#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 3.83 -0.06 -1.08 2.85 -1.16 -4.75 118.16 117.79 2awi n LYS 3 Ca 0.00 -3.79 -0.11 0.00 -1.05 0.00 0.00 58.31 53.36 2awi n LYS 3 Cb 0.00 -2.36 -0.04 0.00 -0.65 0.00 0.00 35.03 31.98 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 2.12 1.18 -0.62 0.58 2.04 -1.94 -2.39 117.51 118.49 2awi h ILE 4 Ca 0.55 -0.54 0.01 0.00 1.00 0.00 0.00 64.86 65.88 2awi h ILE 4 Cb 0.23 1.16 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 2awi h ILE 4 CO 1.29 0.17 0.40 1.23 0.00 0.00 0.00 178.15 181.24 2awi h GLY 5 N 0.17 0.87 1.78 5.37 0.00 -1.86 -0.82 103.07 108.58 2awi h GLY 5 Ca 0.07 -0.31 -0.06 0.00 0.00 0.00 0.00 47.33 47.03 2awi h GLY 5 CO -0.00 0.29 -0.15 1.48 0.00 0.00 0.00 176.54 178.16 2awi h SER 6 N 0.81 0.26 -0.39 0.19 4.64 -1.59 -1.25 113.55 116.22 2awi h SER 6 Ca 0.23 -0.06 -0.15 0.00 -0.47 0.00 0.00 61.79 61.34 2awi h SER 6 Cb -0.06 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 61.96 2awi h SER 6 CO -0.07 0.43 -0.35 0.58 -0.87 0.00 0.00 176.83 176.56 2awi h VAL 7 N 0.25 1.27 -0.87 0.95 2.07 -0.85 -1.40 116.25 117.68 2awi h VAL 7 Ca 0.05 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 66.05 2awi h VAL 7 Cb 0.42 1.37 -0.04 0.00 -1.52 0.00 0.00 31.29 31.52 2awi h VAL 7 CO 0.03 0.51 0.55 -0.07 0.02 0.00 0.00 177.57 178.60 2awi h LEU 8 N 0.73 1.03 -0.04 2.57 3.38 -0.50 -0.82 115.31 121.65 2awi h LEU 8 Ca 0.07 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2awi h LEU 8 Cb 0.94 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 2awi h LEU 8 CO 0.09 0.77 0.01 0.50 0.09 0.00 0.00 178.44 179.89 2awi h LYS 9 N 1.20 0.08 -0.15 1.13 3.64 -1.04 0.27 116.57 121.70 2awi h LYS 9 Ca 0.32 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.72 2awi h LYS 9 Cb -0.09 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.67 2awi h LYS 9 CO -0.06 0.32 -0.19 0.37 -2.27 0.00 0.00 179.45 177.62 2awi h GLN 10 N -0.18 -0.23 -0.11 1.90 4.15 -0.92 -0.01 115.11 119.71 2awi h GLN 10 Ca 0.01 0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.43 2awi h GLN 10 Cb 0.29 0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.02 2awi h GLN 10 CO 0.00 -0.15 0.01 0.82 -1.93 0.00 0.00 178.83 177.58 2awi h ILE 11 N -0.24 1.23 -0.58 2.39 2.04 -1.12 -1.18 117.51 120.06 2awi h ILE 11 Ca 0.10 -0.73 0.09 0.00 1.00 0.00 0.00 64.86 65.32 2awi h ILE 11 Cb 0.39 1.51 -0.07 0.00 -0.74 0.00 0.00 36.82 37.91 2awi h ILE 11 CO -0.29 0.21 0.22 -0.09 0.00 0.00 0.00 178.15 178.20 2awi h ARG 12 N -0.07 0.39 0.00 2.37 2.43 -0.24 -1.49 114.38 117.78 2awi h ARG 12 Ca 0.03 -0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 59.03 2awi h ARG 12 Cb 0.31 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 2awi h ARG 12 CO 0.00 0.26 -0.70 1.96 -1.51 0.00 0.00 179.97 179.98 2awi h GLN 13 N 0.40 0.00 -0.05 0.20 4.20 -0.94 -0.07 115.11 118.86 2awi h GLN 13 Ca 0.29 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.91 2awi h GLN 13 Cb 0.34 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 2awi h GLN 13 CO -0.29 0.70 -0.38 1.49 -0.67 0.00 0.00 178.83 179.68 2awi h GLU 14 N 0.00 0.10 -0.10 1.46 4.57 -0.61 -2.60 114.58 117.40 2awi h GLU 14 Ca -0.01 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 2awi h GLU 14 Cb 1.24 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.83 2awi h GLU 14 CO 0.09 0.47 0.00 1.28 -1.18 0.00 0.00 179.01 179.67 2awi n LEU 15 N -4.07 2.00 -0.89 1.64 4.77 -0.62 -4.95 117.00 114.88 2awi n LEU 15 Ca -0.02 -0.74 -0.10 0.00 -0.03 0.00 0.00 56.01 55.12 2awi n LEU 15 Cb 0.43 -0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.44 2awi n LEU 15 CO 0.40 0.37 -0.10 0.59 -1.33 0.00 0.00 177.39 177.32 2awi n ASN 16 N 0.55 -3.76 -4.86 -1.43 4.13 -0.98 -5.03 115.26 103.89 2awi n ASN 16 Ca 0.17 0.13 -0.33 0.00 1.68 0.00 0.00 54.58 56.24 2awi n ASN 16 Cb 0.41 -2.50 -0.06 0.00 -1.54 0.00 0.00 39.78 36.09 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 -2.41 3.43 0.30 3.10 2.02 -0.07 -5.01 117.35 118.71 2awi s TYR 17 Ca 0.00 1.09 0.05 0.00 -0.37 0.00 0.00 57.07 57.84 2awi s TYR 17 Cb 0.00 -2.43 -0.02 0.00 -0.40 0.00 0.00 41.96 39.11 2awi s TYR 17 CO 0.00 0.20 0.45 -1.01 -1.57 0.00 0.00 175.55 173.62 2awi s HIS 18 N -1.85 3.31 0.33 2.71 3.76 -1.26 -4.44 115.29 117.86 2awi s HIS 18 Ca 0.49 -0.03 0.07 0.00 -0.15 0.00 0.00 55.06 55.44 2awi s HIS 18 Cb -0.11 -1.82 0.76 0.00 1.11 0.00 0.00 32.58 32.51 2awi s HIS 18 CO 0.19 0.17 1.85 1.96 -0.85 0.00 0.00 174.74 178.06 2awi h GLN 19 N 0.96 0.74 -1.01 1.40 4.20 -1.98 -1.47 115.11 117.95 2awi h GLN 19 Ca -0.49 -0.04 0.06 0.00 0.06 0.00 0.00 58.65 58.23 2awi h GLN 19 Cb 1.24 -0.17 -0.06 0.00 0.30 0.00 0.00 27.48 28.79 2awi h GLN 19 CO 0.58 0.49 0.65 -0.84 -0.67 0.00 0.00 178.83 179.04 2awi h ILE 20 N 0.76 1.12 0.00 2.54 3.07 -1.98 -1.42 117.51 121.60 2awi h ILE 20 Ca 0.48 -0.42 -0.00 0.00 1.55 0.00 0.00 64.86 66.47 2awi h ILE 20 Cb 0.72 -0.20 -0.00 0.00 -0.27 0.00 0.00 36.82 37.07 2awi h ILE 20 CO -0.24 0.22 -0.01 0.44 -1.05 0.00 0.00 178.15 177.51 2awi h ASP 21 N 1.21 0.00 0.00 2.16 3.32 -1.66 -1.62 116.42 119.84 2awi h ASP 21 Ca 0.42 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 57.12 2awi h ASP 21 Cb 0.11 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.61 2awi h ASP 21 CO -0.16 0.01 -1.94 0.18 -1.72 0.00 0.00 179.24 175.62 2awi n LEU 22 N -3.19 1.98 0.11 1.55 7.99 -0.60 -4.67 117.00 120.16 2awi n LEU 22 Ca -0.02 0.35 0.12 0.00 -0.01 0.00 0.00 56.01 56.45 2awi n LEU 22 Cb 0.14 -0.90 0.05 0.00 -0.11 0.00 0.00 43.42 42.60 2awi n LEU 22 CO 0.23 0.46 0.18 0.10 -1.51 0.00 0.00 177.39 176.85 2awi h TYR 23 N -0.92 0.00 -2.41 -1.77 -0.00 -1.36 -3.45 116.97 107.07 2awi h TYR 23 Ca -0.53 0.00 -0.54 0.00 -0.00 0.00 0.00 58.73 57.66 2awi h TYR 23 Cb 1.50 0.00 0.03 0.00 -0.00 0.00 0.00 36.73 38.27 2awi h TYR 23 CO 0.01 0.00 1.13 -1.13 -0.00 0.00 0.00 178.16 178.16 2awi n SER 24 N -2.61 3.98 0.00 0.10 3.41 -0.61 -0.10 113.62 117.78 2awi n SER 24 Ca 0.01 0.97 0.00 0.00 -0.26 0.00 0.00 58.87 59.59 2awi n SER 24 Cb 0.52 -1.52 0.00 0.00 -0.26 0.00 0.00 64.21 62.96 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 4.29 1.32 0.01 5.00 0.00 -1.26 -5.03 105.19 109.52 2awi n GLY 25 Ca 0.19 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -2.00 0.13 -2.62 -0.61 5.41 0.86 -5.25 119.36 115.28 2awi n ILE 26 Ca 0.00 -0.11 -0.29 0.00 1.00 0.00 0.00 62.75 63.35 2awi n ILE 26 Cb 0.00 -0.45 -0.01 0.00 -0.71 0.00 0.00 39.64 38.47 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 -3.02 6.34 0.15 4.38 1.04 -1.26 -5.11 113.70 116.22 2awi s SER 28 Ca -0.01 1.05 -0.16 0.00 0.48 0.00 0.00 55.95 57.30 2awi s SER 28 Cb 0.01 -2.30 0.02 0.00 0.10 0.00 0.00 66.02 63.86 2awi s SER 28 CO 0.13 -0.55 1.80 0.50 0.98 0.00 0.00 173.24 176.09 2awi h LYS 29 N 0.50 0.45 -0.06 4.02 3.64 -1.99 -1.82 116.57 121.31 2awi h LYS 29 Ca -0.47 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 58.91 2awi h LYS 29 Cb 1.20 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.89 2awi h LYS 29 CO 0.62 0.30 -0.10 0.66 -2.27 0.00 0.00 179.45 178.66 2awi h SER 30 N 0.47 -0.31 -0.78 4.20 4.64 -2.03 -2.38 113.55 117.36 2awi h SER 30 Ca 0.15 0.06 -0.04 0.00 -0.47 0.00 0.00 61.79 61.48 2awi h SER 30 Cb -0.02 0.15 -0.04 0.00 -0.31 0.00 0.00 62.40 62.18 2awi h SER 30 CO -0.06 -0.14 0.34 0.58 -0.87 0.00 0.00 176.83 176.68 2awi h VAL 31 N -0.15 1.25 -0.42 0.95 2.07 -1.98 -2.57 116.25 115.40 2awi h VAL 31 Ca 0.06 -0.76 -0.02 0.00 0.82 0.00 0.00 66.70 66.80 2awi h VAL 31 Cb 0.23 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 2awi h VAL 31 CO -0.15 0.32 0.18 0.22 0.02 0.00 0.00 177.57 178.15 2awi h TYR 32 N 1.13 0.59 -0.80 1.57 5.03 -1.06 -1.77 116.97 121.67 2awi h TYR 32 Ca 0.27 -0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.51 2awi h TYR 32 Cb 0.17 -0.19 -0.04 0.00 1.55 0.00 0.00 36.73 38.23 2awi h TYR 32 CO 0.02 0.46 0.33 0.82 -1.32 0.00 0.00 178.16 178.47 2awi h ILE 33 N 0.60 1.26 -0.38 1.81 2.04 -1.02 -1.81 117.51 120.01 2awi h ILE 33 Ca 0.15 -0.80 -0.08 0.00 1.00 0.00 0.00 64.86 65.13 2awi h ILE 33 Cb 0.11 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.47 2awi h ILE 33 CO -0.02 0.33 -0.09 0.11 0.00 0.00 0.00 178.15 178.49 2awi h LYS 34 N 1.16 0.64 -0.46 2.37 1.57 -1.22 -2.21 116.57 118.41 2awi h LYS 34 Ca 0.27 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 2awi h LYS 34 Cb 0.20 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 2awi h LYS 34 CO -0.02 0.73 0.23 0.28 -0.57 0.00 0.00 179.45 180.09 2awi h VAL 35 N 0.59 1.18 0.00 0.50 2.07 -0.62 -0.52 116.25 119.45 2awi h VAL 35 Ca 0.11 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 67.13 2awi h VAL 35 Cb 0.51 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2awi h VAL 35 CO 0.03 0.20 0.00 -0.33 0.02 0.00 0.00 177.57 177.48 2awi h GLU 36 N 0.60 0.00 -0.01 1.57 5.08 -1.13 -1.90 114.58 118.80 2awi h GLU 36 Ca 0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2awi h GLU 36 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 2awi h GLU 36 CO -0.02 0.00 -0.15 0.00 -1.00 0.00 0.00 179.01 177.84 2awi n ALA 37 N -2.01 2.85 -2.89 3.43 0.00 -0.85 -3.53 120.51 117.51 2awi n ALA 37 Ca 0.02 -0.35 -0.16 0.00 0.00 0.00 0.00 53.44 52.95 2awi n ALA 37 Cb 0.35 -1.24 0.03 0.00 0.00 0.00 0.00 19.45 18.60 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 -0.65 -4.88 -0.17 0.00 9.92 -0.71 -4.91 116.55 115.14 2awi n ASP 38 Ca 0.15 -0.24 0.09 0.00 -0.53 0.00 0.00 54.79 54.26 2awi n ASP 38 Cb 0.31 -3.69 0.14 0.00 -0.64 0.00 0.00 41.12 37.23 2awi n ASP 38 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 2awi n SER 39 N -1.36 2.11 -3.58 -2.24 3.41 -0.26 -4.95 113.62 106.73 2awi n SER 39 Ca -0.07 -3.09 -0.04 0.00 -0.26 0.00 0.00 58.87 55.42 2awi n SER 39 Cb 0.58 -0.42 -0.06 0.00 -0.26 0.00 0.00 64.21 64.05 2awi n SER 39 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2awi s ARG 40 N -2.70 0.48 0.41 4.33 3.00 -1.22 -4.88 118.95 118.37 2awi s ARG 40 Ca 0.30 1.21 -0.25 0.00 -1.00 0.00 0.00 55.73 56.00 2awi s ARG 40 Cb 0.27 0.58 -0.10 0.00 0.00 0.00 0.00 34.95 35.70 2awi s ARG 40 CO 0.02 -0.29 1.15 -2.30 0.00 0.00 0.00 175.30 173.88 2awi n PRO 41 N 5.42 1.66 -4.57 5.12 -0.02 -1.26 -4.54 135.00 136.82 2awi n PRO 41 Ca -0.09 0.59 -0.34 0.00 -2.02 0.00 0.00 63.50 61.64 2awi n PRO 41 Cb 0.49 -2.20 -0.12 0.00 -0.02 0.00 0.00 33.50 31.65 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 -1.21 3.70 0.59 4.25 2.07 -1.26 -5.03 121.20 124.31 2awi s ILE 42 Ca 0.61 -0.46 -0.14 0.00 -1.41 0.00 0.00 60.65 59.26 2awi s ILE 42 Cb -0.54 -2.55 -0.04 0.00 0.13 0.00 0.00 42.46 39.45 2awi s ILE 42 CO 0.58 0.56 1.02 -0.94 -1.91 0.00 0.00 174.94 174.25 2awi s SER 43 N -0.28 6.16 0.21 4.50 1.04 -1.26 -4.90 113.70 119.17 2awi s SER 43 Ca 0.04 1.56 -0.10 0.00 0.48 0.00 0.00 55.95 57.93 2awi s SER 43 Cb -0.13 -2.50 0.18 0.00 0.10 0.00 0.00 66.02 63.68 2awi s SER 43 CO 0.02 -0.91 1.87 0.58 0.98 0.00 0.00 173.24 175.78 2awi h VAL 44 N 0.15 1.14 -0.53 5.02 2.07 -1.99 -1.28 116.25 120.83 2awi h VAL 44 Ca -0.45 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 66.71 2awi h VAL 44 Cb 1.20 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 2awi h VAL 44 CO 0.60 0.17 0.21 -0.08 0.02 0.00 0.00 177.57 178.49 2awi h GLU 45 N 0.95 0.79 -0.27 1.57 4.81 -1.99 -0.73 114.58 119.71 2awi h GLU 45 Ca 0.29 -0.15 0.01 0.00 -0.13 0.00 0.00 59.36 59.38 2awi h GLU 45 Cb -0.04 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.19 2awi h GLU 45 CO -0.09 0.70 0.16 0.93 -0.73 0.00 0.00 179.01 179.98 2awi h GLU 46 N 0.71 0.33 -0.88 1.92 5.08 -1.83 0.63 114.58 120.54 2awi h GLU 46 Ca 0.18 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 2awi h GLU 46 Cb 0.20 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 2awi h GLU 46 CO -0.01 0.22 0.46 1.25 -1.00 0.00 0.00 179.01 179.92 2awi h LEU 47 N 0.34 1.12 -0.99 1.33 5.85 -1.07 0.15 115.31 122.02 2awi h LEU 47 Ca 0.10 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 2awi h LEU 47 Cb -0.01 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 40.70 2awi h LEU 47 CO -0.04 0.91 0.23 -1.28 -0.34 0.00 0.00 178.44 177.92 2awi h SER 48 N 1.24 0.88 -0.13 1.25 0.87 -0.57 0.23 113.55 117.32 2awi h SER 48 Ca 0.31 -0.13 -0.03 0.00 -1.23 0.00 0.00 61.79 60.70 2awi h SER 48 Cb 0.06 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 61.79 2awi h SER 48 CO -0.05 0.81 -0.05 0.11 -0.53 0.00 0.00 176.83 177.12 2awi h LYS 49 N 0.93 0.27 -0.70 2.24 1.57 0.13 -1.83 116.57 119.18 2awi h LYS 49 Ca 0.21 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.85 2awi h LYS 49 Cb 0.22 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 2awi h LYS 49 CO -0.01 0.59 0.30 0.74 -0.57 0.00 0.00 179.45 180.50 2awi h PHE 50 N -0.06 1.01 -0.56 -1.35 0.04 -0.50 -1.69 116.94 113.84 2awi h PHE 50 Ca 0.03 -0.05 0.05 0.00 2.80 0.00 0.00 57.97 60.80 2awi h PHE 50 Cb 0.50 -0.31 -0.05 0.00 2.20 0.00 0.00 35.95 38.29 2awi h PHE 50 CO 0.06 0.76 0.28 1.03 -0.60 0.00 0.00 178.31 179.84 2awi h SER 51 N 0.99 0.39 -0.05 2.17 0.87 -0.40 0.10 113.55 117.63 2awi h SER 51 Ca 0.24 0.04 -0.09 0.00 -1.23 0.00 0.00 61.79 60.74 2awi h SER 51 Cb 0.15 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 2awi h SER 51 CO -0.03 0.26 -0.24 -0.08 -0.53 0.00 0.00 176.83 176.22 2awi h GLU 52 N 0.53 0.46 -0.12 2.24 4.81 -0.79 -0.96 114.58 120.75 2awi h GLU 52 Ca 0.25 -0.17 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 2awi h GLU 52 Cb 0.18 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 2awi h GLU 52 CO -0.18 0.67 0.03 0.00 -0.73 0.00 0.00 179.01 178.80 2awi h ARG 53 N 0.41 0.19 0.00 1.92 2.47 -0.35 -2.93 114.38 116.10 2awi h ARG 53 Ca 0.06 -0.04 -0.04 0.00 -1.26 0.00 0.00 59.98 58.70 2awi h ARG 53 Cb 0.64 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.93 2awi h ARG 53 CO 0.05 0.35 -0.19 -0.07 0.56 0.00 0.00 179.97 180.66 2awi h LEU 54 N 0.00 0.00 0.01 3.04 3.38 -0.68 -3.47 115.31 117.59 2awi h LEU 54 Ca 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2awi h LEU 54 Cb 0.24 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 2awi h LEU 54 CO -0.00 0.19 -0.00 0.61 0.09 0.00 0.00 178.44 179.33 2awi n GLY 55 N -0.04 0.46 3.48 0.83 0.00 -0.38 -5.02 105.19 104.52 2awi n GLY 55 Ca -0.00 -0.36 -0.34 0.00 0.00 0.00 0.00 46.02 45.32 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 -1.99 3.82 0.02 1.61 1.01 -1.14 -5.04 120.40 118.68 2awi s VAL 56 Ca 0.00 -0.38 -0.38 0.00 0.00 0.00 0.00 61.98 61.22 2awi s VAL 56 Cb 0.00 -2.67 -0.17 0.00 0.00 0.00 0.00 36.38 33.54 2awi s VAL 56 CO 0.00 0.49 1.38 0.59 0.00 0.00 0.00 175.10 177.56 2awi n ASN 57 N 3.61 1.61 -0.23 3.32 3.02 -1.26 -4.65 115.26 120.68 2awi n ASN 57 Ca -0.17 1.12 0.03 0.00 -0.03 0.00 0.00 54.58 55.52 2awi n ASN 57 Cb 0.52 -1.16 0.13 0.00 -0.61 0.00 0.00 39.78 38.67 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 4.82 -0.06 -0.56 3.10 3.57 -1.95 -1.48 116.94 124.38 2awi h PHE 58 Ca -0.48 0.05 -0.08 0.00 3.53 0.00 0.00 57.97 60.99 2awi h PHE 58 Cb 1.34 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 40.20 2awi h PHE 58 CO 0.62 -0.21 0.03 0.74 -2.23 0.00 0.00 178.31 177.26 2awi h PHE 59 N 0.10 1.00 -0.94 0.41 0.05 -2.00 -2.14 116.94 113.44 2awi h PHE 59 Ca 0.37 -0.15 -0.00 0.00 3.82 0.00 0.00 57.97 62.01 2awi h PHE 59 Cb 0.63 -0.27 -0.05 0.00 2.00 0.00 0.00 35.95 38.26 2awi h PHE 59 CO -0.41 0.89 0.57 1.49 -0.18 0.00 0.00 178.31 180.67 2awi h GLU 60 N 0.87 1.27 -0.05 1.51 4.81 -1.66 0.18 114.58 121.52 2awi h GLU 60 Ca 0.17 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 2awi h GLU 60 Cb 0.47 -0.27 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 2awi h GLU 60 CO 0.02 0.88 0.01 0.82 -0.73 0.00 0.00 179.01 180.01 2awi h ILE 61 N 1.29 1.20 -0.32 2.32 2.04 -1.10 0.12 117.51 123.06 2awi h ILE 61 Ca 0.34 -0.61 0.07 0.00 1.00 0.00 0.00 64.86 65.65 2awi h ILE 61 Cb -0.07 1.52 -0.06 0.00 -0.74 0.00 0.00 36.82 37.47 2awi h ILE 61 CO -0.06 0.17 -0.09 -0.07 0.00 0.00 0.00 178.15 178.09 2awi h LEU 62 N -0.16 -0.34 -0.17 1.44 3.38 -0.96 0.52 115.31 119.02 2awi h LEU 62 Ca 0.01 0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.10 2awi h LEU 62 Cb 0.26 0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 2awi h LEU 62 CO 0.00 -0.12 0.07 0.78 0.09 0.00 0.00 178.44 179.26 2awi h ASN 63 N -0.02 0.08 -0.28 -0.43 2.35 -0.79 -1.33 115.58 115.17 2awi h ASN 63 Ca 0.16 0.01 0.08 0.00 -0.55 0.00 0.00 56.30 56.00 2awi h ASN 63 Cb 0.26 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 2awi h ASN 63 CO -0.34 0.07 0.20 0.03 -1.65 0.00 0.00 177.43 175.74 2awi h ARG 64 N 0.15 0.00 0.00 0.81 3.08 0.01 0.19 114.38 118.62 2awi h ARG 64 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 2awi h ARG 64 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2awi h ARG 64 CO -0.07 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.83 2awi n ALA 65 N -2.58 2.16 0.00 0.04 0.00 0.10 -4.99 120.51 115.24 2awi n ALA 65 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2awi n ALA 65 Cb 0.36 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.45 2awi n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2awi n GLY 66 N 0.63 1.17 3.86 0.00 0.00 0.67 -2.97 105.19 108.56 2awi n GLY 66 Ca 0.11 -0.62 -0.37 0.00 0.00 0.00 0.00 46.02 45.14 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 -4.38 0.00 1.61 2.04 -1.26 -4.73 115.26 108.55 2awi n ASN 68 Ca 0.00 -1.13 0.00 0.00 -0.44 0.00 0.00 54.58 53.01 2awi n ASN 68 Cb 0.00 -2.69 0.00 0.00 -2.53 0.00 0.00 39.78 34.56 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 -2.51 0.00 -0.02 0.53 2.88 -1.24 -5.21 113.62 108.05 2awi n SER 71 Ca -0.12 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.36 2awi n SER 71 Cb 0.59 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.03 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 0.62 -1.86 2.46 3.14 -1.26 -4.83 118.33 116.61 2awi n VAL 72 Ca 0.00 0.02 -0.16 0.00 -2.96 0.00 0.00 64.34 61.24 2awi n VAL 72 Cb 0.00 -1.64 0.11 0.00 -1.06 0.00 0.00 33.84 31.24 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 -3.42 0.31 -0.36 6.55 0.23 -1.26 -4.84 115.26 112.47 2awi n ASN 73 Ca -0.11 -1.42 0.02 0.00 -0.53 0.00 0.00 54.58 52.54 2awi n ASN 73 Cb 0.47 -0.54 0.18 0.00 -2.08 0.00 0.00 39.78 37.81 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 1.14 -0.12 -3.83 4.57 -1.99 -1.71 114.58 112.64 2awi h GLU 74 Ca -0.24 -0.07 -0.12 0.00 -1.18 0.00 0.00 59.36 57.75 2awi h GLU 74 Cb 0.72 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 29.04 2awi h GLU 74 CO 0.19 0.76 -0.44 1.15 -1.18 0.00 0.00 179.01 179.49 2awi h THR 75 N 1.18 1.32 -0.21 0.32 2.02 -1.99 -2.08 112.91 113.47 2awi h THR 75 Ca 0.42 -1.61 -0.14 0.00 0.77 0.00 0.00 66.41 65.85 2awi h THR 75 Cb 0.15 1.72 0.00 0.00 -1.74 0.00 0.00 68.15 68.28 2awi h THR 75 CO -0.16 0.48 -0.43 1.23 0.37 0.00 0.00 175.52 177.01 2awi h GLY 76 N 1.24 0.72 0.50 2.16 0.00 -1.80 -1.44 103.07 104.45 2awi h GLY 76 Ca 0.02 -0.86 0.06 0.00 0.00 0.00 0.00 47.33 46.54 2awi h GLY 76 CO 0.07 0.77 0.02 0.50 0.00 0.00 0.00 176.54 177.90 2awi h LYS 77 N 0.35 0.11 0.33 4.80 1.57 -1.19 -0.21 116.57 122.33 2awi h LYS 77 Ca 0.00 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2awi h LYS 77 Cb 1.04 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.32 2awi h LYS 77 CO 0.10 0.08 -0.16 0.93 -0.57 0.00 0.00 179.45 179.82 2awi h GLU 78 N 0.12 -0.42 -0.04 3.15 4.39 -1.33 0.16 114.58 120.61 2awi h GLU 78 Ca 0.16 0.03 0.01 0.00 0.34 0.00 0.00 59.36 59.90 2awi h GLU 78 Cb 0.21 0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2awi h GLU 78 CO -0.26 -0.24 0.04 -0.22 -1.16 0.00 0.00 179.01 177.17 2awi h LYS 79 N -0.51 0.00 -0.04 2.33 3.64 -1.06 -0.87 116.57 120.05 2awi h LYS 79 Ca -0.05 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.15 2awi h LYS 79 Cb 0.39 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.22 2awi h LYS 79 CO 0.07 0.00 -0.69 1.25 -2.27 0.00 0.00 179.45 177.81 2awi h LEU 80 N 0.00 0.68 -1.97 5.20 7.12 -0.65 -3.22 115.31 122.46 2awi h LEU 80 Ca 0.02 -0.71 0.17 0.00 0.13 0.00 0.00 57.88 57.49 2awi h LEU 80 Cb 0.09 -0.21 -0.02 0.00 -0.53 0.00 0.00 40.66 39.99 2awi h LEU 80 CO -0.00 1.30 0.51 0.25 -0.13 0.00 0.00 178.44 180.37 2awi h LEU 81 N 0.13 0.00 -0.68 2.25 5.85 0.51 -2.41 115.31 120.95 2awi h LEU 81 Ca -0.07 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.71 2awi h LEU 81 Cb 1.36 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.34 2awi h LEU 81 CO 0.14 0.00 0.38 0.40 -0.34 0.00 0.00 178.44 179.01 2awi h ILE 82 N 0.00 0.96 -0.55 4.05 2.04 -1.54 -1.81 117.51 120.67 2awi h ILE 82 Ca 0.28 -0.24 0.01 0.00 1.00 0.00 0.00 64.86 65.91 2awi h ILE 82 Cb 1.30 0.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.56 2awi h ILE 82 CO -0.00 0.13 0.36 0.77 0.00 0.00 0.00 178.15 179.40 2awi h SER 83 N 0.69 0.61 -0.37 1.72 4.64 -1.64 -1.09 113.55 118.11 2awi h SER 83 Ca 0.31 -0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.59 2awi h SER 83 Cb 0.21 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.13 2awi h SER 83 CO -0.19 0.44 0.13 0.11 -0.87 0.00 0.00 176.83 176.45 2awi h LYS 84 N 0.73 0.56 0.00 4.77 1.57 -1.60 -2.62 116.57 119.98 2awi h LYS 84 Ca 0.20 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 2awi h LYS 84 Cb -0.07 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.15 2awi h LYS 84 CO -0.05 0.56 -0.15 0.82 -0.57 0.00 0.00 179.45 180.06 2awi h ILE 85 N 0.45 0.56 -0.51 1.86 2.04 -1.07 -1.83 117.51 119.00 2awi h ILE 85 Ca 0.12 -0.68 -0.12 0.00 1.00 0.00 0.00 64.86 65.19 2awi h ILE 85 Cb 0.22 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 2awi h ILE 85 CO -0.01 0.14 -0.13 0.15 0.00 0.00 0.00 178.15 178.30 2awi h PHE 86 N 0.00 1.12 0.02 1.37 3.57 -0.81 -2.60 116.94 119.61 2awi h PHE 86 Ca -0.00 -0.24 -0.25 0.00 3.53 0.00 0.00 57.97 61.01 2awi h PHE 86 Cb 0.44 -0.27 0.01 0.00 2.79 0.00 0.00 35.95 38.91 2awi h PHE 86 CO 0.00 1.06 -1.02 1.79 -2.23 0.00 0.00 178.31 177.91 2awi h THR 87 N 0.86 1.37 -3.06 4.41 1.35 -1.38 -3.39 112.91 113.07 2awi h THR 87 Ca 0.13 -2.44 -0.62 0.00 -0.55 0.00 0.00 66.41 62.93 2awi h THR 87 Cb 0.70 2.47 -0.42 0.00 -1.73 0.00 0.00 68.15 69.18 2awi h THR 87 CO 0.05 0.73 -0.60 0.21 -0.25 0.00 0.00 175.52 175.67 2awi s ASN 88 N -7.17 4.58 0.00 5.36 2.47 -0.72 -4.96 114.94 114.50 2awi s ASN 88 Ca -0.07 -3.74 0.00 0.00 0.42 0.00 0.00 52.86 49.47 2awi s ASN 88 Cb 0.08 -1.56 0.00 0.00 -1.45 0.00 0.00 41.25 38.32 2awi s ASN 88 CO 0.89 -0.10 0.67 -0.81 -3.72 0.00 0.00 177.10 174.03 2awi n PRO 89 N 2.11 0.00 0.26 0.43 -0.04 -0.99 -2.02 135.00 134.75 2awi n PRO 89 Ca 0.19 0.18 0.15 0.00 -0.04 0.00 0.00 63.50 63.98 2awi n PRO 89 Cb 0.36 -1.51 0.56 0.00 -0.04 0.00 0.00 33.50 32.86 2awi n PRO 89 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2awi h ASP 90 N 0.00 0.00 1.19 3.54 1.82 -1.93 -2.67 116.42 118.37 2awi h ASP 90 Ca 0.00 0.00 -0.17 0.00 -0.39 0.00 0.00 57.03 56.47 2awi h ASP 90 Cb 0.02 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.00 2awi h ASP 90 CO 0.00 0.05 -0.79 -0.07 -1.61 0.00 0.00 179.24 176.82 2awi h LEU 91 N 0.00 0.00 0.00 2.28 3.38 -1.73 -3.40 115.31 115.85 2awi h LEU 91 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2awi h LEU 91 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2awi h LEU 91 CO 0.01 0.79 0.00 0.33 0.09 0.00 0.00 178.44 179.65 2awi n PHE 92 N -3.31 0.00 -0.06 1.13 7.35 -1.01 -2.62 117.46 118.95 2awi n PHE 92 Ca 0.01 0.00 -0.01 0.00 -0.76 0.00 0.00 57.45 56.68 2awi n PHE 92 Cb 0.85 -0.03 -0.01 0.00 0.35 0.00 0.00 39.48 40.63 2awi n PHE 92 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 2awi n ASP 93 N -1.07 -0.14 -0.11 -2.13 -0.08 -1.26 0.28 116.55 112.04 2awi n ASP 93 Ca 0.00 0.49 0.01 0.00 -1.51 0.00 0.00 54.79 53.78 2awi n ASP 93 Cb 0.00 -0.16 0.31 0.00 2.34 0.00 0.00 41.12 43.61 2awi n ASP 93 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 2awi h LYS 94 N 0.00 0.76 0.13 -0.67 3.64 -1.82 -1.79 116.57 116.82 2awi h LYS 94 Ca 0.02 -0.07 -0.29 0.00 -1.27 0.00 0.00 60.65 59.05 2awi h LYS 94 Cb 0.05 -0.16 0.02 0.00 -0.41 0.00 0.00 32.23 31.73 2awi h LYS 94 CO -0.13 0.54 -1.24 -0.91 -2.27 0.00 0.00 179.45 175.45 2awi h ASN 95 N 0.77 0.68 0.19 4.20 -0.26 -0.66 -3.20 115.58 117.30 2awi h ASN 95 Ca 0.20 -0.66 -0.02 0.00 -0.56 0.00 0.00 56.30 55.26 2awi h ASN 95 Cb -0.01 -0.22 -0.00 0.00 -1.06 0.00 0.00 38.32 37.03 2awi h ASN 95 CO -0.04 1.49 -0.11 0.15 -1.06 0.00 0.00 177.43 177.86 2awi h PHE 96 N 0.19 0.00 0.00 1.19 3.57 0.18 -0.30 116.94 121.76 2awi h PHE 96 Ca -0.17 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.33 2awi h PHE 96 Cb 1.92 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.66 2awi h PHE 96 CO 0.09 0.11 0.00 1.04 -2.23 0.00 0.00 178.31 177.33 2awi n GLN 97 N -4.03 0.20 -0.08 1.11 6.02 -0.71 -1.22 117.38 118.67 2awi n GLN 97 Ca -0.02 0.30 -0.20 0.00 -0.01 0.00 0.00 57.00 57.07 2awi n GLN 97 Cb 0.20 -1.80 -0.13 0.00 1.02 0.00 0.00 30.24 29.53 2awi n GLN 97 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 2awi n ARG 98 N -2.16 0.69 -0.02 -1.09 0.63 -0.22 -4.52 116.66 109.96 2awi n ARG 98 Ca 0.04 0.20 -0.13 0.00 -0.92 0.00 0.00 57.85 57.04 2awi n ARG 98 Cb 0.32 -1.59 -0.10 0.00 0.45 0.00 0.00 32.46 31.53 2awi n ARG 98 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 2awi h ILE 99 N -0.02 1.41 -0.99 5.15 1.08 -1.26 -3.32 117.51 119.56 2awi h ILE 99 Ca -0.52 -1.53 0.18 0.00 -0.39 0.00 0.00 64.86 62.60 2awi h ILE 99 Cb 1.93 2.41 -0.18 0.00 -3.07 0.00 0.00 36.82 37.92 2awi h ILE 99 CO -0.04 0.38 -0.30 -0.08 -0.69 0.00 0.00 178.15 177.42 2awi h GLU 100 N -0.72 -0.00 -0.01 2.37 4.22 -1.41 0.40 114.58 119.43 2awi h GLU 100 Ca -0.00 0.00 -0.05 0.00 0.08 0.00 0.00 59.36 59.39 2awi h GLU 100 Cb 0.65 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 2awi h GLU 100 CO 0.01 -0.00 -0.23 -1.35 -2.18 0.00 0.00 179.01 175.25 2awi h PRO 101 N -0.00 0.01 -0.43 0.92 0.11 -1.80 -2.82 132.00 127.99 2awi h PRO 101 Ca 0.42 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.53 2awi h PRO 101 Cb 0.67 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.78 2awi h PRO 101 CO -1.01 0.24 0.00 1.63 -0.21 0.00 0.00 178.00 178.65 2awi n LYS 102 N -4.26 2.25 0.14 1.05 5.02 0.13 -4.56 118.16 117.92 2awi n LYS 102 Ca -0.02 -1.92 0.08 0.00 -2.02 0.00 0.00 58.31 54.43 2awi n LYS 102 Cb 0.29 -1.45 0.44 0.00 -0.02 0.00 0.00 35.03 34.29 2awi n LYS 102 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 2awi n ARG 103 N 1.09 0.11 -0.03 1.97 1.85 -0.39 -1.58 116.66 119.68 2awi n ARG 103 Ca 0.18 0.59 0.03 0.00 -1.00 0.00 0.00 57.85 57.66 2awi n ARG 103 Cb 0.49 -1.92 0.04 0.00 -1.05 0.00 0.00 32.46 30.02 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 1.79 -0.34 2.89 4.77 -1.26 -2.45 117.00 120.32 2awi n LEU 104 Ca -0.01 -1.26 0.09 0.00 -0.03 0.00 0.00 56.01 54.80 2awi n LEU 104 Cb 0.10 -0.03 0.26 0.00 -2.33 0.00 0.00 43.42 41.42 2awi n LEU 104 CO 0.07 0.40 1.19 0.74 -1.33 0.00 0.00 177.39 178.46 2awi h THR 105 N 1.24 0.80 -2.84 -5.08 2.02 -1.62 -3.45 112.91 103.98 2awi h THR 105 Ca 0.00 -0.28 0.05 0.00 0.77 0.00 0.00 66.41 66.95 2awi h THR 105 Cb 0.36 -0.09 -0.09 0.00 -1.74 0.00 0.00 68.15 66.58 2awi h THR 105 CO 0.00 0.15 0.28 -0.94 0.37 0.00 0.00 175.52 175.38 2awi s SER 106 N -5.53 -0.39 0.45 4.18 1.04 -1.26 -5.02 113.70 107.17 2awi s SER 106 Ca -0.12 -0.26 0.11 0.00 0.48 0.00 0.00 55.95 56.16 2awi s SER 106 Cb 0.23 0.61 1.02 0.00 0.10 0.00 0.00 66.02 67.98 2awi s SER 106 CO 0.80 -1.06 2.07 -0.07 0.98 0.00 0.00 173.24 175.96 2awi h LEU 107 N 2.00 0.31 0.49 2.42 3.38 -1.90 -0.93 115.31 121.07 2awi h LEU 107 Ca -0.26 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 2awi h LEU 107 Cb 1.27 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2awi h LEU 107 CO 0.30 0.22 -0.23 1.56 0.09 0.00 0.00 178.44 180.38 2awi h GLN 108 N 0.36 -0.63 -0.64 1.13 1.08 -1.94 -1.07 115.11 113.40 2awi h GLN 108 Ca 0.14 0.04 0.10 0.00 -1.45 0.00 0.00 58.65 57.48 2awi h GLN 108 Cb 0.11 0.14 -0.04 0.00 -0.05 0.00 0.00 27.48 27.65 2awi h GLN 108 CO -0.03 -0.34 0.42 1.88 -0.95 0.00 0.00 178.83 179.81 2awi h TYR 109 N -0.83 0.50 -0.32 2.96 0.05 -1.73 0.78 116.97 118.37 2awi h TYR 109 Ca -0.07 0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.70 2awi h TYR 109 Cb 0.57 -0.16 -0.01 0.00 1.01 0.00 0.00 36.73 38.14 2awi h TYR 109 CO -0.01 0.24 0.08 0.35 -1.05 0.00 0.00 178.16 177.77 2awi h PHE 110 N 0.47 0.53 -0.90 4.88 3.57 -0.85 0.13 116.94 124.77 2awi h PHE 110 Ca 0.29 -0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.78 2awi h PHE 110 Cb 0.53 -0.15 -0.06 0.00 2.79 0.00 0.00 35.95 39.06 2awi h PHE 110 CO -0.00 0.55 0.57 1.03 -2.23 0.00 0.00 178.31 178.23 2awi h SER 111 N 0.35 0.93 -0.41 0.41 0.87 0.39 -0.99 113.55 115.10 2awi h SER 111 Ca 0.10 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.61 2awi h SER 111 Cb 0.29 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 2awi h SER 111 CO 0.00 0.61 0.06 0.40 -0.53 0.00 0.00 176.83 177.38 2awi h ILE 112 N 1.07 1.24 -0.33 2.23 2.04 -0.58 -2.67 117.51 120.52 2awi h ILE 112 Ca 0.38 -0.88 0.07 0.00 1.00 0.00 0.00 64.86 65.43 2awi h ILE 112 Cb 0.09 1.02 -0.07 0.00 -0.74 0.00 0.00 36.82 37.12 2awi h ILE 112 CO -0.15 0.30 -0.17 0.22 0.00 0.00 0.00 178.15 178.35 2awi h TYR 113 N 0.53 -0.43 0.00 1.37 3.20 0.27 0.42 116.97 122.33 2awi h TYR 113 Ca 0.12 0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.03 2awi h TYR 113 Cb 0.38 0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.89 2awi h TYR 113 CO 0.03 -0.25 0.00 -0.07 -1.64 0.00 0.00 178.16 176.23 2awi h LEU 114 N -0.13 0.00 -0.66 2.82 3.38 -1.11 0.29 115.31 119.90 2awi h LEU 114 Ca 0.17 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.01 2awi h LEU 114 Cb 0.38 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2awi h LEU 114 CO -0.41 0.00 -0.34 1.23 0.09 0.00 0.00 178.44 179.02 2awi h GLY 115 N 0.50 0.73 1.27 0.83 0.00 0.18 -1.60 103.07 104.98 2awi h GLY 115 Ca 0.00 -0.69 -0.22 0.00 0.00 0.00 0.00 47.33 46.43 2awi h GLY 115 CO 0.00 0.62 -0.77 -0.97 0.00 0.00 0.00 176.54 175.42 2awi h TYR 116 N 0.57 0.97 -0.84 5.60 -1.99 -0.46 -2.73 116.97 118.08 2awi h TYR 116 Ca 0.06 -0.43 -0.00 0.00 2.00 0.00 0.00 58.73 60.36 2awi h TYR 116 Cb 0.85 -0.15 -0.04 0.00 2.00 0.00 0.00 36.73 39.39 2awi h TYR 116 CO 0.04 1.25 0.52 0.82 -0.00 0.00 0.00 178.16 180.79 2awi h ILE 117 N 0.49 1.23 -0.06 -2.88 1.08 -1.25 -0.76 117.51 115.35 2awi h ILE 117 Ca -0.05 -0.48 0.01 0.00 -0.39 0.00 0.00 64.86 63.95 2awi h ILE 117 Cb 1.39 0.03 -0.01 0.00 -3.07 0.00 0.00 36.82 35.17 2awi h ILE 117 CO 0.15 0.24 0.01 -1.28 -0.69 0.00 0.00 178.15 176.58 2awi h SER 118 N 1.15 0.01 -0.22 1.72 0.87 -1.27 -0.75 113.55 115.07 2awi h SER 118 Ca 0.30 0.01 0.05 0.00 -1.23 0.00 0.00 61.79 60.92 2awi h SER 118 Cb -0.07 0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 61.86 2awi h SER 118 CO -0.06 0.02 -0.08 0.40 -0.53 0.00 0.00 176.83 176.58 2awi h ILE 119 N 0.04 0.73 -0.62 2.23 2.04 -1.10 -2.13 117.51 118.70 2awi h ILE 119 Ca 0.03 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.92 2awi h ILE 119 Cb 0.02 0.73 -0.04 0.00 -0.74 0.00 0.00 36.82 36.79 2awi h ILE 119 CO -0.04 0.00 0.38 0.00 0.00 0.00 0.00 178.15 178.49 2awi h ALA 120 N 1.17 0.81 0.00 1.87 0.00 -0.89 -0.91 119.26 121.31 2awi h ALA 120 Ca 0.11 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2awi h ALA 120 Cb 0.20 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2awi h ALA 120 CO -0.25 0.11 -0.00 0.45 0.00 0.00 0.00 179.25 179.56 2awi h HIS 121 N 0.73 0.00 0.23 0.00 3.86 -0.72 0.50 115.15 119.74 2awi h HIS 121 Ca 0.25 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.45 2awi h HIS 121 Cb 0.04 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.52 2awi h HIS 121 CO -0.06 0.00 -0.11 1.25 0.86 0.00 0.00 177.93 179.88 2awi h HIS 122 N 0.00 -0.29 -0.15 2.45 6.17 -0.56 -3.29 115.15 119.49 2awi h HIS 122 Ca -0.00 -0.01 -0.07 0.00 0.71 0.00 0.00 60.37 61.00 2awi h HIS 122 Cb 0.01 0.09 -0.04 0.00 2.52 0.00 0.00 27.41 29.99 2awi h HIS 122 CO 0.00 -0.18 0.09 0.66 0.71 0.00 0.00 177.93 179.21 2awi n TYR 123 N -4.72 0.46 -4.33 5.26 4.01 -0.67 -4.85 117.16 112.34 2awi n TYR 123 Ca -0.04 -0.62 -0.34 0.00 -0.16 0.00 0.00 57.90 56.74 2awi n TYR 123 Cb 0.12 -0.33 -0.08 0.00 -0.31 0.00 0.00 39.34 38.74 2awi n TYR 123 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2awi n ASN 124 N 0.22 -0.36 -4.84 7.72 5.15 -0.66 -4.93 115.26 117.55 2awi n ASN 124 Ca 0.09 -1.21 -0.34 0.00 -0.60 0.00 0.00 54.58 52.51 2awi n ASN 124 Cb 0.64 -1.89 -0.06 0.00 -0.53 0.00 0.00 39.78 37.94 2awi n ASN 124 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2awi s ILE 125 N -3.92 4.75 -0.23 -1.44 1.01 0.16 -5.01 121.20 116.53 2awi s ILE 125 Ca 0.30 0.91 -0.27 0.00 0.00 0.00 0.00 60.65 61.59 2awi s ILE 125 Cb -0.17 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.58 2awi s ILE 125 CO 0.99 0.08 0.92 -1.61 0.00 0.00 0.00 174.94 175.32 2awi s GLU 126 N -2.35 4.23 -0.51 2.79 0.41 -1.26 -4.51 118.70 117.50 2awi s GLU 126 Ca 0.45 1.13 0.08 0.00 -0.41 0.00 0.00 54.97 56.22 2awi s GLU 126 Cb -0.14 -3.64 0.30 0.00 -1.78 0.00 0.00 34.13 28.87 2awi s GLU 126 CO 0.20 -0.55 0.75 1.33 -0.49 0.00 0.00 175.26 176.50 2awi n VAL 127 N 5.23 1.30 -0.16 2.63 0.24 -1.26 -4.95 118.33 121.36 2awi n VAL 127 Ca 0.08 -4.90 0.13 0.00 -2.04 0.00 0.00 64.34 57.62 2awi n VAL 127 Cb 0.47 -1.48 0.48 0.00 -1.47 0.00 0.00 33.84 31.84 2awi n VAL 127 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 2awi h PRO 128 N 3.56 0.45 -0.18 7.34 0.13 -2.03 -1.20 132.00 140.08 2awi h PRO 128 Ca 0.13 -0.03 0.03 0.00 -0.87 0.00 0.00 66.00 65.26 2awi h PRO 128 Cb 0.74 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 31.76 2awi h PRO 128 CO 0.67 0.30 0.12 1.79 -0.23 0.00 0.00 178.00 180.66 2awi h THR 129 N 0.47 0.97 0.07 1.56 1.35 -1.98 -2.92 112.91 112.43 2awi h THR 129 Ca 0.35 -0.04 -0.00 0.00 -0.55 0.00 0.00 66.41 66.17 2awi h THR 129 Cb 0.71 0.85 -0.01 0.00 -1.73 0.00 0.00 68.15 67.98 2awi h THR 129 CO -0.12 0.02 -0.09 0.15 -0.25 0.00 0.00 175.52 175.23 2awi h PHE 130 N 0.12 -0.26 -0.40 4.73 3.57 -1.64 -1.38 116.94 121.67 2awi h PHE 130 Ca 0.08 0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.70 2awi h PHE 130 Cb 0.16 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.99 2awi h PHE 130 CO -0.00 -0.12 0.30 -0.91 -2.23 0.00 0.00 178.31 175.35 2awi h ASN 131 N -0.17 0.00 1.39 0.41 -0.26 -1.70 0.23 115.58 115.49 2awi h ASN 131 Ca -0.01 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.73 2awi h ASN 131 Cb 0.15 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.41 2awi h ASN 131 CO -0.02 0.00 0.00 0.11 -1.06 0.00 0.00 177.43 176.46 2awi h LYS 132 N 0.00 0.00 0.00 0.81 6.56 -1.26 -3.37 116.57 119.30 2awi h LYS 132 Ca 0.19 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.78 2awi h LYS 132 Cb 0.78 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.44 2awi h LYS 132 CO -0.00 0.00 -0.16 0.25 -2.06 0.00 0.00 179.45 177.48 2awi n THR 133 N -2.95 0.00 0.08 -0.16 -2.24 -0.35 -4.87 114.28 103.79 2awi n THR 133 Ca 0.02 -0.21 -0.12 0.00 -2.27 0.00 0.00 64.05 61.47 2awi n THR 133 Cb 0.39 0.81 -0.05 0.00 -2.10 0.00 0.00 70.33 69.38 2awi n THR 133 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 2awi h ILE 134 N 0.00 0.36 -0.99 2.28 6.09 -0.78 0.89 117.51 125.37 2awi h ILE 134 Ca 0.00 0.00 0.11 0.00 -1.37 0.00 0.00 64.86 63.60 2awi h ILE 134 Cb 0.00 0.36 -0.08 0.00 0.47 0.00 0.00 36.82 37.57 2awi h ILE 134 CO 0.00 0.00 0.62 0.74 -3.07 0.00 0.00 178.15 176.44 2awi h THR 135 N -0.47 0.93 -0.13 2.19 2.02 -1.84 -0.75 112.91 114.85 2awi h THR 135 Ca 0.05 -0.34 -0.12 0.00 0.77 0.00 0.00 66.41 66.77 2awi h THR 135 Cb 0.53 -0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.78 2awi h THR 135 CO -0.21 0.18 -0.45 -1.28 0.37 0.00 0.00 175.52 174.13 2awi h SER 136 N 0.99 0.33 -0.06 4.18 0.87 -1.74 -2.82 113.55 115.30 2awi h SER 136 Ca 0.48 -0.15 -0.02 0.00 -1.23 0.00 0.00 61.79 60.87 2awi h SER 136 Cb 0.45 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.32 2awi h SER 136 CO -0.26 0.74 -0.06 0.44 -0.53 0.00 0.00 176.83 177.16 2awi h ASP 137 N 0.25 0.15 -0.85 6.23 3.45 0.51 -2.26 116.42 123.90 2awi h ASP 137 Ca 0.02 -0.48 0.05 0.00 0.43 0.00 0.00 57.03 57.04 2awi h ASP 137 Cb 0.89 -0.04 -0.06 0.00 -0.56 0.00 0.00 39.33 39.56 2awi h ASP 137 CO 0.07 0.61 0.54 -0.07 -1.57 0.00 0.00 179.24 178.81 2awi h LEU 138 N -0.30 0.86 -0.36 1.55 3.38 -1.19 -0.37 115.31 118.88 2awi h LEU 138 Ca 0.01 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 2awi h LEU 138 Cb 0.56 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2awi h LEU 138 CO 0.01 0.57 0.08 0.11 0.09 0.00 0.00 178.44 179.30 2awi h LYS 139 N 1.00 0.58 -0.60 1.13 1.57 -1.53 0.22 116.57 118.95 2awi h LYS 139 Ca 0.36 -0.14 0.02 0.00 -1.87 0.00 0.00 60.65 59.02 2awi h LYS 139 Cb 0.11 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 2awi h LYS 139 CO -0.15 0.63 0.40 1.25 -0.57 0.00 0.00 179.45 181.01 2awi h HIS 140 N 0.43 0.72 0.09 -1.35 2.76 -0.73 0.10 115.15 117.17 2awi h HIS 140 Ca 0.11 0.02 -0.30 0.00 -2.20 0.00 0.00 60.37 58.00 2awi h HIS 140 Cb 0.31 -0.24 -0.02 0.00 1.55 0.00 0.00 27.41 29.01 2awi h HIS 140 CO 0.02 0.43 -1.58 -0.07 -1.30 0.00 0.00 177.93 175.43 2awi h LEU 141 N 0.75 0.31 -0.75 0.26 3.38 -0.78 -3.42 115.31 115.07 2awi h LEU 141 Ca 0.23 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2awi h LEU 141 Cb 0.01 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2awi h LEU 141 CO -0.06 1.40 -0.18 -1.22 0.09 0.00 0.00 178.44 178.47 2awi n TYR 142 N -3.38 0.00 0.27 1.13 4.01 0.76 -4.66 117.16 115.29 2awi n TYR 142 Ca -0.17 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.69 2awi n TYR 142 Cb 1.04 0.00 0.77 0.00 -0.31 0.00 0.00 39.34 40.84 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 1.02 0.00 -0.01 7.72 3.45 -1.15 -3.14 116.42 124.31 2awi h ASP 143 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2awi h ASP 143 Cb 0.30 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.07 2awi h ASP 143 CO 0.00 0.05 -0.25 0.29 -1.57 0.00 0.00 179.24 177.75 2awi n LYS 144 N -4.00 2.17 -1.75 3.56 5.02 -1.26 -5.05 118.16 116.84 2awi n LYS 144 Ca -0.03 -0.57 -0.37 0.00 -2.02 0.00 0.00 58.31 55.32 2awi n LYS 144 Cb 0.14 -1.10 0.07 0.00 -0.02 0.00 0.00 35.03 34.11 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 -1.50 2.59 0.00 1.97 1.81 -1.19 -4.96 118.95 117.67 2awi s ARG 145 Ca 0.09 2.08 0.00 0.00 -1.72 0.00 0.00 55.73 56.17 2awi s ARG 145 Cb 0.09 -1.87 0.00 0.00 -0.45 0.00 0.00 34.95 32.72 2awi s ARG 145 CO 0.29 -1.57 0.00 0.25 -0.68 0.00 0.00 175.30 173.59 2awi n THR 146 N -1.84 0.00 -4.15 0.02 -2.24 -1.26 -5.08 114.28 99.73 2awi n THR 146 Ca 0.16 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.78 2awi n THR 146 Cb 0.48 -0.23 -0.14 0.00 -2.10 0.00 0.00 70.33 68.34 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 -1.21 0.46 0.21 4.28 -4.23 -1.26 -5.16 115.64 108.73 2awi s THR 147 Ca 0.00 -0.44 0.10 0.00 -1.18 0.00 0.00 61.69 60.17 2awi s THR 147 Cb 0.00 -0.43 -0.04 0.00 1.34 0.00 0.00 72.50 73.37 2awi s THR 147 CO 0.00 0.00 -0.14 -0.36 -0.54 0.00 0.00 174.62 173.58 2awi s PHE 148 N -0.43 2.50 0.46 3.99 0.40 -1.26 -5.14 117.98 118.49 2awi s PHE 148 Ca -0.01 -0.28 0.05 0.00 -0.60 0.00 0.00 56.93 56.09 2awi s PHE 148 Cb -0.04 -1.19 -0.04 0.00 0.51 0.00 0.00 43.02 42.27 2awi s PHE 148 CO -0.00 0.56 0.08 -0.06 0.70 0.00 0.00 175.22 176.50 2awi s PHE 149 N -1.92 2.21 0.21 0.36 0.40 -1.26 -5.00 117.98 112.98 2awi s PHE 149 Ca 0.26 -0.78 -0.14 0.00 -0.60 0.00 0.00 56.93 55.66 2awi s PHE 149 Cb -0.08 -1.77 0.22 0.00 0.51 0.00 0.00 43.02 41.91 2awi s PHE 149 CO 0.14 0.23 1.62 0.78 0.70 0.00 0.00 175.22 178.70 2awi h GLY 150 N 1.45 0.39 1.83 4.36 0.00 -1.99 0.15 103.07 109.27 2awi h GLY 150 Ca -0.43 0.23 0.02 0.00 0.00 0.00 0.00 47.33 47.14 2awi h GLY 150 CO 0.74 -0.23 0.07 1.19 0.00 0.00 0.00 176.54 178.30 2awi h ILE 151 N -0.02 0.53 -0.36 2.60 6.09 -1.98 -0.08 117.51 124.28 2awi h ILE 151 Ca 0.29 0.00 -0.13 0.00 -1.37 0.00 0.00 64.86 63.65 2awi h ILE 151 Cb 0.46 0.95 -0.01 0.00 0.47 0.00 0.00 36.82 38.69 2awi h ILE 151 CO -0.64 0.00 -0.28 0.44 -3.07 0.00 0.00 178.15 174.60 2awi h ASP 152 N 0.00 0.86 0.98 2.19 3.32 -1.09 0.10 116.42 122.79 2awi h ASP 152 Ca 0.03 -0.44 -0.04 0.00 0.02 0.00 0.00 57.03 56.59 2awi h ASP 152 Cb 0.16 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2awi h ASP 152 CO -0.00 1.13 -0.19 0.00 -1.72 0.00 0.00 179.24 178.45 2awi h GLU 154 N 0.00 0.32 -0.32 0.00 4.81 -0.88 -2.64 114.58 115.87 2awi h GLU 154 Ca -0.00 -0.27 0.04 0.00 -0.13 0.00 0.00 59.36 59.00 2awi h GLU 154 Cb 0.73 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.13 2awi h GLU 154 CO 0.02 0.93 0.08 0.82 -0.73 0.00 0.00 179.01 180.13 2awi h ILE 155 N -0.20 0.87 -0.97 2.32 2.04 -0.71 -0.77 117.51 120.09 2awi h ILE 155 Ca -0.03 -0.07 0.09 0.00 1.00 0.00 0.00 64.86 65.85 2awi h ILE 155 Cb 1.00 0.65 -0.07 0.00 -0.74 0.00 0.00 36.82 37.65 2awi h ILE 155 CO 0.07 0.04 0.61 0.58 0.00 0.00 0.00 178.15 179.45 2awi h VAL 156 N 0.20 1.00 -0.53 1.67 2.07 -1.19 0.04 116.25 119.52 2awi h VAL 156 Ca 0.15 -0.36 -0.07 0.00 0.82 0.00 0.00 66.70 67.24 2awi h VAL 156 Cb 0.14 -0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 29.75 2awi h VAL 156 CO -0.18 0.19 0.07 -1.28 0.02 0.00 0.00 177.57 176.39 2awi h SER 157 N 1.05 0.86 -0.28 0.57 0.87 -0.99 -2.08 113.55 113.54 2awi h SER 157 Ca 0.45 -0.27 -0.05 0.00 -1.23 0.00 0.00 61.79 60.69 2awi h SER 157 Cb 0.31 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 2awi h SER 157 CO -0.22 0.91 0.04 0.78 -0.53 0.00 0.00 176.83 177.82 2awi h ASN 158 N 0.77 0.53 -0.36 6.23 -0.26 -0.07 -2.83 115.58 119.59 2awi h ASN 158 Ca 0.16 -0.09 -0.15 0.00 -0.56 0.00 0.00 56.30 55.65 2awi h ASN 158 Cb 0.43 -0.14 -0.01 0.00 -1.06 0.00 0.00 38.32 37.55 2awi h ASN 158 CO 0.01 0.57 -0.36 -0.07 -1.06 0.00 0.00 177.43 176.53 2awi h LEU 159 N 0.55 0.96 -0.60 1.61 3.38 -0.69 -2.48 115.31 118.06 2awi h LEU 159 Ca 0.12 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2awi h LEU 159 Cb 0.29 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2awi h LEU 159 CO 0.00 1.21 0.00 0.18 0.09 0.00 0.00 178.44 179.93 2awi n LEU 160 N -4.06 0.28 0.05 1.67 4.77 -0.81 -1.36 117.00 117.54 2awi n LEU 160 Ca -0.02 0.61 0.09 0.00 -0.03 0.00 0.00 56.01 56.66 2awi n LEU 160 Cb 0.53 -0.63 -0.07 0.00 -2.33 0.00 0.00 43.42 40.92 2awi n LEU 160 CO 0.48 -0.64 -0.29 -3.20 -1.33 0.00 0.00 177.39 172.41 2awi n ASN 161 N -1.86 0.58 -0.52 -1.43 5.15 -0.94 -4.46 115.26 111.79 2awi n ASN 161 Ca 0.00 0.23 0.04 0.00 -0.60 0.00 0.00 54.58 54.25 2awi n ASN 161 Cb 0.06 0.86 0.05 0.00 -0.53 0.00 0.00 39.78 40.22 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 -2.60 0.66 -3.78 3.44 0.24 -0.69 -4.97 118.33 110.64 2awi n VAL 162 Ca -0.04 -0.96 -0.13 0.00 -2.04 0.00 0.00 64.34 61.17 2awi n VAL 162 Cb 0.62 0.31 -0.10 0.00 -1.47 0.00 0.00 33.84 33.21 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 -1.00 0.94 0.42 1.34 2.96 -0.46 -5.06 118.68 117.82 2awi s LEU 163 Ca 0.16 0.26 -0.26 0.00 -0.22 0.00 0.00 54.13 54.06 2awi s LEU 163 Cb 0.15 1.10 -0.10 0.00 0.50 0.00 0.00 46.19 47.85 2awi s LEU 163 CO -0.02 -0.30 1.33 -2.65 -1.32 0.00 0.00 176.35 173.39 2awi n PRO 164 N 1.95 2.07 -0.29 0.98 -0.02 -1.26 -4.69 135.00 133.73 2awi n PRO 164 Ca -0.18 0.74 0.09 0.00 -2.02 0.00 0.00 63.50 62.12 2awi n PRO 164 Cb 0.57 -2.46 0.21 0.00 -0.02 0.00 0.00 33.50 31.80 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 2.22 0.01 -0.15 6.00 3.20 -1.94 -1.90 116.97 124.41 2awi h TYR 165 Ca -0.49 0.06 0.04 0.00 3.14 0.00 0.00 58.73 61.49 2awi h TYR 165 Cb 1.28 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 39.68 2awi h TYR 165 CO 0.49 -0.29 0.11 1.49 -1.64 0.00 0.00 178.16 178.32 2awi h GLU 166 N 0.10 0.01 0.00 1.82 4.57 -2.01 -0.04 114.58 119.03 2awi h GLU 166 Ca 0.49 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.66 2awi h GLU 166 Cb 0.92 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.50 2awi h GLU 166 CO -0.74 0.00 0.00 0.39 -1.18 0.00 0.00 179.01 177.49 2awi n GLU 167 N -4.50 0.08 -0.06 1.92 1.02 -0.72 -3.95 120.64 114.43 2awi n GLU 167 Ca 0.01 0.02 -0.10 0.00 -0.02 0.00 0.00 57.16 57.07 2awi n GLU 167 Cb 0.23 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.10 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 -1.46 0.71 -0.33 2.62 0.31 -0.51 -4.71 118.33 114.96 2awi n VAL 168 Ca 0.08 -0.25 0.03 0.00 -0.01 0.00 0.00 64.34 64.18 2awi n VAL 168 Cb 0.30 -1.08 0.10 0.00 -0.91 0.00 0.00 33.84 32.25 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 -0.09 -1.00 -0.01 4.52 4.64 -1.18 0.63 113.55 121.06 2awi h SER 169 Ca -0.29 0.28 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2awi h SER 169 Cb 1.40 0.61 -0.00 0.00 -0.31 0.00 0.00 62.40 64.11 2awi h SER 169 CO -0.07 -0.30 0.01 0.77 -0.87 0.00 0.00 176.83 176.37 2awi h SER 170 N -0.01 0.00 1.02 4.97 4.64 -1.85 -0.76 113.55 121.56 2awi h SER 170 Ca 0.41 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.55 2awi h SER 170 Cb 0.65 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.71 2awi h SER 170 CO -0.94 0.00 -1.04 0.40 -0.87 0.00 0.00 176.83 174.38 2awi h ILE 171 N 0.00 0.98 0.01 0.95 2.04 -0.03 -3.38 117.51 118.08 2awi h ILE 171 Ca 0.00 -2.53 -0.02 0.00 1.00 0.00 0.00 64.86 63.30 2awi h ILE 171 Cb 0.03 2.43 0.00 0.00 -0.74 0.00 0.00 36.82 38.54 2awi h ILE 171 CO -0.00 0.56 -0.09 0.40 0.00 0.00 0.00 178.15 179.02 2awi h ILE 172 N 0.00 1.65 -0.94 -0.67 2.04 -0.69 -3.37 117.51 115.53 2awi h ILE 172 Ca -0.09 -2.03 0.23 0.00 1.00 0.00 0.00 64.86 63.97 2awi h ILE 172 Cb 1.62 3.01 -0.17 0.00 -0.74 0.00 0.00 36.82 40.54 2awi h ILE 172 CO 0.08 0.54 -0.07 0.11 0.00 0.00 0.00 178.15 178.81 2awi h LYS 173 N -0.76 0.02 -2.44 2.37 1.79 -1.63 -3.25 116.57 112.67 2awi h LYS 173 Ca -0.01 -0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.43 2awi h LYS 173 Cb 0.93 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.57 2awi h LYS 173 CO 0.02 0.01 0.16 -0.35 -1.08 0.00 0.00 179.45 178.21 2awi n PRO 174 N -5.51 0.39 0.00 3.15 -0.04 -1.26 -4.60 135.00 127.13 2awi n PRO 174 Ca 0.19 -0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 2awi n PRO 174 Cb 0.62 -1.52 0.00 0.00 -0.04 0.00 0.00 33.50 32.56 2awi n PRO 174 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2awi n TYR 176 N 2.46 0.00 -1.59 0.54 4.02 -1.23 -4.94 117.16 116.42 2awi n TYR 176 Ca 0.06 0.00 -0.31 0.00 -0.01 0.00 0.00 57.90 57.65 2awi n TYR 176 Cb 0.19 0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.57 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 2.61 0.20 -0.72 0.04 -1.26 -5.14 135.00 130.72 2awi s PRO 177 Ca 0.00 0.79 -0.26 0.00 0.04 0.00 0.00 61.00 61.58 2awi s PRO 177 Cb 0.00 -1.97 -0.08 0.00 0.04 0.00 0.00 34.50 32.49 2awi s PRO 177 CO 0.00 -1.29 0.81 0.42 0.04 0.00 0.00 177.00 176.98 2awi s ILE 178 N -3.11 4.32 -0.10 0.56 -1.09 -1.26 -4.98 121.20 115.55 2awi s ILE 178 Ca 0.59 1.73 0.02 0.00 -2.23 0.00 0.00 60.65 60.77 2awi s ILE 178 Cb -0.14 -4.13 -0.07 0.00 -1.58 0.00 0.00 42.46 36.54 2awi s ILE 178 CO 0.54 0.45 -0.06 1.33 -1.23 0.00 0.00 174.94 175.97 2awi n VAL 179 N 1.38 0.57 -4.37 2.92 0.24 -1.26 -4.91 118.33 112.91 2awi n VAL 179 Ca -0.04 -0.25 -0.24 0.00 -2.04 0.00 0.00 64.34 61.77 2awi n VAL 179 Cb 0.49 -0.84 -0.13 0.00 -1.47 0.00 0.00 33.84 31.89 2awi n VAL 179 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2awi s ASP 180 N -4.74 2.42 -0.11 -1.34 -0.00 -1.26 -4.83 116.67 106.81 2awi s ASP 180 Ca -0.11 -0.63 -0.13 0.00 -0.00 0.00 0.00 52.55 51.68 2awi s ASP 180 Cb 0.03 -0.15 -0.05 0.00 -0.00 0.00 0.00 42.92 42.76 2awi s ASP 180 CO 0.26 0.07 0.30 -0.55 -0.00 0.00 0.00 175.17 175.25 2awi s SER 181 N -1.67 6.53 -0.32 0.27 0.15 -1.26 -5.01 113.70 112.38 2awi s SER 181 Ca 0.06 0.62 0.09 0.00 0.70 0.00 0.00 55.95 57.42 2awi s SER 181 Cb -0.10 -2.18 0.46 0.00 -1.71 0.00 0.00 66.02 62.49 2awi s SER 181 CO 0.03 0.20 1.15 0.49 1.20 0.00 0.00 173.24 176.32 2awi n PHE 182 N 2.88 2.65 0.00 3.44 3.72 -1.26 -5.04 117.46 123.86 2awi n PHE 182 Ca -0.14 -2.45 0.00 0.00 -0.05 0.00 0.00 57.45 54.82 2awi n PHE 182 Cb 0.52 -0.27 0.00 0.00 -0.94 0.00 0.00 39.48 38.80 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 -0.61 2.71 0.34 1.37 0.00 -1.26 -4.52 105.19 103.21 2awi n GLY 183 Ca 0.37 -1.93 -0.03 0.00 0.00 0.00 0.00 46.02 44.43 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 1.05 -0.08 1.61 1.57 -1.96 -0.12 116.57 118.64 2awi h LYS 184 Ca 0.00 -0.14 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 2awi h LYS 184 Cb 0.00 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.11 2awi h LYS 184 CO 0.00 0.80 0.05 -0.44 -0.57 0.00 0.00 179.45 179.29 2awi h ASP 185 N 1.04 0.10 -0.35 0.86 3.45 -1.99 -1.60 116.42 117.94 2awi h ASP 185 Ca 0.26 -0.06 -0.00 0.00 0.43 0.00 0.00 57.03 57.66 2awi h ASP 185 Cb 0.10 -0.03 -0.02 0.00 -0.56 0.00 0.00 39.33 38.82 2awi h ASP 185 CO -0.03 0.13 0.21 0.22 -1.57 0.00 0.00 179.24 178.20 2awi h TYR 186 N 0.06 0.46 -0.57 4.55 5.03 -1.73 -2.59 116.97 122.17 2awi h TYR 186 Ca 0.03 -0.00 0.09 0.00 2.58 0.00 0.00 58.73 61.43 2awi h TYR 186 Cb 0.05 -0.15 -0.07 0.00 1.55 0.00 0.00 36.73 38.11 2awi h TYR 186 CO -0.05 0.33 0.19 -0.44 -1.32 0.00 0.00 178.16 176.86 2awi h ASP 187 N 0.45 0.15 -0.20 -2.11 3.45 -0.80 -1.85 116.42 115.52 2awi h ASP 187 Ca 0.12 0.08 -0.00 0.00 0.43 0.00 0.00 57.03 57.66 2awi h ASP 187 Cb 0.00 0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 38.84 2awi h ASP 187 CO -0.02 0.10 0.12 0.25 -1.57 0.00 0.00 179.24 178.12 2awi h LEU 188 N 0.35 0.25 -0.67 1.55 6.46 -1.03 -2.67 115.31 119.55 2awi h LEU 188 Ca 0.29 -0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.99 2awi h LEU 188 Cb 0.37 -0.06 -0.03 0.00 -0.73 0.00 0.00 40.66 40.20 2awi h LEU 188 CO -0.31 0.24 0.44 0.74 -0.62 0.00 0.00 178.44 178.92 2awi h THR 189 N 0.24 1.18 0.00 1.05 2.02 -1.08 -0.49 112.91 115.82 2awi h THR 189 Ca 0.07 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.91 2awi h THR 189 Cb 0.04 0.20 -0.00 0.00 -1.74 0.00 0.00 68.15 66.65 2awi h THR 189 CO -0.01 0.17 -0.04 0.16 0.37 0.00 0.00 175.52 176.17 2awi h ILE 190 N 0.91 0.12 0.15 3.11 3.07 -1.28 -3.03 117.51 120.57 2awi h ILE 190 Ca 0.25 -0.60 -0.33 0.00 1.55 0.00 0.00 64.86 65.73 2awi h ILE 190 Cb -0.09 1.53 0.00 0.00 -0.27 0.00 0.00 36.82 38.00 2awi h ILE 190 CO -0.05 0.04 -1.61 1.56 -1.05 0.00 0.00 178.15 177.04 2awi h GLN 191 N 0.00 0.33 -0.85 0.16 4.20 -1.00 -3.35 115.11 114.59 2awi h GLN 191 Ca -0.00 -0.56 0.08 0.00 0.06 0.00 0.00 58.65 58.23 2awi h GLN 191 Cb 0.53 0.21 -0.07 0.00 0.30 0.00 0.00 27.48 28.45 2awi h GLN 191 CO 0.01 1.21 0.51 1.15 -0.67 0.00 0.00 178.83 181.04 2awi h THR 192 N 0.09 0.98 0.03 -0.54 2.02 -0.99 -2.02 112.91 112.48 2awi h THR 192 Ca -0.28 -0.31 0.02 0.00 0.77 0.00 0.00 66.41 66.62 2awi h THR 192 Cb 2.06 0.01 -0.04 0.00 -1.74 0.00 0.00 68.15 68.44 2awi h THR 192 CO 0.18 0.16 -0.21 0.58 0.37 0.00 0.00 175.52 176.60 2awi h VAL 193 N 0.90 0.52 -0.36 3.16 2.07 -1.69 -0.62 116.25 120.23 2awi h VAL 193 Ca 0.39 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.92 2awi h VAL 193 Cb 0.26 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 2awi h VAL 193 CO -0.21 0.00 0.22 -0.07 0.02 0.00 0.00 177.57 177.54 2awi h LEU 194 N -0.35 0.38 -0.31 2.57 3.38 -1.58 0.29 115.31 119.68 2awi h LEU 194 Ca 0.05 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2awi h LEU 194 Cb 0.41 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2awi h LEU 194 CO -0.17 0.27 0.20 0.50 0.09 0.00 0.00 178.44 179.33 2awi h LYS 195 N 0.46 0.41 -0.53 1.13 3.11 -1.11 0.35 116.57 120.39 2awi h LYS 195 Ca 0.14 -0.03 -0.12 0.00 -2.81 0.00 0.00 60.65 57.83 2awi h LYS 195 Cb -0.03 -0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 31.09 2awi h LYS 195 CO -0.05 0.29 -0.14 -0.91 -2.81 0.00 0.00 179.45 175.84 2awi h ASN 196 N 0.41 1.04 -0.51 4.20 2.35 -0.87 -1.54 115.58 120.67 2awi h ASN 196 Ca 0.11 -0.36 -0.07 0.00 -0.55 0.00 0.00 56.30 55.43 2awi h ASN 196 Cb -0.03 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.04 2awi h ASN 196 CO -0.02 1.16 0.03 0.00 -1.65 0.00 0.00 177.43 176.95 2awi h ALA 197 N 0.92 0.68 -0.12 -0.83 0.00 -0.07 -2.67 119.26 117.18 2awi h ALA 197 Ca 0.13 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 2awi h ALA 197 Cb 0.71 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2awi h ALA 197 CO 0.05 0.47 -0.36 1.25 0.00 0.00 0.00 179.25 180.66 2awi h LEU 198 N 0.75 0.25 -0.11 0.00 5.85 -0.18 -1.33 115.31 120.54 2awi h LEU 198 Ca 0.15 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 2awi h LEU 198 Cb 0.47 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 2awi h LEU 198 CO 0.02 0.60 0.03 0.74 -0.34 0.00 0.00 178.44 179.48 2awi h THR 199 N 0.21 1.19 -0.74 1.05 2.02 -1.13 -1.85 112.91 113.66 2awi h THR 199 Ca 0.02 -0.60 -0.02 0.00 0.77 0.00 0.00 66.41 66.58 2awi h THR 199 Cb 0.73 1.38 -0.03 0.00 -1.74 0.00 0.00 68.15 68.49 2awi h THR 199 CO 0.06 0.18 0.38 0.40 0.37 0.00 0.00 175.52 176.90 2awi h ILE 200 N -0.02 1.23 -0.88 3.11 2.04 -1.33 -2.97 117.51 118.70 2awi h ILE 200 Ca 0.04 -0.63 -0.02 0.00 1.00 0.00 0.00 64.86 65.25 2awi h ILE 200 Cb 0.25 0.28 -0.04 0.00 -0.74 0.00 0.00 36.82 36.57 2awi h ILE 200 CO 0.00 0.27 0.47 0.28 0.00 0.00 0.00 178.15 179.17 2awi h SER 201 N 1.04 1.10 0.00 1.72 0.02 -1.05 -2.23 113.55 114.16 2awi h SER 201 Ca 0.26 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2awi h SER 201 Cb 0.08 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.34 2awi h SER 201 CO -0.04 0.90 0.00 -0.38 -1.14 0.00 0.00 176.83 176.17 2awi n ILE 202 N -4.33 0.74 0.00 3.27 2.08 -0.71 -1.21 119.36 119.20 2awi n ILE 202 Ca 0.09 -0.10 0.00 0.00 0.56 0.00 0.00 62.75 63.30 2awi n ILE 202 Cb 0.11 -0.96 0.00 0.00 -0.75 0.00 0.00 39.64 38.04 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 1.14 0.00 -1.75 4.38 3.02 -0.84 -4.58 115.26 116.63 2awi n ASN 204 Ca 0.00 0.00 -0.06 0.00 -0.03 0.00 0.00 54.58 54.49 2awi n ASN 204 Cb 0.26 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.42 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 -1.78 -2.56 3.52 0.63 -1.11 -4.82 116.66 110.54 2awi n ARG 205 Ca 0.00 0.34 -0.42 0.00 -0.92 0.00 0.00 57.85 56.86 2awi n ARG 205 Cb 0.00 -4.65 -0.02 0.00 0.45 0.00 0.00 32.46 28.24 2awi n ARG 205 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 2awi s ASN 206 N -1.75 6.60 0.36 6.15 3.84 -0.35 -4.85 114.94 124.95 2awi s ASN 206 Ca 0.00 -1.77 0.06 0.00 0.21 0.00 0.00 52.86 51.36 2awi s ASN 206 Cb 0.00 -2.57 0.70 0.00 -0.55 0.00 0.00 41.25 38.83 2awi s ASN 206 CO 0.00 -1.41 1.92 -0.07 -2.79 0.00 0.00 177.10 174.75 2awi h LEU 207 N 12.75 0.41 -0.46 3.21 3.38 -1.88 -2.19 115.31 130.54 2awi h LEU 207 Ca 0.28 -0.07 -0.16 0.00 0.09 0.00 0.00 57.88 58.02 2awi h LEU 207 Cb 0.96 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 2awi h LEU 207 CO 1.44 0.47 -0.77 0.07 0.09 0.00 0.00 178.44 179.74 2awi h LYS 208 N 0.43 0.02 -0.18 1.13 2.10 -1.96 -2.35 116.57 115.77 2awi h LYS 208 Ca 0.10 -0.02 -0.17 0.00 -2.00 0.00 0.00 60.65 58.55 2awi h LYS 208 Cb 0.27 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.61 2awi h LYS 208 CO 0.01 0.78 -0.55 0.93 -2.00 0.00 0.00 179.45 178.62 2awi h GLU 209 N 0.01 0.69 -0.51 0.07 4.39 -1.91 -2.62 114.58 114.70 2awi h GLU 209 Ca -0.01 -0.50 0.05 0.00 0.34 0.00 0.00 59.36 59.23 2awi h GLU 209 Cb 1.36 0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 30.05 2awi h GLU 209 CO 0.10 1.12 0.26 0.00 -1.16 0.00 0.00 179.01 179.33 2awi h ALA 210 N 0.57 0.65 -0.48 3.43 0.00 -1.34 -0.98 119.26 121.12 2awi h ALA 210 Ca -0.02 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2awi h ALA 210 Cb 1.17 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 2awi h ALA 210 CO 0.12 -0.09 0.13 0.37 0.00 0.00 0.00 179.25 179.78 2awi h GLN 211 N 0.50 0.71 0.38 0.00 4.15 -1.42 -0.57 115.11 118.87 2awi h GLN 211 Ca 0.23 -0.12 -0.00 0.00 0.77 0.00 0.00 58.65 59.52 2awi h GLN 211 Cb 0.14 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.68 2awi h GLN 211 CO -0.16 0.63 -0.45 -0.92 -1.93 0.00 0.00 178.83 176.00 2awi h TYR 212 N 0.69 -1.23 -0.84 3.99 3.20 -0.80 0.15 116.97 122.13 2awi h TYR 212 Ca 0.16 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.01 2awi h TYR 212 Cb 0.23 0.49 -0.04 0.00 1.54 0.00 0.00 36.73 38.95 2awi h TYR 212 CO 0.01 -0.59 0.41 1.88 -1.64 0.00 0.00 178.16 178.23 2awi h TYR 213 N -0.86 1.20 -0.76 -3.82 0.05 -1.15 -0.31 116.97 111.32 2awi h TYR 213 Ca -0.03 -0.05 0.02 0.00 0.05 0.00 0.00 58.73 58.72 2awi h TYR 213 Cb 0.78 -0.37 -0.04 0.00 1.01 0.00 0.00 36.73 38.10 2awi h TYR 213 CO -0.26 0.86 0.50 0.82 -1.05 0.00 0.00 178.16 179.03 2awi h ILE 214 N 1.19 1.15 -0.21 -2.88 2.04 -0.87 0.58 117.51 118.51 2awi h ILE 214 Ca 0.29 -0.33 -0.09 0.00 1.00 0.00 0.00 64.86 65.72 2awi h ILE 214 Cb 0.10 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.27 2awi h ILE 214 CO -0.04 0.18 -0.23 0.78 0.00 0.00 0.00 178.15 178.84 2awi h ASN 215 N 0.97 0.56 -0.49 1.72 -0.26 -0.12 -1.68 115.58 116.28 2awi h ASN 215 Ca 0.29 -0.49 0.01 0.00 -0.56 0.00 0.00 56.30 55.56 2awi h ASN 215 Cb -0.02 -0.16 -0.03 0.00 -1.06 0.00 0.00 38.32 37.06 2awi h ASN 215 CO -0.08 0.94 0.31 1.56 -1.06 0.00 0.00 177.43 179.10 2awi h GLN 216 N 0.20 0.61 -0.22 0.81 1.08 -0.39 -0.64 115.11 116.55 2awi h GLN 216 Ca 0.03 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 2awi h GLN 216 Cb 0.79 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 28.07 2awi h GLN 216 CO 0.06 0.40 0.11 0.35 -0.95 0.00 0.00 178.83 178.80 2awi h PHE 217 N 0.63 0.32 0.00 2.96 3.57 -0.89 -2.54 116.94 120.98 2awi h PHE 217 Ca 0.18 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.64 2awi h PHE 217 Cb -0.04 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 38.60 2awi h PHE 217 CO -0.05 0.31 -0.16 0.93 -2.23 0.00 0.00 178.31 177.11 2awi h GLU 218 N 0.24 0.00 -0.09 1.11 4.39 -1.05 -1.92 114.58 117.26 2awi h GLU 218 Ca 0.08 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.66 2awi h GLU 218 Cb 0.11 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.75 2awi h GLU 218 CO -0.01 0.16 -0.48 1.25 -1.16 0.00 0.00 179.01 178.77 2awi h HIS 219 N 0.00 0.26 -0.63 4.33 2.76 -0.72 -2.81 115.15 118.34 2awi h HIS 219 Ca -0.00 -0.08 0.15 0.00 -2.20 0.00 0.00 60.37 58.24 2awi h HIS 219 Cb 0.31 -0.05 -0.03 0.00 1.55 0.00 0.00 27.41 29.18 2awi h HIS 219 CO 0.00 0.66 0.44 -0.07 -1.30 0.00 0.00 177.93 177.66 2awi h LEU 220 N 0.18 0.16 0.00 0.26 3.38 -0.99 -0.24 115.31 118.06 2awi h LEU 220 Ca 0.01 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2awi h LEU 220 Cb 0.92 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.65 2awi h LEU 220 CO 0.07 0.08 0.00 0.29 0.09 0.00 0.00 178.44 178.98 2awi n LYS 221 N -4.41 0.25 0.00 1.13 5.02 -1.06 -1.92 118.16 117.16 2awi n LYS 221 Ca 0.12 0.12 0.10 0.00 -2.02 0.00 0.00 58.31 56.63 2awi n LYS 221 Cb 0.59 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 34.03 2awi n LYS 221 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2awi n THR 222 N -1.21 0.00 -2.51 -0.18 -2.24 -0.10 -4.96 114.28 103.07 2awi n THR 222 Ca 0.07 -0.13 -0.40 0.00 -2.27 0.00 0.00 64.05 61.32 2awi n THR 222 Cb 0.09 1.10 -0.04 0.00 -2.10 0.00 0.00 70.33 69.37 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 -2.66 3.60 0.11 2.28 1.01 -0.81 -4.99 121.20 119.73 2awi s ILE 223 Ca 0.11 1.58 -0.31 0.00 0.00 0.00 0.00 60.65 62.03 2awi s ILE 223 Cb 0.16 -4.00 -0.08 0.00 0.01 0.00 0.00 42.46 38.54 2awi s ILE 223 CO 0.70 0.36 1.45 -0.75 0.00 0.00 0.00 174.94 176.70 2awi s LYS 224 N -1.27 4.28 -1.74 2.79 2.20 -1.26 -3.11 119.74 121.63 2awi s LYS 224 Ca 0.45 2.14 0.00 0.00 -0.36 0.00 0.00 55.97 58.20 2awi s LYS 224 Cb -0.31 -3.31 0.00 0.00 -1.51 0.00 0.00 37.83 32.70 2awi s LYS 224 CO 0.39 -0.52 0.00 0.09 -0.36 0.00 0.00 175.35 174.96 2awi n ASN 225 N 4.29 -5.33 -4.80 1.43 3.02 -1.26 -4.51 115.26 108.11 2awi n ASN 225 Ca 0.13 0.17 -0.35 0.00 -0.03 0.00 0.00 54.58 54.50 2awi n ASN 225 Cb 0.42 -4.42 -0.05 0.00 -0.61 0.00 0.00 39.78 35.12 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 -2.83 4.01 -0.66 2.41 1.10 -1.18 -4.92 121.20 119.14 2awi s ILE 226 Ca 0.00 1.37 -0.01 0.00 -0.51 0.00 0.00 60.65 61.50 2awi s ILE 226 Cb 0.00 -3.62 0.17 0.00 0.15 0.00 0.00 42.46 39.16 2awi s ILE 226 CO 0.00 -0.16 0.47 -0.44 -2.11 0.00 0.00 174.94 172.70 2awi s SER 227 N -1.90 5.17 0.23 4.50 0.01 -1.26 -5.07 113.70 115.37 2awi s SER 227 Ca 0.61 -3.10 -0.30 0.00 1.31 0.00 0.00 55.95 54.48 2awi s SER 227 Cb -0.16 -1.81 -0.09 0.00 0.21 0.00 0.00 66.02 64.17 2awi s SER 227 CO 0.20 -0.29 1.29 -0.63 0.41 0.00 0.00 173.24 174.21 2awi s ILE 228 N -0.42 3.14 -0.29 1.44 -1.09 -1.26 -4.68 121.20 118.03 2awi s ILE 228 Ca 0.19 0.99 -0.28 0.00 -2.23 0.00 0.00 60.65 59.32 2awi s ILE 228 Cb -0.18 -3.63 0.01 0.00 -1.58 0.00 0.00 42.46 37.08 2awi s ILE 228 CO -0.05 0.17 1.00 0.21 -1.23 0.00 0.00 174.94 175.04 2awi s ASN 229 N 0.05 6.91 0.27 3.58 3.84 -1.26 -4.94 114.94 123.40 2awi s ASN 229 Ca 0.54 1.05 -0.01 0.00 0.21 0.00 0.00 52.86 54.65 2awi s ASN 229 Cb -0.37 -2.51 0.50 0.00 -0.55 0.00 0.00 41.25 38.32 2awi s ASN 229 CO 0.41 -0.77 1.81 1.23 -2.79 0.00 0.00 177.10 177.00 2awi h GLY 230 N 9.78 1.48 1.03 1.21 0.00 -1.99 0.47 103.07 115.06 2awi h GLY 230 Ca -0.21 -0.36 -0.06 0.00 0.00 0.00 0.00 47.33 46.71 2awi h GLY 230 CO 0.99 0.11 0.17 -0.97 0.00 0.00 0.00 176.54 176.84 2awi h TYR 231 N 0.86 1.06 -0.51 5.60 0.05 -1.99 -2.00 116.97 120.03 2awi h TYR 231 Ca 0.46 -0.12 -0.11 0.00 0.05 0.00 0.00 58.73 59.01 2awi h TYR 231 Cb 0.48 -0.30 -0.02 0.00 1.01 0.00 0.00 36.73 37.90 2awi h TYR 231 CO -0.04 0.87 -0.12 1.88 -1.05 0.00 0.00 178.16 179.71 2awi h TYR 232 N 0.94 1.09 0.00 4.88 0.99 -1.75 -0.80 116.97 122.31 2awi h TYR 232 Ca 0.20 -0.22 -0.04 0.00 2.00 0.00 0.00 58.73 60.67 2awi h TYR 232 Cb 0.34 -0.27 -0.01 0.00 1.00 0.00 0.00 36.73 37.79 2awi h TYR 232 CO 0.02 1.02 -0.19 0.22 -0.00 0.00 0.00 178.16 179.24 2awi h ASP 233 N 0.86 0.00 0.09 3.88 3.58 -0.67 0.23 116.42 124.38 2awi h ASP 233 Ca 0.13 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.46 2awi h ASP 233 Cb 0.67 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.74 2awi h ASP 233 CO 0.05 0.19 -0.54 0.25 -2.88 0.00 0.00 179.24 176.31 2awi h LEU 234 N 0.00 0.32 -0.23 2.28 5.85 -1.03 -2.76 115.31 119.75 2awi h LEU 234 Ca -0.00 -0.95 -0.06 0.00 0.84 0.00 0.00 57.88 57.71 2awi h LEU 234 Cb 0.34 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 2awi h LEU 234 CO 0.02 1.25 -0.10 -0.08 -0.34 0.00 0.00 178.44 179.19 2awi h GLU 235 N -0.55 0.48 -0.50 1.25 4.81 -0.91 -2.16 114.58 117.00 2awi h GLU 235 Ca -0.09 -0.21 -0.04 0.00 -0.13 0.00 0.00 59.36 58.90 2awi h GLU 235 Cb 1.41 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.75 2awi h GLU 235 CO 0.10 0.74 0.16 0.82 -0.73 0.00 0.00 179.01 180.11 2awi h ILE 236 N 0.19 1.20 0.00 2.32 2.04 -0.70 -1.03 117.51 121.54 2awi h ILE 236 Ca 0.05 -0.67 -0.05 0.00 1.00 0.00 0.00 64.86 65.18 2awi h ILE 236 Cb 0.60 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 2awi h ILE 236 CO 0.03 0.26 -0.26 -1.13 0.00 0.00 0.00 178.15 177.05 2awi h ASN 237 N 0.73 0.00 0.34 1.72 -0.73 -1.36 -0.35 115.58 115.92 2awi h ASN 237 Ca 0.17 0.00 -0.22 0.00 1.87 0.00 0.00 56.30 58.12 2awi h ASN 237 Cb 0.21 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.80 2awi h ASN 237 CO -0.01 0.26 -0.94 0.22 -0.37 0.00 0.00 177.43 176.59 2awi h TYR 238 N 0.00 0.60 0.00 0.67 5.03 -0.56 -1.86 116.97 120.85 2awi h TYR 238 Ca -0.00 -0.33 -0.11 0.00 2.58 0.00 0.00 58.73 60.87 2awi h TYR 238 Cb 0.69 -0.07 -0.02 0.00 1.55 0.00 0.00 36.73 38.88 2awi h TYR 238 CO 0.00 1.14 -0.53 -0.07 -1.32 0.00 0.00 178.16 177.39 2awi h LEU 239 N 0.23 0.00 -0.34 2.82 3.38 -0.60 -1.70 115.31 119.09 2awi h LEU 239 Ca -0.08 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.76 2awi h LEU 239 Cb 1.57 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.32 2awi h LEU 239 CO 0.16 0.53 -0.32 0.50 0.09 0.00 0.00 178.44 179.40 2awi h LYS 240 N 0.00 0.82 -0.63 1.13 3.64 -0.96 0.85 116.57 121.42 2awi h LYS 240 Ca -0.01 -0.43 -0.03 0.00 -1.27 0.00 0.00 60.65 58.92 2awi h LYS 240 Cb 0.95 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.76 2awi h LYS 240 CO 0.07 1.06 0.26 1.96 -2.27 0.00 0.00 179.45 180.53 2awi h GLN 241 N 0.60 0.92 -0.37 1.90 1.08 -0.98 -0.29 115.11 117.97 2awi h GLN 241 Ca 0.06 -0.14 -0.15 0.00 -1.45 0.00 0.00 58.65 56.97 2awi h GLN 241 Cb 0.90 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 28.16 2awi h GLN 241 CO 0.08 0.75 -0.35 0.82 -0.95 0.00 0.00 178.83 179.17 2awi h ILE 242 N 0.91 1.28 -0.51 2.54 1.08 -1.03 -2.25 117.51 119.52 2awi h ILE 242 Ca 0.22 -1.52 0.03 0.00 -0.39 0.00 0.00 64.86 63.19 2awi h ILE 242 Cb 0.16 1.36 -0.04 0.00 -3.07 0.00 0.00 36.82 35.24 2awi h ILE 242 CO -0.02 0.51 0.29 0.22 -0.69 0.00 0.00 178.15 178.46 2awi h TYR 243 N 0.72 0.54 -0.26 1.37 3.20 0.03 0.18 116.97 122.75 2awi h TYR 243 Ca 0.07 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.90 2awi h TYR 243 Cb 0.92 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 39.01 2awi h TYR 243 CO 0.05 0.30 -0.09 1.96 -1.64 0.00 0.00 178.16 178.74 2awi h GLN 244 N 0.58 0.42 -0.11 1.82 4.20 -0.94 -1.52 115.11 119.56 2awi h GLN 244 Ca 0.21 -0.11 -0.08 0.00 0.06 0.00 0.00 58.65 58.74 2awi h GLN 244 Cb 0.05 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2awi h GLN 244 CO -0.11 0.53 -0.23 0.35 -0.67 0.00 0.00 178.83 178.70 2awi h PHE 245 N 0.40 0.43 -0.03 2.96 3.57 -0.79 -2.28 116.94 121.20 2awi h PHE 245 Ca 0.08 -0.16 -0.01 0.00 3.53 0.00 0.00 57.97 61.41 2awi h PHE 245 Cb 0.41 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.07 2awi h PHE 245 CO 0.01 0.84 -0.04 -0.07 -2.23 0.00 0.00 178.31 176.82 2awi h LEU 246 N -0.10 0.04 0.04 0.59 3.38 -0.74 0.80 115.31 119.32 2awi h LEU 246 Ca 0.00 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2awi h LEU 246 Cb 0.82 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.57 2awi h LEU 246 CO 0.05 0.09 -0.36 0.74 0.09 0.00 0.00 178.44 179.05 2awi h THR 247 N 0.04 1.61 -1.62 0.22 2.02 -1.22 -3.42 112.91 110.54 2awi h THR 247 Ca 0.01 -2.26 -0.49 0.00 0.77 0.00 0.00 66.41 64.43 2awi h THR 247 Cb 0.11 3.10 -0.34 0.00 -1.74 0.00 0.00 68.15 69.27 2awi h THR 247 CO 0.01 0.62 -0.99 -0.90 0.37 0.00 0.00 175.52 174.63 2awi n ASP 248 N -4.41 -0.44 0.00 4.18 5.75 -0.86 -5.04 116.55 115.73 2awi n ASP 248 Ca -0.11 -2.80 0.00 0.00 -0.01 0.00 0.00 54.79 51.86 2awi n ASP 248 Cb 0.60 -0.16 0.00 0.00 -1.03 0.00 0.00 41.12 40.54 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 1.48 0.00 -3.33 0.11 4.76 0.27 -4.78 118.16 116.67 2awi n LYS 249 Ca 0.19 0.00 -0.39 0.00 -2.87 0.00 0.00 58.31 55.24 2awi n LYS 249 Cb 0.55 0.00 -0.08 0.00 -1.84 0.00 0.00 35.03 33.66 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 0.00 6.34 0.14 4.39 3.84 -1.26 -4.98 114.94 123.41 2awi s ASN 250 Ca 0.00 0.40 -0.12 0.00 0.21 0.00 0.00 52.86 53.35 2awi s ASN 250 Cb 0.00 -2.24 -0.02 0.00 -0.55 0.00 0.00 41.25 38.44 2awi s ASN 250 CO 0.00 -0.21 1.52 -0.29 -2.79 0.00 0.00 177.10 175.33 2awi h ILE 251 N 5.35 1.28 -0.74 -5.21 2.10 -1.97 -2.75 117.51 115.57 2awi h ILE 251 Ca -0.31 -1.32 0.11 0.00 1.08 0.00 0.00 64.86 64.42 2awi h ILE 251 Cb 1.15 1.23 -0.05 0.00 -1.09 0.00 0.00 36.82 38.06 2awi h ILE 251 CO 0.68 0.45 0.49 0.44 -1.08 0.00 0.00 178.15 179.13 2awi h ASP 252 N 0.70 0.53 0.24 2.19 3.32 -1.99 0.26 116.42 121.68 2awi h ASP 252 Ca 0.10 0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.05 2awi h ASP 252 Cb 0.74 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 2awi h ASP 252 CO 0.06 0.31 -0.44 0.28 -1.72 0.00 0.00 179.24 177.72 2awi h SER 253 N 0.58 0.27 -0.22 6.45 0.02 -1.83 0.47 113.55 119.29 2awi h SER 253 Ca 0.35 -0.12 -0.18 0.00 -0.84 0.00 0.00 61.79 61.00 2awi h SER 253 Cb 0.57 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.03 2awi h SER 253 CO -0.12 0.68 -0.55 0.22 -1.14 0.00 0.00 176.83 175.91 2awi h TYR 254 N 0.21 1.02 -0.29 3.45 5.03 -0.32 -2.26 116.97 123.80 2awi h TYR 254 Ca 0.02 -0.36 -0.07 0.00 2.58 0.00 0.00 58.73 60.89 2awi h TYR 254 Cb 0.87 -0.19 -0.01 0.00 1.55 0.00 0.00 36.73 38.94 2awi h TYR 254 CO 0.02 1.18 -0.09 -0.07 -1.32 0.00 0.00 178.16 177.87 2awi h LEU 255 N 0.62 0.59 -0.49 2.82 3.38 -0.59 -1.86 115.31 119.78 2awi h LEU 255 Ca 0.01 -0.38 0.07 0.00 0.09 0.00 0.00 57.88 57.67 2awi h LEU 255 Cb 1.15 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.68 2awi h LEU 255 CO 0.12 0.83 0.17 0.78 0.09 0.00 0.00 178.44 180.43 2awi h ASN 256 N 0.34 0.16 -0.28 -0.43 2.35 -0.86 0.35 115.58 117.21 2awi h ASN 256 Ca 0.07 0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 2awi h ASN 256 Cb 0.59 0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.99 2awi h ASN 256 CO 0.03 0.12 0.18 0.00 -1.65 0.00 0.00 177.43 176.12 2awi h ALA 257 N 1.33 0.36 -0.76 -0.83 0.00 -1.30 0.34 119.26 118.41 2awi h ALA 257 Ca 0.24 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 2awi h ALA 257 Cb 0.25 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2awi h ALA 257 CO -0.25 -0.18 0.33 0.28 0.00 0.00 0.00 179.25 179.43 2awi h VAL 258 N 0.37 1.25 -0.25 0.00 2.07 -0.60 -1.54 116.25 117.54 2awi h VAL 258 Ca 0.11 -0.74 -0.06 0.00 0.82 0.00 0.00 66.70 66.82 2awi h VAL 258 Cb -0.03 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.03 2awi h VAL 258 CO -0.03 0.31 -0.12 -1.13 0.02 0.00 0.00 177.57 176.62 2awi h ASN 259 N 1.09 0.40 -0.27 0.57 -1.24 0.28 -1.66 115.58 114.75 2awi h ASN 259 Ca 0.26 -0.10 -0.18 0.00 0.71 0.00 0.00 56.30 56.99 2awi h ASN 259 Cb 0.16 -0.11 0.00 0.00 0.73 0.00 0.00 38.32 39.11 2awi h ASN 259 CO -0.03 0.56 -0.55 0.40 -1.29 0.00 0.00 177.43 176.52 2awi h ILE 260 N 0.39 1.28 -0.85 2.57 2.04 -0.31 -2.09 117.51 120.55 2awi h ILE 260 Ca 0.08 -1.74 0.05 0.00 1.00 0.00 0.00 64.86 64.25 2awi h ILE 260 Cb 0.45 1.69 -0.05 0.00 -0.74 0.00 0.00 36.82 38.17 2awi h ILE 260 CO 0.03 0.56 0.55 0.40 0.00 0.00 0.00 178.15 179.69 2awi h ILE 261 N 0.61 1.10 -0.27 -0.67 2.04 -0.86 -1.32 117.51 118.13 2awi h ILE 261 Ca 0.01 -0.34 -0.09 0.00 1.00 0.00 0.00 64.86 65.43 2awi h ILE 261 Cb 1.16 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.24 2awi h ILE 261 CO 0.12 0.18 -0.23 -1.13 0.00 0.00 0.00 178.15 177.09 2awi h ASN 262 N 1.00 0.52 -0.67 1.72 -1.24 -1.06 -2.96 115.58 112.89 2awi h ASN 262 Ca 0.35 -0.17 -0.03 0.00 0.71 0.00 0.00 56.30 57.16 2awi h ASN 262 Cb 0.12 -0.14 -0.03 0.00 0.73 0.00 0.00 38.32 39.00 2awi h ASN 262 CO -0.12 0.75 0.31 0.40 -1.29 0.00 0.00 177.43 177.49 2awi h ILE 263 N 0.46 1.23 -0.06 2.57 1.08 -0.55 -1.63 117.51 120.62 2awi h ILE 263 Ca 0.07 -0.66 -0.01 0.00 -0.39 0.00 0.00 64.86 63.87 2awi h ILE 263 Cb 0.66 0.42 -0.00 0.00 -3.07 0.00 0.00 36.82 34.83 2awi h ILE 263 CO 0.05 0.27 -0.01 -0.26 -0.69 0.00 0.00 178.15 177.51 2awi h PHE 264 N 0.93 0.08 0.02 1.37 0.04 -1.32 -1.45 116.94 116.61 2awi h PHE 264 Ca 0.23 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 61.00 2awi h PHE 264 Cb 0.14 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.26 2awi h PHE 264 CO 0.01 0.10 -0.01 -0.22 -0.60 0.00 0.00 178.31 177.59 2awi h LYS 265 N 0.09 -0.02 -0.10 1.51 3.64 -1.23 -0.62 116.57 119.83 2awi h LYS 265 Ca 0.02 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.44 2awi h LYS 265 Cb 0.09 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.87 2awi h LYS 265 CO 0.00 0.49 -0.15 0.82 -2.27 0.00 0.00 179.45 178.34 2awi h ILE 266 N -0.55 0.60 0.00 2.00 2.04 -0.67 -2.26 117.51 118.66 2awi h ILE 266 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 2awi h ILE 266 Cb 0.53 0.60 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 2awi h ILE 266 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 178.15 180.45 2awi n ILE 267 N -5.30 0.03 -0.46 -0.67 -5.35 -0.61 -4.89 119.36 102.12 2awi n ILE 267 Ca -0.03 0.01 0.00 0.00 -0.27 0.00 0.00 62.75 62.45 2awi n ILE 267 Cb 0.21 -0.64 0.00 0.00 -1.74 0.00 0.00 39.64 37.47 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 0.49 0.76 3.23 3.28 0.00 -0.85 -5.00 105.19 107.10 2awi n GLY 268 Ca 0.17 -0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.46 3.52 0.16 1.61 4.76 -0.25 -4.85 118.16 120.64 2awi n LYS 269 Ca 0.00 -3.81 -0.14 0.00 -2.87 0.00 0.00 58.31 51.49 2awi n LYS 269 Cb 0.00 -2.95 -0.08 0.00 -1.84 0.00 0.00 35.03 30.16 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 6.55 -0.32 -0.85 1.97 4.57 -1.91 -0.73 114.58 123.87 2awi h GLU 270 Ca 0.33 0.02 0.14 0.00 -1.18 0.00 0.00 59.36 58.67 2awi h GLU 270 Cb 0.78 0.07 -0.09 0.00 -0.16 0.00 0.00 28.75 29.35 2awi h GLU 270 CO 1.37 -0.20 0.45 -0.44 -1.18 0.00 0.00 179.01 179.01 2awi h ASP 271 N -0.34 0.57 -0.35 1.04 3.32 -1.96 0.77 116.42 119.46 2awi h ASP 271 Ca -0.03 0.08 -0.12 0.00 0.02 0.00 0.00 57.03 56.98 2awi h ASP 271 Cb 0.26 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 2awi h ASP 271 CO 0.05 0.26 -0.26 0.40 -1.72 0.00 0.00 179.24 177.97 2awi h ILE 272 N 0.66 1.29 -0.70 0.35 2.04 -1.94 -0.98 117.51 118.23 2awi h ILE 272 Ca 0.46 -1.41 0.00 0.00 1.00 0.00 0.00 64.86 64.90 2awi h ILE 272 Cb 0.61 1.42 -0.03 0.00 -0.74 0.00 0.00 36.82 38.07 2awi h ILE 272 CO -0.34 0.46 0.44 -0.74 0.00 0.00 0.00 178.15 177.97 2awi h HIS 273 N 0.58 0.91 0.45 1.37 2.76 0.50 -0.68 115.15 121.04 2awi h HIS 273 Ca 0.07 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.23 2awi h HIS 273 Cb 0.83 -0.30 -0.00 0.00 1.55 0.00 0.00 27.41 29.48 2awi h HIS 273 CO 0.06 0.60 -0.25 -0.09 -1.30 0.00 0.00 177.93 176.95 2awi h ARG 274 N 0.96 -0.64 -0.58 5.26 2.43 0.61 -1.84 114.38 120.58 2awi h ARG 274 Ca 0.25 0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.44 2awi h ARG 274 Cb -0.06 0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.61 2awi h ARG 274 CO -0.05 -0.42 0.27 0.66 -1.51 0.00 0.00 179.97 178.91 2awi h SER 275 N -0.66 0.74 0.15 -3.80 4.64 -0.93 -2.25 113.55 111.44 2awi h SER 275 Ca -0.05 -0.08 -0.14 0.00 -0.47 0.00 0.00 61.79 61.05 2awi h SER 275 Cb 0.53 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 2awi h SER 275 CO 0.07 0.64 -0.49 -0.07 -0.87 0.00 0.00 176.83 176.11 2awi h LEU 276 N 0.82 0.42 -0.30 5.97 4.07 -1.02 -0.41 115.31 124.87 2awi h LEU 276 Ca 0.20 -0.21 -0.04 0.00 0.08 0.00 0.00 57.88 57.92 2awi h LEU 276 Cb 0.11 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.71 2awi h LEU 276 CO -0.02 0.85 0.04 0.58 -1.08 0.00 0.00 178.44 178.80 2awi h VAL 277 N 0.31 1.24 -0.45 1.22 2.07 -0.93 -0.06 116.25 119.64 2awi h VAL 277 Ca 0.02 -0.83 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 2awi h VAL 277 Cb 0.98 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.94 2awi h VAL 277 CO 0.08 0.27 0.24 -0.33 0.02 0.00 0.00 177.57 177.86 2awi h GLU 278 N 0.31 0.63 0.42 1.57 5.08 -1.31 -1.28 114.58 120.01 2awi h GLU 278 Ca 0.09 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2awi h GLU 278 Cb 0.36 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2awi h GLU 278 CO 0.01 0.51 -0.41 0.93 -1.00 0.00 0.00 179.01 179.05 2awi h GLU 279 N 0.59 -0.81 -0.01 2.33 5.08 -0.84 -2.12 114.58 118.80 2awi h GLU 279 Ca 0.16 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2awi h GLU 279 Cb 0.06 0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 2awi h GLU 279 CO -0.02 -0.54 0.01 1.25 -1.00 0.00 0.00 179.01 178.71 2awi h LEU 280 N -0.84 0.00 -0.43 1.33 5.85 -0.90 -0.34 115.31 119.98 2awi h LEU 280 Ca -0.04 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.53 2awi h LEU 280 Cb 0.74 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 2awi h LEU 280 CO -0.06 0.00 -0.34 0.74 -0.34 0.00 0.00 178.44 178.44 2awi h THR 281 N 0.00 1.27 0.00 1.05 2.02 -0.69 -0.89 112.91 115.67 2awi h THR 281 Ca 0.01 -1.51 -0.27 0.00 0.77 0.00 0.00 66.41 65.41 2awi h THR 281 Cb 0.03 1.31 0.02 0.00 -1.74 0.00 0.00 68.15 67.77 2awi h THR 281 CO -0.00 0.51 -1.05 0.11 0.37 0.00 0.00 175.52 175.46 2awi h LYS 282 N 0.78 0.68 0.22 6.66 1.57 -0.71 -2.51 116.57 123.27 2awi h LYS 282 Ca 0.07 -0.74 -0.00 0.00 -1.87 0.00 0.00 60.65 58.11 2awi h LYS 282 Cb 0.93 0.21 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 2awi h LYS 282 CO 0.09 1.32 -0.17 0.82 -0.57 0.00 0.00 179.45 180.94 2awi h ILE 283 N 0.38 0.63 -0.86 1.86 1.08 -1.06 -2.40 117.51 117.14 2awi h ILE 283 Ca -0.13 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.43 2awi h ILE 283 Cb 1.70 0.63 -0.06 0.00 -3.07 0.00 0.00 36.82 36.02 2awi h ILE 283 CO 0.20 0.00 0.56 0.28 -0.69 0.00 0.00 178.15 178.50 2awi h SER 284 N -0.40 0.79 0.06 1.72 0.02 -1.20 -2.58 113.55 111.95 2awi h SER 284 Ca -0.01 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2awi h SER 284 Cb 0.35 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.74 2awi h SER 284 CO -0.01 0.48 -0.03 0.00 -1.14 0.00 0.00 176.83 176.13 2awi h ALA 285 N 1.56 -0.08 -0.21 3.77 0.00 -1.15 0.35 119.26 123.51 2awi h ALA 285 Ca 0.39 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.25 2awi h ALA 285 Cb 0.35 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2awi h ALA 285 CO -0.16 -0.44 0.19 0.87 0.00 0.00 0.00 179.25 179.72 2awi h LYS 286 N -0.29 0.00 -0.24 0.00 1.57 -1.09 0.39 116.57 116.91 2awi h LYS 286 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2awi h LYS 286 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 2awi h LYS 286 CO 0.01 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.28 2awi n GLU 287 N -4.05 2.17 -2.66 3.15 -0.58 -1.00 -4.94 120.64 112.72 2awi n GLU 287 Ca 0.02 -1.75 -0.20 0.00 -0.42 0.00 0.00 57.16 54.81 2awi n GLU 287 Cb 0.33 -1.46 0.01 0.00 -0.57 0.00 0.00 31.44 29.74 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 0.99 -3.06 -4.61 3.49 4.76 0.14 -5.00 118.16 114.88 2awi n LYS 288 Ca 0.18 0.92 -0.34 0.00 -2.87 0.00 0.00 58.31 56.19 2awi n LYS 288 Cb 0.50 -5.60 -0.11 0.00 -1.84 0.00 0.00 35.03 27.97 2awi n LYS 288 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2awi s PHE 289 N -3.07 2.94 -0.32 2.13 0.40 0.11 -5.01 117.98 115.17 2awi s PHE 289 Ca 0.14 -0.05 -0.19 0.00 -0.60 0.00 0.00 56.93 56.22 2awi s PHE 289 Cb -0.06 -1.75 -0.01 0.00 0.51 0.00 0.00 43.02 41.71 2awi s PHE 289 CO 0.17 0.26 0.57 0.99 0.70 0.00 0.00 175.22 177.91 2awi s THR 290 N -0.60 4.98 0.83 0.64 2.01 -1.26 -3.94 115.64 118.29 2awi s THR 290 Ca 0.09 0.65 -0.11 0.00 0.31 0.00 0.00 61.69 62.63 2awi s THR 290 Cb -0.12 -3.97 0.09 0.00 0.01 0.00 0.00 72.50 68.52 2awi s THR 290 CO 0.02 -0.15 1.13 -2.16 -0.69 0.00 0.00 174.62 172.77 2awi s PRO 291 N 2.51 1.68 0.74 4.92 0.04 -1.26 -4.96 135.00 138.66 2awi s PRO 291 Ca 0.22 1.43 -0.16 0.00 0.04 0.00 0.00 61.00 62.54 2awi s PRO 291 Cb -0.15 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.54 2awi s PRO 291 CO 0.12 -2.12 0.45 -2.30 0.04 0.00 0.00 177.00 173.20 2awi n PRO 292 N -3.71 0.24 -0.23 0.56 -0.02 -1.26 -4.75 135.00 125.83 2awi n PRO 292 Ca 0.11 0.12 0.01 0.00 -2.02 0.00 0.00 63.50 61.72 2awi n PRO 292 Cb 0.52 -1.77 0.09 0.00 -0.02 0.00 0.00 33.50 32.32 2awi n PRO 292 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2awi h LYS 293 N -0.45 0.04 0.00 -0.52 -0.00 -2.00 -2.86 116.57 110.78 2awi h LYS 293 Ca -0.45 -0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.20 2awi h LYS 293 Cb 1.35 -0.01 0.00 0.00 -0.00 0.00 0.00 32.23 33.57 2awi h LYS 293 CO 0.41 0.02 0.00 -1.91 -0.00 0.00 0.00 179.45 177.98 2awi n GLU 294 N -5.40 0.00 -0.27 0.07 2.13 -1.26 -2.22 120.64 113.68 2awi n GLU 294 Ca 0.10 0.73 0.09 0.00 0.66 0.00 0.00 57.16 58.73 2awi n GLU 294 Cb 0.37 -1.32 0.22 0.00 0.27 0.00 0.00 31.44 30.98 2awi n GLU 294 CO 0.00 0.00 0.00 -0.39 -0.41 0.00 0.00 177.13 176.33 2awi h VAL 295 N 0.00 0.37 0.00 6.31 -1.51 -1.86 -0.78 116.25 118.77 2awi h VAL 295 Ca 0.00 -0.06 -0.02 0.00 -1.23 0.00 0.00 66.70 65.39 2awi h VAL 295 Cb 0.00 0.16 -0.00 0.00 -2.13 0.00 0.00 31.29 29.32 2awi h VAL 295 CO 0.00 0.03 -0.09 0.71 -1.23 0.00 0.00 177.57 177.00 2awi h THR 296 N 0.19 0.37 -0.12 7.19 1.35 -1.31 -1.79 112.91 118.78 2awi h THR 296 Ca 0.47 -0.51 -0.22 0.00 -0.55 0.00 0.00 66.41 65.60 2awi h THR 296 Cb 0.88 1.37 0.01 0.00 -1.73 0.00 0.00 68.15 68.68 2awi h THR 296 CO -0.63 0.09 -0.80 -0.03 -0.25 0.00 0.00 175.52 173.90 2awi h MET 297 N 0.00 0.75 0.42 4.72 -1.53 -0.66 -2.08 114.93 116.55 2awi h MET 297 Ca -0.00 -0.65 -0.02 0.00 -3.44 0.00 0.00 59.70 55.59 2awi h MET 297 Cb 0.36 0.15 0.00 0.00 -0.55 0.00 0.00 31.60 31.56 2awi h MET 297 CO 0.01 1.25 -0.20 1.88 0.14 0.00 0.00 176.91 179.99 2awi h TYR 298 N 0.46 -0.53 -0.05 1.39 0.99 -1.40 -3.01 116.97 114.82 2awi h TYR 298 Ca -0.07 -0.01 0.04 0.00 2.00 0.00 0.00 58.73 60.69 2awi h TYR 298 Cb 1.44 0.17 -0.05 0.00 1.00 0.00 0.00 36.73 39.29 2awi h TYR 298 CO 0.09 -0.21 -0.29 -0.92 -0.00 0.00 0.00 178.16 176.84 2awi h TYR 299 N -0.99 -0.78 -0.89 4.88 5.03 -1.45 -1.92 116.97 120.85 2awi h TYR 299 Ca -0.06 0.03 0.24 0.00 2.58 0.00 0.00 58.73 61.52 2awi h TYR 299 Cb 0.55 0.35 -0.14 0.00 1.55 0.00 0.00 36.73 39.05 2awi h TYR 299 CO 0.02 -0.37 0.30 1.49 -1.32 0.00 0.00 178.16 178.27 2awi h GLU 300 N -0.40 0.25 -0.01 1.82 4.81 -1.47 -3.51 114.58 116.06 2awi h GLU 300 Ca 0.08 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2awi h GLU 300 Cb 0.51 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.84 2awi h GLU 300 CO -0.28 0.17 0.00 0.09 -0.73 0.00 0.00 179.01 178.26