#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uio n PRO 5 N 0.00 1.35 0.09 1.09 -0.02 -1.26 -4.93 135.00 131.33 1uio n PRO 5 Ca 0.00 0.49 -0.03 0.00 -2.02 0.00 0.00 63.50 61.94 1uio n PRO 5 Cb 0.00 -2.04 0.19 0.00 -0.02 0.00 0.00 33.50 31.63 1uio n PRO 5 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1uio h ALA 6 N 1.55 1.03 -1.95 3.55 0.00 -1.91 -3.39 119.26 118.13 1uio h ALA 6 Ca -0.44 -0.46 -0.38 0.00 0.00 0.00 0.00 54.91 53.63 1uio h ALA 6 Cb 1.34 -0.09 -0.31 0.00 0.00 0.00 0.00 17.79 18.73 1uio h ALA 6 CO 0.57 0.64 -0.70 0.12 0.00 0.00 0.00 179.25 179.88 1uio s PHE 7 N -4.01 -0.24 -1.30 0.00 5.36 -1.26 -4.93 117.98 111.59 1uio s PHE 7 Ca -0.04 -0.92 -0.10 0.00 -0.96 0.00 0.00 56.93 54.91 1uio s PHE 7 Cb 0.13 -0.42 0.15 0.00 -0.34 0.00 0.00 43.02 42.54 1uio s PHE 7 CO 0.78 -0.97 1.92 -1.71 -1.46 0.00 0.00 175.22 173.78 1uio n ASN 8 N 4.12 4.93 -3.86 6.13 5.15 -1.26 -4.88 115.26 125.59 1uio n ASN 8 Ca 0.12 -3.07 -0.10 0.00 -0.60 0.00 0.00 54.58 50.93 1uio n ASN 8 Cb 0.45 -1.50 -0.05 0.00 -0.53 0.00 0.00 39.78 38.14 1uio n ASN 8 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1uio s LYS 9 N 0.77 1.25 0.50 1.20 -0.14 -1.26 -5.15 119.74 116.91 1uio s LYS 9 Ca 0.41 -1.03 -0.21 0.00 -1.36 0.00 0.00 55.97 53.77 1uio s LYS 9 Cb 0.10 0.44 -0.09 0.00 -1.68 0.00 0.00 37.83 36.60 1uio s LYS 9 CO -0.01 -0.50 0.84 -2.30 -0.76 0.00 0.00 175.35 172.62 1uio n PRO 10 N -0.27 0.95 -4.20 -1.68 -0.02 -1.26 -4.86 135.00 123.67 1uio n PRO 10 Ca -0.09 0.35 -0.12 0.00 -2.02 0.00 0.00 63.50 61.63 1uio n PRO 10 Cb 0.63 -1.93 -0.10 0.00 -0.02 0.00 0.00 33.50 32.07 1uio n PRO 10 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1uio s LYS 11 N -2.17 0.94 -0.11 -0.52 1.02 0.44 -4.94 119.74 114.40 1uio s LYS 11 Ca 0.68 -1.41 0.02 0.00 0.02 0.00 0.00 55.97 55.27 1uio s LYS 11 Cb -0.50 -0.24 0.01 0.00 -0.52 0.00 0.00 37.83 36.58 1uio s LYS 11 CO 0.54 -0.05 -0.15 0.08 -0.92 0.00 0.00 175.35 174.84 1uio s VAL 12 N -3.63 1.51 -0.16 3.17 1.01 -1.26 -0.91 120.40 120.13 1uio s VAL 12 Ca 0.16 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.50 1uio s VAL 12 Cb 0.05 -1.38 0.01 0.00 0.00 0.00 0.00 36.38 35.06 1uio s VAL 12 CO -0.01 0.44 -0.17 -0.70 0.00 0.00 0.00 175.10 174.66 1uio s GLU 13 N 0.97 3.13 -0.01 2.72 2.12 -0.78 -4.72 118.70 122.13 1uio s GLU 13 Ca -0.07 -0.78 0.11 0.00 0.36 0.00 0.00 54.97 54.59 1uio s GLU 13 Cb -0.15 -2.60 -0.15 0.00 0.26 0.00 0.00 34.13 31.50 1uio s GLU 13 CO -0.01 -0.06 0.36 1.28 -0.54 0.00 0.00 175.26 176.29 1uio n LEU 14 N 4.24 0.27 -3.62 2.70 4.32 -1.26 -1.13 117.00 122.52 1uio n LEU 14 Ca -0.20 -0.25 -0.29 0.00 -0.02 0.00 0.00 56.01 55.25 1uio n LEU 14 Cb 0.51 0.00 -0.13 0.00 -1.62 0.00 0.00 43.42 42.19 1uio n LEU 14 CO 0.28 0.07 -0.27 -2.28 -1.22 0.00 0.00 177.39 173.96 1uio s HIS 15 N -2.42 1.54 -0.13 -1.77 2.46 -1.26 -4.72 115.29 109.00 1uio s HIS 15 Ca 0.00 -2.16 -0.10 0.00 0.47 0.00 0.00 55.06 53.28 1uio s HIS 15 Cb 0.08 -1.54 0.04 0.00 -0.13 0.00 0.00 32.58 31.03 1uio s HIS 15 CO 0.47 -0.80 0.32 0.54 -2.47 0.00 0.00 174.74 172.80 1uio s VAL 16 N 0.57 -0.01 -0.26 0.89 0.11 -1.26 -0.98 120.40 119.45 1uio s VAL 16 Ca 0.18 0.05 -0.16 0.00 -2.93 0.00 0.00 61.98 59.12 1uio s VAL 16 Cb -0.23 -0.47 -0.03 0.00 -1.53 0.00 0.00 36.38 34.12 1uio s VAL 16 CO -0.00 0.02 0.41 -1.00 -3.33 0.00 0.00 175.10 171.20 1uio s HIS 17 N 0.61 3.26 0.24 1.54 3.76 0.25 -0.79 115.29 124.16 1uio s HIS 17 Ca -0.04 0.49 -0.05 0.00 -0.15 0.00 0.00 55.06 55.31 1uio s HIS 17 Cb -0.05 -2.61 0.35 0.00 1.11 0.00 0.00 32.58 31.38 1uio s HIS 17 CO -0.04 -0.23 1.84 1.25 -0.85 0.00 0.00 174.74 176.72 1uio h LEU 18 N 8.58 0.82 0.00 0.89 5.85 -0.92 0.11 115.31 130.63 1uio h LEU 18 Ca -0.31 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.43 1uio h LEU 18 Cb 1.16 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.04 1uio h LEU 18 CO 0.67 0.51 0.00 -0.90 -0.34 0.00 0.00 178.44 178.38 1uio n ASP 19 N -4.64 0.00 -0.47 1.25 5.75 -1.26 -2.23 116.55 114.95 1uio n ASP 19 Ca 0.13 -0.32 0.05 0.00 -0.01 0.00 0.00 54.79 54.64 1uio n ASP 19 Cb 0.20 -0.16 0.12 0.00 -1.03 0.00 0.00 41.12 40.24 1uio n ASP 19 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1uio n GLY 20 N 0.51 3.09 2.23 6.12 0.00 0.30 -4.63 105.19 112.81 1uio n GLY 20 Ca 0.13 -0.39 -0.17 0.00 0.00 0.00 0.00 46.02 45.59 1uio n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uio n ALA 21 N 0.02 1.84 -2.62 4.61 0.00 -0.79 -0.82 120.51 122.75 1uio n ALA 21 Ca 0.10 -3.27 -0.28 0.00 0.00 0.00 0.00 53.44 49.98 1uio n ALA 21 Cb 0.44 -0.94 -0.09 0.00 0.00 0.00 0.00 19.45 18.86 1uio n ALA 21 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1uio s ILE 22 N -2.26 3.55 0.00 0.00 1.01 -1.26 -4.81 121.20 117.43 1uio s ILE 22 Ca 0.39 -1.34 -0.30 0.00 0.00 0.00 0.00 60.65 59.40 1uio s ILE 22 Cb 0.35 -2.72 -0.03 0.00 0.01 0.00 0.00 42.46 40.06 1uio s ILE 22 CO -0.08 0.00 1.02 -0.54 0.00 0.00 0.00 174.94 175.35 1uio s LYS 23 N -2.57 4.53 0.46 2.79 1.02 -1.26 -4.68 119.74 120.03 1uio s LYS 23 Ca 0.25 1.48 0.16 0.00 0.02 0.00 0.00 55.97 57.88 1uio s LYS 23 Cb -0.10 -3.45 1.12 0.00 -0.52 0.00 0.00 37.83 34.88 1uio s LYS 23 CO 0.16 -0.11 2.00 -1.35 -0.92 0.00 0.00 175.35 175.13 1uio h PRO 24 N 6.83 0.28 0.00 -1.68 0.11 -1.99 0.18 132.00 135.73 1uio h PRO 24 Ca -0.40 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.63 1uio h PRO 24 Cb 1.21 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1uio h PRO 24 CO 0.77 0.18 -0.29 0.93 -0.21 0.00 0.00 178.00 179.39 1uio h GLU 25 N 0.29 0.00 0.05 1.05 3.07 -1.94 0.69 114.58 117.78 1uio h GLU 25 Ca 0.24 0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 58.84 1uio h GLU 25 Cb 0.57 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.46 1uio h GLU 25 CO -0.05 0.29 -1.33 1.15 -1.40 0.00 0.00 179.01 177.66 1uio h THR 26 N 0.00 1.34 0.36 1.13 2.02 -1.08 -2.02 112.91 114.66 1uio h THR 26 Ca -0.00 -3.05 -0.02 0.00 0.77 0.00 0.00 66.41 64.11 1uio h THR 26 Cb 0.51 2.74 0.00 0.00 -1.74 0.00 0.00 68.15 69.66 1uio h THR 26 CO 0.04 0.82 -0.17 0.40 0.37 0.00 0.00 175.52 176.97 1uio h ILE 27 N 0.03 0.63 -0.54 3.11 2.04 -0.61 -1.60 117.51 120.56 1uio h ILE 27 Ca -0.15 -0.46 0.10 0.00 1.00 0.00 0.00 64.86 65.35 1uio h ILE 27 Cb 1.91 0.86 -0.08 0.00 -0.74 0.00 0.00 36.82 38.77 1uio h ILE 27 CO 0.13 0.09 0.07 0.25 0.00 0.00 0.00 178.15 178.69 1uio h LEU 28 N -0.75 -0.09 -0.51 1.44 5.85 -0.99 -0.88 115.31 119.38 1uio h LEU 28 Ca -0.05 0.11 0.06 0.00 0.84 0.00 0.00 57.88 58.84 1uio h LEU 28 Cb 0.51 0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.66 1uio h LEU 28 CO 0.08 -0.02 0.22 0.22 -0.34 0.00 0.00 178.44 178.59 1uio h TYR 29 N 0.19 0.39 0.00 1.25 3.20 -1.21 -2.61 116.97 118.18 1uio h TYR 29 Ca 0.28 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 62.06 1uio h TYR 29 Cb 0.41 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 1uio h TYR 29 CO -0.27 0.15 -0.52 0.74 -1.64 0.00 0.00 178.16 176.62 1uio h PHE 30 N 0.42 0.00 0.07 -3.82 0.04 -0.20 -1.50 116.94 111.95 1uio h PHE 30 Ca 0.24 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 61.01 1uio h PHE 30 Cb 0.22 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.37 1uio h PHE 30 CO -0.14 0.52 -0.03 0.78 -0.60 0.00 0.00 178.31 178.84 1uio h GLY 31 N 3.05 -0.09 0.96 -1.45 0.00 -0.89 0.14 103.07 104.78 1uio h GLY 31 Ca -0.01 0.03 -0.05 0.00 0.00 0.00 0.00 47.33 47.31 1uio h GLY 31 CO 0.07 -0.03 -0.47 0.50 0.00 0.00 0.00 176.54 176.60 1uio h LYS 32 N -0.34 -1.25 -0.86 4.80 1.57 -1.55 1.34 116.57 120.28 1uio h LYS 32 Ca -0.01 0.09 0.21 0.00 -1.87 0.00 0.00 60.65 59.06 1uio h LYS 32 Cb 0.30 0.28 -0.12 0.00 0.08 0.00 0.00 32.23 32.77 1uio h LYS 32 CO 0.01 -0.83 0.34 -0.22 -0.57 0.00 0.00 179.45 178.18 1uio h LYS 33 N -1.30 0.35 0.00 3.15 3.11 -1.25 0.21 116.57 120.84 1uio h LYS 33 Ca -0.13 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.69 1uio h LYS 33 Cb 1.00 -0.08 0.00 0.00 -1.00 0.00 0.00 32.23 32.15 1uio h LYS 33 CO 0.21 0.23 -0.83 0.54 -2.81 0.00 0.00 179.45 176.79 1uio n ARG 34 N -5.08 0.06 -2.78 1.90 1.74 0.48 -4.97 116.66 108.01 1uio n ARG 34 Ca 0.20 -0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.19 1uio n ARG 34 Cb 0.62 -1.52 0.04 0.00 -1.02 0.00 0.00 32.46 30.58 1uio n ARG 34 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uio n GLY 35 N 1.47 0.14 3.45 -0.13 0.00 0.43 -5.03 105.19 105.52 1uio n GLY 35 Ca 0.04 -0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 1uio n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uio s ILE 36 N -3.16 2.85 0.34 -0.61 1.01 0.86 -5.01 121.20 117.48 1uio s ILE 36 Ca 0.10 -0.94 -0.19 0.00 0.00 0.00 0.00 60.65 59.61 1uio s ILE 36 Cb -0.04 -2.14 -0.10 0.00 0.01 0.00 0.00 42.46 40.19 1uio s ILE 36 CO 0.34 0.49 0.84 0.00 0.00 0.00 0.00 174.94 176.60 1uio s ALA 37 N -0.80 3.22 0.21 9.38 0.00 -1.26 -4.31 121.76 128.20 1uio s ALA 37 Ca 0.13 0.25 0.10 0.00 0.00 0.00 0.00 51.96 52.44 1uio s ALA 37 Cb -0.10 -2.96 -0.05 0.00 0.00 0.00 0.00 23.12 20.01 1uio s ALA 37 CO 0.02 0.24 -0.19 -0.51 0.00 0.00 0.00 175.76 175.32 1uio s LEU 38 N -2.76 2.50 0.00 0.00 2.01 -1.26 -4.94 118.68 114.23 1uio s LEU 38 Ca 0.55 -0.94 0.06 0.00 0.01 0.00 0.00 54.13 53.80 1uio s LEU 38 Cb -0.12 -0.95 0.33 0.00 0.01 0.00 0.00 46.19 45.46 1uio s LEU 38 CO 0.17 -0.01 0.77 -0.81 1.01 0.00 0.00 176.35 177.49 1uio n PRO 39 N -0.07 0.46 -3.60 1.29 -0.04 -1.26 -4.76 135.00 127.02 1uio n PRO 39 Ca -0.10 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.31 1uio n PRO 39 Cb 0.58 -1.19 -0.02 0.00 -0.04 0.00 0.00 33.50 32.84 1uio n PRO 39 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1uio s ALA 40 N -2.00 -1.86 -0.14 0.55 0.00 -1.26 -4.93 121.76 112.12 1uio s ALA 40 Ca 0.08 0.81 0.15 0.00 0.00 0.00 0.00 51.96 53.00 1uio s ALA 40 Cb 0.04 0.40 0.39 0.00 0.00 0.00 0.00 23.12 23.95 1uio s ALA 40 CO 0.06 -0.82 1.19 -0.25 0.00 0.00 0.00 175.76 175.95 1uio n ASP 41 N -0.31 1.53 -3.77 0.00 8.00 -1.26 -4.82 116.55 115.91 1uio n ASP 41 Ca -0.07 -3.27 -0.13 0.00 0.71 0.00 0.00 54.79 52.04 1uio n ASP 41 Cb 0.61 -0.45 -0.13 0.00 -0.02 0.00 0.00 41.12 41.13 1uio n ASP 41 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1uio s THR 42 N -2.26 -0.03 0.32 -3.53 2.01 -1.26 -5.03 115.64 105.87 1uio s THR 42 Ca 0.35 0.10 0.02 0.00 0.31 0.00 0.00 61.69 62.47 1uio s THR 42 Cb 0.35 -0.28 0.28 0.00 0.01 0.00 0.00 72.50 72.87 1uio s THR 42 CO -0.08 0.04 1.93 -0.37 -0.69 0.00 0.00 174.62 175.45 1uio h VAL 43 N 5.54 1.06 0.03 3.82 -1.51 -1.94 0.82 116.25 124.07 1uio h VAL 43 Ca -0.35 -0.32 -0.00 0.00 -1.23 0.00 0.00 66.70 64.79 1uio h VAL 43 Cb 1.17 0.03 0.00 0.00 -2.13 0.00 0.00 31.29 30.36 1uio h VAL 43 CO 0.40 0.17 -0.01 -0.33 -1.23 0.00 0.00 177.57 176.57 1uio h GLU 44 N 0.94 -0.03 0.00 5.19 3.07 -1.98 0.55 114.58 122.32 1uio h GLU 44 Ca 0.36 0.00 -0.18 0.00 -0.50 0.00 0.00 59.36 59.04 1uio h GLU 44 Cb 0.21 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.10 1uio h GLU 44 CO -0.13 0.03 -0.86 0.93 -1.40 0.00 0.00 179.01 177.57 1uio h GLU 45 N -0.08 0.02 -0.89 2.33 4.39 -1.82 -2.42 114.58 116.11 1uio h GLU 45 Ca -0.00 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 1uio h GLU 45 Cb 0.07 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.69 1uio h GLU 45 CO 0.01 0.87 0.51 1.25 -1.16 0.00 0.00 179.01 180.49 1uio h LEU 46 N 0.01 1.10 -1.06 1.33 5.85 0.99 -1.54 115.31 121.99 1uio h LEU 46 Ca -0.01 -0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.54 1uio h LEU 46 Cb 1.52 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.26 1uio h LEU 46 CO 0.11 0.87 -0.21 0.03 -0.34 0.00 0.00 178.44 178.90 1uio h ARG 47 N 1.24 0.42 0.00 1.25 3.08 0.42 -1.01 114.38 119.78 1uio h ARG 47 Ca 0.32 -0.14 -0.16 0.00 0.07 0.00 0.00 59.98 60.07 1uio h ARG 47 Cb -0.01 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 1uio h ARG 47 CO -0.05 0.61 -0.74 -0.91 -1.07 0.00 0.00 179.97 177.81 1uio h ASN 48 N 0.38 0.00 0.16 7.04 2.35 -0.96 0.55 115.58 125.10 1uio h ASN 48 Ca 0.06 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 1uio h ASN 48 Cb 0.59 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.96 1uio h ASN 48 CO 0.04 0.74 -0.08 0.40 -1.65 0.00 0.00 177.43 176.88 1uio h ILE 49 N 0.00 0.00 -0.45 2.81 1.08 -1.01 -3.38 117.51 116.55 1uio h ILE 49 Ca -0.01 -0.56 -0.01 0.00 -0.39 0.00 0.00 64.86 63.89 1uio h ILE 49 Cb 1.38 0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 35.11 1uio h ILE 49 CO 0.10 0.00 0.24 0.40 -0.69 0.00 0.00 178.15 178.19 1uio h ILE 50 N -0.78 1.17 -4.22 -0.67 2.04 -1.32 -3.45 117.51 110.27 1uio h ILE 50 Ca -0.02 -0.44 -0.50 0.00 1.00 0.00 0.00 64.86 64.89 1uio h ILE 50 Cb 0.17 0.64 0.14 0.00 -0.74 0.00 0.00 36.82 37.03 1uio h ILE 50 CO 0.04 0.18 0.29 -0.83 0.00 0.00 0.00 178.15 177.82 1uio s GLY 51 N -2.81 1.66 0.01 5.37 0.00 0.18 -4.73 107.32 107.00 1uio s GLY 51 Ca -0.13 0.17 0.01 0.00 0.00 0.00 0.00 44.72 44.77 1uio s GLY 51 CO 0.75 0.57 -0.04 -3.16 0.00 0.00 0.00 173.10 171.23 1uio s MET 52 N -4.89 0.28 0.00 2.90 0.23 -0.70 -4.80 119.30 112.32 1uio s MET 52 Ca 0.62 -0.31 0.00 0.00 -1.03 0.00 0.00 55.69 54.97 1uio s MET 52 Cb -0.18 -0.16 0.00 0.00 -1.53 0.00 0.00 34.83 32.97 1uio s MET 52 CO 0.57 0.03 0.60 -0.40 -2.03 0.00 0.00 175.02 173.79 1uio n ASP 53 N 2.47 1.03 -3.97 -1.18 5.68 -1.26 -4.67 116.55 114.65 1uio n ASP 53 Ca -0.16 -1.35 -0.14 0.00 -0.50 0.00 0.00 54.79 52.64 1uio n ASP 53 Cb 0.58 0.00 -0.13 0.00 -1.14 0.00 0.00 41.12 40.42 1uio n ASP 53 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1uio s LYS 54 N -0.35 0.37 0.56 0.11 1.02 -1.26 -5.07 119.74 115.12 1uio s LYS 54 Ca 0.00 -0.33 -0.19 0.00 0.02 0.00 0.00 55.97 55.46 1uio s LYS 54 Cb 0.00 -0.27 -0.07 0.00 -0.52 0.00 0.00 37.83 36.97 1uio s LYS 54 CO 0.00 0.06 0.76 -2.30 -0.92 0.00 0.00 175.35 172.96 1uio n PRO 55 N 2.49 0.77 0.00 -1.68 -0.02 -1.26 -4.88 135.00 130.41 1uio n PRO 55 Ca -0.16 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 1uio n PRO 55 Cb 0.57 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 1uio n PRO 55 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1uio n LEU 56 N 0.01 0.00 -4.20 2.45 7.94 -0.90 -4.98 117.00 117.32 1uio n LEU 56 Ca 0.12 0.00 -0.14 0.00 -1.11 0.00 0.00 56.01 54.88 1uio n LEU 56 Cb 0.46 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.32 1uio n LEU 56 CO 0.51 0.00 -0.16 -0.94 -1.11 0.00 0.00 177.39 175.69 1uio s SER 57 N 1.00 0.54 0.01 1.96 1.04 -1.26 -4.32 113.70 112.67 1uio s SER 57 Ca 0.00 -1.45 -0.23 0.00 0.48 0.00 0.00 55.95 54.75 1uio s SER 57 Cb 0.00 0.45 -0.17 0.00 0.10 0.00 0.00 66.02 66.40 1uio s SER 57 CO 0.00 -0.94 1.30 0.25 0.98 0.00 0.00 173.24 174.83 1uio h LEU 58 N 2.45 0.21 -1.38 2.42 5.85 -1.93 0.18 115.31 123.11 1uio h LEU 58 Ca -0.32 -0.49 -0.00 0.00 0.84 0.00 0.00 57.88 57.90 1uio h LEU 58 Cb 1.24 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 1uio h LEU 58 CO 0.47 0.66 0.32 -0.65 -0.34 0.00 0.00 178.44 178.89 1uio h PRO 59 N -0.24 0.74 0.00 5.25 0.11 -1.96 0.72 132.00 136.61 1uio h PRO 59 Ca 0.01 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 65.94 1uio h PRO 59 Cb 0.60 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 31.54 1uio h PRO 59 CO 0.02 0.52 -0.56 0.78 -0.21 0.00 0.00 178.00 178.55 1uio h GLY 60 N 0.80 0.00 1.36 -0.55 0.00 -1.92 -3.12 103.07 99.64 1uio h GLY 60 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.23 1uio h GLY 60 CO -0.04 0.00 -1.28 -2.75 0.00 0.00 0.00 176.54 172.47 1uio h PHE 61 N 0.00 0.86 0.00 5.60 3.57 -0.01 -3.29 116.94 123.67 1uio h PHE 61 Ca -0.01 -0.57 -0.00 0.00 3.53 0.00 0.00 57.97 60.92 1uio h PHE 61 Cb 1.02 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.71 1uio h PHE 61 CO 0.00 1.43 -0.01 -0.07 -2.23 0.00 0.00 178.31 177.43 1uio h LEU 62 N 0.19 0.00 -1.20 0.59 3.38 -0.84 -2.55 115.31 114.89 1uio h LEU 62 Ca -0.19 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 1uio h LEU 62 Cb 1.97 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.71 1uio h LEU 62 CO 0.24 0.01 -0.22 0.00 0.09 0.00 0.00 178.44 178.56 1uio h ALA 63 N 1.99 1.05 -0.24 1.53 0.00 -1.62 -3.04 119.26 118.93 1uio h ALA 63 Ca -0.00 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 54.78 1uio h ALA 63 Cb 0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1uio h ALA 63 CO 0.00 0.27 0.26 0.87 0.00 0.00 0.00 179.25 180.65 1uio h LYS 64 N 0.00 0.00 0.00 0.00 1.79 -1.63 0.55 116.57 117.28 1uio h LYS 64 Ca -0.00 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 1uio h LYS 64 Cb 0.70 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.35 1uio h LYS 64 CO 0.03 0.00 -0.18 0.74 -1.08 0.00 0.00 179.45 178.95 1uio h PHE 65 N 0.00 0.00 -1.00 -1.35 -1.00 -1.74 -2.94 116.94 108.91 1uio h PHE 65 Ca 0.11 0.00 0.14 0.00 2.81 0.00 0.00 57.97 61.03 1uio h PHE 65 Cb 0.63 0.00 -0.09 0.00 3.61 0.00 0.00 35.95 40.10 1uio h PHE 65 CO 0.00 0.18 0.63 -0.44 -1.61 0.00 0.00 178.31 177.07 1uio h ASP 66 N 0.00 0.89 -0.63 2.17 3.32 -1.11 0.23 116.42 121.29 1uio h ASP 66 Ca -0.00 0.06 0.07 0.00 0.02 0.00 0.00 57.03 57.18 1uio h ASP 66 Cb 0.45 -0.11 -0.06 0.00 0.22 0.00 0.00 39.33 39.83 1uio h ASP 66 CO 0.02 0.43 0.31 1.88 -1.72 0.00 0.00 179.24 180.17 1uio h TYR 67 N 0.93 0.56 0.00 4.55 0.05 -1.67 -3.39 116.97 118.01 1uio h TYR 67 Ca 0.52 0.03 -0.04 0.00 0.05 0.00 0.00 58.73 59.28 1uio h TYR 67 Cb 0.60 -0.16 -0.01 0.00 1.01 0.00 0.00 36.73 38.18 1uio h TYR 67 CO -0.00 0.23 -1.24 2.48 -1.05 0.00 0.00 178.16 178.58 1uio n TYR 68 N -4.87 0.00 -0.33 4.88 4.11 -1.09 -4.54 117.16 115.32 1uio n TYR 68 Ca 0.08 0.00 0.20 0.00 -0.00 0.00 0.00 57.90 58.18 1uio n TYR 68 Cb 0.21 -0.16 0.45 0.00 -0.00 0.00 0.00 39.34 39.84 1uio n TYR 68 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.86 177.38 1uio h MET 69 N 0.00 0.49 0.00 -3.48 2.86 -1.13 -0.55 114.93 113.11 1uio h MET 69 Ca -0.06 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.54 1uio h MET 69 Cb 0.81 -0.11 -0.00 0.00 0.06 0.00 0.00 31.60 32.36 1uio h MET 69 CO 0.00 0.32 -0.01 -1.35 1.06 0.00 0.00 176.91 176.93 1uio h PRO 70 N 0.50 0.00 0.00 -0.22 0.11 -1.79 0.55 132.00 131.14 1uio h PRO 70 Ca 0.60 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.71 1uio h PRO 70 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1uio h PRO 70 CO -0.36 0.01 -0.29 -0.39 -0.21 0.00 0.00 178.00 176.76 1uio h VAL 71 N 0.00 0.00 0.00 3.15 -1.51 -1.42 -3.38 116.25 113.10 1uio h VAL 71 Ca -0.00 -0.92 -0.14 0.00 -1.23 0.00 0.00 66.70 64.40 1uio h VAL 71 Cb 0.03 1.77 -0.02 0.00 -2.13 0.00 0.00 31.29 30.94 1uio h VAL 71 CO 0.00 0.00 -1.19 -0.38 -1.23 0.00 0.00 177.57 174.77 1uio n ILE 72 N -2.86 1.49 -1.46 7.19 2.08 -0.70 -4.68 119.36 120.42 1uio n ILE 72 Ca 0.03 0.03 -0.43 0.00 0.56 0.00 0.00 62.75 62.94 1uio n ILE 72 Cb 0.52 -2.21 -0.00 0.00 -0.75 0.00 0.00 39.64 37.20 1uio n ILE 72 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1uio n ALA 73 N -3.92 -1.55 -0.05 -1.39 0.00 0.10 -1.15 120.51 112.56 1uio n ALA 73 Ca -0.24 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1uio n ALA 73 Cb 0.54 -1.78 0.00 0.00 0.00 0.00 0.00 19.45 18.22 1uio n ALA 73 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uio n GLY 74 N 1.76 1.40 3.39 0.00 0.00 0.15 -4.95 105.19 106.94 1uio n GLY 74 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 1uio n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uio h ARG 76 N 8.61 0.39 -0.66 0.00 3.08 -1.92 0.01 114.38 123.89 1uio h ARG 76 Ca -0.27 -0.02 0.09 0.00 0.07 0.00 0.00 59.98 59.85 1uio h ARG 76 Cb 1.11 -0.09 -0.07 0.00 0.08 0.00 0.00 29.97 31.00 1uio h ARG 76 CO 0.78 0.26 0.31 1.49 -1.07 0.00 0.00 179.97 181.73 1uio h GLU 77 N 0.40 0.52 -0.23 0.04 4.81 -1.95 -2.08 114.58 116.08 1uio h GLU 77 Ca 0.21 -0.03 -0.15 0.00 -0.13 0.00 0.00 59.36 59.26 1uio h GLU 77 Cb 0.17 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1uio h GLU 77 CO -0.18 0.34 -0.46 0.00 -0.73 0.00 0.00 179.01 177.98 1uio h ALA 78 N 1.41 0.76 -0.46 2.92 0.00 -1.58 -2.27 119.26 120.03 1uio h ALA 78 Ca 0.32 -0.47 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1uio h ALA 78 Cb 0.34 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1uio h ALA 78 CO -0.27 0.67 -0.06 0.82 0.00 0.00 0.00 179.25 180.41 1uio h ILE 79 N 0.48 1.27 -0.22 0.00 2.04 -0.60 -1.72 117.51 118.76 1uio h ILE 79 Ca 0.03 -1.15 -0.12 0.00 1.00 0.00 0.00 64.86 64.62 1uio h ILE 79 Cb 0.99 1.08 -0.00 0.00 -0.74 0.00 0.00 36.82 38.15 1uio h ILE 79 CO 0.09 0.40 -0.32 0.50 0.00 0.00 0.00 178.15 178.82 1uio h LYS 80 N 0.70 0.60 -0.33 2.37 3.64 -1.41 -3.23 116.57 118.90 1uio h LYS 80 Ca 0.12 -0.35 -0.00 0.00 -1.27 0.00 0.00 60.65 59.15 1uio h LYS 80 Cb 0.58 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.42 1uio h LYS 80 CO 0.03 0.96 0.20 -0.09 -2.27 0.00 0.00 179.45 178.28 1uio h ARG 81 N 0.28 0.44 0.00 1.90 2.43 -1.35 -0.67 114.38 117.41 1uio h ARG 81 Ca 0.02 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 1uio h ARG 81 Cb 0.90 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.35 1uio h ARG 81 CO 0.07 0.34 -0.15 -0.84 -1.51 0.00 0.00 179.97 177.88 1uio h ILE 82 N 0.42 0.92 0.09 1.20 3.07 -1.39 0.13 117.51 121.94 1uio h ILE 82 Ca 0.12 -0.57 -0.00 0.00 1.55 0.00 0.00 64.86 65.95 1uio h ILE 82 Cb 0.01 1.32 0.00 0.00 -0.27 0.00 0.00 36.82 37.88 1uio h ILE 82 CO -0.02 0.15 -0.04 0.00 -1.05 0.00 0.00 178.15 177.19 1uio h ALA 83 N 1.85 -0.12 -0.50 0.16 0.00 -1.46 -1.63 119.26 117.56 1uio h ALA 83 Ca -0.00 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.70 1uio h ALA 83 Cb 0.31 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1uio h ALA 83 CO 0.02 -0.29 0.25 -0.92 0.00 0.00 0.00 179.25 178.31 1uio h TYR 84 N -0.68 0.45 0.00 0.00 3.20 -0.50 -1.07 116.97 118.37 1uio h TYR 84 Ca -0.01 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 1uio h TYR 84 Cb 0.54 -0.13 -0.00 0.00 1.54 0.00 0.00 36.73 38.68 1uio h TYR 84 CO 0.10 0.22 -0.04 0.93 -1.64 0.00 0.00 178.16 177.73 1uio h GLU 85 N 0.48 0.00 -0.19 1.82 5.08 -0.80 -2.98 114.58 117.99 1uio h GLU 85 Ca 0.22 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.52 1uio h GLU 85 Cb 0.13 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 1uio h GLU 85 CO -0.16 0.04 -0.11 0.35 -1.00 0.00 0.00 179.01 178.13 1uio h PHE 86 N 0.00 0.47 -0.17 4.33 3.57 -0.18 -2.25 116.94 122.72 1uio h PHE 86 Ca -0.00 -0.12 0.01 0.00 3.53 0.00 0.00 57.97 61.39 1uio h PHE 86 Cb 0.52 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.14 1uio h PHE 86 CO 0.00 0.72 0.08 0.28 -2.23 0.00 0.00 178.31 177.16 1uio h VAL 87 N 0.09 1.00 -0.72 1.41 2.07 -1.35 -1.61 116.25 117.14 1uio h VAL 87 Ca 0.04 -0.06 0.15 0.00 0.82 0.00 0.00 66.70 67.65 1uio h VAL 87 Cb 0.60 0.80 -0.10 0.00 -1.52 0.00 0.00 31.29 31.07 1uio h VAL 87 CO 0.03 0.03 0.22 -0.08 0.02 0.00 0.00 177.57 177.79 1uio h GLU 88 N 0.18 0.32 -0.64 1.57 4.81 -1.54 0.46 114.58 119.75 1uio h GLU 88 Ca 0.07 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.19 1uio h GLU 88 Cb 0.01 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 1uio h GLU 88 CO -0.05 0.21 0.05 0.52 -0.73 0.00 0.00 179.01 179.01 1uio h MET 89 N 0.33 1.09 -0.25 1.92 2.86 -0.84 -2.01 114.93 118.03 1uio h MET 89 Ca 0.40 -0.32 -0.18 0.00 -2.06 0.00 0.00 59.70 57.54 1uio h MET 89 Cb 0.64 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.20 1uio h MET 89 CO -0.45 1.03 -0.55 0.87 1.06 0.00 0.00 176.91 178.87 1uio h LYS 90 N 1.00 0.82 0.06 1.72 1.79 -0.31 -2.82 116.57 118.83 1uio h LYS 90 Ca 0.19 -0.54 0.02 0.00 -2.18 0.00 0.00 60.65 58.13 1uio h LYS 90 Cb 0.51 0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.21 1uio h LYS 90 CO 0.02 1.17 -0.15 0.00 -1.08 0.00 0.00 179.45 179.41 1uio h ALA 91 N 0.64 -0.23 -0.08 3.86 0.00 -0.05 0.04 119.26 123.44 1uio h ALA 91 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1uio h ALA 91 Cb 1.16 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.20 1uio h ALA 91 CO 0.12 -0.66 0.09 0.87 0.00 0.00 0.00 179.25 179.66 1uio h LYS 92 N -0.28 0.00 -0.00 0.00 1.57 -1.39 0.02 116.57 116.49 1uio h LYS 92 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1uio h LYS 92 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1uio h LYS 92 CO -0.11 0.00 -0.02 0.39 -0.57 0.00 0.00 179.45 179.14 1uio n GLU 93 N -3.94 0.70 -2.20 3.15 1.02 -0.03 -4.90 120.64 114.43 1uio n GLU 93 Ca -0.01 -0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 1uio n GLU 93 Cb 0.19 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 1uio n GLU 93 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1uio n GLY 94 N 1.19 0.81 3.70 0.62 0.00 -0.01 -4.92 105.19 106.58 1uio n GLY 94 Ca 0.18 -0.70 -0.35 0.00 0.00 0.00 0.00 46.02 45.15 1uio n GLY 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uio s VAL 95 N -2.65 5.11 -0.10 1.61 1.01 -1.02 -0.42 120.40 123.94 1uio s VAL 95 Ca 0.00 0.08 0.19 0.00 0.00 0.00 0.00 61.98 62.24 1uio s VAL 95 Cb 0.00 -3.31 -0.27 0.00 0.00 0.00 0.00 36.38 32.80 1uio s VAL 95 CO 0.00 0.47 0.26 1.33 0.00 0.00 0.00 175.10 177.16 1uio n VAL 96 N 3.39 0.62 -3.79 2.92 0.24 -0.09 -4.46 118.33 117.16 1uio n VAL 96 Ca -0.17 -0.62 -0.13 0.00 -2.04 0.00 0.00 64.34 61.38 1uio n VAL 96 Cb 0.52 -0.22 -0.13 0.00 -1.47 0.00 0.00 33.84 32.54 1uio n VAL 96 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1uio s TYR 97 N -2.94 -0.18 -0.10 6.34 5.04 -1.22 -1.27 117.35 123.00 1uio s TYR 97 Ca -0.08 0.47 -0.10 0.00 -2.44 0.00 0.00 57.07 54.92 1uio s TYR 97 Cb 0.09 0.02 0.03 0.00 0.35 0.00 0.00 41.96 42.45 1uio s TYR 97 CO 0.81 -0.12 0.28 0.54 -1.34 0.00 0.00 175.55 175.72 1uio s VAL 98 N 0.45 -0.00 -0.33 3.14 0.11 -0.84 -1.87 120.40 121.06 1uio s VAL 98 Ca -0.03 0.00 -0.07 0.00 -2.93 0.00 0.00 61.98 58.95 1uio s VAL 98 Cb -0.04 -0.39 0.03 0.00 -1.53 0.00 0.00 36.38 34.44 1uio s VAL 98 CO -0.02 0.00 0.11 -1.61 -3.33 0.00 0.00 175.10 170.25 1uio s GLU 99 N 0.16 2.82 -0.13 1.54 2.02 -0.28 -0.47 118.70 124.36 1uio s GLU 99 Ca -0.00 -1.05 -0.15 0.00 0.02 0.00 0.00 54.97 53.80 1uio s GLU 99 Cb -0.02 -3.47 -0.05 0.00 0.10 0.00 0.00 34.13 30.70 1uio s GLU 99 CO 0.00 -0.59 0.35 0.08 0.02 0.00 0.00 175.26 175.12 1uio s VAL 100 N 1.46 5.25 0.29 2.63 1.01 0.13 -4.16 120.40 127.01 1uio s VAL 100 Ca 0.00 0.67 0.08 0.00 0.00 0.00 0.00 61.98 62.73 1uio s VAL 100 Cb -0.19 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 1uio s VAL 100 CO 0.03 0.41 0.17 0.00 0.00 0.00 0.00 175.10 175.71 1uio s ARG 101 N 0.25 2.66 -0.29 2.72 1.70 0.03 -0.76 118.95 125.27 1uio s ARG 101 Ca 0.20 -1.26 -0.38 0.00 -0.47 0.00 0.00 55.73 53.82 1uio s ARG 101 Cb -0.14 -2.40 0.16 0.00 -0.57 0.00 0.00 34.95 32.00 1uio s ARG 101 CO 0.07 0.27 1.38 1.52 -1.08 0.00 0.00 175.30 177.46 1uio s TYR 102 N -2.26 -0.02 -0.23 5.89 -0.85 -0.89 -0.24 117.35 118.75 1uio s TYR 102 Ca 0.35 0.01 -0.17 0.00 -0.52 0.00 0.00 57.07 56.74 1uio s TYR 102 Cb -0.06 0.50 -0.03 0.00 0.38 0.00 0.00 41.96 42.75 1uio s TYR 102 CO 0.24 -0.03 0.49 0.45 -1.52 0.00 0.00 175.55 175.18 1uio s SER 103 N -1.92 6.46 0.34 -0.18 0.15 -1.26 -0.97 113.70 116.31 1uio s SER 103 Ca 0.11 0.55 0.16 0.00 0.70 0.00 0.00 55.95 57.47 1uio s SER 103 Cb -0.01 -2.27 0.55 0.00 -1.71 0.00 0.00 66.02 62.57 1uio s SER 103 CO -0.03 -0.21 1.68 1.55 1.20 0.00 0.00 173.24 177.43 1uio h PRO 104 N 7.76 0.00 -0.58 5.44 0.13 -1.91 -3.25 132.00 139.59 1uio h PRO 104 Ca -0.32 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.76 1uio h PRO 104 Cb 1.15 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.26 1uio h PRO 104 CO 0.72 0.46 0.17 0.45 -0.23 0.00 0.00 178.00 179.57 1uio h HIS 105 N 0.00 0.95 0.00 1.56 3.86 -1.91 -2.88 115.15 116.74 1uio h HIS 105 Ca -0.00 -0.10 0.00 0.00 -1.16 0.00 0.00 60.37 59.10 1uio h HIS 105 Cb 0.99 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 29.19 1uio h HIS 105 CO 0.00 0.80 0.00 1.28 0.86 0.00 0.00 177.93 180.87 1uio n LEU 106 N -4.41 0.00 0.00 2.43 4.77 -1.23 -1.75 117.00 116.82 1uio n LEU 106 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1uio n LEU 106 Cb 0.22 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1uio n LEU 106 CO 0.40 0.00 0.21 0.18 -1.33 0.00 0.00 177.39 176.85 1uio n LEU 107 N -0.71 0.77 -4.91 2.23 4.77 -1.09 -4.74 117.00 113.31 1uio n LEU 107 Ca 0.04 -0.77 -0.29 0.00 -0.03 0.00 0.00 56.01 54.97 1uio n LEU 107 Cb 0.02 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 1uio n LEU 107 CO 0.03 0.19 0.19 0.00 -1.33 0.00 0.00 177.39 176.47 1uio s ALA 108 N -0.14 3.64 -0.10 -1.18 0.00 -0.72 -0.67 121.76 122.60 1uio s ALA 108 Ca 0.00 -0.57 0.15 0.00 0.00 0.00 0.00 51.96 51.53 1uio s ALA 108 Cb 0.00 -2.28 0.31 0.00 0.00 0.00 0.00 23.12 21.15 1uio s ALA 108 CO 0.00 0.28 1.15 0.27 0.00 0.00 0.00 175.76 177.46 1uio n ASN 109 N -0.86 1.35 -3.55 0.00 0.23 0.30 -4.50 115.26 108.22 1uio n ASN 109 Ca -0.02 -2.86 -0.16 0.00 -0.53 0.00 0.00 54.58 51.02 1uio n ASN 109 Cb 0.54 -0.38 -0.06 0.00 -2.08 0.00 0.00 39.78 37.79 1uio n ASN 109 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1uio s SER 110 N -2.40 -0.60 -1.57 0.53 0.15 -1.03 0.35 113.70 109.12 1uio s SER 110 Ca 0.28 0.75 -0.01 0.00 0.70 0.00 0.00 55.95 57.67 1uio s SER 110 Cb 0.28 0.62 0.01 0.00 -1.71 0.00 0.00 66.02 65.22 1uio s SER 110 CO -0.06 -0.49 0.16 0.29 1.20 0.00 0.00 173.24 174.34 1uio n LYS 111 N 1.15 -2.57 -4.26 5.44 4.01 -1.26 -3.96 118.16 116.71 1uio n LYS 111 Ca -0.16 0.88 -0.19 0.00 -0.51 0.00 0.00 58.31 58.33 1uio n LYS 111 Cb 0.57 -5.58 -0.13 0.00 -0.51 0.00 0.00 35.03 29.38 1uio n LYS 111 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1uio s VAL 112 N -2.98 1.09 -0.20 -0.18 1.01 -1.26 -4.76 120.40 113.11 1uio s VAL 112 Ca 0.09 -1.13 -0.08 0.00 0.00 0.00 0.00 61.98 60.85 1uio s VAL 112 Cb -0.04 -1.02 0.09 0.00 0.00 0.00 0.00 36.38 35.41 1uio s VAL 112 CO 0.11 -0.11 0.45 -0.62 0.00 0.00 0.00 175.10 174.92 1uio s ASP 113 N -1.42 -0.42 0.38 3.32 2.15 -1.26 -3.98 116.67 115.45 1uio s ASP 113 Ca -0.00 1.04 -0.26 0.00 0.43 0.00 0.00 52.55 53.76 1uio s ASP 113 Cb -0.09 1.30 -0.09 0.00 -0.30 0.00 0.00 42.92 43.74 1uio s ASP 113 CO 0.02 -0.22 1.21 -2.84 -0.17 0.00 0.00 175.17 173.16 1uio s PRO 114 N 2.32 4.13 0.08 4.34 0.02 -1.26 -4.94 135.00 139.69 1uio s PRO 114 Ca -0.04 1.95 -0.31 0.00 0.02 0.00 0.00 61.00 62.62 1uio s PRO 114 Cb -0.11 -2.80 -0.09 0.00 0.02 0.00 0.00 34.50 31.53 1uio s PRO 114 CO -0.14 -0.28 1.76 1.41 -0.33 0.00 0.00 177.00 179.42 1uio s MET 115 N -2.13 4.17 0.50 5.54 -2.45 -1.26 -4.94 119.30 118.72 1uio s MET 115 Ca 0.55 2.46 -0.22 0.00 -1.25 0.00 0.00 55.69 57.23 1uio s MET 115 Cb -0.33 -3.69 -0.06 0.00 1.25 0.00 0.00 34.83 31.99 1uio s MET 115 CO 0.43 -0.81 1.20 -2.14 1.05 0.00 0.00 175.02 174.75 1uio s PRO 116 N 2.99 3.52 -1.18 4.11 0.02 -1.26 -3.61 135.00 139.59 1uio s PRO 116 Ca 0.78 1.84 0.00 0.00 0.02 0.00 0.00 61.00 63.65 1uio s PRO 116 Cb -0.42 -2.29 0.00 0.00 0.02 0.00 0.00 34.50 31.81 1uio s PRO 116 CO 0.35 -0.77 0.00 0.91 -0.33 0.00 0.00 177.00 177.16 1uio n TRP 117 N -0.79 -1.32 -4.12 6.54 7.02 -1.26 -2.22 117.44 121.28 1uio n TRP 117 Ca 0.09 0.00 -0.29 0.00 -1.02 0.00 0.00 57.50 56.28 1uio n TRP 117 Cb 0.48 -2.95 -0.05 0.00 -2.42 0.00 0.00 31.31 26.37 1uio n TRP 117 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 1uio n ASN 118 N -1.81 0.06 -4.90 -0.99 4.13 -1.24 -4.89 115.26 105.63 1uio n ASN 118 Ca -0.16 -1.14 -0.29 0.00 1.68 0.00 0.00 54.58 54.67 1uio n ASN 118 Cb 0.62 -2.36 0.03 0.00 -1.54 0.00 0.00 39.78 36.54 1uio n ASN 118 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1uio s GLN 119 N -6.95 3.03 -0.19 3.52 -0.21 -0.94 -5.04 119.66 112.88 1uio s GLN 119 Ca 0.02 0.32 -0.15 0.00 0.02 0.00 0.00 55.36 55.57 1uio s GLN 119 Cb -0.01 -2.14 -0.04 0.00 1.00 0.00 0.00 33.01 31.81 1uio s GLN 119 CO 0.94 -0.79 0.37 0.99 -2.12 0.00 0.00 175.29 174.68 1uio s THR 120 N -3.16 5.23 0.31 -0.19 2.01 -1.26 -4.97 115.64 113.60 1uio s THR 120 Ca 0.55 0.65 -0.14 0.00 0.31 0.00 0.00 61.69 63.07 1uio s THR 120 Cb -0.11 -3.70 -0.11 0.00 0.01 0.00 0.00 72.50 68.59 1uio s THR 120 CO 0.49 0.28 0.00 -0.62 -0.69 0.00 0.00 174.62 174.08 1uio n GLU 121 N 4.29 0.00 0.00 4.92 -0.58 -1.26 -4.94 120.64 123.07 1uio n GLU 121 Ca -0.09 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.65 1uio n GLU 121 Cb 0.51 -0.70 0.00 0.00 -0.57 0.00 0.00 31.44 30.68 1uio n GLU 121 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1uio n GLY 122 N 1.68 4.09 0.00 0.62 0.00 0.15 -4.99 105.19 106.75 1uio n GLY 122 Ca 0.07 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1uio n GLY 122 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1uio n ASP 123 N 0.00 1.15 -4.52 1.61 5.68 -1.26 -4.59 116.55 114.62 1uio n ASP 123 Ca 0.00 -1.34 -0.42 0.00 -0.50 0.00 0.00 54.79 52.53 1uio n ASP 123 Cb 0.00 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 39.95 1uio n ASP 123 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1uio s VAL 124 N -0.34 4.16 0.70 2.12 1.01 -1.26 -4.89 120.40 121.90 1uio s VAL 124 Ca 0.00 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 60.95 1uio s VAL 124 Cb 0.00 -4.95 0.01 0.00 0.00 0.00 0.00 36.38 31.43 1uio s VAL 124 CO 0.00 -1.79 1.06 -0.89 0.00 0.00 0.00 175.10 173.48 1uio s THR 125 N 4.31 4.02 0.29 3.92 2.01 -1.26 -0.54 115.64 128.40 1uio s THR 125 Ca 0.41 0.66 0.00 0.00 0.31 0.00 0.00 61.69 63.07 1uio s THR 125 Cb -0.03 -3.41 0.28 0.00 0.01 0.00 0.00 72.50 69.35 1uio s THR 125 CO -0.08 -0.86 1.89 -0.65 -0.69 0.00 0.00 174.62 174.23 1uio h PRO 126 N -0.71 1.02 -0.48 4.92 0.11 -1.83 -1.17 132.00 133.86 1uio h PRO 126 Ca -0.44 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 1uio h PRO 126 Cb 1.21 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 32.07 1uio h PRO 126 CO 0.57 0.67 0.24 0.22 -0.21 0.00 0.00 178.00 179.50 1uio h ASP 127 N 1.05 0.61 -0.71 -2.05 1.82 -1.93 -1.86 116.42 113.35 1uio h ASP 127 Ca 0.43 -0.11 0.08 0.00 -0.39 0.00 0.00 57.03 57.04 1uio h ASP 127 Cb 0.28 -0.16 -0.05 0.00 0.68 0.00 0.00 39.33 40.08 1uio h ASP 127 CO -0.18 0.55 0.47 0.44 -1.61 0.00 0.00 179.24 178.91 1uio h ASP 128 N 0.63 0.58 -0.25 2.28 5.19 -1.61 -1.79 116.42 121.44 1uio h ASP 128 Ca 0.17 0.01 -0.03 0.00 -0.62 0.00 0.00 57.03 56.55 1uio h ASP 128 Cb 0.09 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.48 1uio h ASP 128 CO -0.02 0.36 0.04 0.58 -3.12 0.00 0.00 179.24 177.07 1uio h VAL 129 N 0.65 1.23 -0.19 -1.35 2.07 -0.48 -1.60 116.25 116.59 1uio h VAL 129 Ca 0.32 -0.79 0.02 0.00 0.82 0.00 0.00 66.70 67.07 1uio h VAL 129 Cb 0.38 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 1uio h VAL 129 CO -0.11 0.25 0.04 0.58 0.02 0.00 0.00 177.57 178.35 1uio h VAL 130 N 0.23 0.91 -0.54 2.57 2.07 -1.00 -0.43 116.25 120.06 1uio h VAL 130 Ca 0.08 -0.04 0.07 0.00 0.82 0.00 0.00 66.70 67.62 1uio h VAL 130 Cb 0.34 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 30.84 1uio h VAL 130 CO 0.01 0.02 0.23 -0.78 0.02 0.00 0.00 177.57 177.07 1uio h ASP 131 N 0.12 0.28 -0.16 0.57 1.82 -1.31 0.17 116.42 117.91 1uio h ASP 131 Ca 0.09 0.05 -0.00 0.00 -0.39 0.00 0.00 57.03 56.78 1uio h ASP 131 Cb 0.08 0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.10 1uio h ASP 131 CO -0.12 0.18 0.09 -0.07 -1.61 0.00 0.00 179.24 177.72 1uio h LEU 132 N 0.43 0.19 -0.32 2.28 -0.00 -0.61 -1.50 115.31 115.79 1uio h LEU 132 Ca 0.25 -0.06 -0.01 0.00 -0.00 0.00 0.00 57.88 58.07 1uio h LEU 132 Cb 0.24 -0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 40.84 1uio h LEU 132 CO -0.23 0.19 0.16 0.58 -0.00 0.00 0.00 178.44 179.15 1uio h VAL 133 N 0.17 1.15 -0.18 1.22 2.07 -0.72 -1.14 116.25 118.82 1uio h VAL 133 Ca 0.06 -0.41 0.05 0.00 0.82 0.00 0.00 66.70 67.21 1uio h VAL 133 Cb 0.04 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 30.59 1uio h VAL 133 CO -0.01 0.15 -0.14 0.78 0.02 0.00 0.00 177.57 178.37 1uio h ASN 134 N 0.38 -0.46 -0.88 0.57 -0.26 -0.83 0.33 115.58 114.43 1uio h ASN 134 Ca 0.11 0.09 0.04 0.00 -0.56 0.00 0.00 56.30 55.99 1uio h ASN 134 Cb 0.10 0.23 -0.06 0.00 -1.06 0.00 0.00 38.32 37.53 1uio h ASN 134 CO -0.02 -0.18 0.56 1.56 -1.06 0.00 0.00 177.43 178.29 1uio h GLN 135 N -0.15 1.03 -0.16 0.81 4.20 -1.14 0.20 115.11 119.91 1uio h GLN 135 Ca 0.11 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.72 1uio h GLN 135 Cb 0.31 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 1uio h GLN 135 CO -0.27 0.68 -0.05 0.78 -0.67 0.00 0.00 178.83 179.30 1uio h GLY 136 N 1.06 0.34 0.89 3.46 0.00 -0.14 -2.14 103.07 106.55 1uio h GLY 136 Ca 0.36 -0.29 0.03 0.00 0.00 0.00 0.00 47.33 47.43 1uio h GLY 136 CO -0.14 0.27 0.43 1.41 0.00 0.00 0.00 176.54 178.51 1uio h LEU 137 N 0.00 0.72 0.04 3.11 3.38 0.01 -1.28 115.31 121.29 1uio h LEU 137 Ca 0.04 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1uio h LEU 137 Cb 0.50 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1uio h LEU 137 CO 0.02 0.50 -0.02 1.56 0.09 0.00 0.00 178.44 180.59 1uio h GLN 138 N 0.85 -0.06 -0.42 1.13 4.20 -0.64 -0.52 115.11 119.66 1uio h GLN 138 Ca 0.27 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.99 1uio h GLN 138 Cb -0.00 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 1uio h GLN 138 CO -0.10 0.07 0.28 0.93 -0.67 0.00 0.00 178.83 179.35 1uio h GLU 139 N -0.17 0.54 -0.14 1.46 5.08 -1.19 -1.35 114.58 118.81 1uio h GLU 139 Ca -0.01 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.24 1uio h GLU 139 Cb 0.15 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 1uio h GLU 139 CO 0.01 0.36 -0.24 0.78 -1.00 0.00 0.00 179.01 178.92 1uio h GLY 140 N 0.55 0.45 0.47 -3.84 0.00 -0.66 -3.00 103.07 97.06 1uio h GLY 140 Ca 0.16 -0.52 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 1uio h GLY 140 CO -0.04 0.47 -0.44 0.83 0.00 0.00 0.00 176.54 177.36 1uio h GLU 141 N 0.03 -0.80 -0.66 4.80 5.08 -0.70 0.22 114.58 122.55 1uio h GLU 141 Ca 0.01 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1uio h GLU 141 Cb 0.82 0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.25 1uio h GLU 141 CO 0.05 -0.54 0.00 1.04 -1.00 0.00 0.00 179.01 178.57 1uio n GLN 142 N -5.51 0.33 0.00 2.33 6.02 -0.54 0.70 117.38 120.71 1uio n GLN 142 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.89 1uio n GLN 142 Cb 0.41 -1.21 0.00 0.00 1.02 0.00 0.00 30.24 30.47 1uio n GLN 142 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1uio n ALA 143 N 0.45 0.55 0.11 -1.58 0.00 -0.49 -4.84 120.51 114.71 1uio n ALA 143 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1uio n ALA 143 Cb 0.10 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.56 1uio n ALA 143 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1uio n PHE 144 N -0.35 0.00 -3.67 0.00 3.72 0.67 -5.04 117.46 112.79 1uio n PHE 144 Ca 0.00 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.15 1uio n PHE 144 Cb 0.00 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.61 1uio n PHE 144 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1uio n GLY 145 N 0.25 -0.51 3.42 1.37 0.00 0.22 -4.93 105.19 105.01 1uio n GLY 145 Ca 0.01 0.23 -0.23 0.00 0.00 0.00 0.00 46.02 46.02 1uio n GLY 145 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1uio s ILE 146 N -3.33 2.25 -0.06 -0.61 -4.36 -1.24 -5.05 121.20 108.80 1uio s ILE 146 Ca 0.54 -2.23 -0.17 0.00 -0.26 0.00 0.00 60.65 58.53 1uio s ILE 146 Cb -0.25 -2.16 -0.05 0.00 1.25 0.00 0.00 42.46 41.25 1uio s ILE 146 CO 0.76 -0.36 0.45 -0.75 0.24 0.00 0.00 174.94 175.28 1uio s LYS 147 N -3.25 4.18 -0.03 0.37 2.47 -0.40 -4.43 119.74 118.65 1uio s LYS 147 Ca 0.25 0.44 0.01 0.00 -1.56 0.00 0.00 55.97 55.10 1uio s LYS 147 Cb -0.05 -3.34 0.02 0.00 -1.46 0.00 0.00 37.83 33.00 1uio s LYS 147 CO 0.11 0.39 -0.02 0.08 0.16 0.00 0.00 175.35 176.08 1uio s VAL 148 N -0.14 0.30 0.43 4.02 1.01 -1.26 -1.99 120.40 122.77 1uio s VAL 148 Ca 0.25 -0.03 0.05 0.00 0.00 0.00 0.00 61.98 62.26 1uio s VAL 148 Cb -0.16 -0.35 -0.06 0.00 0.00 0.00 0.00 36.38 35.81 1uio s VAL 148 CO 0.12 0.16 0.01 -0.13 0.00 0.00 0.00 175.10 175.25 1uio s ARG 149 N 0.76 1.99 0.14 2.72 1.81 0.38 -4.91 118.95 121.84 1uio s ARG 149 Ca -0.08 -2.16 0.05 0.00 -1.72 0.00 0.00 55.73 51.81 1uio s ARG 149 Cb -0.12 -1.55 -0.04 0.00 -0.45 0.00 0.00 34.95 32.79 1uio s ARG 149 CO -0.01 -0.13 -0.12 -1.54 -0.68 0.00 0.00 175.30 172.82 1uio s SER 150 N -3.73 1.90 -0.05 0.23 1.04 -0.02 -0.70 113.70 112.37 1uio s SER 150 Ca 0.28 -0.92 0.02 0.00 0.48 0.00 0.00 55.95 55.81 1uio s SER 150 Cb 0.08 -0.04 0.02 0.00 0.10 0.00 0.00 66.02 66.17 1uio s SER 150 CO 0.14 -0.24 -0.09 -0.63 0.98 0.00 0.00 173.24 173.40 1uio s ILE 151 N -2.78 0.85 -0.21 -1.02 1.01 0.06 -1.04 121.20 118.08 1uio s ILE 151 Ca 0.13 -0.32 -0.15 0.00 0.00 0.00 0.00 60.65 60.31 1uio s ILE 151 Cb -0.01 -0.80 -0.04 0.00 0.01 0.00 0.00 42.46 41.62 1uio s ILE 151 CO 0.02 0.29 0.38 -0.76 0.00 0.00 0.00 174.94 174.86 1uio s LEU 152 N 0.69 4.15 -0.07 2.97 1.43 -0.73 -2.09 118.68 125.02 1uio s LEU 152 Ca -0.12 0.48 -0.18 0.00 -1.03 0.00 0.00 54.13 53.27 1uio s LEU 152 Cb -0.14 -2.47 -0.05 0.00 0.03 0.00 0.00 46.19 43.56 1uio s LEU 152 CO 0.02 -0.06 0.50 0.00 0.23 0.00 0.00 176.35 177.04 1uio s MET 155 N -3.17 3.43 0.34 0.00 -1.94 -1.26 -0.39 119.30 116.31 1uio s MET 155 Ca 0.51 -0.64 0.14 0.00 -1.71 0.00 0.00 55.69 53.98 1uio s MET 155 Cb -0.11 -2.80 1.01 0.00 2.01 0.00 0.00 34.83 34.95 1uio s MET 155 CO 0.23 0.09 1.71 0.00 -0.01 0.00 0.00 175.02 177.03 1uio h ARG 156 N 7.14 0.43 0.00 2.03 3.08 -1.25 -1.44 114.38 124.37 1uio h ARG 156 Ca -0.32 -0.03 -0.13 0.00 0.07 0.00 0.00 59.98 59.58 1uio h ARG 156 Cb 1.19 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 31.13 1uio h ARG 156 CO 0.59 0.29 -0.60 1.25 -1.07 0.00 0.00 179.97 180.43 1uio h HIS 157 N 0.45 0.00 -2.36 3.04 2.76 -1.89 -3.39 115.15 113.76 1uio h HIS 157 Ca 0.68 0.00 -0.64 0.00 -2.20 0.00 0.00 60.37 58.21 1uio h HIS 157 Cb 1.48 0.00 -0.39 0.00 1.55 0.00 0.00 27.41 30.05 1uio h HIS 157 CO -0.01 0.60 -0.33 1.04 -1.30 0.00 0.00 177.93 177.93 1uio n GLN 158 N -3.38 2.88 0.33 5.26 1.13 -0.54 -4.91 117.38 118.16 1uio n GLN 158 Ca 0.01 -4.65 0.22 0.00 -1.94 0.00 0.00 57.00 50.63 1uio n GLN 158 Cb 0.72 -2.31 1.18 0.00 0.11 0.00 0.00 30.24 29.94 1uio n GLN 158 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1uio h PRO 159 N 4.45 0.00 0.00 -1.09 0.13 -1.76 -1.54 132.00 132.19 1uio h PRO 159 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 1uio h PRO 159 Cb 0.65 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.78 1uio h PRO 159 CO 0.93 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.36 1uio h SER 160 N 0.00 0.00 0.54 1.44 4.64 -1.92 -1.53 113.55 116.72 1uio h SER 160 Ca 0.00 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.17 1uio h SER 160 Cb 0.02 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.08 1uio h SER 160 CO -0.00 0.00 -1.58 0.79 -0.87 0.00 0.00 176.83 175.17 1uio n TRP 161 N -2.38 0.72 -0.21 4.77 8.01 -0.58 -4.66 117.44 123.11 1uio n TRP 161 Ca 0.00 0.23 0.01 0.00 -1.31 0.00 0.00 57.50 56.44 1uio n TRP 161 Cb 0.16 -0.98 0.10 0.00 -2.01 0.00 0.00 31.31 28.57 1uio n TRP 161 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.69 177.45 1uio h SER 162 N 0.00 -0.37 0.22 -0.99 0.02 -1.38 -2.17 113.55 108.87 1uio h SER 162 Ca -0.18 0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1uio h SER 162 Cb 1.53 0.31 -0.00 0.00 0.14 0.00 0.00 62.40 64.38 1uio h SER 162 CO 0.03 -0.15 -0.09 -0.07 -1.14 0.00 0.00 176.83 175.41 1uio h LEU 163 N 0.08 0.00 0.07 5.07 3.38 -1.76 -1.11 115.31 121.03 1uio h LEU 163 Ca 0.33 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 58.05 1uio h LEU 163 Cb 0.53 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1uio h LEU 163 CO -0.58 0.09 -1.17 -0.08 0.09 0.00 0.00 178.44 176.80 1uio h GLU 164 N 0.00 0.14 -0.11 1.13 4.81 -1.71 -2.01 114.58 116.83 1uio h GLU 164 Ca -0.00 -0.24 -0.00 0.00 -0.13 0.00 0.00 59.36 58.99 1uio h GLU 164 Cb 0.22 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 1uio h GLU 164 CO 0.01 1.09 0.06 0.28 -0.73 0.00 0.00 179.01 179.73 1uio h VAL 165 N 0.04 1.07 -0.88 0.32 2.07 -0.89 -0.18 116.25 117.80 1uio h VAL 165 Ca -0.09 -0.19 0.13 0.00 0.82 0.00 0.00 66.70 67.37 1uio h VAL 165 Cb 1.89 1.00 -0.09 0.00 -1.52 0.00 0.00 31.29 32.57 1uio h VAL 165 CO 0.16 0.06 0.49 0.25 0.02 0.00 0.00 177.57 178.56 1uio h LEU 166 N 0.10 0.66 -1.08 2.57 5.85 -1.28 0.15 115.31 122.28 1uio h LEU 166 Ca 0.04 0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.74 1uio h LEU 166 Cb 0.05 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1uio h LEU 166 CO -0.01 0.32 -0.29 -0.33 -0.34 0.00 0.00 178.44 177.80 1uio h GLU 167 N 0.75 0.30 -0.11 1.25 4.39 -0.58 -1.32 114.58 119.25 1uio h GLU 167 Ca 0.46 -0.11 -0.13 0.00 0.34 0.00 0.00 59.36 59.91 1uio h GLU 167 Cb 0.55 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 1uio h GLU 167 CO -0.31 0.56 -0.51 -0.07 -1.16 0.00 0.00 179.01 177.52 1uio h LEU 168 N 0.26 0.32 -0.18 1.33 4.07 0.10 -0.77 115.31 120.45 1uio h LEU 168 Ca 0.04 -0.16 -0.04 0.00 0.08 0.00 0.00 57.88 57.79 1uio h LEU 168 Cb 0.65 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 42.29 1uio h LEU 168 CO 0.05 0.78 -0.06 0.00 -1.08 0.00 0.00 178.44 178.12 1uio h LYS 170 N 0.05 -0.36 -0.54 0.00 1.57 -1.12 0.17 116.57 116.35 1uio h LYS 170 Ca 0.04 0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 1uio h LYS 170 Cb 0.52 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 1uio h LYS 170 CO 0.02 -0.24 0.13 -0.22 -0.57 0.00 0.00 179.45 178.58 1uio h LYS 171 N -0.37 0.82 -0.45 3.15 3.64 -1.17 -2.92 116.57 119.27 1uio h LYS 171 Ca -0.00 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 1uio h LYS 171 Cb 0.34 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1uio h LYS 171 CO -0.02 0.74 0.00 0.66 -2.27 0.00 0.00 179.45 178.55 1uio n TYR 172 N -4.28 1.64 -1.71 1.91 4.01 -0.31 -4.95 117.16 113.48 1uio n TYR 172 Ca 0.04 -0.79 -0.59 0.00 -0.16 0.00 0.00 57.90 56.40 1uio n TYR 172 Cb 0.22 -0.44 -0.08 0.00 -0.31 0.00 0.00 39.34 38.74 1uio n TYR 172 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1uio n ASN 173 N 0.17 2.26 0.00 7.72 2.85 0.58 -0.38 115.26 128.46 1uio n ASN 173 Ca 0.25 1.07 0.00 0.00 -0.11 0.00 0.00 54.58 55.79 1uio n ASN 173 Cb 1.08 -1.11 0.00 0.00 1.24 0.00 0.00 39.78 40.99 1uio n ASN 173 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1uio n GLN 174 N 5.36 0.00 -1.76 1.20 1.13 0.13 -4.67 117.38 118.77 1uio n GLN 174 Ca 0.28 0.00 -0.33 0.00 -1.94 0.00 0.00 57.00 55.01 1uio n GLN 174 Cb 0.11 -4.01 -0.03 0.00 0.11 0.00 0.00 30.24 26.42 1uio n GLN 174 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1uio n LYS 175 N -1.69 3.33 0.00 -1.09 5.02 0.48 -4.52 118.16 119.69 1uio n LYS 175 Ca 0.00 -2.95 0.00 0.00 -2.02 0.00 0.00 58.31 53.34 1uio n LYS 175 Cb 0.00 -2.33 0.00 0.00 -0.02 0.00 0.00 35.03 32.68 1uio n LYS 175 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1uio n THR 176 N 0.97 0.00 -2.78 -0.18 -2.24 -1.25 -4.90 114.28 103.90 1uio n THR 176 Ca 0.54 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.89 1uio n THR 176 Cb 0.41 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.61 1uio n THR 176 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1uio s VAL 177 N -0.72 4.69 -0.35 2.28 1.01 -0.92 -0.84 120.40 125.55 1uio s VAL 177 Ca 0.00 1.60 0.09 0.00 0.00 0.00 0.00 61.98 63.67 1uio s VAL 177 Cb 0.00 -4.26 -0.10 0.00 0.00 0.00 0.00 36.38 32.02 1uio s VAL 177 CO 0.00 -0.27 0.34 1.33 0.00 0.00 0.00 175.10 176.50 1uio n VAL 178 N 5.54 0.00 -3.82 2.92 0.24 -0.20 0.18 118.33 123.18 1uio n VAL 178 Ca 0.08 -0.28 -0.06 0.00 -2.04 0.00 0.00 64.34 62.05 1uio n VAL 178 Cb 0.47 0.90 -0.01 0.00 -1.47 0.00 0.00 33.84 33.73 1uio n VAL 178 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1uio s ALA 179 N -1.94 -1.35 -0.00 2.33 0.00 -1.25 -3.85 121.76 115.69 1uio s ALA 179 Ca 0.02 -0.21 0.08 0.00 0.00 0.00 0.00 51.96 51.85 1uio s ALA 179 Cb 0.06 0.74 -0.02 0.00 0.00 0.00 0.00 23.12 23.90 1uio s ALA 179 CO 0.36 -1.04 -0.24 1.41 0.00 0.00 0.00 175.76 176.26 1uio s MET 180 N -3.34 2.10 0.39 0.00 1.75 -0.74 -1.78 119.30 117.67 1uio s MET 180 Ca 0.13 -0.94 0.05 0.00 -1.25 0.00 0.00 55.69 53.68 1uio s MET 180 Cb -0.04 -2.09 -0.07 0.00 2.84 0.00 0.00 34.83 35.47 1uio s MET 180 CO 0.06 0.56 0.03 0.34 -0.65 0.00 0.00 175.02 175.36 1uio s ASP 181 N -0.84 3.32 -0.32 1.11 2.15 -0.49 -0.93 116.67 120.67 1uio s ASP 181 Ca 0.11 -1.40 -0.01 0.00 0.43 0.00 0.00 52.55 51.68 1uio s ASP 181 Cb -0.10 -0.20 0.10 0.00 -0.30 0.00 0.00 42.92 42.42 1uio s ASP 181 CO 0.00 -0.55 0.11 -0.22 -0.17 0.00 0.00 175.17 174.34 1uio s LEU 182 N -3.64 2.22 0.56 -1.34 2.96 -1.23 -0.84 118.68 117.37 1uio s LEU 182 Ca 0.33 -1.69 0.04 0.00 -0.22 0.00 0.00 54.13 52.60 1uio s LEU 182 Cb 0.09 -0.86 0.04 0.00 0.50 0.00 0.00 46.19 45.96 1uio s LEU 182 CO 0.16 -0.41 0.36 0.00 -1.32 0.00 0.00 176.35 175.14 1uio s ALA 183 N 1.56 4.48 0.00 5.97 0.00 0.48 -2.57 121.76 131.67 1uio s ALA 183 Ca 0.10 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 51.07 1uio s ALA 183 Cb -0.18 -0.62 0.00 0.00 0.00 0.00 0.00 23.12 22.32 1uio s ALA 183 CO -0.24 -0.41 0.00 0.41 0.00 0.00 0.00 175.76 175.52 1uio n GLY 184 N -1.74 -0.09 3.51 0.00 0.00 -1.26 -0.68 105.19 104.92 1uio n GLY 184 Ca -0.05 -2.06 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 1uio n GLY 184 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1uio s ASP 185 N -4.00 6.22 0.12 1.61 -1.08 -1.26 -4.83 116.67 113.46 1uio s ASP 185 Ca 0.00 -0.84 0.15 0.00 -0.52 0.00 0.00 52.55 51.34 1uio s ASP 185 Cb 0.00 -2.50 0.68 0.00 -1.46 0.00 0.00 42.92 39.64 1uio s ASP 185 CO 0.00 -1.62 1.47 1.21 0.52 0.00 0.00 175.17 176.75 1uio n GLU 186 N 8.54 0.08 0.19 4.34 2.13 -1.26 -1.93 120.64 132.72 1uio n GLU 186 Ca 0.04 0.41 0.08 0.00 0.66 0.00 0.00 57.16 58.36 1uio n GLU 186 Cb 0.48 -1.68 0.14 0.00 0.27 0.00 0.00 31.44 30.65 1uio n GLU 186 CO 0.00 0.00 0.00 1.79 -0.41 0.00 0.00 177.13 178.51 1uio h THR 187 N 0.00 0.39 -1.27 6.31 1.35 -1.95 -3.44 112.91 114.30 1uio h THR 187 Ca 0.00 -1.49 -0.37 0.00 -0.55 0.00 0.00 66.41 63.99 1uio h THR 187 Cb 0.19 2.15 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 1uio h THR 187 CO 0.00 0.22 1.34 -0.38 -0.25 0.00 0.00 175.52 176.45 1uio n ILE 188 N -3.17 -0.07 -1.62 6.82 5.41 -0.82 -4.82 119.36 121.10 1uio n ILE 188 Ca 0.03 -0.71 -0.59 0.00 1.00 0.00 0.00 62.75 62.49 1uio n ILE 188 Cb 0.60 -2.51 -0.08 0.00 -0.71 0.00 0.00 39.64 36.94 1uio n ILE 188 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1uio n GLU 189 N 8.90 0.54 -0.91 0.38 2.13 -1.26 -1.40 120.64 129.03 1uio n GLU 189 Ca 0.41 0.20 0.00 0.00 0.66 0.00 0.00 57.16 58.42 1uio n GLU 189 Cb 0.50 -1.77 0.00 0.00 0.27 0.00 0.00 31.44 30.43 1uio n GLU 189 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1uio n GLY 190 N 2.79 0.43 0.31 8.31 0.00 -1.26 -4.88 105.19 110.88 1uio n GLY 190 Ca 0.23 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.37 1uio n GLY 190 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1uio h SER 191 N 0.00 0.01 0.30 1.61 4.64 -1.56 0.10 113.55 118.65 1uio h SER 191 Ca 0.00 -0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1uio h SER 191 Cb 0.23 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 1uio h SER 191 CO 0.00 0.01 -0.23 0.28 -0.87 0.00 0.00 176.83 176.02 1uio h SER 192 N 0.01 0.00 -0.02 4.97 0.02 -1.90 -3.07 113.55 113.58 1uio h SER 192 Ca 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1uio h SER 192 Cb 0.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.91 1uio h SER 192 CO -0.00 0.23 -0.04 0.18 -1.14 0.00 0.00 176.83 176.06 1uio n LEU 193 N -4.09 2.39 -4.70 5.07 4.32 0.33 -4.50 117.00 115.83 1uio n LEU 193 Ca -0.02 -0.80 -0.43 0.00 -0.02 0.00 0.00 56.01 54.73 1uio n LEU 193 Cb 0.30 -0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.08 1uio n LEU 193 CO 0.36 0.40 1.09 0.49 -1.22 0.00 0.00 177.39 178.51 1uio n PHE 194 N 0.82 2.42 -0.23 -1.77 3.72 -1.11 -4.72 117.46 116.59 1uio n PHE 194 Ca 0.15 0.38 -0.03 0.00 -0.05 0.00 0.00 57.45 57.90 1uio n PHE 194 Cb 0.51 -2.51 0.03 0.00 -0.94 0.00 0.00 39.48 36.57 1uio n PHE 194 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1uio h PRO 195 N 4.30 -0.10 -0.83 -1.08 0.11 -1.93 -1.12 132.00 131.34 1uio h PRO 195 Ca -0.46 0.01 0.17 0.00 0.11 0.00 0.00 66.00 65.83 1uio h PRO 195 Cb 1.26 0.02 -0.10 0.00 0.11 0.00 0.00 31.00 32.29 1uio h PRO 195 CO 0.76 -0.07 0.38 0.78 -0.21 0.00 0.00 178.00 179.64 1uio h GLY 196 N -0.10 1.35 0.53 -0.55 0.00 -1.90 0.30 103.07 102.69 1uio h GLY 196 Ca 0.28 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.40 1uio h GLY 196 CO -0.73 -0.13 -0.17 0.45 0.00 0.00 0.00 176.54 175.96 1uio h HIS 197 N 0.50 -0.44 -0.53 5.60 3.86 -1.46 -1.59 115.15 121.08 1uio h HIS 197 Ca 0.48 -0.01 0.11 0.00 -1.16 0.00 0.00 60.37 59.78 1uio h HIS 197 Cb 0.77 0.15 -0.11 0.00 1.06 0.00 0.00 27.41 29.28 1uio h HIS 197 CO -0.13 -0.12 -0.23 0.28 0.86 0.00 0.00 177.93 178.59 1uio h VAL 198 N -0.96 0.31 -0.23 2.45 2.07 -0.77 0.58 116.25 119.70 1uio h VAL 198 Ca -0.05 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.40 1uio h VAL 198 Cb 0.52 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1uio h VAL 198 CO 0.08 0.00 -0.16 -0.33 0.02 0.00 0.00 177.57 177.18 1uio h GLU 199 N -0.10 0.39 -0.51 1.57 5.08 -0.47 -0.53 114.58 120.01 1uio h GLU 199 Ca 0.24 -0.11 -0.12 0.00 -1.00 0.00 0.00 59.36 58.37 1uio h GLU 199 Cb 0.49 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 1uio h GLU 199 CO -0.60 0.55 -0.17 0.00 -1.00 0.00 0.00 179.01 177.79 1uio h ALA 200 N 1.48 0.73 -0.21 3.43 0.00 0.08 -2.66 119.26 122.11 1uio h ALA 200 Ca 0.07 -0.38 -0.12 0.00 0.00 0.00 0.00 54.91 54.48 1uio h ALA 200 Cb 0.50 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1uio h ALA 200 CO 0.03 0.67 -0.34 1.88 0.00 0.00 0.00 179.25 181.50 1uio h TYR 201 N 0.88 0.74 -0.75 0.00 -1.99 -0.53 -2.17 116.97 113.16 1uio h TYR 201 Ca 0.12 -0.26 0.19 0.00 2.00 0.00 0.00 58.73 60.79 1uio h TYR 201 Cb 0.74 -0.14 -0.04 0.00 2.00 0.00 0.00 36.73 39.29 1uio h TYR 201 CO 0.05 0.99 0.52 0.93 -0.00 0.00 0.00 178.16 180.65 1uio h GLU 202 N 0.28 0.18 0.00 4.88 5.08 -1.06 0.81 114.58 124.75 1uio h GLU 202 Ca 0.02 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 1uio h GLU 202 Cb 0.93 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.13 1uio h GLU 202 CO 0.08 0.12 -0.67 0.78 -1.00 0.00 0.00 179.01 178.31 1uio h GLY 203 N 0.18 0.00 0.96 -3.84 0.00 -1.32 -2.45 103.07 96.61 1uio h GLY 203 Ca 0.37 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.56 1uio h GLY 203 CO -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 176.54 176.06 1uio h ALA 204 N 1.77 0.33 0.04 3.60 0.00 0.12 -1.48 119.26 123.65 1uio h ALA 204 Ca -0.03 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 1uio h ALA 204 Cb 1.20 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1uio h ALA 204 CO 0.02 0.45 -0.02 0.28 0.00 0.00 0.00 179.25 179.98 1uio h VAL 205 N 0.35 0.99 0.00 0.00 2.07 -0.81 0.15 116.25 119.00 1uio h VAL 205 Ca 0.01 -0.10 -0.05 0.00 0.82 0.00 0.00 66.70 67.37 1uio h VAL 205 Cb 1.02 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 1uio h VAL 205 CO 0.09 0.03 -0.26 0.07 0.02 0.00 0.00 177.57 177.52 1uio h LYS 206 N -0.10 0.00 -0.66 1.57 2.10 -1.44 -2.68 116.57 115.36 1uio h LYS 206 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 1uio h LYS 206 Cb 0.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.41 1uio h LYS 206 CO 0.01 0.26 0.00 0.09 -2.00 0.00 0.00 179.45 177.81 1uio n ASN 207 N -3.81 4.03 -3.33 7.07 3.02 -0.56 -4.96 115.26 116.72 1uio n ASN 207 Ca -0.01 -2.12 -0.23 0.00 -0.03 0.00 0.00 54.58 52.18 1uio n ASN 207 Cb 0.35 -0.48 0.06 0.00 -0.61 0.00 0.00 39.78 39.11 1uio n ASN 207 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uio n GLY 208 N 1.35 -0.51 3.65 7.41 0.00 -0.32 -4.98 105.19 111.79 1uio n GLY 208 Ca 0.23 0.19 -0.37 0.00 0.00 0.00 0.00 46.02 46.07 1uio n GLY 208 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uio s ILE 209 N -3.26 5.29 0.76 -0.61 -1.09 0.38 -5.03 121.20 117.62 1uio s ILE 209 Ca 0.48 0.36 -0.15 0.00 -2.23 0.00 0.00 60.65 59.11 1uio s ILE 209 Cb -0.21 -3.59 -0.00 0.00 -1.58 0.00 0.00 42.46 37.08 1uio s ILE 209 CO 0.59 0.29 0.74 1.41 -1.23 0.00 0.00 174.94 176.74 1uio n HIS 210 N 4.56 -0.13 -4.15 3.97 8.25 -1.25 -4.43 115.22 122.04 1uio n HIS 210 Ca -0.12 0.36 -0.20 0.00 -0.26 0.00 0.00 57.72 57.49 1uio n HIS 210 Cb 0.52 -1.98 -0.16 0.00 1.12 0.00 0.00 29.99 29.48 1uio n HIS 210 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1uio s ARG 211 N -3.21 0.86 0.11 -0.41 0.52 -1.26 -1.80 118.95 113.76 1uio s ARG 211 Ca 0.68 -0.11 0.05 0.00 -0.52 0.00 0.00 55.73 55.84 1uio s ARG 211 Cb -0.33 -0.88 -0.04 0.00 0.52 0.00 0.00 34.95 34.23 1uio s ARG 211 CO 0.56 -0.09 -0.13 -0.08 0.02 0.00 0.00 175.30 175.57 1uio s THR 212 N 0.98 1.21 -0.18 0.02 -1.32 -0.11 -0.96 115.64 115.29 1uio s THR 212 Ca -0.10 -1.66 -0.09 0.00 -1.21 0.00 0.00 61.69 58.63 1uio s THR 212 Cb -0.14 -1.45 0.07 0.00 -1.51 0.00 0.00 72.50 69.47 1uio s THR 212 CO -0.00 -0.43 0.41 -0.69 -2.21 0.00 0.00 174.62 171.69 1uio s VAL 213 N -2.14 -0.15 0.06 5.08 1.01 -1.09 -3.56 120.40 119.62 1uio s VAL 213 Ca 0.07 0.11 -0.31 0.00 0.00 0.00 0.00 61.98 61.85 1uio s VAL 213 Cb -0.05 -0.62 -0.06 0.00 0.00 0.00 0.00 36.38 35.65 1uio s VAL 213 CO 0.02 0.05 1.28 -1.00 0.00 0.00 0.00 175.10 175.44 1uio s HIS 214 N 1.66 3.31 -0.20 5.22 3.76 -1.06 0.19 115.29 128.16 1uio s HIS 214 Ca -0.08 1.14 -0.28 0.00 -0.15 0.00 0.00 55.06 55.70 1uio s HIS 214 Cb -0.09 -3.52 0.12 0.00 1.11 0.00 0.00 32.58 30.19 1uio s HIS 214 CO -0.13 -1.73 0.96 0.00 -0.85 0.00 0.00 174.74 173.00 1uio s ALA 215 N 1.27 -1.92 -0.08 -1.40 0.00 -0.62 -4.82 121.76 114.18 1uio s ALA 215 Ca 0.61 1.70 0.00 0.00 0.00 0.00 0.00 51.96 54.27 1uio s ALA 215 Cb -0.32 -0.96 0.00 0.00 0.00 0.00 0.00 23.12 21.84 1uio s ALA 215 CO 0.29 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.17 1uio n GLY 216 N 1.45 0.38 0.16 0.00 0.00 -1.26 -0.84 105.19 105.09 1uio n GLY 216 Ca -0.12 -0.07 -0.08 0.00 0.00 0.00 0.00 46.02 45.75 1uio n GLY 216 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1uio h GLU 217 N 0.57 -0.28 0.00 1.61 4.81 -1.91 -1.74 114.58 117.64 1uio h GLU 217 Ca -0.02 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1uio h GLU 217 Cb 0.38 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.83 1uio h GLU 217 CO 0.02 0.01 -0.01 1.33 -0.73 0.00 0.00 179.01 179.63 1uio n VAL 218 N -4.96 0.00 -2.15 0.32 0.24 -1.26 -4.44 118.33 106.08 1uio n VAL 218 Ca -0.06 -0.31 -0.28 0.00 -2.04 0.00 0.00 64.34 61.65 1uio n VAL 218 Cb 0.21 0.99 0.17 0.00 -1.47 0.00 0.00 33.84 33.74 1uio n VAL 218 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1uio s GLY 219 N -0.63 1.78 0.73 7.63 0.00 -1.26 -5.00 107.32 110.57 1uio s GLY 219 Ca 0.00 -1.42 -0.03 0.00 0.00 0.00 0.00 44.72 43.27 1uio s GLY 219 CO 0.00 -0.69 1.01 -1.35 0.00 0.00 0.00 173.10 172.07 1uio s SER 220 N -4.87 4.32 0.35 1.64 1.04 -1.26 -4.36 113.70 110.56 1uio s SER 220 Ca 0.72 -0.22 0.10 0.00 0.48 0.00 0.00 55.95 57.03 1uio s SER 220 Cb -0.04 -0.18 0.84 0.00 0.10 0.00 0.00 66.02 66.74 1uio s SER 220 CO 0.51 -1.88 1.84 -0.65 0.98 0.00 0.00 173.24 174.04 1uio h PRO 221 N -0.60 0.65 0.00 4.02 0.11 -1.93 0.34 132.00 134.59 1uio h PRO 221 Ca -0.38 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.68 1uio h PRO 221 Cb 1.27 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 1uio h PRO 221 CO 0.42 0.43 -0.05 1.49 -0.21 0.00 0.00 178.00 180.09 1uio h GLU 222 N 0.67 0.00 -0.35 1.05 4.57 -1.95 0.20 114.58 118.77 1uio h GLU 222 Ca 0.49 0.00 -0.13 0.00 -1.18 0.00 0.00 59.36 58.53 1uio h GLU 222 Cb 0.84 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.42 1uio h GLU 222 CO -0.24 0.05 -0.30 0.28 -1.18 0.00 0.00 179.01 177.61 1uio h VAL 223 N 0.00 1.28 -0.27 0.32 2.07 -1.28 -1.20 116.25 117.17 1uio h VAL 223 Ca -0.00 -1.47 -0.03 0.00 0.82 0.00 0.00 66.70 66.02 1uio h VAL 223 Cb 0.10 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1uio h VAL 223 CO 0.01 0.48 0.04 0.58 0.02 0.00 0.00 177.57 178.70 1uio h VAL 224 N 0.62 1.23 -0.98 2.57 2.07 -1.05 -1.71 116.25 119.01 1uio h VAL 224 Ca 0.06 -0.80 0.06 0.00 0.82 0.00 0.00 66.70 66.84 1uio h VAL 224 Cb 0.88 1.23 -0.06 0.00 -1.52 0.00 0.00 31.29 31.82 1uio h VAL 224 CO 0.08 0.26 0.64 -0.09 0.02 0.00 0.00 177.57 178.47 1uio h ARG 225 N 0.26 1.13 -0.04 1.57 2.43 -0.59 0.12 114.38 119.26 1uio h ARG 225 Ca 0.08 -0.07 -0.20 0.00 -0.81 0.00 0.00 59.98 58.99 1uio h ARG 225 Cb 0.34 -0.25 -0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1uio h ARG 225 CO 0.01 0.75 -0.81 0.93 -1.51 0.00 0.00 179.97 179.33 1uio h GLU 226 N 1.16 0.35 -0.24 0.20 5.08 -1.10 0.13 114.58 120.17 1uio h GLU 226 Ca 0.41 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1uio h GLU 226 Cb 0.14 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1uio h GLU 226 CO -0.16 0.99 0.14 0.00 -1.00 0.00 0.00 179.01 178.98 1uio h ALA 227 N 0.91 0.30 0.13 3.43 0.00 -0.16 0.22 119.26 124.10 1uio h ALA 227 Ca -0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1uio h ALA 227 Cb 1.41 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1uio h ALA 227 CO 0.13 -0.18 -0.06 0.28 0.00 0.00 0.00 179.25 179.42 1uio h VAL 228 N 0.29 1.03 0.00 0.00 2.07 -1.06 -0.26 116.25 118.32 1uio h VAL 228 Ca 0.09 -1.05 -0.23 0.00 0.82 0.00 0.00 66.70 66.32 1uio h VAL 228 Cb 0.04 1.64 -0.04 0.00 -1.52 0.00 0.00 31.29 31.41 1uio h VAL 228 CO -0.02 0.23 -1.22 0.44 0.02 0.00 0.00 177.57 177.03 1uio h ASP 229 N -0.71 0.00 0.00 0.57 3.32 -0.74 -2.38 116.42 116.48 1uio h ASP 229 Ca -0.02 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.65 1uio h ASP 229 Cb 0.52 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.00 1uio h ASP 229 CO 0.03 0.97 -2.42 -0.38 -1.72 0.00 0.00 179.24 175.72 1uio n ILE 230 N -3.23 1.42 0.28 0.35 5.41 0.63 -4.52 119.36 119.70 1uio n ILE 230 Ca -0.06 -0.51 0.12 0.00 1.00 0.00 0.00 62.75 63.30 1uio n ILE 230 Cb 0.97 -1.45 0.12 0.00 -0.71 0.00 0.00 39.64 38.56 1uio n ILE 230 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1uio h LEU 231 N -0.16 0.00 -0.96 1.39 4.07 -1.00 -3.47 115.31 115.18 1uio h LEU 231 Ca -0.57 -0.05 -0.29 0.00 0.08 0.00 0.00 57.88 57.05 1uio h LEU 231 Cb 1.81 0.00 0.11 0.00 1.08 0.00 0.00 40.66 43.66 1uio h LEU 231 CO -0.14 0.02 -0.52 0.29 -1.08 0.00 0.00 178.44 177.02 1uio n LYS 232 N -2.64 -5.90 -1.90 1.13 4.76 -0.22 -4.78 118.16 108.61 1uio n LYS 232 Ca 0.02 0.62 -0.37 0.00 -2.87 0.00 0.00 58.31 55.72 1uio n LYS 232 Cb 0.51 -5.04 0.04 0.00 -1.84 0.00 0.00 35.03 28.71 1uio n LYS 232 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1uio s THR 233 N -3.24 2.35 -0.14 -0.18 -4.23 -0.55 -4.83 115.64 104.82 1uio s THR 233 Ca 0.40 0.23 0.18 0.00 -1.18 0.00 0.00 61.69 61.33 1uio s THR 233 Cb -0.18 -3.10 -0.15 0.00 1.34 0.00 0.00 72.50 70.41 1uio s THR 233 CO 0.55 -0.03 0.75 -0.62 -0.54 0.00 0.00 174.62 174.72 1uio n GLU 234 N -1.42 0.63 -4.03 3.99 1.02 -0.13 -4.79 120.64 115.90 1uio n GLU 234 Ca 0.13 0.14 -0.08 0.00 -0.02 0.00 0.00 57.16 57.33 1uio n GLU 234 Cb 0.48 -1.75 -0.10 0.00 -0.02 0.00 0.00 31.44 30.04 1uio n GLU 234 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1uio s ARG 235 N -3.01 0.47 -0.22 3.49 0.52 -1.14 -4.20 118.95 114.87 1uio s ARG 235 Ca -0.04 -0.92 -0.03 0.00 -0.52 0.00 0.00 55.73 54.22 1uio s ARG 235 Cb 0.09 0.16 -0.00 0.00 0.52 0.00 0.00 34.95 35.72 1uio s ARG 235 CO 0.82 -0.08 -0.06 0.08 0.02 0.00 0.00 175.30 176.08 1uio s VAL 236 N -2.72 3.17 -0.05 3.52 1.01 -0.84 -2.65 120.40 121.84 1uio s VAL 236 Ca -0.04 -0.61 -0.30 0.00 0.00 0.00 0.00 61.98 61.03 1uio s VAL 236 Cb -0.01 -2.45 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 1uio s VAL 236 CO -0.06 0.41 1.17 -0.83 0.00 0.00 0.00 175.10 175.79 1uio s GLY 237 N 1.44 2.18 0.00 4.51 0.00 0.13 -0.92 107.32 114.66 1uio s GLY 237 Ca 0.05 0.61 0.00 0.00 0.00 0.00 0.00 44.72 45.38 1uio s GLY 237 CO -0.05 2.15 0.00 0.00 0.00 0.00 0.00 173.10 175.20 1uio n ALA 238 N 5.03 0.00 -0.91 3.20 0.00 0.12 -1.59 120.51 126.36 1uio n ALA 238 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1uio n ALA 238 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 1uio n ALA 238 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uio n GLY 239 N 0.00 0.21 0.40 0.00 0.00 -0.02 -4.50 105.19 101.28 1uio n GLY 239 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.22 1uio n GLY 239 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1uio h TYR 240 N 0.00 0.21 0.00 1.61 0.05 -1.73 -1.13 116.97 115.97 1uio h TYR 240 Ca 0.00 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.79 1uio h TYR 240 Cb 0.50 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 38.17 1uio h TYR 240 CO 0.31 0.07 0.00 0.72 -1.05 0.00 0.00 178.16 178.22 1uio n HIS 241 N -4.40 0.00 -0.20 4.88 8.25 -0.68 -3.37 115.22 119.70 1uio n HIS 241 Ca 0.14 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.59 1uio n HIS 241 Cb 0.67 -0.32 0.20 0.00 1.12 0.00 0.00 29.99 31.66 1uio n HIS 241 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1uio h THR 242 N 0.00 1.22 0.00 1.59 2.02 -1.48 -2.31 112.91 113.94 1uio h THR 242 Ca 0.00 -0.57 0.00 0.00 0.77 0.00 0.00 66.41 66.61 1uio h THR 242 Cb 0.26 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1uio h THR 242 CO 0.00 0.25 0.00 2.30 0.37 0.00 0.00 175.52 178.44 1uio n ILE 243 N -4.35 0.43 1.12 3.11 -5.35 -1.22 -0.48 119.36 112.62 1uio n ILE 243 Ca 0.07 0.11 0.13 0.00 -0.27 0.00 0.00 62.75 62.78 1uio n ILE 243 Cb 0.12 -1.02 0.41 0.00 -1.74 0.00 0.00 39.64 37.41 1uio n ILE 243 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1uio n GLU 244 N -1.13 0.27 -3.79 6.28 1.02 -0.87 -4.30 120.64 118.11 1uio n GLU 244 Ca 0.03 -0.12 -0.29 0.00 -0.02 0.00 0.00 57.16 56.76 1uio n GLU 244 Cb 0.03 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 29.82 1uio n GLU 244 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1uio s ASP 245 N -2.82 3.91 0.28 1.62 -1.08 0.36 -4.98 116.67 113.96 1uio s ASP 245 Ca 0.17 -3.02 -0.04 0.00 -0.52 0.00 0.00 52.55 49.14 1uio s ASP 245 Cb 0.19 -1.29 0.56 0.00 -1.46 0.00 0.00 42.92 40.91 1uio s ASP 245 CO 0.59 -0.21 1.59 -0.33 0.52 0.00 0.00 175.17 177.33 1uio h GLU 246 N 6.31 0.03 0.17 4.34 4.39 -1.77 0.81 114.58 128.86 1uio h GLU 246 Ca 0.02 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.71 1uio h GLU 246 Cb 0.88 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.53 1uio h GLU 246 CO 0.58 0.02 -0.08 0.00 -1.16 0.00 0.00 179.01 178.37 1uio h ALA 247 N 1.90 -0.23 -0.39 3.43 0.00 -1.93 -1.02 119.26 121.01 1uio h ALA 247 Ca 0.50 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.38 1uio h ALA 247 Cb 0.91 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.75 1uio h ALA 247 CO -0.88 -0.60 0.13 1.25 0.00 0.00 0.00 179.25 179.15 1uio h LEU 248 N -0.29 0.14 0.38 0.00 5.85 -1.37 -1.42 115.31 118.60 1uio h LEU 248 Ca -0.02 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1uio h LEU 248 Cb 0.22 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1uio h LEU 248 CO 0.04 0.12 -0.29 0.22 -0.34 0.00 0.00 178.44 178.18 1uio h TYR 249 N 0.29 -0.78 -0.90 1.25 3.20 -0.68 -1.11 116.97 118.24 1uio h TYR 249 Ca 0.18 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.20 1uio h TYR 249 Cb 0.16 0.29 -0.07 0.00 1.54 0.00 0.00 36.73 38.65 1uio h TYR 249 CO -0.15 -0.44 0.58 -0.91 -1.64 0.00 0.00 178.16 175.60 1uio h ASN 250 N -0.67 0.63 0.85 -2.11 -0.26 -0.80 0.30 115.58 113.53 1uio h ASN 250 Ca -0.03 0.04 -0.10 0.00 -0.56 0.00 0.00 56.30 55.65 1uio h ASN 250 Cb 0.58 -0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 37.75 1uio h ASN 250 CO -0.01 0.31 -0.48 -0.09 -1.06 0.00 0.00 177.43 176.10 1uio h ARG 251 N 0.67 0.00 0.12 0.81 2.43 -0.80 0.64 114.38 118.26 1uio h ARG 251 Ca 0.46 0.00 -0.27 0.00 -0.81 0.00 0.00 59.98 59.35 1uio h ARG 251 Cb 0.77 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.33 1uio h ARG 251 CO -0.21 0.48 -1.23 -0.07 -1.51 0.00 0.00 179.97 177.43 1uio h LEU 252 N 0.00 0.43 -0.12 3.80 4.07 0.60 -1.91 115.31 122.18 1uio h LEU 252 Ca -0.00 -0.46 0.00 0.00 0.08 0.00 0.00 57.88 57.50 1uio h LEU 252 Cb 1.04 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 42.63 1uio h LEU 252 CO 0.06 1.35 0.08 0.25 -1.08 0.00 0.00 178.44 179.10 1uio h LEU 253 N 0.08 0.14 0.14 1.67 5.85 -0.20 0.15 115.31 123.14 1uio h LEU 253 Ca -0.13 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.56 1uio h LEU 253 Cb 1.96 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.94 1uio h LEU 253 CO 0.20 0.12 -0.13 0.50 -0.34 0.00 0.00 178.44 178.80 1uio h LYS 254 N 0.14 -0.28 0.00 1.25 3.11 -0.88 -0.89 116.57 119.02 1uio h LYS 254 Ca 0.04 0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.90 1uio h LYS 254 Cb 0.01 0.06 0.00 0.00 -1.00 0.00 0.00 32.23 31.30 1uio h LYS 254 CO -0.01 -0.19 0.00 0.39 -2.81 0.00 0.00 179.45 176.83 1uio n GLU 255 N -5.25 0.04 -3.42 1.90 1.02 -0.72 -4.84 120.64 109.37 1uio n GLU 255 Ca -0.08 0.33 -0.20 0.00 -0.02 0.00 0.00 57.16 57.19 1uio n GLU 255 Cb 0.17 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.16 1uio n GLU 255 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1uio n ASN 256 N -1.41 -5.51 -4.75 1.62 4.05 -0.34 -4.95 115.26 103.97 1uio n ASN 256 Ca 0.02 -0.46 -0.41 0.00 0.45 0.00 0.00 54.58 54.17 1uio n ASN 256 Cb 0.06 -4.36 -0.02 0.00 1.23 0.00 0.00 39.78 36.70 1uio n ASN 256 CO 0.00 0.00 0.00 -0.32 -3.05 0.00 0.00 177.26 173.89 1uio s MET 257 N -6.06 4.12 -0.01 1.20 -2.45 -0.07 -4.81 119.30 111.23 1uio s MET 257 Ca 0.47 2.58 -0.25 0.00 -1.25 0.00 0.00 55.69 57.24 1uio s MET 257 Cb -0.21 -3.02 -0.04 0.00 1.25 0.00 0.00 34.83 32.81 1uio s MET 257 CO 0.62 -0.64 0.76 -1.58 1.05 0.00 0.00 175.02 175.23 1uio s HIS 258 N 0.02 3.66 -0.26 4.11 2.46 -1.26 -4.11 115.29 119.91 1uio s HIS 258 Ca 0.63 1.40 -0.05 0.00 0.47 0.00 0.00 55.06 57.51 1uio s HIS 258 Cb -0.48 -2.84 0.00 0.00 -0.13 0.00 0.00 32.58 29.13 1uio s HIS 258 CO 0.48 0.17 0.03 -0.06 -2.47 0.00 0.00 174.74 172.89 1uio s PHE 259 N 0.39 3.08 -0.93 3.88 0.08 0.62 -1.98 117.98 123.12 1uio s PHE 259 Ca 0.39 -0.96 -0.22 0.00 0.12 0.00 0.00 56.93 56.26 1uio s PHE 259 Cb -0.19 -2.19 0.07 0.00 -0.57 0.00 0.00 43.02 40.14 1uio s PHE 259 CO 0.21 -0.56 1.30 -1.21 -0.10 0.00 0.00 175.22 174.87 1uio s GLU 260 N 1.49 3.50 0.03 0.44 2.02 -0.09 -1.88 118.70 124.20 1uio s GLU 260 Ca 0.04 -1.14 -0.25 0.00 0.02 0.00 0.00 54.97 53.64 1uio s GLU 260 Cb -0.16 -4.99 -0.05 0.00 0.10 0.00 0.00 34.13 29.03 1uio s GLU 260 CO 0.00 -2.06 0.76 0.08 0.02 0.00 0.00 175.26 174.07 1uio s VAL 261 N 4.43 4.79 -0.40 2.63 1.01 -0.84 0.16 120.40 132.18 1uio s VAL 261 Ca 0.39 1.62 0.02 0.00 0.00 0.00 0.00 61.98 64.01 1uio s VAL 261 Cb -0.04 -4.11 0.11 0.00 0.00 0.00 0.00 36.38 32.35 1uio s VAL 261 CO -0.05 0.34 0.15 0.00 0.00 0.00 0.00 175.10 175.54 1uio h PRO 263 N 7.27 -1.03 0.08 0.00 0.11 -1.91 -2.64 132.00 133.89 1uio h PRO 263 Ca -0.06 0.07 0.02 0.00 0.11 0.00 0.00 66.00 66.13 1uio h PRO 263 Cb 0.97 0.23 -0.03 0.00 0.11 0.00 0.00 31.00 32.29 1uio h PRO 263 CO 0.54 -0.68 -0.17 2.35 -0.21 0.00 0.00 178.00 179.82 1uio h TRP 264 N -1.07 -0.45 -1.01 0.65 -0.00 -1.90 -2.41 115.95 109.76 1uio h TRP 264 Ca -0.10 0.01 0.25 0.00 -0.00 0.00 0.00 58.89 59.05 1uio h TRP 264 Cb 0.83 0.19 -0.09 0.00 -0.00 0.00 0.00 29.16 30.09 1uio h TRP 264 CO -0.05 -0.26 0.65 1.03 -0.00 0.00 0.00 178.44 179.81 1uio h SER 265 N -0.33 0.48 0.55 2.65 0.87 -1.84 0.61 113.55 116.55 1uio h SER 265 Ca 0.03 0.08 -0.07 0.00 -1.23 0.00 0.00 61.79 60.59 1uio h SER 265 Cb 0.35 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.30 1uio h SER 265 CO -0.11 0.12 -0.35 0.77 -0.53 0.00 0.00 176.83 176.73 1uio h SER 266 N 0.44 0.00 0.00 6.23 4.64 -1.04 -2.24 113.55 121.58 1uio h SER 266 Ca 0.57 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.88 1uio h SER 266 Cb 1.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.47 1uio h SER 266 CO -0.29 0.35 -0.03 0.22 -0.87 0.00 0.00 176.83 176.22 1uio h TYR 267 N 0.00 0.03 0.00 4.77 3.20 -0.86 0.82 116.97 124.93 1uio h TYR 267 Ca -0.00 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1uio h TYR 267 Cb 0.72 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.99 1uio h TYR 267 CO 0.00 0.81 0.00 1.28 -1.64 0.00 0.00 178.16 178.61 1uio n LEU 268 N -4.68 0.48 -0.27 2.82 4.32 -1.01 -2.24 117.00 116.41 1uio n LEU 268 Ca -0.09 0.65 0.04 0.00 -0.02 0.00 0.00 56.01 56.59 1uio n LEU 268 Cb 0.40 -0.63 0.02 0.00 -1.62 0.00 0.00 43.42 41.60 1uio n LEU 268 CO 0.34 -0.61 0.32 0.35 -1.22 0.00 0.00 177.39 176.56 1uio n THR 269 N -2.07 0.00 -1.08 -5.08 -2.24 -0.85 -2.12 114.28 100.84 1uio n THR 269 Ca 0.01 -0.47 -0.03 0.00 -2.27 0.00 0.00 64.05 61.29 1uio n THR 269 Cb 0.15 1.14 -0.01 0.00 -2.10 0.00 0.00 70.33 69.51 1uio n THR 269 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uio n GLY 270 N 0.57 0.56 0.23 3.38 0.00 -0.95 -3.50 105.19 105.48 1uio n GLY 270 Ca 0.04 -0.27 0.06 0.00 0.00 0.00 0.00 46.02 45.86 1uio n GLY 270 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uio h ALA 271 N 0.00 1.77 -3.24 4.61 0.00 -1.15 -3.39 119.26 117.87 1uio h ALA 271 Ca -0.06 -0.12 -0.55 0.00 0.00 0.00 0.00 54.91 54.18 1uio h ALA 271 Cb 0.39 -0.02 -0.35 0.00 0.00 0.00 0.00 17.79 17.81 1uio h ALA 271 CO 0.08 0.16 -0.82 -0.46 0.00 0.00 0.00 179.25 178.22 1uio s TRP 272 N -4.75 1.73 -0.33 0.00 -0.00 -0.09 -4.74 118.94 110.76 1uio s TRP 272 Ca -0.04 -0.84 -0.29 0.00 -0.00 0.00 0.00 56.10 54.93 1uio s TRP 272 Cb 0.16 -1.32 0.01 0.00 -0.00 0.00 0.00 33.47 32.32 1uio s TRP 272 CO 0.69 -0.49 1.22 0.34 -0.00 0.00 0.00 176.95 178.71 1uio s ASP 273 N 1.28 6.74 0.00 5.86 -1.08 -1.26 -4.54 116.67 123.66 1uio s ASP 273 Ca -0.02 1.07 0.00 0.00 -0.52 0.00 0.00 52.55 53.08 1uio s ASP 273 Cb -0.14 -2.54 0.01 0.00 -1.46 0.00 0.00 42.92 38.79 1uio s ASP 273 CO -0.05 -1.05 0.79 -2.65 0.52 0.00 0.00 175.17 172.74 1uio n PRO 274 N 7.26 0.00 0.00 4.34 -0.02 -1.26 -0.61 135.00 144.72 1uio n PRO 274 Ca 0.14 0.28 0.11 0.00 -2.02 0.00 0.00 63.50 62.01 1uio n PRO 274 Cb 0.47 -1.50 0.04 0.00 -0.02 0.00 0.00 33.50 32.49 1uio n PRO 274 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 1uio n LYS 275 N -1.29 0.05 -4.11 -0.52 2.85 -1.26 -4.93 118.16 108.95 1uio n LYS 275 Ca 0.00 -0.00 -0.22 0.00 -1.05 0.00 0.00 58.31 57.04 1uio n LYS 275 Cb 0.00 -1.51 -0.04 0.00 -0.65 0.00 0.00 35.03 32.82 1uio n LYS 275 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1uio s THR 276 N -3.04 4.45 0.16 0.58 -4.23 0.22 -5.10 115.64 108.69 1uio s THR 276 Ca 0.08 -1.39 -0.30 0.00 -1.18 0.00 0.00 61.69 58.91 1uio s THR 276 Cb 0.16 -3.40 -0.07 0.00 1.34 0.00 0.00 72.50 70.53 1uio s THR 276 CO 0.80 -0.34 1.11 -0.89 -0.54 0.00 0.00 174.62 174.77 1uio s THR 277 N -2.11 3.88 0.36 3.99 2.01 -1.26 -4.86 115.64 117.64 1uio s THR 277 Ca 0.33 1.59 -0.29 0.00 0.31 0.00 0.00 61.69 63.63 1uio s THR 277 Cb -0.08 -4.01 -0.11 0.00 0.01 0.00 0.00 72.50 68.31 1uio s THR 277 CO 0.25 0.25 1.51 -2.28 -0.69 0.00 0.00 174.62 173.66 1uio s HIS 278 N -0.07 2.63 0.57 4.92 2.46 -1.26 -4.87 115.29 119.66 1uio s HIS 278 Ca 0.51 1.08 0.40 0.00 0.47 0.00 0.00 55.06 57.52 1uio s HIS 278 Cb -0.29 -4.03 2.16 0.00 -0.13 0.00 0.00 32.58 30.28 1uio s HIS 278 CO 0.34 -3.13 2.29 0.00 -2.47 0.00 0.00 174.74 171.78 1uio h ALA 279 N 3.45 1.08 0.00 1.58 0.00 -1.94 -0.26 119.26 123.17 1uio h ALA 279 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1uio h ALA 279 Cb 1.23 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1uio h ALA 279 CO 0.68 0.01 0.00 1.55 0.00 0.00 0.00 179.25 181.49 1uio n VAL 280 N -3.21 0.56 -0.02 0.00 3.14 -1.26 -1.22 118.33 116.32 1uio n VAL 280 Ca -0.02 0.02 -0.15 0.00 -2.96 0.00 0.00 64.34 61.22 1uio n VAL 280 Cb 0.12 -0.78 -0.10 0.00 -1.06 0.00 0.00 33.84 32.01 1uio n VAL 280 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 1uio h VAL 281 N 0.00 1.47 -0.57 1.55 2.07 -1.40 -0.47 116.25 118.89 1uio h VAL 281 Ca 0.00 -1.86 -0.08 0.00 0.82 0.00 0.00 66.70 65.59 1uio h VAL 281 Cb 0.48 2.53 -0.02 0.00 -1.52 0.00 0.00 31.29 32.76 1uio h VAL 281 CO 0.00 0.53 0.05 -0.09 0.02 0.00 0.00 177.57 178.08 1uio h ARG 282 N -0.27 0.95 -0.21 1.57 2.43 -1.54 -0.30 114.38 117.00 1uio h ARG 282 Ca -0.03 -0.25 0.01 0.00 -0.81 0.00 0.00 59.98 58.89 1uio h ARG 282 Cb 1.04 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.46 1uio h ARG 282 CO 0.07 0.90 0.13 0.74 -1.51 0.00 0.00 179.97 180.30 1uio h PHE 283 N 0.88 0.25 -0.90 2.20 0.04 -1.11 0.20 116.94 118.50 1uio h PHE 283 Ca 0.17 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.95 1uio h PHE 283 Cb 0.44 -0.08 -0.04 0.00 2.20 0.00 0.00 35.95 38.47 1uio h PHE 283 CO 0.03 0.15 0.54 -0.22 -0.60 0.00 0.00 178.31 178.21 1uio h LYS 284 N 0.27 1.22 0.00 1.51 3.64 -0.63 0.14 116.57 122.72 1uio h LYS 284 Ca 0.08 -0.11 -0.10 0.00 -1.27 0.00 0.00 60.65 59.24 1uio h LYS 284 Cb -0.02 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 31.53 1uio h LYS 284 CO -0.03 0.86 -0.50 -0.91 -2.27 0.00 0.00 179.45 176.60 1uio h ASN 285 N 1.24 0.00 -0.37 4.20 2.35 -0.32 -2.67 115.58 120.01 1uio h ASN 285 Ca 0.32 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.07 1uio h ASN 285 Cb -0.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.32 1uio h ASN 285 CO -0.06 0.50 0.00 0.47 -1.65 0.00 0.00 177.43 176.69 1uio n ASP 286 N -3.56 2.75 -3.70 5.81 8.00 0.62 -4.95 116.55 121.53 1uio n ASP 286 Ca -0.00 -1.91 -0.26 0.00 0.71 0.00 0.00 54.79 53.32 1uio n ASP 286 Cb 0.59 -0.24 0.03 0.00 -0.02 0.00 0.00 41.12 41.48 1uio n ASP 286 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1uio n LYS 287 N 1.02 -2.61 -2.12 -1.24 4.76 -0.49 -4.95 118.16 112.52 1uio n LYS 287 Ca 0.18 0.52 -0.28 0.00 -2.87 0.00 0.00 58.31 55.87 1uio n LYS 287 Cb 0.48 -4.61 0.05 0.00 -1.84 0.00 0.00 35.03 29.12 1uio n LYS 287 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1uio s ALA 288 N -3.60 3.05 -0.45 7.82 0.00 0.36 -5.01 121.76 123.93 1uio s ALA 288 Ca 0.27 -0.64 -0.25 0.00 0.00 0.00 0.00 51.96 51.34 1uio s ALA 288 Cb -0.09 -2.78 0.02 0.00 0.00 0.00 0.00 23.12 20.28 1uio s ALA 288 CO 0.84 -1.16 0.87 1.21 0.00 0.00 0.00 175.76 177.52 1uio s ASN 289 N -4.42 6.48 -0.11 0.00 3.04 -1.26 -4.91 114.94 113.77 1uio s ASN 289 Ca 0.58 0.09 -0.26 0.00 0.04 0.00 0.00 52.86 53.30 1uio s ASN 289 Cb -0.11 -2.43 0.06 0.00 -1.54 0.00 0.00 41.25 37.24 1uio s ASN 289 CO 0.48 -0.98 0.62 -0.72 -3.04 0.00 0.00 177.10 173.46 1uio s TYR 290 N 3.55 -0.61 0.39 0.43 -0.85 -1.26 -0.28 117.35 118.72 1uio s TYR 290 Ca 0.34 1.21 0.08 0.00 -0.52 0.00 0.00 57.07 58.18 1uio s TYR 290 Cb -0.11 0.32 -0.03 0.00 0.38 0.00 0.00 41.96 42.52 1uio s TYR 290 CO 0.24 -0.50 0.31 -1.54 -1.52 0.00 0.00 175.55 172.54 1uio s SER 291 N -0.72 4.96 -0.17 -0.18 1.04 -0.79 -4.60 113.70 113.24 1uio s SER 291 Ca -0.08 -0.76 -0.00 0.00 0.48 0.00 0.00 55.95 55.60 1uio s SER 291 Cb -0.02 -0.64 0.00 0.00 0.10 0.00 0.00 66.02 65.46 1uio s SER 291 CO 0.06 -0.55 -0.15 -0.22 0.98 0.00 0.00 173.24 173.37 1uio s LEU 292 N -4.04 2.42 0.25 2.42 2.96 -1.26 -1.98 118.68 119.44 1uio s LEU 292 Ca 0.45 -0.52 0.04 0.00 -0.22 0.00 0.00 54.13 53.87 1uio s LEU 292 Cb -0.02 -1.56 -0.05 0.00 0.50 0.00 0.00 46.19 45.05 1uio s LEU 292 CO 0.26 0.04 0.00 0.20 -1.32 0.00 0.00 176.35 175.53 1uio s ASN 293 N 1.08 1.99 -0.16 3.68 0.01 0.22 -4.77 114.94 116.99 1uio s ASN 293 Ca -0.00 -1.24 0.08 0.00 -0.71 0.00 0.00 52.86 50.99 1uio s ASN 293 Cb -0.14 -0.02 -0.23 0.00 0.41 0.00 0.00 41.25 41.27 1uio s ASN 293 CO -0.05 -0.51 0.21 1.07 -1.51 0.00 0.00 177.10 176.31 1uio n THR 294 N -0.48 1.54 0.00 1.60 5.66 -1.22 -4.12 114.28 117.27 1uio n THR 294 Ca -0.04 -0.74 0.00 0.00 -3.05 0.00 0.00 64.05 60.22 1uio n THR 294 Cb 0.64 -1.07 0.00 0.00 -1.55 0.00 0.00 70.33 68.36 1uio n THR 294 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1uio n ASP 295 N -3.08 0.00 -3.34 1.09 2.03 -0.15 -4.19 116.55 108.90 1uio n ASP 295 Ca -0.32 0.00 -0.26 0.00 0.52 0.00 0.00 54.79 54.73 1uio n ASP 295 Cb 1.07 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 41.38 1uio n ASP 295 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1uio n ASP 296 N 3.77 -0.10 0.22 1.67 8.00 -1.26 0.84 116.55 129.69 1uio n ASP 296 Ca 0.00 -2.52 0.11 0.00 0.71 0.00 0.00 54.79 53.09 1uio n ASP 296 Cb 0.00 -0.59 0.67 0.00 -0.02 0.00 0.00 41.12 41.18 1uio n ASP 296 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1uio h PRO 297 N 5.08 0.00 0.82 -0.24 0.13 -1.46 -1.54 132.00 134.79 1uio h PRO 297 Ca 0.20 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.29 1uio h PRO 297 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1uio h PRO 297 CO 0.42 0.00 -0.47 1.25 -0.23 0.00 0.00 178.00 178.97 1uio h LEU 298 N 0.00 -1.16 -1.50 1.56 5.85 -1.25 0.10 115.31 118.90 1uio h LEU 298 Ca 0.04 0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.77 1uio h LEU 298 Cb 0.18 0.33 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 1uio h LEU 298 CO -0.00 -0.74 -0.25 0.40 -0.34 0.00 0.00 178.44 177.51 1uio h ILE 299 N -1.20 0.95 -0.02 4.05 2.04 -1.69 -2.26 117.51 119.37 1uio h ILE 299 Ca -0.11 -0.94 0.00 0.00 1.00 0.00 0.00 64.86 64.81 1uio h ILE 299 Cb 0.95 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 38.57 1uio h ILE 299 CO 0.14 0.25 -0.11 0.49 0.00 0.00 0.00 178.15 178.91 1uio n PHE 300 N -3.90 0.00 -3.68 1.37 3.72 -0.59 -1.71 117.46 112.66 1uio n PHE 300 Ca -0.02 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.12 1uio n PHE 300 Cb 0.33 -0.03 0.03 0.00 -0.94 0.00 0.00 39.48 38.88 1uio n PHE 300 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1uio n LYS 301 N 0.23 -2.61 -2.83 -1.08 5.02 -0.07 -4.82 118.16 112.01 1uio n LYS 301 Ca 0.15 0.53 -0.08 0.00 -2.02 0.00 0.00 58.31 56.90 1uio n LYS 301 Cb 0.42 -4.64 -0.03 0.00 -0.02 0.00 0.00 35.03 30.76 1uio n LYS 301 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1uio n SER 302 N -2.88 -0.39 -3.75 4.39 3.41 -0.66 -5.06 113.62 108.68 1uio n SER 302 Ca -0.18 -1.89 -0.14 0.00 -0.26 0.00 0.00 58.87 56.41 1uio n SER 302 Cb 0.63 0.83 -0.08 0.00 -0.26 0.00 0.00 64.21 65.34 1uio n SER 302 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1uio s THR 303 N -2.58 0.00 0.42 6.66 -1.32 -1.26 -4.76 115.64 112.80 1uio s THR 303 Ca 0.15 -1.82 0.11 0.00 -1.21 0.00 0.00 61.69 58.93 1uio s THR 303 Cb 0.00 -2.48 0.19 0.00 -1.51 0.00 0.00 72.50 68.70 1uio s THR 303 CO 0.11 0.00 1.98 0.25 -2.21 0.00 0.00 174.62 174.75 1uio h LEU 304 N 2.33 0.18 -1.71 9.08 5.85 -1.97 0.51 115.31 129.58 1uio h LEU 304 Ca -0.30 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.38 1uio h LEU 304 Cb 1.24 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 42.23 1uio h LEU 304 CO 0.43 0.28 -0.05 -0.78 -0.34 0.00 0.00 178.44 177.98 1uio h ASP 305 N 0.19 0.00 -0.32 1.25 3.58 -1.96 -2.27 116.42 116.89 1uio h ASP 305 Ca 0.04 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.46 1uio h ASP 305 Cb 0.25 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.29 1uio h ASP 305 CO 0.01 0.05 0.08 0.74 -2.88 0.00 0.00 179.24 177.25 1uio h THR 306 N 0.00 1.21 -0.08 2.25 2.02 -1.28 0.44 112.91 117.47 1uio h THR 306 Ca -0.00 -0.71 -0.12 0.00 0.77 0.00 0.00 66.41 66.34 1uio h THR 306 Cb 0.44 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 1uio h THR 306 CO 0.01 0.24 -0.50 0.44 0.37 0.00 0.00 175.52 176.07 1uio h ASP 307 N 0.36 0.23 -0.16 4.18 5.19 -1.51 -1.76 116.42 122.95 1uio h ASP 307 Ca 0.10 -0.11 -0.13 0.00 -0.62 0.00 0.00 57.03 56.27 1uio h ASP 307 Cb 0.28 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 39.73 1uio h ASP 307 CO -0.00 0.70 -0.41 1.88 -3.12 0.00 0.00 179.24 178.29 1uio h TYR 308 N 0.17 0.72 -0.34 4.55 -1.99 -0.97 -2.66 116.97 116.44 1uio h TYR 308 Ca 0.01 -0.28 -0.05 0.00 2.00 0.00 0.00 58.73 60.41 1uio h TYR 308 Cb 0.95 -0.13 -0.02 0.00 2.00 0.00 0.00 36.73 39.53 1uio h TYR 308 CO 0.02 1.03 0.00 1.96 -0.00 0.00 0.00 178.16 181.17 1uio h GLN 309 N 0.21 0.53 -0.20 4.88 1.08 -0.13 -0.89 115.11 120.59 1uio h GLN 309 Ca -0.00 -0.11 -0.04 0.00 -1.45 0.00 0.00 58.65 57.04 1uio h GLN 309 Cb 1.02 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 28.36 1uio h GLN 309 CO 0.09 0.56 -0.02 1.98 -0.95 0.00 0.00 178.83 180.48 1uio h MET 310 N 0.51 0.37 -0.30 1.46 4.05 -1.25 0.76 114.93 120.53 1uio h MET 310 Ca 0.11 -0.13 -0.10 0.00 -0.28 0.00 0.00 59.70 59.31 1uio h MET 310 Cb 0.33 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.10 1uio h MET 310 CO 0.01 0.59 -0.18 1.79 0.23 0.00 0.00 176.91 179.35 1uio h THR 311 N 0.10 1.30 0.23 -0.77 1.35 -1.32 0.66 112.91 114.45 1uio h THR 311 Ca 0.05 -1.30 -0.01 0.00 -0.55 0.00 0.00 66.41 64.60 1uio h THR 311 Cb 0.44 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 68.35 1uio h THR 311 CO 0.01 0.42 -0.13 0.50 -0.25 0.00 0.00 175.52 176.07 1uio h LYS 312 N 0.41 -0.32 -0.42 4.72 3.64 -1.14 0.41 116.57 123.87 1uio h LYS 312 Ca 0.06 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.50 1uio h LYS 312 Cb 0.72 0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.58 1uio h LYS 312 CO 0.05 -0.21 0.20 0.87 -2.27 0.00 0.00 179.45 178.09 1uio h LYS 313 N -0.33 0.40 0.00 1.90 6.56 -0.92 -2.84 116.57 121.33 1uio h LYS 313 Ca -0.03 -0.02 -0.07 0.00 -1.06 0.00 0.00 60.65 59.46 1uio h LYS 313 Cb 0.26 -0.09 -0.01 0.00 -0.57 0.00 0.00 32.23 31.82 1uio h LYS 313 CO 0.04 0.26 -2.05 -0.25 -2.06 0.00 0.00 179.45 175.39 1uio n ASP 314 N -4.93 0.11 -0.35 0.86 8.00 0.22 -4.54 116.55 115.93 1uio n ASP 314 Ca 0.02 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.55 1uio n ASP 314 Cb 0.11 1.78 0.08 0.00 -0.02 0.00 0.00 41.12 43.07 1uio n ASP 314 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1uio n MET 315 N -2.34 2.27 -3.10 -1.24 2.81 0.13 -5.01 117.12 110.65 1uio n MET 315 Ca -0.09 -1.62 -0.13 0.00 -1.81 0.00 0.00 57.70 54.05 1uio n MET 315 Cb 0.67 -1.15 0.05 0.00 -0.71 0.00 0.00 33.22 32.08 1uio n MET 315 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1uio n GLY 316 N 0.15 0.09 3.74 3.03 0.00 -0.52 -4.93 105.19 106.75 1uio n GLY 316 Ca 0.06 -0.15 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 1uio n GLY 316 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1uio s PHE 317 N -3.18 3.67 0.35 1.61 0.40 -0.99 -4.97 117.98 114.87 1uio s PHE 317 Ca 0.31 1.31 0.07 0.00 -0.60 0.00 0.00 56.93 58.02 1uio s PHE 317 Cb -0.13 -2.74 -0.02 0.00 0.51 0.00 0.00 43.02 40.63 1uio s PHE 317 CO 0.41 0.25 0.36 0.95 0.70 0.00 0.00 175.22 177.89 1uio s THR 318 N 0.13 3.50 0.52 0.64 -4.23 -1.26 -4.51 115.64 110.43 1uio s THR 318 Ca 0.36 -1.27 0.28 0.00 -1.18 0.00 0.00 61.69 59.88 1uio s THR 318 Cb -0.19 -3.20 0.32 0.00 1.34 0.00 0.00 72.50 70.78 1uio s THR 318 CO 0.20 -0.14 2.18 -0.08 -0.54 0.00 0.00 174.62 176.24 1uio h GLU 319 N 1.11 0.00 -0.31 3.99 4.81 -1.97 -1.13 114.58 121.08 1uio h GLU 319 Ca -0.44 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 58.67 1uio h GLU 319 Cb 1.26 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.63 1uio h GLU 319 CO 0.56 0.05 -0.27 1.49 -0.73 0.00 0.00 179.01 180.11 1uio h GLU 320 N 0.00 0.73 -0.28 1.92 4.81 -1.99 0.55 114.58 120.32 1uio h GLU 320 Ca -0.00 -0.37 -0.13 0.00 -0.13 0.00 0.00 59.36 58.72 1uio h GLU 320 Cb 0.13 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 1uio h GLU 320 CO 0.01 0.99 -0.38 1.49 -0.73 0.00 0.00 179.01 180.39 1uio h GLU 321 N 0.49 0.65 -0.70 1.92 4.57 -1.72 -0.44 114.58 119.35 1uio h GLU 321 Ca 0.05 -0.32 -0.01 0.00 -1.18 0.00 0.00 59.36 57.90 1uio h GLU 321 Cb 0.84 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.40 1uio h GLU 321 CO 0.07 0.92 0.39 0.74 -1.18 0.00 0.00 179.01 179.95 1uio h PHE 322 N 0.54 0.95 -0.53 0.92 0.04 -0.97 0.77 116.94 118.66 1uio h PHE 322 Ca 0.05 -0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.70 1uio h PHE 322 Cb 0.89 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.72 1uio h PHE 322 CO 0.04 0.66 -0.07 0.87 -0.60 0.00 0.00 178.31 179.22 1uio h LYS 323 N 0.95 0.98 -0.30 1.51 1.57 -0.54 -2.66 116.57 118.09 1uio h LYS 323 Ca 0.25 -0.35 -0.06 0.00 -1.87 0.00 0.00 60.65 58.62 1uio h LYS 323 Cb 0.02 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1uio h LYS 323 CO -0.04 1.02 -0.03 -0.09 -0.57 0.00 0.00 179.45 179.74 1uio h ARG 324 N 0.85 0.55 -0.48 3.15 2.43 -0.48 -1.26 114.38 119.14 1uio h ARG 324 Ca 0.14 -0.19 -0.06 0.00 -0.81 0.00 0.00 59.98 59.06 1uio h ARG 324 Cb 0.62 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.11 1uio h ARG 324 CO 0.04 0.71 0.06 1.37 -1.51 0.00 0.00 179.97 180.64 1uio h LEU 325 N 0.33 0.71 -0.62 3.80 -0.00 -0.84 -0.92 115.31 117.77 1uio h LEU 325 Ca 0.08 -0.14 -0.11 0.00 -0.00 0.00 0.00 57.88 57.71 1uio h LEU 325 Cb 0.49 -0.19 -0.02 0.00 -0.00 0.00 0.00 40.66 40.95 1uio h LEU 325 CO 0.02 0.74 -0.51 0.78 -0.00 0.00 0.00 178.44 179.47 1uio h ASN 326 N 0.72 0.00 -0.11 0.17 2.35 -1.32 0.16 115.58 117.55 1uio h ASN 326 Ca 0.15 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.67 1uio h ASN 326 Cb 0.35 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.73 1uio h ASN 326 CO 0.01 0.51 -0.81 0.40 -1.65 0.00 0.00 177.43 175.88 1uio h ILE 327 N 0.00 1.28 -0.47 2.81 2.04 -0.79 -2.13 117.51 120.25 1uio h ILE 327 Ca -0.01 -2.02 -0.07 0.00 1.00 0.00 0.00 64.86 63.77 1uio h ILE 327 Cb 1.13 2.04 -0.02 0.00 -0.74 0.00 0.00 36.82 39.22 1uio h ILE 327 CO 0.07 0.64 0.00 0.78 0.00 0.00 0.00 178.15 179.63 1uio h ASN 328 N 0.51 0.74 -0.64 1.72 2.35 -0.90 -1.00 115.58 118.37 1uio h ASN 328 Ca -0.06 -0.18 -0.01 0.00 -0.55 0.00 0.00 56.30 55.50 1uio h ASN 328 Cb 1.44 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 39.59 1uio h ASN 328 CO 0.17 0.81 0.34 0.00 -1.65 0.00 0.00 177.43 177.10 1uio h ALA 329 N 1.27 0.83 -0.34 -0.83 0.00 -0.65 0.33 119.26 119.88 1uio h ALA 329 Ca 0.14 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1uio h ALA 329 Cb 0.44 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1uio h ALA 329 CO 0.02 0.35 0.20 0.00 0.00 0.00 0.00 179.25 179.82 1uio h ALA 330 N 1.16 0.43 -0.43 0.00 0.00 -0.96 -0.42 119.26 119.05 1uio h ALA 330 Ca 0.23 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 1uio h ALA 330 Cb 0.06 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1uio h ALA 330 CO -0.03 -0.06 -0.07 0.87 0.00 0.00 0.00 179.25 179.95 1uio h LYS 331 N 0.43 0.74 -0.00 0.00 1.57 -0.85 -2.86 116.57 115.60 1uio h LYS 331 Ca 0.12 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1uio h LYS 331 Cb 0.02 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1uio h LYS 331 CO -0.02 0.80 -0.04 0.43 -0.57 0.00 0.00 179.45 180.05 1uio n SER 332 N -4.19 0.13 -4.56 0.86 7.64 0.11 -4.94 113.62 108.68 1uio n SER 332 Ca 0.02 -0.29 -0.29 0.00 1.01 0.00 0.00 58.87 59.32 1uio n SER 332 Cb 0.33 -0.21 0.22 0.00 -1.01 0.00 0.00 64.21 63.54 1uio n SER 332 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1uio s SER 333 N -2.53 1.70 -0.23 6.43 1.04 -0.22 -4.94 113.70 114.94 1uio s SER 333 Ca 0.29 1.67 0.14 0.00 0.48 0.00 0.00 55.95 58.53 1uio s SER 333 Cb 0.20 -2.34 0.71 0.00 0.10 0.00 0.00 66.02 64.69 1uio s SER 333 CO 0.46 -3.78 1.64 0.49 0.98 0.00 0.00 173.24 173.03 1uio n PHE 334 N -4.65 1.71 -2.27 5.02 3.72 -1.26 -4.97 117.46 114.77 1uio n PHE 334 Ca 0.06 -0.86 -0.36 0.00 -0.05 0.00 0.00 57.45 56.24 1uio n PHE 334 Cb 0.54 -0.47 -0.00 0.00 -0.94 0.00 0.00 39.48 38.61 1uio n PHE 334 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1uio s LEU 335 N -2.84 3.86 0.72 4.37 2.96 -1.26 -4.93 118.68 121.56 1uio s LEU 335 Ca 0.50 2.22 -0.12 0.00 -0.22 0.00 0.00 54.13 56.51 1uio s LEU 335 Cb 0.39 -4.44 0.03 0.00 0.50 0.00 0.00 46.19 42.67 1uio s LEU 335 CO 0.13 -1.09 1.09 -2.84 -1.32 0.00 0.00 176.35 172.33 1uio s PRO 336 N -3.05 2.56 0.14 0.98 0.02 -1.26 -4.65 135.00 129.74 1uio s PRO 336 Ca 0.69 1.23 -0.22 0.00 0.02 0.00 0.00 61.00 62.72 1uio s PRO 336 Cb -0.26 -1.93 0.00 0.00 0.02 0.00 0.00 34.50 32.33 1uio s PRO 336 CO 0.30 -1.42 1.24 0.39 -0.33 0.00 0.00 177.00 177.18 1uio n GLU 337 N -3.02 -0.32 -0.04 5.54 -0.58 -1.26 -0.35 120.64 120.61 1uio n GLU 337 Ca 0.09 1.22 -0.08 0.00 -0.42 0.00 0.00 57.16 57.98 1uio n GLU 337 Cb 0.53 -1.80 -0.02 0.00 -0.57 0.00 0.00 31.44 29.58 1uio n GLU 337 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1uio h GLU 338 N 0.00 -0.14 -0.06 3.49 3.07 -2.00 0.13 114.58 119.08 1uio h GLU 338 Ca 0.16 0.01 -0.11 0.00 -0.50 0.00 0.00 59.36 58.92 1uio h GLU 338 Cb 0.36 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.29 1uio h GLU 338 CO -0.77 -0.09 -0.46 0.93 -1.40 0.00 0.00 179.01 177.22 1uio h GLU 339 N -0.14 0.15 -0.27 2.33 5.08 -1.71 -1.54 114.58 118.47 1uio h GLU 339 Ca 0.13 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1uio h GLU 339 Cb 0.34 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1uio h GLU 339 CO -0.32 0.59 0.12 -0.22 -1.00 0.00 0.00 179.01 178.19 1uio h LYS 340 N 0.13 0.40 -0.42 2.33 3.64 0.30 -0.32 116.57 122.62 1uio h LYS 340 Ca 0.01 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1uio h LYS 340 Cb 0.87 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.60 1uio h LYS 340 CO 0.07 0.40 0.27 0.87 -2.27 0.00 0.00 179.45 178.79 1uio h LYS 341 N 0.30 0.55 -0.89 1.90 1.57 -0.47 -1.63 116.57 117.90 1uio h LYS 341 Ca 0.09 -0.04 0.12 0.00 -1.87 0.00 0.00 60.65 58.95 1uio h LYS 341 Cb 0.14 -0.12 -0.07 0.00 0.08 0.00 0.00 32.23 32.26 1uio h LYS 341 CO -0.01 0.38 0.57 0.93 -0.57 0.00 0.00 179.45 180.75 1uio h GLU 342 N 0.56 0.79 0.14 3.15 5.08 -0.86 0.34 114.58 123.78 1uio h GLU 342 Ca 0.15 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 1uio h GLU 342 Cb -0.05 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.03 1uio h GLU 342 CO -0.03 0.52 -0.07 1.25 -1.00 0.00 0.00 179.01 179.68 1uio h LEU 343 N 0.81 -0.16 -0.88 1.33 6.46 -0.18 -2.61 115.31 120.07 1uio h LEU 343 Ca 0.43 -0.23 0.12 0.00 -0.12 0.00 0.00 57.88 58.09 1uio h LEU 343 Cb 0.53 0.04 -0.09 0.00 -0.73 0.00 0.00 40.66 40.42 1uio h LEU 343 CO -0.19 0.14 0.50 -0.07 -0.62 0.00 0.00 178.44 178.20 1uio h LEU 344 N -0.48 0.68 -0.67 2.25 3.38 -0.82 -1.38 115.31 118.27 1uio h LEU 344 Ca -0.02 0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.04 1uio h LEU 344 Cb 0.38 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 1uio h LEU 344 CO 0.03 0.34 0.42 -0.08 0.09 0.00 0.00 178.44 179.25 1uio h GLU 345 N 0.77 0.82 -0.51 1.13 4.81 -0.86 -1.06 114.58 119.68 1uio h GLU 345 Ca 0.45 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 59.56 1uio h GLU 345 Cb 0.53 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 1uio h GLU 345 CO -0.30 0.54 0.02 -0.09 -0.73 0.00 0.00 179.01 178.45 1uio h ARG 346 N 0.84 0.89 0.36 1.92 2.43 -0.90 0.57 114.38 120.50 1uio h ARG 346 Ca 0.26 -0.27 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1uio h ARG 346 Cb -0.01 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1uio h ARG 346 CO -0.09 0.91 -0.18 -0.07 -1.51 0.00 0.00 179.97 179.03 1uio h LEU 347 N 0.76 -0.42 -0.93 3.80 3.38 -0.97 0.39 115.31 121.33 1uio h LEU 347 Ca 0.15 -0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.10 1uio h LEU 347 Cb 0.50 0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.30 1uio h LEU 347 CO 0.02 -0.20 0.60 1.88 0.09 0.00 0.00 178.44 180.84 1uio h TYR 348 N -0.62 1.12 0.69 1.13 0.05 -1.12 0.64 116.97 118.86 1uio h TYR 348 Ca -0.05 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.73 1uio h TYR 348 Cb 0.45 -0.37 -0.00 0.00 1.01 0.00 0.00 36.73 37.82 1uio h TYR 348 CO -0.02 0.63 -0.40 -0.09 -1.05 0.00 0.00 178.16 177.23 1uio h ARG 349 N 1.15 -0.98 0.00 4.88 2.43 -0.68 -2.73 114.38 118.44 1uio h ARG 349 Ca 0.38 0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.61 1uio h ARG 349 Cb 0.04 0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 29.81 1uio h ARG 349 CO -0.13 -0.65 -0.02 0.93 -1.51 0.00 0.00 179.97 178.59 1uio h GLU 350 N -1.02 0.00 -0.03 0.20 5.08 -0.43 0.47 114.58 118.84 1uio h GLU 350 Ca -0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1uio h GLU 350 Cb 0.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1uio h GLU 350 CO 0.11 0.02 0.00 0.66 -1.00 0.00 0.00 179.01 178.79 1uio n TYR 351 N -3.22 0.04 1.36 4.33 4.02 0.22 -4.94 117.16 118.97 1uio n TYR 351 Ca -0.02 -0.02 0.11 0.00 -0.01 0.00 0.00 57.90 57.96 1uio n TYR 351 Cb 0.15 0.00 0.65 0.00 -0.02 0.00 0.00 39.34 40.12 1uio n TYR 351 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89