -0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.30 2awi n ILE 202 Cb 0.16 -0.52 0.00 0.00 -0.75 0.00 0.00 39.64 38.53 2awi n ILE 202 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 2awi n ASN 204 N 1.01 0.00 -2.65 4.38 3.02 -0.80 -4.60 115.26 115.62 2awi n ASN 204 Ca 0.00 0.00 -0.19 0.00 -0.03 0.00 0.00 54.58 54.36 2awi n ASN 204 Cb 0.01 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.18 2awi n ASN 204 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 2awi n ARG 205 N 0.00 -2.73 -2.68 3.52 0.63 -0.73 -4.88 116.66 109.79 2awi n ARG 205 Ca 0.00 0.81 -0.43 0.00 -0.92 0.00 0.00 57.85 57.30 2awi n ARG 205 Cb 0.00 -5.50 0.00 0.00 0.45 0.00 0.00 32.46 27.41 2awi n ARG 205 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 2awi n ASN 206 N -2.09 5.08 -0.30 6.15 2.85 -0.40 -4.81 115.26 121.74 2awi n ASN 206 Ca -0.16 -3.00 0.17 0.00 -0.11 0.00 0.00 54.58 51.47 2awi n ASN 206 Cb 0.63 -1.57 0.43 0.00 1.24 0.00 0.00 39.78 40.51 2awi n ASN 206 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 2awi h LEU 207 N 9.61 0.57 0.33 1.20 3.38 -1.90 -0.85 115.31 127.65 2awi h LEU 207 Ca 0.37 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.40 2awi h LEU 207 Cb 0.80 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 2awi h LEU 207 CO 1.41 0.21 -0.46 0.50 0.09 0.00 0.00 178.44 180.19 2awi h LYS 208 N 0.56 -0.79 0.00 1.13 1.63 -1.97 -2.05 116.57 115.08 2awi h LYS 208 Ca 0.52 0.05 -0.07 0.00 -0.85 0.00 0.00 60.65 60.31 2awi h LYS 208 Cb 1.07 0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 32.87 2awi h LYS 208 CO -0.27 -0.53 -0.34 0.93 -3.45 0.00 0.00 179.45 175.80 2awi h GLU 209 N -0.82 0.00 -0.23 1.90 4.39 -1.86 -3.12 114.58 114.84 2awi h GLU 209 Ca -0.04 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.67 2awi h GLU 209 Cb 0.74 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.38 2awi h GLU 209 CO -0.13 0.34 0.12 0.00 -1.16 0.00 0.00 179.01 178.18 2awi h ALA 210 N 1.66 0.28 -0.09 3.43 0.00 -0.78 -2.51 119.26 121.26 2awi h ALA 210 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2awi h ALA 210 Cb 0.65 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2awi h ALA 210 CO 0.04 -0.28 -0.30 0.37 0.00 0.00 0.00 179.25 179.08 2awi h GLN 211 N 0.25 0.17 -0.06 0.00 4.15 -1.33 -2.53 115.11 115.78 2awi h GLN 211 Ca 0.09 -0.06 0.02 0.00 0.77 0.00 0.00 58.65 59.47 2awi h GLN 211 Cb 0.02 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.67 2awi h GLN 211 CO -0.06 0.46 -0.05 -0.92 -1.93 0.00 0.00 178.83 176.33 2awi h TYR 212 N 0.15 -0.13 -0.12 3.99 3.20 -1.41 -0.95 116.97 121.70 2awi h TYR 212 Ca 0.02 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.80 2awi h TYR 212 Cb 0.62 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 2awi h TYR 212 CO 0.01 -0.09 -0.38 1.88 -1.64 0.00 0.00 178.16 177.94 2awi h TYR 213 N -0.07 0.29 -0.18 -3.82 0.05 -1.37 -0.76 116.97 111.11 2awi h TYR 213 Ca 0.04 -0.07 -0.01 0.00 0.05 0.00 0.00 58.73 58.74 2awi h TYR 213 Cb 0.13 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 37.80 2awi h TYR 213 CO -0.15 0.60 0.08 0.82 -1.05 0.00 0.00 178.16 178.46 2awi h ILE 214 N 0.21 1.14 -0.45 -2.88 2.04 -1.02 -0.45 117.51 116.11 2awi h ILE 214 Ca 0.02 -0.42 -0.08 0.00 1.00 0.00 0.00 64.86 65.38 2awi h ILE 214 Cb 0.77 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.93 2awi h ILE 214 CO 0.06 0.14 -0.06 0.78 0.00 0.00 0.00 178.15 179.06 2awi h ASN 215 N 0.15 0.76 -0.27 1.72 -0.26 -1.02 -0.49 115.58 116.17 2awi h ASN 215 Ca 0.06 -0.21 -0.05 0.00 -0.56 0.00 0.00 56.30 55.55 2awi h ASN 215 Cb 0.14 -0.20 -0.02 0.00 -1.06 0.00 0.00 38.32 37.18 2awi h ASN 215 CO -0.01 0.86 0.03 1.56 -1.06 0.00 0.00 177.43 178.82 2awi h GLN 216 N 0.71 0.56 -0.03 0.81 1.08 -0.83 -1.31 115.11 116.10 2awi h GLN 216 Ca 0.13 -0.11 -0.11 0.00 -1.45 0.00 0.00 58.65 57.10 2awi h GLN 216 Cb 0.53 -0.09 0.01 0.00 -0.05 0.00 0.00 27.48 27.88 2awi h GLN 216 CO 0.03 0.56 -0.42 0.35 -0.95 0.00 0.00 178.83 178.41 2awi h PHE 217 N 0.54 0.48 -0.01 2.96 3.57 -0.61 -3.02 116.94 120.86 2awi h PHE 217 Ca 0.12 -0.24 0.00 0.00 3.53 0.00 0.00 57.97 61.38 2awi h PHE 217 Cb 0.30 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 38.98 2awi h PHE 217 CO 0.01 1.02 0.01 0.93 -2.23 0.00 0.00 178.31 178.05 2awi h GLU 218 N -0.19 0.00 -0.09 1.11 4.39 -0.87 -2.22 114.58 116.71 2awi h GLU 218 Ca -0.04 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.42 2awi h GLU 218 Cb 1.11 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.77 2awi h GLU 218 CO 0.08 0.00 -0.88 1.25 -1.16 0.00 0.00 179.01 178.31 2awi h HIS 219 N 0.00 1.04 -0.86 4.33 2.76 -1.19 -3.15 115.15 118.09 2awi h HIS 219 Ca 0.00 -0.50 0.19 0.00 -2.20 0.00 0.00 60.37 57.86 2awi h HIS 219 Cb 0.02 -0.14 -0.06 0.00 1.55 0.00 0.00 27.41 28.77 2awi h HIS 219 CO 0.00 1.33 0.57 -0.07 -1.30 0.00 0.00 177.93 178.46 2awi h LEU 220 N 0.48 0.38 -2.09 0.26 3.38 -1.27 0.14 115.31 116.59 2awi h LEU 220 Ca -0.08 0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.95 2awi h LEU 220 Cb 1.51 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.22 2awi h LEU 220 CO 0.18 0.17 0.07 0.11 0.09 0.00 0.00 178.44 179.05 2awi h LYS 221 N 0.39 0.00 -0.00 1.13 1.57 -1.57 -1.04 116.57 117.04 2awi h LYS 221 Ca 0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.22 2awi h LYS 221 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.40 2awi h LYS 221 CO -0.15 0.00 -0.15 0.25 -0.57 0.00 0.00 179.45 178.83 2awi n THR 222 N -4.36 0.00 -2.38 -0.16 -2.24 0.47 -4.89 114.28 100.72 2awi n THR 222 Ca -0.01 -0.03 -0.35 0.00 -2.27 0.00 0.00 64.05 61.39 2awi n THR 222 Cb 0.18 -0.16 -0.01 0.00 -2.10 0.00 0.00 70.33 68.24 2awi n THR 222 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2awi s ILE 223 N -2.71 3.41 0.00 2.28 1.01 -0.40 -4.98 121.20 119.82 2awi s ILE 223 Ca 0.22 0.88 -0.30 0.00 0.00 0.00 0.00 60.65 61.45 2awi s ILE 223 Cb 0.19 -3.36 -0.05 0.00 0.01 0.00 0.00 42.46 39.26 2awi s ILE 223 CO 0.53 -0.19 1.22 -0.75 0.00 0.00 0.00 174.94 175.75 2awi s LYS 224 N -3.26 4.38 -2.05 2.79 2.20 -1.26 -3.44 119.74 119.10 2awi s LYS 224 Ca 0.70 1.74 0.00 0.00 -0.36 0.00 0.00 55.97 58.06 2awi s LYS 224 Cb -0.21 -3.46 0.00 0.00 -1.51 0.00 0.00 37.83 32.65 2awi s LYS 224 CO 0.24 -0.37 0.00 0.09 -0.36 0.00 0.00 175.35 174.95 2awi n ASN 225 N 4.62 -5.62 -4.76 1.43 3.02 -1.26 -4.52 115.26 108.18 2awi n ASN 225 Ca 0.10 0.33 -0.41 0.00 -0.03 0.00 0.00 54.58 54.58 2awi n ASN 225 Cb 0.46 -4.86 -0.04 0.00 -0.61 0.00 0.00 39.78 34.74 2awi n ASN 225 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2awi s ILE 226 N -2.86 3.38 -0.86 2.41 1.10 -1.22 -4.96 121.20 118.19 2awi s ILE 226 Ca 0.00 1.35 -0.09 0.00 -0.51 0.00 0.00 60.65 61.39 2awi s ILE 226 Cb 0.00 -3.86 0.22 0.00 0.15 0.00 0.00 42.46 38.97 2awi s ILE 226 CO 0.00 0.30 0.78 -0.44 -2.11 0.00 0.00 174.94 173.47 2awi s SER 227 N -0.63 6.51 0.11 4.50 0.01 -1.26 -5.04 113.70 117.90 2awi s SER 227 Ca 0.47 -3.04 -0.31 0.00 1.31 0.00 0.00 55.95 54.38 2awi s SER 227 Cb -0.33 -2.11 -0.08 0.00 0.21 0.00 0.00 66.02 63.71 2awi s SER 227 CO 0.42 -0.43 1.47 -0.63 0.41 0.00 0.00 173.24 174.48 2awi s ILE 228 N -0.36 3.12 -0.12 1.44 -1.09 -1.26 -4.70 121.20 118.23 2awi s ILE 228 Ca 0.22 0.76 -0.30 0.00 -2.23 0.00 0.00 60.65 59.10 2awi s ILE 228 Cb -0.12 -3.49 -0.02 0.00 -1.58 0.00 0.00 42.46 37.26 2awi s ILE 228 CO -0.08 0.05 1.16 0.21 -1.23 0.00 0.00 174.94 175.04 2awi s ASN 229 N 1.32 7.07 0.14 3.58 3.84 -1.26 -4.96 114.94 124.66 2awi s ASN 229 Ca 0.67 1.67 -0.18 0.00 0.21 0.00 0.00 52.86 55.22 2awi s ASN 229 Cb -0.39 -2.55 0.01 0.00 -0.55 0.00 0.00 41.25 37.77 2awi s ASN 229 CO 0.30 -0.62 1.73 1.23 -2.79 0.00 0.00 177.10 176.95 2awi h GLY 230 N 8.73 0.28 0.89 1.21 0.00 -1.99 -1.04 103.07 111.15 2awi h GLY 230 Ca -0.29 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.06 2awi h GLY 230 CO 0.91 -0.03 0.36 -0.97 0.00 0.00 0.00 176.54 176.82 2awi h TYR 231 N 0.12 0.68 -0.59 5.60 0.05 -1.99 -1.02 116.97 119.82 2awi h TYR 231 Ca 0.12 0.02 -0.05 0.00 0.05 0.00 0.00 58.73 58.87 2awi h TYR 231 Cb 0.14 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.63 2awi h TYR 231 CO -0.18 0.39 0.17 1.88 -1.05 0.00 0.00 178.16 179.37 2awi h TYR 232 N 0.72 0.97 -0.86 4.88 0.99 -1.93 0.19 116.97 121.93 2awi h TYR 232 Ca 0.23 -0.10 0.04 0.00 2.00 0.00 0.00 58.73 60.90 2awi h TYR 232 Cb 0.01 -0.28 -0.05 0.00 1.00 0.00 0.00 36.73 37.41 2awi h TYR 232 CO -0.05 0.81 0.55 0.22 -0.00 0.00 0.00 178.16 179.69 2awi h ASP 233 N 0.84 0.91 -0.23 3.88 3.58 -0.76 0.61 116.42 125.25 2awi h ASP 233 Ca 0.19 -0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.56 2awi h ASP 233 Cb 0.31 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.16 2awi h ASP 233 CO -0.00 0.62 -0.15 0.25 -2.88 0.00 0.00 179.24 177.08 2awi h LEU 234 N 1.06 0.53 -0.31 2.28 5.85 -0.75 -2.49 115.31 121.48 2awi h LEU 234 Ca 0.35 -0.43 -0.10 0.00 0.84 0.00 0.00 57.88 58.53 2awi h LEU 234 Cb 0.03 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 2awi h LEU 234 CO -0.13 0.85 -0.21 -0.08 -0.34 0.00 0.00 178.44 178.53 2awi h GLU 235 N 0.21 0.70 -0.01 1.25 4.81 -0.12 -2.57 114.58 118.85 2awi h GLU 235 Ca 0.05 -0.33 -0.06 0.00 -0.13 0.00 0.00 59.36 58.89 2awi h GLU 235 Cb 0.67 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 2awi h GLU 235 CO 0.04 0.94 -0.27 0.82 -0.73 0.00 0.00 179.01 179.81 2awi h ILE 236 N 0.46 1.20 0.00 2.32 2.04 0.15 -0.86 117.51 122.82 2awi h ILE 236 Ca 0.06 -0.94 -0.09 0.00 1.00 0.00 0.00 64.86 64.89 2awi h ILE 236 Cb 0.76 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 38.32 2awi h ILE 236 CO 0.06 0.27 -0.45 -1.13 0.00 0.00 0.00 178.15 176.90 2awi h ASN 237 N 0.01 0.00 -0.07 1.72 -0.73 -1.34 0.62 115.58 115.80 2awi h ASN 237 Ca -0.00 0.00 -0.03 0.00 1.87 0.00 0.00 56.30 58.14 2awi h ASN 237 Cb 0.48 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 39.07 2awi h ASN 237 CO 0.04 0.45 -0.07 0.22 -0.37 0.00 0.00 177.43 177.70 2awi h TYR 238 N 0.00 0.19 -0.38 0.67 5.03 -0.78 -1.05 116.97 120.65 2awi h TYR 238 Ca -0.00 -0.06 -0.00 0.00 2.58 0.00 0.00 58.73 61.25 2awi h TYR 238 Cb 1.04 -0.04 -0.02 0.00 1.55 0.00 0.00 36.73 39.26 2awi h TYR 238 CO 0.00 0.61 0.23 -0.07 -1.32 0.00 0.00 178.16 177.61 2awi h LEU 239 N -0.27 0.45 -0.87 2.82 3.38 -1.06 0.14 115.31 119.89 2awi h LEU 239 Ca 0.01 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 2awi h LEU 239 Cb 0.58 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2awi h LEU 239 CO 0.02 0.34 -0.28 0.50 0.09 0.00 0.00 178.44 179.11 2awi h LYS 240 N 0.52 0.52 -0.31 1.13 3.64 -0.64 0.23 116.57 121.66 2awi h LYS 240 Ca 0.14 -0.21 -0.11 0.00 -1.27 0.00 0.00 60.65 59.20 2awi h LYS 240 Cb -0.02 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 2awi h LYS 240 CO -0.03 0.75 -0.22 1.96 -2.27 0.00 0.00 179.45 179.64 2awi h GLN 241 N 0.45 0.69 -0.76 1.90 1.08 0.35 -0.89 115.11 117.93 2awi h GLN 241 Ca 0.06 -0.33 -0.03 0.00 -1.45 0.00 0.00 58.65 56.90 2awi h GLN 241 Cb 0.72 -0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.11 2awi h GLN 241 CO 0.06 0.94 0.36 0.82 -0.95 0.00 0.00 178.83 180.05 2awi h ILE 242 N 0.44 1.24 0.44 2.54 1.08 -0.50 -1.78 117.51 120.98 2awi h ILE 242 Ca 0.06 -0.68 -0.01 0.00 -0.39 0.00 0.00 64.86 63.84 2awi h ILE 242 Cb 0.77 0.27 -0.02 0.00 -3.07 0.00 0.00 36.82 34.78 2awi h ILE 242 CO 0.06 0.29 -0.42 0.22 -0.69 0.00 0.00 178.15 177.61 2awi h TYR 243 N 1.08 -1.13 -0.96 1.37 3.20 -0.17 -0.52 116.97 119.83 2awi h TYR 243 Ca 0.26 0.01 0.21 0.00 3.14 0.00 0.00 58.73 62.34 2awi h TYR 243 Cb 0.11 0.44 -0.08 0.00 1.54 0.00 0.00 36.73 38.74 2awi h TYR 243 CO 0.01 -0.58 0.62 1.96 -1.64 0.00 0.00 178.16 178.53 2awi h GLN 244 N -0.87 0.51 -0.32 1.82 4.20 -0.85 -0.83 115.11 118.77 2awi h GLN 244 Ca -0.04 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.55 2awi h GLN 244 Cb 0.76 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 2awi h GLN 244 CO -0.05 0.34 -0.13 0.35 -0.67 0.00 0.00 178.83 178.67 2awi h PHE 245 N 0.53 0.75 -0.05 2.96 3.57 -0.45 -2.41 116.94 121.84 2awi h PHE 245 Ca 0.52 -0.18 -0.09 0.00 3.53 0.00 0.00 57.97 61.75 2awi h PHE 245 Cb 1.13 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.68 2awi h PHE 245 CO -0.00 0.86 -0.40 -0.07 -2.23 0.00 0.00 178.31 176.46 2awi h LEU 246 N 0.43 0.11 -0.16 0.59 3.38 0.09 0.46 115.31 120.21 2awi h LEU 246 Ca 0.08 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 2awi h LEU 246 Cb 0.65 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.36 2awi h LEU 246 CO 0.04 0.51 -0.11 0.74 0.09 0.00 0.00 178.44 179.70 2awi h THR 247 N 0.09 1.33 -0.18 0.22 2.02 -1.08 -3.39 112.91 111.91 2awi h THR 247 Ca 0.01 -1.22 -0.20 0.00 0.77 0.00 0.00 66.41 65.76 2awi h THR 247 Cb 0.75 1.78 -0.36 0.00 -1.74 0.00 0.00 68.15 68.58 2awi h THR 247 CO 0.06 0.36 -0.98 -0.90 0.37 0.00 0.00 175.52 174.42 2awi n ASP 248 N -4.58 0.98 -3.53 4.18 5.75 -0.92 -5.04 116.55 113.38 2awi n ASP 248 Ca -0.06 -2.02 -0.19 0.00 -0.01 0.00 0.00 54.79 52.51 2awi n ASP 248 Cb 0.34 -0.28 0.00 0.00 -1.03 0.00 0.00 41.12 40.15 2awi n ASP 248 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2awi n LYS 249 N -0.11 -0.73 -3.52 0.11 4.76 0.16 -4.88 118.16 113.95 2awi n LYS 249 Ca 0.03 0.13 -0.39 0.00 -2.87 0.00 0.00 58.31 55.22 2awi n LYS 249 Cb 0.96 -1.08 -0.10 0.00 -1.84 0.00 0.00 35.03 32.97 2awi n LYS 249 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2awi s ASN 250 N -3.27 6.10 0.09 4.39 3.84 -1.25 -4.99 114.94 119.85 2awi s ASN 250 Ca 0.12 0.04 -0.24 0.00 0.21 0.00 0.00 52.86 52.99 2awi s ASN 250 Cb -0.07 -2.15 -0.14 0.00 -0.55 0.00 0.00 41.25 38.34 2awi s ASN 250 CO 0.51 -0.12 1.73 0.40 -2.79 0.00 0.00 177.10 176.83 2awi h ILE 251 N 5.39 0.92 -0.66 -5.21 1.08 -1.96 -2.49 117.51 114.59 2awi h ILE 251 Ca -0.33 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.27 2awi h ILE 251 Cb 1.18 0.92 -0.12 0.00 -3.07 0.00 0.00 36.82 35.72 2awi h ILE 251 CO 0.59 0.00 -0.13 0.44 -0.69 0.00 0.00 178.15 178.37 2awi h ASP 252 N -0.08 -0.54 -0.78 1.72 3.32 -1.99 0.17 116.42 118.25 2awi h ASP 252 Ca 0.00 0.19 0.06 0.00 0.02 0.00 0.00 57.03 57.31 2awi h ASP 252 Cb 0.08 0.38 -0.06 0.00 0.22 0.00 0.00 39.33 39.95 2awi h ASP 252 CO -0.01 -0.20 0.47 0.28 -1.72 0.00 0.00 179.24 178.05 2awi h SER 253 N 0.02 0.72 -0.77 6.45 0.02 -1.83 0.21 113.55 118.37 2awi h SER 253 Ca 0.33 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.28 2awi h SER 253 Cb 0.51 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 62.89 2awi h SER 253 CO -0.66 0.46 0.39 0.22 -1.14 0.00 0.00 176.83 176.11 2awi h TYR 254 N 0.85 1.09 -0.41 3.45 5.03 -0.30 -1.79 116.97 124.89 2awi h TYR 254 Ca 0.34 -0.04 -0.11 0.00 2.58 0.00 0.00 58.73 61.50 2awi h TYR 254 Cb 0.18 -0.34 -0.01 0.00 1.55 0.00 0.00 36.73 38.11 2awi h TYR 254 CO -0.05 0.78 -0.19 -0.07 -1.32 0.00 0.00 178.16 177.31 2awi h LEU 255 N 1.08 0.87 -1.22 2.82 3.38 0.03 -1.91 115.31 120.36 2awi h LEU 255 Ca 0.27 -0.40 0.10 0.00 0.09 0.00 0.00 57.88 57.94 2awi h LEU 255 Cb 0.08 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.53 2awi h LEU 255 CO -0.04 1.08 0.57 0.78 0.09 0.00 0.00 178.44 180.92 2awi h ASN 256 N 0.66 0.78 -0.25 -0.43 2.35 -0.32 0.40 115.58 118.77 2awi h ASN 256 Ca 0.09 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.84 2awi h ASN 256 Cb 0.75 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.97 2awi h ASN 256 CO 0.06 0.45 0.07 0.00 -1.65 0.00 0.00 177.43 176.36 2awi h ALA 257 N 1.56 0.32 -0.35 -0.83 0.00 -0.90 -0.58 119.26 118.48 2awi h ALA 257 Ca 0.41 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 2awi h ALA 257 Cb 0.43 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2awi h ALA 257 CO -0.18 -0.03 0.19 0.28 0.00 0.00 0.00 179.25 179.51 2awi h VAL 258 N 0.23 1.14 -0.98 0.00 2.07 -0.40 -1.02 116.25 117.29 2awi h VAL 258 Ca 0.08 -0.36 0.02 0.00 0.82 0.00 0.00 66.70 67.26 2awi h VAL 258 Cb 0.26 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 30.72 2awi h VAL 258 CO -0.00 0.14 0.65 -1.13 0.02 0.00 0.00 177.57 177.25 2awi h ASN 259 N 0.45 1.09 -0.53 0.57 -1.24 -0.08 -0.84 115.58 114.99 2awi h ASN 259 Ca 0.12 -0.02 -0.06 0.00 0.71 0.00 0.00 56.30 57.05 2awi h ASN 259 Cb 0.06 -0.26 -0.02 0.00 0.73 0.00 0.00 38.32 38.83 2awi h ASN 259 CO -0.02 0.77 0.08 0.40 -1.29 0.00 0.00 177.43 177.37 2awi h ILE 260 N 1.28 1.25 -0.29 2.57 2.04 -0.70 -2.48 117.51 121.18 2awi h ILE 260 Ca 0.38 -0.95 0.05 0.00 1.00 0.00 0.00 64.86 65.34 2awi h ILE 260 Cb -0.07 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 36.81 2awi h ILE 260 CO -0.10 0.34 -0.02 0.40 0.00 0.00 0.00 178.15 178.77 2awi h ILE 261 N 0.76 0.77 -0.41 -0.67 2.04 -0.06 -1.59 117.51 118.34 2awi h ILE 261 Ca 0.16 -0.02 0.03 0.00 1.00 0.00 0.00 64.86 66.03 2awi h ILE 261 Cb 0.41 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 2awi h ILE 261 CO 0.01 0.01 0.28 -1.13 0.00 0.00 0.00 178.15 177.32 2awi h ASN 262 N 0.06 0.38 -0.71 1.72 -1.24 -1.00 -2.10 115.58 112.69 2awi h ASN 262 Ca 0.14 -0.01 0.01 0.00 0.71 0.00 0.00 56.30 57.16 2awi h ASN 262 Cb 0.20 -0.09 -0.04 0.00 0.73 0.00 0.00 38.32 39.12 2awi h ASN 262 CO -0.25 0.27 0.47 0.40 -1.29 0.00 0.00 177.43 177.02 2awi h ILE 263 N 0.45 1.16 -0.12 2.57 1.08 -0.83 0.84 117.51 122.66 2awi h ILE 263 Ca 0.17 -0.32 -0.04 0.00 -0.39 0.00 0.00 64.86 64.27 2awi h ILE 263 Cb 0.12 0.14 -0.01 0.00 -3.07 0.00 0.00 36.82 33.99 2awi h ILE 263 CO -0.04 0.17 -0.11 -0.26 -0.69 0.00 0.00 178.15 177.22 2awi h PHE 264 N 0.95 0.20 -0.02 1.37 0.04 -1.21 -0.58 116.94 117.68 2awi h PHE 264 Ca 0.27 -0.02 -0.02 0.00 2.80 0.00 0.00 57.97 61.00 2awi h PHE 264 Cb -0.08 -0.06 0.00 0.00 2.20 0.00 0.00 35.95 38.01 2awi h PHE 264 CO -0.03 0.31 -0.06 -0.22 -0.60 0.00 0.00 178.31 177.71 2awi h LYS 265 N 0.18 0.08 -0.93 1.51 3.64 -1.25 -0.64 116.57 119.16 2awi h LYS 265 Ca 0.04 -0.05 0.14 0.00 -1.27 0.00 0.00 60.65 59.51 2awi h LYS 265 Cb 0.32 0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.07 2awi h LYS 265 CO 0.02 0.67 0.59 0.82 -2.27 0.00 0.00 179.45 179.28 2awi h ILE 266 N -0.51 0.84 -0.37 2.00 2.04 -0.35 -1.47 117.51 119.69 2awi h ILE 266 Ca -0.00 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.60 2awi h ILE 266 Cb 0.68 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 2awi h ILE 266 CO 0.01 0.14 0.00 2.30 0.00 0.00 0.00 178.15 180.60 2awi n ILE 267 N -4.59 0.48 -0.73 -0.67 -5.35 -0.27 -4.96 119.36 103.27 2awi n ILE 267 Ca 0.18 -0.59 0.00 0.00 -0.27 0.00 0.00 62.75 62.07 2awi n ILE 267 Cb 0.46 0.52 0.00 0.00 -1.74 0.00 0.00 39.64 38.87 2awi n ILE 267 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2awi n GLY 268 N 1.30 0.78 3.27 3.28 0.00 -0.55 -4.97 105.19 108.30 2awi n GLY 268 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 2awi n GLY 268 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2awi n LYS 269 N -2.26 3.20 -0.31 1.61 4.76 -0.27 -4.78 118.16 120.09 2awi n LYS 269 Ca 0.00 -3.25 -0.04 0.00 -2.87 0.00 0.00 58.31 52.14 2awi n LYS 269 Cb 0.00 -3.29 0.08 0.00 -1.84 0.00 0.00 35.03 29.97 2awi n LYS 269 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 2awi h GLU 270 N 6.90 1.16 -0.48 1.97 4.57 -1.91 -1.79 114.58 125.00 2awi h GLU 270 Ca 0.45 -0.12 0.02 0.00 -1.18 0.00 0.00 59.36 58.53 2awi h GLU 270 Cb 0.79 -0.24 -0.03 0.00 -0.16 0.00 0.00 28.75 29.11 2awi h GLU 270 CO 1.54 0.83 0.28 -0.44 -1.18 0.00 0.00 179.01 180.04 2awi h ASP 271 N 1.17 0.45 -0.05 1.04 3.32 -1.95 0.26 116.42 120.66 2awi h ASP 271 Ca 0.30 0.01 -0.15 0.00 0.02 0.00 0.00 57.03 57.21 2awi h ASP 271 Cb -0.02 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 2awi h ASP 271 CO -0.05 0.32 -0.48 0.40 -1.72 0.00 0.00 179.24 177.70 2awi h ILE 272 N 0.56 1.31 -0.45 0.35 2.04 -1.94 -1.67 117.51 117.70 2awi h ILE 272 Ca 0.19 -1.69 -0.01 0.00 1.00 0.00 0.00 64.86 64.36 2awi h ILE 272 Cb 0.03 1.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 2awi h ILE 272 CO -0.09 0.53 0.25 -0.74 0.00 0.00 0.00 178.15 178.10 2awi h HIS 273 N 0.48 0.62 -0.13 1.37 2.76 -0.72 -1.28 115.15 118.25 2awi h HIS 273 Ca 0.03 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 2awi h HIS 273 Cb 1.02 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 29.77 2awi h HIS 273 CO 0.04 0.46 0.08 -0.09 -1.30 0.00 0.00 177.93 177.13 2awi h ARG 274 N 0.59 0.17 -0.18 5.26 2.43 -0.36 -2.00 114.38 120.31 2awi h ARG 274 Ca 0.16 -0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.36 2awi h ARG 274 Cb 0.05 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.51 2awi h ARG 274 CO -0.03 0.14 -0.14 1.03 -1.51 0.00 0.00 179.97 179.46 2awi h SER 275 N 0.15 -0.45 0.49 -3.80 0.87 -0.98 -2.33 113.55 107.50 2awi h SER 275 Ca 0.05 0.09 -0.06 0.00 -1.23 0.00 0.00 61.79 60.64 2awi h SER 275 Cb 0.01 0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 2awi h SER 275 CO -0.01 -0.18 -0.27 -0.07 -0.53 0.00 0.00 176.83 175.77 2awi h LEU 276 N -0.15 0.00 -0.08 2.23 4.07 -1.16 -0.89 115.31 119.33 2awi h LEU 276 Ca 0.11 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 58.05 2awi h LEU 276 Cb 0.31 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.05 2awi h LEU 276 CO -0.27 0.27 -0.03 0.58 -1.08 0.00 0.00 178.44 177.92 2awi h VAL 277 N 0.00 1.30 -0.52 1.22 2.07 -0.86 0.20 116.25 119.67 2awi h VAL 277 Ca -0.00 -0.98 -0.03 0.00 0.82 0.00 0.00 66.70 66.50 2awi h VAL 277 Cb 0.58 1.79 -0.02 0.00 -1.52 0.00 0.00 31.29 32.12 2awi h VAL 277 CO 0.03 0.27 0.19 -0.33 0.02 0.00 0.00 177.57 177.76 2awi h GLU 278 N -0.19 0.78 -0.09 1.57 5.08 -1.29 -2.04 114.58 118.40 2awi h GLU 278 Ca 0.02 -0.15 0.02 0.00 -1.00 0.00 0.00 59.36 58.26 2awi h GLU 278 Cb 0.45 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 2awi h GLU 278 CO 0.01 0.70 -0.06 1.49 -1.00 0.00 0.00 179.01 180.15 2awi h GLU 279 N 0.69 -0.07 -0.21 2.33 4.22 -1.03 -0.60 114.58 119.92 2awi h GLU 279 Ca 0.17 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.59 2awi h GLU 279 Cb 0.22 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2awi h GLU 279 CO -0.01 -0.04 0.02 1.25 -2.18 0.00 0.00 179.01 178.04 2awi h LEU 280 N -0.07 0.27 -0.08 1.64 5.85 -0.44 -0.53 115.31 121.96 2awi h LEU 280 Ca 0.06 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 2awi h LEU 280 Cb 0.15 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 2awi h LEU 280 CO -0.13 0.31 -0.07 0.74 -0.34 0.00 0.00 178.44 178.95 2awi h THR 281 N 0.30 1.36 -0.35 1.05 2.02 -0.62 -0.51 112.91 116.16 2awi h THR 281 Ca 0.07 -1.19 -0.08 0.00 0.77 0.00 0.00 66.41 65.98 2awi h THR 281 Cb 0.17 1.97 -0.02 0.00 -1.74 0.00 0.00 68.15 68.54 2awi h THR 281 CO 0.00 0.33 -0.11 0.11 0.37 0.00 0.00 175.52 176.22 2awi h LYS 282 N -0.23 0.60 -0.10 6.66 1.57 -0.89 0.14 116.57 124.32 2awi h LYS 282 Ca 0.01 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 58.59 2awi h LYS 282 Cb 0.56 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.81 2awi h LYS 282 CO 0.02 0.70 -0.03 0.82 -0.57 0.00 0.00 179.45 180.39 2awi h ILE 283 N 0.55 1.30 -0.43 1.86 1.08 -1.07 -2.37 117.51 118.44 2awi h ILE 283 Ca 0.10 -0.99 -0.05 0.00 -0.39 0.00 0.00 64.86 63.54 2awi h ILE 283 Cb 0.52 1.75 -0.02 0.00 -3.07 0.00 0.00 36.82 36.00 2awi h ILE 283 CO 0.03 0.28 0.08 0.28 -0.69 0.00 0.00 178.15 178.13 2awi h SER 284 N -0.13 0.67 -0.65 1.72 0.02 -0.95 -2.76 113.55 111.47 2awi h SER 284 Ca 0.03 -0.25 0.06 0.00 -0.84 0.00 0.00 61.79 60.79 2awi h SER 284 Cb 0.45 -0.18 -0.06 0.00 0.14 0.00 0.00 62.40 62.76 2awi h SER 284 CO 0.01 0.74 0.35 0.00 -1.14 0.00 0.00 176.83 176.79 2awi h ALA 285 N 0.95 0.87 0.00 3.77 0.00 -0.94 0.19 119.26 124.09 2awi h ALA 285 Ca 0.13 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2awi h ALA 285 Cb 0.35 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2awi h ALA 285 CO 0.01 0.01 -0.05 0.87 0.00 0.00 0.00 179.25 180.09 2awi h LYS 286 N 0.64 0.00 -0.64 0.00 1.57 -1.27 0.44 116.57 117.30 2awi h LYS 286 Ca 0.30 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 2awi h LYS 286 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 2awi h LYS 286 CO -0.19 0.05 0.00 0.39 -0.57 0.00 0.00 179.45 179.12 2awi n GLU 287 N -3.39 4.10 -3.55 3.15 -0.58 0.38 -4.94 120.64 115.82 2awi n GLU 287 Ca -0.02 -2.97 -0.23 0.00 -0.42 0.00 0.00 57.16 53.53 2awi n GLU 287 Cb 0.18 -2.02 0.03 0.00 -0.57 0.00 0.00 31.44 29.06 2awi n GLU 287 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2awi n LYS 288 N 1.00 -1.35 -3.74 3.49 4.76 0.14 -4.99 118.16 117.48 2awi n LYS 288 Ca 0.27 0.75 -0.12 0.00 -2.87 0.00 0.00 58.31 56.34 2awi n LYS 288 Cb 0.99 -4.23 -0.12 0.00 -1.84 0.00 0.00 35.03 29.83 2awi n LYS 288 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 2awi s PHE 289 N -3.28 -0.40 -0.22 2.13 2.19 0.36 -4.98 117.98 113.78 2awi s PHE 289 Ca 0.29 0.92 -0.15 0.00 0.33 0.00 0.00 56.93 58.33 2awi s PHE 289 Cb -0.10 0.13 -0.04 0.00 -1.31 0.00 0.00 43.02 41.70 2awi s PHE 289 CO 0.84 -0.23 0.35 0.99 1.83 0.00 0.00 175.22 179.00 2awi s THR 290 N 0.85 5.23 1.10 0.12 2.01 -1.26 -3.23 115.64 120.46 2awi s THR 290 Ca -0.06 0.59 -0.14 0.00 0.31 0.00 0.00 61.69 62.40 2awi s THR 290 Cb -0.07 -3.68 0.24 0.00 0.01 0.00 0.00 72.50 69.00 2awi s THR 290 CO -0.06 0.26 1.07 -2.84 -0.69 0.00 0.00 174.62 172.36 2awi s PRO 291 N 1.34 -0.38 1.01 4.92 0.02 -1.26 -5.00 135.00 135.65 2awi s PRO 291 Ca 0.16 0.48 -0.11 0.00 0.02 0.00 0.00 61.00 61.55 2awi s PRO 291 Cb -0.15 -1.65 0.20 0.00 0.02 0.00 0.00 34.50 32.92 2awi s PRO 291 CO 0.07 -3.27 1.09 -2.14 -0.33 0.00 0.00 177.00 172.42 2awi s PRO 292 N -4.89 0.29 0.13 5.54 0.02 -1.26 -4.81 135.00 130.02 2awi s PRO 292 Ca 0.67 1.11 -0.22 0.00 0.02 0.00 0.00 61.00 62.58 2awi s PRO 292 Cb -0.19 -1.68 -0.04 0.00 0.02 0.00 0.00 34.50 32.62 2awi s PRO 292 CO 0.59 -2.98 1.68 1.57 -0.33 0.00 0.00 177.00 177.53 2awi h LYS 293 N -2.10 -0.16 -0.00 5.54 -0.00 -1.99 -2.80 116.57 115.05 2awi h LYS 293 Ca -0.52 0.01 0.00 0.00 -0.00 0.00 0.00 60.65 60.14 2awi h LYS 293 Cb 1.30 0.04 -0.00 0.00 -0.00 0.00 0.00 32.23 33.56 2awi h LYS 293 CO 0.48 -0.11 -0.01 1.49 -0.00 0.00 0.00 179.45 181.31 2awi h GLU 294 N -0.17 -0.01 -0.76 0.07 4.81 -1.99 0.14 114.58 116.67 2awi h GLU 294 Ca 0.08 0.00 0.18 0.00 -0.13 0.00 0.00 59.36 59.49 2awi h GLU 294 Cb 0.28 0.00 -0.13 0.00 0.63 0.00 0.00 28.75 29.54 2awi h GLU 294 CO -0.20 -0.00 0.09 -0.39 -0.73 0.00 0.00 179.01 177.77 2awi h VAL 295 N -0.01 0.39 0.00 0.32 -1.51 -1.93 -0.11 116.25 113.40 2awi h VAL 295 Ca 0.00 -0.06 -0.07 0.00 -1.23 0.00 0.00 66.70 65.34 2awi h VAL 295 Cb 0.01 0.21 -0.01 0.00 -2.13 0.00 0.00 31.29 29.37 2awi h VAL 295 CO -0.01 0.03 -0.35 0.71 -1.23 0.00 0.00 177.57 176.73 2awi h THR 296 N 0.16 0.75 -0.21 7.19 1.35 -1.25 -1.86 112.91 119.04 2awi h THR 296 Ca 0.43 -1.54 -0.14 0.00 -0.55 0.00 0.00 66.41 64.61 2awi h THR 296 Cb 0.78 1.99 -0.01 0.00 -1.73 0.00 0.00 68.15 69.18 2awi h THR 296 CO -0.62 0.34 -0.46 -0.03 -0.25 0.00 0.00 175.52 174.51 2awi h MET 297 N 0.00 0.54 0.03 4.72 -1.53 0.11 -1.14 114.93 117.66 2awi h MET 297 Ca -0.00 -0.30 -0.00 0.00 -3.44 0.00 0.00 59.70 55.96 2awi h MET 297 Cb 0.96 0.02 0.00 0.00 -0.55 0.00 0.00 31.60 32.03 2awi h MET 297 CO 0.05 0.89 -0.01 1.88 0.14 0.00 0.00 176.91 179.85 2awi h TYR 298 N 0.44 -0.04 -0.31 1.39 -1.99 -1.26 -3.34 116.97 111.85 2awi h TYR 298 Ca 0.03 -0.00 0.07 0.00 2.00 0.00 0.00 58.73 60.83 2awi h TYR 298 Cb 0.97 0.01 -0.08 0.00 2.00 0.00 0.00 36.73 39.63 2awi h TYR 298 CO 0.04 0.64 -0.29 -0.92 -0.00 0.00 0.00 178.16 177.63 2awi h TYR 299 N -0.78 -0.78 -1.68 4.88 5.03 -1.35 -0.81 116.97 121.49 2awi h TYR 299 Ca -0.00 0.05 0.49 0.00 2.58 0.00 0.00 58.73 61.84 2awi h TYR 299 Cb 0.69 0.39 -0.07 0.00 1.55 0.00 0.00 36.73 39.29 2awi h TYR 299 CO 0.17 -0.36 1.21 1.49 -1.32 0.00 0.00 178.16 179.35 2awi h GLU 300 N -0.26 0.00 0.00 1.82 4.81 -1.32 -3.51 114.58 116.13 2awi h GLU 300 Ca 0.15 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 2awi h GLU 300 Cb 0.51 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.89 2awi h GLU 300 CO -0.46 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 177.91