#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tui n PRO 10 N 0.00 0.48 -4.73 1.64 -0.05 -1.26 -4.35 135.00 126.73 1tui n PRO 10 Ca 0.00 0.19 -0.33 0.00 -0.05 0.00 0.00 63.50 63.31 1tui n PRO 10 Cb 0.00 -1.71 -0.14 0.00 -0.05 0.00 0.00 33.50 31.60 1tui n PRO 10 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 175.50 173.87 1tui s HIS 11 N -1.75 2.84 0.02 0.54 2.46 -1.26 -1.24 115.29 116.91 1tui s HIS 11 Ca 0.68 -0.54 0.05 0.00 0.47 0.00 0.00 55.06 55.72 1tui s HIS 11 Cb -0.43 -1.84 -0.02 0.00 -0.13 0.00 0.00 32.58 30.16 1tui s HIS 11 CO 0.55 -0.14 -0.14 0.08 -2.47 0.00 0.00 174.74 172.61 1tui s VAL 12 N 0.25 1.12 -0.31 0.89 1.01 0.12 -4.94 120.40 118.54 1tui s VAL 12 Ca -0.08 -0.88 -0.12 0.00 0.00 0.00 0.00 61.98 60.89 1tui s VAL 12 Cb -0.15 -0.99 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 1tui s VAL 12 CO 0.05 0.10 0.23 0.20 0.00 0.00 0.00 175.10 175.67 1tui s ASN 13 N -0.90 6.06 0.26 3.32 0.01 -1.26 -0.75 114.94 121.67 1tui s ASN 13 Ca 0.03 -0.18 0.02 0.00 -0.71 0.00 0.00 52.86 52.02 1tui s ASN 13 Cb -0.07 -2.14 -0.01 0.00 0.41 0.00 0.00 41.25 39.45 1tui s ASN 13 CO 0.01 -0.15 0.07 1.33 -1.51 0.00 0.00 177.10 176.85 1tui n VAL 14 N 5.09 0.00 -3.63 1.60 0.24 0.12 0.33 118.33 122.08 1tui n VAL 14 Ca -0.13 -1.45 -0.03 0.00 -2.04 0.00 0.00 64.34 60.70 1tui n VAL 14 Cb 0.51 0.48 -0.02 0.00 -1.47 0.00 0.00 33.84 33.34 1tui n VAL 14 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1tui s GLY 15 N -2.55 -0.19 -0.09 7.63 0.00 -1.24 -0.12 107.32 110.76 1tui s GLY 15 Ca 0.11 1.94 -0.18 0.00 0.00 0.00 0.00 44.72 46.59 1tui s GLY 15 CO 0.07 0.66 0.48 -0.51 0.00 0.00 0.00 173.10 173.81 1tui s THR 16 N -2.01 5.14 0.43 0.90 -4.23 -0.72 -0.59 115.64 114.55 1tui s THR 16 Ca 0.11 0.96 0.04 0.00 -1.18 0.00 0.00 61.69 61.62 1tui s THR 16 Cb -0.01 -3.81 -0.04 0.00 1.34 0.00 0.00 72.50 69.98 1tui s THR 16 CO -0.03 0.37 0.04 0.27 -0.54 0.00 0.00 174.62 174.73 1tui s ILE 17 N 0.32 1.24 0.00 2.99 -4.36 -0.56 -4.68 121.20 116.15 1tui s ILE 17 Ca 0.26 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.65 1tui s ILE 17 Cb -0.16 -2.51 0.00 0.00 1.25 0.00 0.00 42.46 41.04 1tui s ILE 17 CO 0.11 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.90 1tui n GLY 18 N -1.02 3.08 3.64 6.27 0.00 -1.26 -1.95 105.19 113.96 1tui n GLY 18 Ca -0.10 -1.86 -0.30 0.00 0.00 0.00 0.00 46.02 43.75 1tui n GLY 18 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1tui s HIS 19 N -2.04 1.70 0.42 1.61 2.46 -1.26 -4.74 115.29 113.44 1tui s HIS 19 Ca 0.00 1.59 -0.26 0.00 0.47 0.00 0.00 55.06 56.86 1tui s HIS 19 Cb 0.00 -3.24 -0.09 0.00 -0.13 0.00 0.00 32.58 29.12 1tui s HIS 19 CO 0.00 -2.93 1.35 0.08 -2.47 0.00 0.00 174.74 170.77 1tui s VAL 20 N -2.65 2.41 0.00 0.89 1.01 -1.26 -2.73 120.40 118.07 1tui s VAL 20 Ca 0.66 0.37 0.00 0.00 0.00 0.00 0.00 61.98 63.01 1tui s VAL 20 Cb -0.22 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 32.94 1tui s VAL 20 CO 0.59 0.05 0.00 -0.67 0.00 0.00 0.00 175.10 175.08 1tui n ASP 21 N 0.03 0.00 0.18 3.32 2.03 -1.26 -4.85 116.55 116.00 1tui n ASP 21 Ca 0.04 0.00 0.14 0.00 0.52 0.00 0.00 54.79 55.49 1tui n ASP 21 Cb 0.43 -0.55 0.56 0.00 -0.72 0.00 0.00 41.12 40.84 1tui n ASP 21 CO 0.00 0.00 0.00 0.45 -1.92 0.00 0.00 177.20 175.73 1tui h HIS 22 N 0.00 0.00 0.00 -0.67 3.86 -1.86 -3.47 115.15 113.02 1tui h HIS 22 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1tui h HIS 22 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1tui h HIS 22 CO 0.00 0.00 0.00 0.41 0.86 0.00 0.00 177.93 179.20 1tui n GLY 23 N -0.02 1.86 0.29 2.45 0.00 -1.26 -4.55 105.19 103.96 1tui n GLY 23 Ca 0.02 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.20 1tui n GLY 23 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tui h LYS 24 N 0.00 0.00 0.05 1.61 1.57 -1.90 -1.48 116.57 116.42 1tui h LYS 24 Ca 0.00 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.65 1tui h LYS 24 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1tui h LYS 24 CO 0.00 0.04 -0.63 1.15 -0.57 0.00 0.00 179.45 179.44 1tui h THR 25 N 0.00 1.47 -0.32 -0.16 2.02 -1.94 -2.43 112.91 111.54 1tui h THR 25 Ca -0.00 -2.38 0.02 0.00 0.77 0.00 0.00 66.41 64.82 1tui h THR 25 Cb 0.14 3.06 -0.02 0.00 -1.74 0.00 0.00 68.15 69.58 1tui h THR 25 CO 0.01 0.61 0.18 0.74 0.37 0.00 0.00 175.52 177.42 1tui h THR 26 N -0.73 1.01 0.00 3.16 2.02 -1.92 -0.68 112.91 115.78 1tui h THR 26 Ca -0.14 -0.12 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 1tui h THR 26 Cb 1.33 0.62 -0.00 0.00 -1.74 0.00 0.00 68.15 68.36 1tui h THR 26 CO 0.02 0.07 -0.01 0.25 0.37 0.00 0.00 175.52 176.21 1tui h LEU 27 N 0.36 0.00 -0.38 2.58 5.85 -1.35 -0.20 115.31 122.17 1tui h LEU 27 Ca 0.13 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.71 1tui h LEU 27 Cb 0.02 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1tui h LEU 27 CO -0.07 0.01 -0.31 0.74 -0.34 0.00 0.00 178.44 178.47 1tui h THR 28 N 0.00 1.28 0.00 1.05 2.02 -0.61 -2.58 112.91 114.06 1tui h THR 28 Ca -0.00 -1.47 -0.03 0.00 0.77 0.00 0.00 66.41 65.67 1tui h THR 28 Cb 0.02 1.37 -0.00 0.00 -1.74 0.00 0.00 68.15 67.80 1tui h THR 28 CO 0.00 0.49 -0.16 0.00 0.37 0.00 0.00 175.52 176.22 1tui h ALA 29 N 0.78 1.02 0.12 6.16 0.00 -0.59 -2.74 119.26 124.01 1tui h ALA 29 Ca 0.07 -0.15 -0.29 0.00 0.00 0.00 0.00 54.91 54.54 1tui h ALA 29 Cb 0.89 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 18.68 1tui h ALA 29 CO 0.08 0.20 -1.20 0.00 0.00 0.00 0.00 179.25 178.34 1tui h ALA 30 N 1.84 -0.02 -0.62 0.00 0.00 -1.17 -2.62 119.26 116.67 1tui h ALA 30 Ca -0.00 -0.76 0.12 0.00 0.00 0.00 0.00 54.91 54.27 1tui h ALA 30 Cb 0.69 0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.50 1tui h ALA 30 CO 0.02 0.65 0.13 -0.07 0.00 0.00 0.00 179.25 179.98 1tui h LEU 31 N 0.22 -0.01 0.54 0.00 3.38 -1.16 0.30 115.31 118.59 1tui h LEU 31 Ca -0.18 0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1tui h LEU 31 Cb 1.88 0.16 0.01 0.00 0.09 0.00 0.00 40.66 42.80 1tui h LEU 31 CO 0.23 -0.00 -0.26 0.71 0.09 0.00 0.00 178.44 179.21 1tui h THR 32 N 0.26 0.46 -0.19 0.22 1.35 -1.42 -1.06 112.91 112.53 1tui h THR 32 Ca 0.33 -0.09 0.01 0.00 -0.55 0.00 0.00 66.41 66.11 1tui h THR 32 Cb 0.50 0.50 -0.01 0.00 -1.73 0.00 0.00 68.15 67.42 1tui h THR 32 CO -0.42 0.02 0.13 1.88 -0.25 0.00 0.00 175.52 176.87 1tui h TYR 33 N -0.78 0.22 0.19 4.73 -1.99 -1.03 -1.51 116.97 116.79 1tui h TYR 33 Ca -0.07 0.01 -0.26 0.00 2.00 0.00 0.00 58.73 60.40 1tui h TYR 33 Cb 0.58 -0.08 0.03 0.00 2.00 0.00 0.00 36.73 39.26 1tui h TYR 33 CO -0.03 0.14 -1.19 0.28 -0.00 0.00 0.00 178.16 177.37 1tui h VAL 34 N 0.24 1.34 0.00 -2.88 2.07 0.00 -3.29 116.25 113.73 1tui h VAL 34 Ca 0.07 -2.58 0.00 0.00 0.82 0.00 0.00 66.70 65.01 1tui h VAL 34 Cb -0.00 3.07 0.00 0.00 -1.52 0.00 0.00 31.29 32.84 1tui h VAL 34 CO -0.02 0.76 0.00 0.00 0.02 0.00 0.00 177.57 178.33 1tui h ALA 35 N 0.09 1.00 -0.42 1.67 0.00 -0.90 -3.06 119.26 117.65 1tui h ALA 35 Ca -0.22 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1tui h ALA 35 Cb 1.88 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.65 1tui h ALA 35 CO 0.19 0.00 0.26 0.00 0.00 0.00 0.00 179.25 179.70 1tui h ALA 36 N 2.35 0.54 -0.87 0.00 0.00 -1.35 -1.68 119.26 118.26 1tui h ALA 36 Ca 0.00 -0.05 0.15 0.00 0.00 0.00 0.00 54.91 55.01 1tui h ALA 36 Cb 0.69 -0.17 -0.15 0.00 0.00 0.00 0.00 17.79 18.16 1tui h ALA 36 CO 0.00 0.02 -0.32 0.00 0.00 0.00 0.00 179.25 178.95 1tui h ALA 37 N 1.13 0.26 -0.01 0.00 0.00 -1.65 3.29 119.26 122.28 1tui h ALA 37 Ca 0.15 0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1tui h ALA 37 Cb -0.02 0.84 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1tui h ALA 37 CO -0.03 -0.56 -0.06 0.39 0.00 0.00 0.00 179.25 179.00 1tui n GLU 38 N -5.50 1.07 -2.45 0.00 1.02 -1.16 -4.26 120.64 109.36 1tui n GLU 38 Ca 0.10 -0.41 -0.02 0.00 -0.02 0.00 0.00 57.16 56.80 1tui n GLU 38 Cb 0.41 -1.49 0.05 0.00 -0.02 0.00 0.00 31.44 30.38 1tui n GLU 38 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1tui n ASN 39 N -0.61 1.93 0.00 1.62 3.02 1.04 -5.00 115.26 117.25 1tui n ASN 39 Ca 0.18 -2.30 0.00 0.00 -0.03 0.00 0.00 54.58 52.43 1tui n ASN 39 Cb 0.26 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.00 1tui n ASN 39 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1tui n PRO 40 N -0.45 0.00 0.00 3.52 -0.04 0.20 -1.12 135.00 137.10 1tui n PRO 40 Ca 0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 1tui n PRO 40 Cb 0.88 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.34 1tui n PRO 40 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1tui n ASN 41 N -0.01 0.00 0.00 3.54 3.02 -1.26 -4.84 115.26 115.71 1tui n ASN 41 Ca 0.00 0.88 0.00 0.00 -0.03 0.00 0.00 54.58 55.43 1tui n ASN 41 Cb 0.00 -0.39 0.00 0.00 -0.61 0.00 0.00 39.78 38.78 1tui n ASN 41 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1tui n VAL 42 N -1.68 0.00 -3.25 2.41 0.31 -0.28 -4.85 118.33 110.99 1tui n VAL 42 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.92 1tui n VAL 42 Cb 0.00 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 32.85 1tui n VAL 42 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1tui s GLU 43 N 0.00 3.65 0.26 5.55 2.02 -1.26 -4.87 118.70 124.06 1tui s GLU 43 Ca 0.00 -0.13 -0.30 0.00 0.02 0.00 0.00 54.97 54.56 1tui s GLU 43 Cb 0.00 -3.80 -0.10 0.00 0.10 0.00 0.00 34.13 30.33 1tui s GLU 43 CO 0.00 -0.62 1.42 0.08 0.02 0.00 0.00 175.26 176.16 1tui s VAL 44 N 2.38 2.67 0.08 2.63 1.01 -1.26 -4.83 120.40 123.08 1tui s VAL 44 Ca 0.19 0.58 0.06 0.00 0.00 0.00 0.00 61.98 62.81 1tui s VAL 44 Cb -0.15 -3.37 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 1tui s VAL 44 CO 0.13 0.10 -0.17 -0.54 0.00 0.00 0.00 175.10 174.62 1tui s LYS 45 N -0.58 0.97 0.47 2.72 -0.14 -1.26 -5.01 119.74 116.91 1tui s LYS 45 Ca 0.58 -1.01 0.07 0.00 -1.36 0.00 0.00 55.97 54.25 1tui s LYS 45 Cb -0.41 -1.09 0.01 0.00 -1.68 0.00 0.00 37.83 34.65 1tui s LYS 45 CO 0.45 0.25 0.43 -0.51 -0.76 0.00 0.00 175.35 175.21 1tui s ASP 46 N -1.72 4.93 0.06 2.83 1.01 -1.26 -4.62 116.67 117.90 1tui s ASP 46 Ca 0.02 -0.90 -0.14 0.00 0.71 0.00 0.00 52.55 52.24 1tui s ASP 46 Cb -0.10 -0.20 -0.04 0.00 1.01 0.00 0.00 42.92 43.59 1tui s ASP 46 CO 0.03 -0.85 1.23 0.22 0.21 0.00 0.00 175.17 176.01 1tui h TYR 47 N 0.87 -0.78 -0.69 4.23 3.20 -1.93 -1.58 116.97 120.29 1tui h TYR 47 Ca -0.39 0.05 0.13 0.00 3.14 0.00 0.00 58.73 61.66 1tui h TYR 47 Cb 1.28 0.38 -0.13 0.00 1.54 0.00 0.00 36.73 39.80 1tui h TYR 47 CO 0.63 -0.18 -0.25 0.78 -1.64 0.00 0.00 178.16 177.51 1tui h GLY 48 N -0.07 0.27 0.81 1.82 0.00 -1.97 1.76 103.07 105.69 1tui h GLY 48 Ca 0.05 0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.69 1tui h GLY 48 CO -0.34 -0.25 -0.37 -0.55 0.00 0.00 0.00 176.54 175.03 1tui h ASP 49 N -0.06 -0.95 -0.27 0.19 3.32 -1.81 -0.75 116.42 116.09 1tui h ASP 49 Ca 0.31 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.40 1tui h ASP 49 Cb 0.54 0.29 -0.02 0.00 0.22 0.00 0.00 39.33 40.36 1tui h ASP 49 CO -0.74 -0.57 0.11 0.40 -1.72 0.00 0.00 179.24 176.72 1tui h ILE 50 N -0.90 1.14 0.00 0.35 2.04 -0.40 -2.02 117.51 117.72 1tui h ILE 50 Ca -0.07 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.33 1tui h ILE 50 Cb 0.74 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 1tui h ILE 50 CO 0.05 0.17 0.00 -0.78 0.00 0.00 0.00 178.15 177.60 1tui h ASP 51 N 0.47 0.00 -3.13 1.72 3.58 0.40 -3.23 116.42 116.23 1tui h ASP 51 Ca 0.11 0.00 -0.69 0.00 0.42 0.00 0.00 57.03 56.87 1tui h ASP 51 Cb 0.13 0.00 -0.36 0.00 1.72 0.00 0.00 39.33 40.82 1tui h ASP 51 CO -0.01 0.00 -0.12 0.29 -2.88 0.00 0.00 179.24 176.52 1tui n LYS 52 N -2.63 2.70 -2.15 0.28 5.02 -0.55 -4.94 118.16 115.90 1tui n LYS 52 Ca -0.01 -4.51 -0.35 0.00 -2.02 0.00 0.00 58.31 51.42 1tui n LYS 52 Cb 0.14 -2.39 0.01 0.00 -0.02 0.00 0.00 35.03 32.77 1tui n LYS 52 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1tui s ALA 53 N -1.63 2.63 0.65 7.82 0.00 -1.22 -4.96 121.76 125.05 1tui s ALA 53 Ca 0.29 0.82 -0.06 0.00 0.00 0.00 0.00 51.96 53.01 1tui s ALA 53 Cb -0.03 -3.37 0.04 0.00 0.00 0.00 0.00 23.12 19.75 1tui s ALA 53 CO -0.10 -0.91 0.96 -2.14 0.00 0.00 0.00 175.76 173.57 1tui s PRO 54 N -3.40 2.49 0.68 0.00 0.02 -1.19 -4.65 135.00 128.95 1tui s PRO 54 Ca 0.73 -0.18 -0.11 0.00 0.02 0.00 0.00 61.00 61.46 1tui s PRO 54 Cb -0.25 -2.22 -0.00 0.00 0.02 0.00 0.00 34.50 32.05 1tui s PRO 54 CO 0.30 -1.01 1.07 -1.21 -0.33 0.00 0.00 177.00 175.82 1tui s GLU 55 N -5.13 3.08 -0.15 5.54 2.02 -1.26 -1.39 118.70 121.41 1tui s GLU 55 Ca 0.58 0.53 -0.09 0.00 0.02 0.00 0.00 54.97 56.01 1tui s GLU 55 Cb -0.11 -2.05 0.05 0.00 0.10 0.00 0.00 34.13 32.13 1tui s GLU 55 CO 0.45 -0.88 0.38 -1.21 0.02 0.00 0.00 175.26 174.01 1tui s GLU 56 N -5.29 0.37 -0.26 1.61 2.02 -0.80 -4.78 118.70 111.57 1tui s GLU 56 Ca 0.57 0.70 -0.10 0.00 0.02 0.00 0.00 54.97 56.16 1tui s GLU 56 Cb -0.11 -0.00 -0.05 0.00 0.10 0.00 0.00 34.13 34.07 1tui s GLU 56 CO 0.52 -0.14 0.17 1.03 0.02 0.00 0.00 175.26 176.86 1tui s ARG 57 N 1.19 3.99 -0.08 1.61 0.52 -1.26 0.59 118.95 125.50 1tui s ARG 57 Ca -0.08 -0.31 -0.03 0.00 -0.52 0.00 0.00 55.73 54.79 1tui s ARG 57 Cb -0.08 -3.57 0.04 0.00 0.52 0.00 0.00 34.95 31.86 1tui s ARG 57 CO -0.10 -0.06 0.08 0.00 0.02 0.00 0.00 175.30 175.24 1tui s ALA 58 N 1.40 0.25 -0.56 2.13 0.00 0.12 -4.86 121.76 120.25 1tui s ALA 58 Ca 0.07 0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.10 1tui s ALA 58 Cb -0.15 -0.76 0.00 0.00 0.00 0.00 0.00 23.12 22.21 1tui s ALA 58 CO 0.07 -0.71 0.00 -2.13 0.00 0.00 0.00 175.76 173.00 1tui n ARG 59 N 5.30 -1.53 0.00 0.00 0.63 -1.26 -1.88 116.66 117.92 1tui n ARG 59 Ca -0.04 0.63 0.00 0.00 -0.92 0.00 0.00 57.85 57.51 1tui n ARG 59 Cb 0.50 -4.87 0.00 0.00 0.45 0.00 0.00 32.46 28.53 1tui n ARG 59 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1tui n GLY 60 N -0.02 0.35 3.92 5.14 0.00 -1.26 -4.91 105.19 108.41 1tui n GLY 60 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 1tui n GLY 60 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tui s ILE 61 N -2.01 5.33 -0.15 -0.61 1.01 -0.79 -4.98 121.20 119.00 1tui s ILE 61 Ca 0.00 -0.32 -0.05 0.00 0.00 0.00 0.00 60.65 60.27 1tui s ILE 61 Cb 0.00 -3.64 -0.04 0.00 0.01 0.00 0.00 42.46 38.79 1tui s ILE 61 CO 0.00 0.09 0.03 -0.89 0.00 0.00 0.00 174.94 174.17 1tui s THR 62 N -1.57 4.49 -0.09 2.92 2.01 -1.26 0.12 115.64 122.26 1tui s THR 62 Ca 0.36 -0.15 -0.00 0.00 0.31 0.00 0.00 61.69 62.21 1tui s THR 62 Cb -0.13 -2.98 0.02 0.00 0.01 0.00 0.00 72.50 69.43 1tui s THR 62 CO 0.27 0.51 -0.06 -0.63 -0.69 0.00 0.00 174.62 174.02 1tui s ILE 63 N 0.03 0.83 -0.12 1.82 1.01 0.20 -4.90 121.20 120.07 1tui s ILE 63 Ca 0.04 -0.19 -0.29 0.00 0.00 0.00 0.00 60.65 60.21 1tui s ILE 63 Cb -0.13 -0.88 -0.04 0.00 0.01 0.00 0.00 42.46 41.43 1tui s ILE 63 CO 0.01 0.33 1.50 0.20 0.00 0.00 0.00 174.94 176.98 1tui s ASN 64 N 1.63 6.73 -0.01 3.58 0.01 -1.26 -1.90 114.94 123.72 1tui s ASN 64 Ca 0.02 1.94 -0.00 0.00 -0.71 0.00 0.00 52.86 54.11 1tui s ASN 64 Cb -0.13 -2.53 0.01 0.00 0.41 0.00 0.00 41.25 39.00 1tui s ASN 64 CO -0.06 -0.91 0.02 -0.89 -1.51 0.00 0.00 177.10 173.75 1tui s THR 65 N 3.99 -0.02 0.01 1.60 2.01 -0.48 -4.26 115.64 118.49 1tui s THR 65 Ca 0.66 0.06 0.08 0.00 0.31 0.00 0.00 61.69 62.79 1tui s THR 65 Cb -0.28 -0.04 -0.02 0.00 0.01 0.00 0.00 72.50 72.17 1tui s THR 65 CO 0.24 0.02 -0.24 0.00 -0.69 0.00 0.00 174.62 173.96 1tui s ALA 66 N 0.28 1.98 0.17 7.40 0.00 0.14 -3.17 121.76 128.56 1tui s ALA 66 Ca -0.02 -1.08 0.10 0.00 0.00 0.00 0.00 51.96 50.96 1tui s ALA 66 Cb -0.03 -0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.59 1tui s ALA 66 CO -0.01 0.47 -0.23 -1.01 0.00 0.00 0.00 175.76 174.99 1tui s HIS 67 N -0.66 2.13 -0.07 0.00 3.76 -1.26 -0.46 115.29 118.74 1tui s HIS 67 Ca 0.09 -0.39 -0.22 0.00 -0.15 0.00 0.00 55.06 54.39 1tui s HIS 67 Cb -0.09 -1.07 0.05 0.00 1.11 0.00 0.00 32.58 32.57 1tui s HIS 67 CO 0.00 0.42 0.51 0.54 -0.85 0.00 0.00 174.74 175.36 1tui s VAL 68 N -1.67 0.02 -0.04 -0.90 0.11 0.22 -4.97 120.40 113.18 1tui s VAL 68 Ca 0.18 -0.19 0.07 0.00 -2.93 0.00 0.00 61.98 59.11 1tui s VAL 68 Cb -0.08 -0.80 -0.01 0.00 -1.53 0.00 0.00 36.38 33.96 1tui s VAL 68 CO 0.08 -0.10 -0.24 -1.61 -3.33 0.00 0.00 175.10 169.90 1tui s GLU 69 N -0.95 2.21 0.08 1.54 0.41 -1.26 0.12 118.70 120.85 1tui s GLU 69 Ca -0.10 -0.87 -0.07 0.00 -0.41 0.00 0.00 54.97 53.52 1tui s GLU 69 Cb -0.03 -1.99 -0.01 0.00 -1.78 0.00 0.00 34.13 30.32 1tui s GLU 69 CO 0.06 0.44 0.15 1.52 -0.49 0.00 0.00 175.26 176.94 1tui s TYR 70 N -0.35 0.23 -0.01 1.61 -0.85 -0.38 -4.44 117.35 113.17 1tui s TYR 70 Ca 0.03 -0.68 0.05 0.00 -0.52 0.00 0.00 57.07 55.95 1tui s TYR 70 Cb -0.11 -0.12 -0.01 0.00 0.38 0.00 0.00 41.96 42.09 1tui s TYR 70 CO 0.01 -0.52 -0.16 -2.00 -1.52 0.00 0.00 175.55 171.37 1tui s GLU 71 N -3.88 1.24 0.32 -3.49 2.12 -1.26 -1.03 118.70 112.73 1tui s GLU 71 Ca 0.06 -0.59 0.02 0.00 0.36 0.00 0.00 54.97 54.82 1tui s GLU 71 Cb 0.05 -1.21 0.02 0.00 0.26 0.00 0.00 34.13 33.25 1tui s GLU 71 CO -0.11 0.33 0.18 0.25 -0.54 0.00 0.00 175.26 175.37 1tui n THR 72 N 2.61 0.00 0.15 -1.70 -2.24 0.26 -4.83 114.28 108.52 1tui n THR 72 Ca -0.15 -1.34 -0.14 0.00 -2.27 0.00 0.00 64.05 60.16 1tui n THR 72 Cb 0.55 -0.08 -0.08 0.00 -2.10 0.00 0.00 70.33 68.62 1tui n THR 72 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tui h ALA 73 N 0.83 -0.31 -0.42 6.98 0.00 -1.98 -3.03 119.26 121.33 1tui h ALA 73 Ca -0.22 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.50 1tui h ALA 73 Cb 0.76 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1tui h ALA 73 CO 0.35 -0.64 -0.15 -0.22 0.00 0.00 0.00 179.25 178.59 1tui h LYS 74 N -0.37 0.77 0.00 0.00 3.64 -1.99 -3.48 116.57 115.15 1tui h LYS 74 Ca -0.03 -0.28 -0.12 0.00 -1.27 0.00 0.00 60.65 58.95 1tui h LYS 74 Cb 0.28 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 1tui h LYS 74 CO 0.05 0.88 0.02 0.54 -2.27 0.00 0.00 179.45 178.67 1tui n ARG 75 N -4.14 0.60 -3.98 1.90 1.74 -1.15 -4.29 116.66 107.34 1tui n ARG 75 Ca 0.01 -1.75 -0.34 0.00 -0.77 0.00 0.00 57.85 54.99 1tui n ARG 75 Cb 0.39 1.86 -0.15 0.00 -1.02 0.00 0.00 32.46 33.55 1tui n ARG 75 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1tui s HIS 76 N -3.92 3.01 -0.18 -1.55 3.76 -0.38 0.89 115.29 116.93 1tui s HIS 76 Ca 0.16 -1.49 -0.03 0.00 -0.15 0.00 0.00 55.06 53.55 1tui s HIS 76 Cb -0.02 -2.04 -0.02 0.00 1.11 0.00 0.00 32.58 31.61 1tui s HIS 76 CO 0.12 -0.72 -0.05 0.71 -0.85 0.00 0.00 174.74 173.95 1tui s TYR 77 N 1.34 2.96 -0.17 1.40 2.02 -0.20 0.16 117.35 124.85 1tui s TYR 77 Ca 0.02 -0.63 -0.06 0.00 -0.37 0.00 0.00 57.07 56.02 1tui s TYR 77 Cb -0.16 -2.01 -0.04 0.00 -0.40 0.00 0.00 41.96 39.36 1tui s TYR 77 CO -0.06 -0.29 0.03 -1.54 -1.57 0.00 0.00 175.55 172.12 1tui s SER 78 N 0.88 5.40 -0.10 2.29 1.04 0.07 -1.25 113.70 122.02 1tui s SER 78 Ca -0.01 0.03 0.02 0.00 0.48 0.00 0.00 55.95 56.47 1tui s SER 78 Cb -0.15 -1.91 0.01 0.00 0.10 0.00 0.00 66.02 64.08 1tui s SER 78 CO 0.01 0.18 -0.15 -2.28 0.98 0.00 0.00 173.24 171.98 1tui s HIS 79 N 0.33 1.93 0.22 5.02 2.46 0.33 -0.70 115.29 124.88 1tui s HIS 79 Ca 0.01 -0.87 -0.00 0.00 0.47 0.00 0.00 55.06 54.67 1tui s HIS 79 Cb -0.13 -1.39 -0.04 0.00 -0.13 0.00 0.00 32.58 30.89 1tui s HIS 79 CO 0.01 -0.44 0.40 0.08 -2.47 0.00 0.00 174.74 172.32 1tui s VAL 80 N 0.90 5.20 -0.25 0.89 1.01 0.83 -0.61 120.40 128.37 1tui s VAL 80 Ca -0.09 -0.42 -0.10 0.00 0.00 0.00 0.00 61.98 61.37 1tui s VAL 80 Cb -0.15 -3.75 0.10 0.00 0.00 0.00 0.00 36.38 32.57 1tui s VAL 80 CO -0.00 -0.22 0.55 -0.62 0.00 0.00 0.00 175.10 174.82 1tui s ASP 81 N -3.30 -0.75 0.20 3.32 2.15 0.39 -1.76 116.67 116.92 1tui s ASP 81 Ca 0.38 1.29 0.08 0.00 0.43 0.00 0.00 52.55 54.73 1tui s ASP 81 Cb -0.11 1.65 -0.04 0.00 -0.30 0.00 0.00 42.92 44.12 1tui s ASP 81 CO 0.30 -0.22 0.03 0.00 -0.17 0.00 0.00 175.17 175.10 1tui h PRO 83 N 2.42 0.66 -6.64 0.00 0.11 -1.93 -3.48 132.00 123.15 1tui h PRO 83 Ca -0.47 -0.80 -0.64 0.00 0.11 0.00 0.00 66.00 64.20 1tui h PRO 83 Cb 1.21 0.25 -0.21 0.00 0.11 0.00 0.00 31.00 32.36 1tui h PRO 83 CO 0.59 1.36 -0.85 0.20 -0.21 0.00 0.00 178.00 179.09 1tui s GLY 84 N -4.38 1.49 0.36 -0.55 0.00 -1.26 -5.00 107.32 97.98 1tui s GLY 84 Ca -0.09 -1.42 0.16 0.00 0.00 0.00 0.00 44.72 43.36 1tui s GLY 84 CO 0.93 -1.42 1.71 0.84 0.00 0.00 0.00 173.10 175.16 1tui h HIS 85 N 3.85 0.83 0.52 1.90 2.76 -1.94 0.20 115.15 123.27 1tui h HIS 85 Ca -0.49 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 57.69 1tui h HIS 85 Cb 1.18 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 29.91 1tui h HIS 85 CO 0.62 -0.03 -0.25 0.00 -1.30 0.00 0.00 177.93 176.96 1tui h ALA 86 N 1.72 -0.70 -0.86 5.26 0.00 -1.99 -0.59 119.26 122.09 1tui h ALA 86 Ca 0.68 -0.15 0.22 0.00 0.00 0.00 0.00 54.91 55.66 1tui h ALA 86 Cb 1.59 0.28 -0.14 0.00 0.00 0.00 0.00 17.79 19.51 1tui h ALA 86 CO -0.45 -0.90 0.18 -0.44 0.00 0.00 0.00 179.25 177.64 1tui h ASP 87 N -0.70 -0.09 -0.29 0.00 3.32 -1.03 0.16 116.42 117.78 1tui h ASP 87 Ca -0.07 0.20 0.01 0.00 0.02 0.00 0.00 57.03 57.19 1tui h ASP 87 Cb 0.54 0.29 -0.02 0.00 0.22 0.00 0.00 39.33 40.36 1tui h ASP 87 CO 0.11 -0.17 0.18 1.88 -1.72 0.00 0.00 179.24 179.52 1tui h TYR 88 N 0.18 0.33 0.40 4.55 -1.99 -0.52 0.65 116.97 120.57 1tui h TYR 88 Ca 0.53 0.01 -0.00 0.00 2.00 0.00 0.00 58.73 61.26 1tui h TYR 88 Cb 1.04 -0.11 -0.02 0.00 2.00 0.00 0.00 36.73 39.64 1tui h TYR 88 CO -0.31 0.20 -0.41 0.82 -0.00 0.00 0.00 178.16 178.46 1tui h ILE 89 N 0.36 0.17 0.55 -2.88 1.08 0.82 -1.97 117.51 115.64 1tui h ILE 89 Ca 0.11 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.57 1tui h ILE 89 Cb -0.01 0.17 -0.01 0.00 -3.07 0.00 0.00 36.82 33.90 1tui h ILE 89 CO -0.05 0.00 -0.41 0.11 -0.69 0.00 0.00 178.15 177.11 1tui h LYS 90 N -0.83 -0.90 -0.10 2.37 1.57 -0.91 -2.79 116.57 114.99 1tui h LYS 90 Ca -0.03 0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1tui h LYS 90 Cb 0.74 0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.24 1tui h LYS 90 CO -0.07 -0.60 -0.08 -0.97 -0.57 0.00 0.00 179.45 177.16 1tui h ASN 91 N -0.93 -0.28 -1.19 0.86 -0.73 -0.86 0.15 115.58 112.59 1tui h ASN 91 Ca -0.06 0.04 0.35 0.00 1.87 0.00 0.00 56.30 58.50 1tui h ASN 91 Cb 0.79 0.12 -0.10 0.00 0.27 0.00 0.00 38.32 39.39 1tui h ASN 91 CO 0.02 -0.04 0.78 0.24 -0.37 0.00 0.00 177.43 178.05 1tui h MET 92 N -0.03 0.21 0.13 6.67 2.86 -1.40 0.77 114.93 124.14 1tui h MET 92 Ca 0.02 -0.01 -0.33 0.00 -2.06 0.00 0.00 59.70 57.31 1tui h MET 92 Cb 0.07 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 1tui h MET 92 CO -0.11 0.14 -1.75 0.82 1.06 0.00 0.00 176.91 177.08 1tui h ILE 93 N 0.22 0.81 0.00 -1.22 2.04 -0.97 -3.18 117.51 115.22 1tui h ILE 93 Ca 0.69 -2.38 0.00 0.00 1.00 0.00 0.00 64.86 64.16 1tui h ILE 93 Cb 2.07 2.59 0.00 0.00 -0.74 0.00 0.00 36.82 40.74 1tui h ILE 93 CO -0.30 0.80 0.00 0.35 0.00 0.00 0.00 178.15 179.00 1tui n THR 94 N -3.69 0.44 -3.31 -0.27 -2.24 0.42 -4.65 114.28 100.99 1tui n THR 94 Ca -0.29 -0.10 -0.16 0.00 -2.27 0.00 0.00 64.05 61.24 1tui n THR 94 Cb 0.99 -0.64 0.08 0.00 -2.10 0.00 0.00 70.33 68.66 1tui n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tui n GLY 95 N 1.15 -0.29 0.38 3.38 0.00 0.26 -4.88 105.19 105.20 1tui n GLY 95 Ca 0.06 0.05 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 1tui n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tui h ALA 96 N 0.82 -0.59 -3.16 4.61 0.00 -1.75 -3.39 119.26 115.79 1tui h ALA 96 Ca -0.53 -0.03 -0.64 0.00 0.00 0.00 0.00 54.91 53.71 1tui h ALA 96 Cb 1.31 0.68 -0.35 0.00 0.00 0.00 0.00 17.79 19.43 1tui h ALA 96 CO 0.46 -0.91 -0.85 0.00 0.00 0.00 0.00 179.25 177.94 1tui s ALA 97 N -5.94 2.06 -0.36 0.00 0.00 -1.26 -5.12 121.76 111.15 1tui s ALA 97 Ca -0.16 -1.00 -0.19 0.00 0.00 0.00 0.00 51.96 50.61 1tui s ALA 97 Cb 0.09 -1.02 0.00 0.00 0.00 0.00 0.00 23.12 22.19 1tui s ALA 97 CO 0.64 -0.19 0.58 -0.65 0.00 0.00 0.00 175.76 176.14 1tui s GLN 98 N 1.11 3.63 0.33 0.00 -0.21 -1.26 -4.81 119.66 118.45 1tui s GLN 98 Ca -0.01 -0.07 -0.29 0.00 0.02 0.00 0.00 55.36 55.01 1tui s GLN 98 Cb -0.14 -3.81 -0.10 0.00 1.00 0.00 0.00 33.01 29.95 1tui s GLN 98 CO -0.06 -0.70 1.31 -1.64 -2.12 0.00 0.00 175.29 172.08 1tui s MET 99 N 2.56 4.35 -0.05 2.91 -1.94 -1.26 -4.70 119.30 121.16 1tui s MET 99 Ca 0.21 2.22 0.21 0.00 -1.71 0.00 0.00 55.69 56.62 1tui s MET 99 Cb -0.15 -3.07 -0.32 0.00 2.01 0.00 0.00 34.83 33.30 1tui s MET 99 CO 0.14 -0.20 0.42 -0.25 -0.01 0.00 0.00 175.02 175.12 1tui n ASP 100 N 0.87 0.11 -3.61 3.03 8.00 0.15 -4.72 116.55 120.38 1tui n ASP 100 Ca 0.00 0.00 -0.05 0.00 0.71 0.00 0.00 54.79 55.45 1tui n ASP 100 Cb 0.42 1.85 -0.02 0.00 -0.02 0.00 0.00 41.12 43.35 1tui n ASP 100 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1tui s GLY 101 N -4.59 -0.36 0.01 0.44 0.00 -1.20 -3.94 107.32 97.68 1tui s GLY 101 Ca -0.08 0.76 -0.07 0.00 0.00 0.00 0.00 44.72 45.34 1tui s GLY 101 CO 0.88 0.23 0.12 0.00 0.00 0.00 0.00 173.10 174.33 1tui s ALA 102 N -3.01 -0.24 -0.31 3.20 0.00 -0.33 -3.69 121.76 117.37 1tui s ALA 102 Ca 0.09 -0.27 -0.08 0.00 0.00 0.00 0.00 51.96 51.69 1tui s ALA 102 Cb -0.00 0.16 0.01 0.00 0.00 0.00 0.00 23.12 23.28 1tui s ALA 102 CO -0.04 -0.24 0.12 0.42 0.00 0.00 0.00 175.76 176.02 1tui s ILE 103 N -1.74 4.23 -0.42 0.00 1.01 0.24 -2.33 121.20 122.19 1tui s ILE 103 Ca -0.12 -0.65 -0.21 0.00 0.00 0.00 0.00 60.65 59.67 1tui s ILE 103 Cb -0.06 -3.21 0.02 0.00 0.01 0.00 0.00 42.46 39.22 1tui s ILE 103 CO -0.00 0.02 0.67 -0.22 0.00 0.00 0.00 174.94 175.41 1tui s LEU 104 N 1.54 4.38 -0.11 2.97 2.96 0.13 -1.50 118.68 129.04 1tui s LEU 104 Ca 0.03 -0.15 -0.15 0.00 -0.22 0.00 0.00 54.13 53.64 1tui s LEU 104 Cb -0.17 -2.79 -0.05 0.00 0.50 0.00 0.00 46.19 43.67 1tui s LEU 104 CO 0.04 -0.75 0.35 -0.69 -1.32 0.00 0.00 176.35 173.98 1tui s VAL 105 N 2.88 5.23 -0.03 1.68 1.01 -0.82 -1.10 120.40 129.25 1tui s VAL 105 Ca 0.25 0.69 0.02 0.00 0.00 0.00 0.00 61.98 62.94 1tui s VAL 105 Cb -0.14 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.57 1tui s VAL 105 CO 0.18 0.43 -0.07 -0.69 0.00 0.00 0.00 175.10 174.95 1tui s VAL 106 N 0.09 0.65 0.03 2.92 1.01 -1.13 -4.14 120.40 119.84 1tui s VAL 106 Ca 0.20 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.61 1tui s VAL 106 Cb -0.14 -0.61 -0.06 0.00 0.00 0.00 0.00 36.38 35.57 1tui s VAL 106 CO 0.07 0.22 1.35 -0.55 0.00 0.00 0.00 175.10 176.19 1tui s SER 107 N 0.39 6.90 0.50 3.32 0.15 -1.26 -1.66 113.70 122.03 1tui s SER 107 Ca -0.06 2.13 0.27 0.00 0.70 0.00 0.00 55.95 58.99 1tui s SER 107 Cb -0.10 -2.57 1.29 0.00 -1.71 0.00 0.00 66.02 62.93 1tui s SER 107 CO 0.00 -0.65 1.99 0.00 1.20 0.00 0.00 173.24 175.78 1tui h ALA 108 N 7.38 1.16 -0.08 5.45 0.00 -1.53 0.26 119.26 131.90 1tui h ALA 108 Ca -0.39 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.19 1tui h ALA 108 Cb 1.19 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.97 1tui h ALA 108 CO 0.88 0.19 -0.69 0.00 0.00 0.00 0.00 179.25 179.62 1tui h ALA 109 N 1.85 0.19 0.00 0.00 0.00 -1.85 -3.39 119.26 116.07 1tui h ALA 109 Ca -0.00 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1tui h ALA 109 Cb 0.48 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1tui h ALA 109 CO 0.02 0.51 -1.34 -0.25 0.00 0.00 0.00 179.25 178.19 1tui n ASP 110 N -4.08 0.89 -0.15 0.00 9.92 -0.81 -5.10 116.55 117.22 1tui n ASP 110 Ca -0.09 -0.42 0.02 0.00 -0.53 0.00 0.00 54.79 53.77 1tui n ASP 110 Cb 0.70 1.43 -0.01 0.00 -0.64 0.00 0.00 41.12 42.61 1tui n ASP 110 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1tui n GLY 111 N 1.45 -1.61 3.66 0.44 0.00 0.85 -4.81 105.19 105.19 1tui n GLY 111 Ca -0.00 -1.48 -0.37 0.00 0.00 0.00 0.00 46.02 44.16 1tui n GLY 111 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1tui n PRO 112 N -1.87 0.88 -3.39 1.61 -0.04 -1.26 -4.40 135.00 126.53 1tui n PRO 112 Ca -0.00 0.35 -0.15 0.00 -0.04 0.00 0.00 63.50 63.66 1tui n PRO 112 Cb 0.07 -2.34 -0.04 0.00 -0.04 0.00 0.00 33.50 31.15 1tui n PRO 112 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1tui n MET 113 N -1.63 0.76 -0.04 0.54 2.81 -1.26 -5.00 117.12 113.30 1tui n MET 113 Ca 0.15 -2.00 -0.10 0.00 -1.81 0.00 0.00 57.70 53.94 1tui n MET 113 Cb 0.48 1.06 -0.03 0.00 -0.71 0.00 0.00 33.22 34.02 1tui n MET 113 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 1tui h PRO 114 N 0.00 0.21 -0.40 0.03 0.11 -1.99 0.37 132.00 130.33 1tui h PRO 114 Ca -0.19 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.88 1tui h PRO 114 Cb 0.70 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 1tui h PRO 114 CO 0.30 0.14 0.13 1.96 -0.21 0.00 0.00 178.00 180.32 1tui h GLN 115 N 0.22 0.57 -0.26 1.05 4.20 -1.97 0.97 115.11 119.89 1tui h GLN 115 Ca 0.07 -0.08 0.06 0.00 0.06 0.00 0.00 58.65 58.76 1tui h GLN 115 Cb 0.00 -0.10 -0.07 0.00 0.30 0.00 0.00 27.48 27.61 1tui h GLN 115 CO -0.04 0.50 -0.21 1.15 -0.67 0.00 0.00 178.83 179.56 1tui h THR 116 N 0.57 0.44 -0.22 -0.54 2.02 -1.39 0.40 112.91 114.18 1tui h THR 116 Ca 0.14 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.23 1tui h THR 116 Cb 0.16 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 1tui h THR 116 CO -0.01 0.00 -0.26 -0.09 0.37 0.00 0.00 175.52 175.54 1tui h ARG 117 N -0.21 0.42 -0.09 6.66 2.43 -0.28 -2.41 114.38 120.90 1tui h ARG 117 Ca 0.14 -0.15 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1tui h ARG 117 Cb 0.43 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1tui h ARG 117 CO -0.38 0.65 -0.02 0.93 -1.51 0.00 0.00 179.97 179.64 1tui h GLU 118 N 0.37 0.17 -0.60 0.20 5.08 0.14 -2.49 114.58 117.45 1tui h GLU 118 Ca 0.06 -0.06 0.08 0.00 -1.00 0.00 0.00 59.36 58.43 1tui h GLU 118 Cb 0.65 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.85 1tui h GLU 118 CO 0.05 0.48 0.40 0.45 -1.00 0.00 0.00 179.01 179.39 1tui h HIS 119 N -0.16 0.52 0.29 4.33 3.86 -0.15 -0.67 115.15 123.18 1tui h HIS 119 Ca 0.02 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.23 1tui h HIS 119 Cb 0.42 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.72 1tui h HIS 119 CO 0.05 0.26 -0.14 0.82 0.86 0.00 0.00 177.93 179.78 1tui h ILE 120 N 0.50 0.74 -0.33 2.45 2.04 -1.34 0.11 117.51 121.68 1tui h ILE 120 Ca 0.27 -0.20 0.06 0.00 1.00 0.00 0.00 64.86 65.99 1tui h ILE 120 Cb 0.40 0.85 -0.06 0.00 -0.74 0.00 0.00 36.82 37.28 1tui h ILE 120 CO -0.08 0.04 -0.05 0.25 0.00 0.00 0.00 178.15 178.31 1tui h LEU 121 N -0.49 -0.24 0.63 1.44 5.85 -0.76 0.64 115.31 122.38 1tui h LEU 121 Ca -0.04 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 1tui h LEU 121 Cb 0.37 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 1tui h LEU 121 CO 0.07 -0.08 -0.43 -0.07 -0.34 0.00 0.00 178.44 177.58 1tui h LEU 122 N 0.03 -1.11 -0.88 2.25 3.38 -0.92 0.36 115.31 118.42 1tui h LEU 122 Ca 0.16 0.07 0.23 0.00 0.09 0.00 0.00 57.88 58.43 1tui h LEU 122 Cb 0.24 0.34 -0.16 0.00 0.09 0.00 0.00 40.66 41.17 1tui h LEU 122 CO -0.32 -0.65 0.05 0.00 0.09 0.00 0.00 178.44 177.62 1tui h ALA 123 N -0.80 1.04 -0.27 1.53 0.00 -0.48 1.82 119.26 122.09 1tui h ALA 123 Ca -0.08 0.28 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1tui h ALA 123 Cb 0.84 0.48 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1tui h ALA 123 CO 0.05 -0.49 0.00 -0.09 0.00 0.00 0.00 179.25 178.72 1tui h ARG 124 N 0.08 0.48 -0.43 0.00 9.65 0.10 0.41 114.38 124.67 1tui h ARG 124 Ca 0.52 -0.15 -0.02 0.00 -1.10 0.00 0.00 59.98 59.23 1tui h ARG 124 Cb 1.01 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.53 1tui h ARG 124 CO -0.78 0.63 0.21 1.96 2.80 0.00 0.00 179.97 184.79 1tui h GLN 125 N 0.26 0.61 0.00 0.20 4.20 0.64 -2.30 115.11 118.73 1tui h GLN 125 Ca 0.08 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1tui h GLN 125 Cb 0.42 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.09 1tui h GLN 125 CO 0.01 0.53 0.00 0.28 -0.67 0.00 0.00 178.83 178.98 1tui n VAL 126 N -4.67 0.24 -0.27 -0.54 0.31 0.32 -4.75 118.33 108.96 1tui n VAL 126 Ca 0.01 0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1tui n VAL 126 Cb 0.11 -0.67 0.00 0.00 -0.91 0.00 0.00 33.84 32.37 1tui n VAL 126 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1tui n GLY 127 N 0.71 0.80 3.61 2.92 0.00 -0.22 -4.94 105.19 108.07 1tui n GLY 127 Ca 0.12 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.61 1tui n GLY 127 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1tui n VAL 128 N -2.20 0.03 0.13 1.61 0.31 -0.04 -4.84 118.33 113.34 1tui n VAL 128 Ca 0.00 -0.01 0.05 0.00 -0.01 0.00 0.00 64.34 64.38 1tui n VAL 128 Cb 0.00 -0.89 0.03 0.00 -0.91 0.00 0.00 33.84 32.07 1tui n VAL 128 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1tui h PRO 129 N 4.89 0.00 -1.98 5.55 0.11 -1.85 -3.44 132.00 135.29 1tui h PRO 129 Ca -0.48 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.59 1tui h PRO 129 Cb 1.33 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.24 1tui h PRO 129 CO 0.80 0.28 0.17 -0.47 -0.21 0.00 0.00 178.00 178.57 1tui s TYR 130 N -3.06 -0.72 0.01 0.65 5.04 -1.26 -4.98 117.35 113.03 1tui s TYR 130 Ca 0.02 1.57 0.07 0.00 -2.44 0.00 0.00 57.07 56.30 1tui s TYR 130 Cb 0.08 0.33 -0.02 0.00 0.35 0.00 0.00 41.96 42.69 1tui s TYR 130 CO 0.75 -0.46 -0.22 0.42 -1.34 0.00 0.00 175.55 174.70 1tui s ILE 131 N -0.24 1.79 -0.02 3.14 1.01 -1.26 -1.19 121.20 124.43 1tui s ILE 131 Ca -0.04 -1.10 0.02 0.00 0.00 0.00 0.00 60.65 59.53 1tui s ILE 131 Cb -0.03 -1.52 0.00 0.00 0.01 0.00 0.00 42.46 40.92 1tui s ILE 131 CO 0.04 0.38 -0.08 -0.69 0.00 0.00 0.00 174.94 174.59 1tui s VAL 132 N -0.66 0.67 -0.09 2.92 1.01 -0.98 -4.65 120.40 118.62 1tui s VAL 132 Ca 0.09 -0.32 -0.04 0.00 0.00 0.00 0.00 61.98 61.71 1tui s VAL 132 Cb -0.09 -0.59 -0.04 0.00 0.00 0.00 0.00 36.38 35.66 1tui s VAL 132 CO 0.00 0.21 0.06 -0.69 0.00 0.00 0.00 175.10 174.68 1tui s VAL 133 N 0.10 4.80 -0.28 2.92 1.01 0.67 0.20 120.40 129.81 1tui s VAL 133 Ca -0.01 -0.08 0.02 0.00 0.00 0.00 0.00 61.98 61.91 1tui s VAL 133 Cb -0.07 -3.06 0.08 0.00 0.00 0.00 0.00 36.38 33.33 1tui s VAL 133 CO 0.00 0.60 -0.03 0.12 0.00 0.00 0.00 175.10 175.79 1tui s PHE 134 N -0.96 3.03 -0.40 5.22 2.19 -0.26 -1.23 117.98 125.57 1tui s PHE 134 Ca 0.14 -2.31 -0.29 0.00 0.33 0.00 0.00 56.93 54.80 1tui s PHE 134 Cb -0.12 -2.11 0.02 0.00 -1.31 0.00 0.00 43.02 39.51 1tui s PHE 134 CO 0.04 -0.87 1.14 1.41 1.83 0.00 0.00 175.22 178.76 1tui s MET 135 N 1.17 3.87 0.45 10.12 -2.45 -0.08 -2.83 119.30 129.54 1tui s MET 135 Ca -0.01 0.84 0.08 0.00 -1.25 0.00 0.00 55.69 55.36 1tui s MET 135 Cb -0.19 -3.84 0.01 0.00 1.25 0.00 0.00 34.83 32.06 1tui s MET 135 CO -0.08 -1.18 0.54 1.21 1.05 0.00 0.00 175.02 176.56 1tui s ASN 136 N 2.23 5.34 0.00 1.11 3.04 -0.67 -0.36 114.94 125.63 1tui s ASN 136 Ca 0.48 -0.63 0.00 0.00 0.04 0.00 0.00 52.86 52.75 1tui s ASN 136 Cb -0.10 -0.43 0.00 0.00 -1.54 0.00 0.00 41.25 39.18 1tui s ASN 136 CO 0.25 -0.84 0.00 0.29 -3.04 0.00 0.00 177.10 173.76 1tui n LYS 137 N -1.82 -0.78 0.16 0.43 5.02 -0.73 -1.38 118.16 119.06 1tui n LYS 137 Ca 0.07 0.20 0.16 0.00 -2.02 0.00 0.00 58.31 56.72 1tui n LYS 137 Cb 0.60 -3.87 0.54 0.00 -0.02 0.00 0.00 35.03 32.28 1tui n LYS 137 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 1tui h VAL 138 N 0.00 0.10 0.00 -0.18 3.04 -1.72 0.51 116.25 118.00 1tui h VAL 138 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1tui h VAL 138 Cb 0.39 0.38 0.00 0.00 -2.01 0.00 0.00 31.29 30.05 1tui h VAL 138 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.57 175.66 1tui n ASP 139 N -3.09 0.00 -0.51 3.17 5.75 -1.26 -2.10 116.55 118.51 1tui n ASP 139 Ca 0.06 0.04 0.12 0.00 -0.01 0.00 0.00 54.79 55.00 1tui n ASP 139 Cb 0.82 -0.23 0.17 0.00 -1.03 0.00 0.00 41.12 40.85 1tui n ASP 139 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 1tui n MET 140 N -1.23 1.36 -3.73 0.11 2.81 0.18 -4.89 117.12 111.73 1tui n MET 140 Ca 0.06 -1.03 -0.24 0.00 -1.81 0.00 0.00 57.70 54.67 1tui n MET 140 Cb 0.07 -1.48 -0.17 0.00 -0.71 0.00 0.00 33.22 30.93 1tui n MET 140 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1tui s VAL 141 N -2.35 0.30 -0.15 2.03 1.01 -0.89 -5.01 120.40 115.33 1tui s VAL 141 Ca 0.24 -0.07 -0.19 0.00 0.00 0.00 0.00 61.98 61.95 1tui s VAL 141 Cb 0.19 -0.64 -0.24 0.00 0.00 0.00 0.00 36.38 35.70 1tui s VAL 141 CO 0.49 0.05 0.44 0.44 0.00 0.00 0.00 175.10 176.51 1tui h ASP 142 N 8.33 0.17 -1.50 3.32 3.32 -1.90 -3.46 116.42 124.70 1tui h ASP 142 Ca -0.17 -0.74 -0.51 0.00 0.02 0.00 0.00 57.03 55.62 1tui h ASP 142 Cb 1.13 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.62 1tui h ASP 142 CO 0.27 1.49 1.60 -0.67 -1.72 0.00 0.00 179.24 180.21 1tui n ASP 143 N -4.20 2.33 0.23 6.45 -0.08 -1.26 -4.79 116.55 115.23 1tui n ASP 143 Ca -0.26 -0.20 0.15 0.00 -1.51 0.00 0.00 54.79 52.97 1tui n ASP 143 Cb 0.76 -1.49 0.82 0.00 2.34 0.00 0.00 41.12 43.55 1tui n ASP 143 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1tui h PRO 144 N 17.27 0.00 -0.24 -0.67 0.13 -1.99 0.44 132.00 146.94 1tui h PRO 144 Ca -0.26 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.72 1tui h PRO 144 Cb 1.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 1tui h PRO 144 CO 1.12 0.00 -0.44 1.49 -0.23 0.00 0.00 178.00 179.94 1tui h GLU 145 N 0.00 0.59 -0.16 0.86 4.81 -2.00 -2.26 114.58 116.43 1tui h GLU 145 Ca 0.00 -0.32 -0.03 0.00 -0.13 0.00 0.00 59.36 58.88 1tui h GLU 145 Cb 0.01 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 1tui h GLU 145 CO 0.00 0.92 -0.03 -0.07 -0.73 0.00 0.00 179.01 179.10 1tui h LEU 146 N 0.48 0.30 -1.69 1.64 3.38 -0.51 0.06 115.31 118.97 1tui h LEU 146 Ca 0.03 -0.36 0.05 0.00 0.09 0.00 0.00 57.88 57.70 1tui h LEU 146 Cb 0.96 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 1tui h LEU 146 CO 0.09 0.59 0.30 -0.07 0.09 0.00 0.00 178.44 179.44 1tui h LEU 147 N 0.01 0.34 -0.20 1.67 3.38 -1.43 -0.15 115.31 118.93 1tui h LEU 147 Ca 0.04 -0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.82 1tui h LEU 147 Cb 0.45 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.13 1tui h LEU 147 CO 0.01 0.23 -0.60 0.44 0.09 0.00 0.00 178.44 178.61 1tui h ASP 148 N 0.39 0.87 0.38 -0.43 3.32 -1.12 -2.11 116.42 117.72 1tui h ASP 148 Ca 0.19 -0.59 -0.00 0.00 0.02 0.00 0.00 57.03 56.65 1tui h ASP 148 Cb 0.27 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 1tui h ASP 148 CO -0.05 1.30 -0.39 0.25 -1.72 0.00 0.00 179.24 178.64 1tui h LEU 149 N 0.48 -1.05 -0.86 1.55 5.85 0.60 -0.36 115.31 121.51 1tui h LEU 149 Ca -0.02 0.09 0.12 0.00 0.84 0.00 0.00 57.88 58.91 1tui h LEU 149 Cb 1.22 0.36 -0.08 0.00 0.37 0.00 0.00 40.66 42.53 1tui h LEU 149 CO 0.13 -0.53 0.49 0.58 -0.34 0.00 0.00 178.44 178.76 1tui h VAL 150 N -0.79 0.85 -0.58 1.05 2.07 -1.01 0.64 116.25 118.49 1tui h VAL 150 Ca -0.03 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 1tui h VAL 150 Cb 0.71 0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 1tui h VAL 150 CO -0.07 0.14 0.29 -0.08 0.02 0.00 0.00 177.57 177.87 1tui h GLU 151 N 0.77 0.82 -0.60 1.57 4.81 -1.01 0.12 114.58 121.04 1tui h GLU 151 Ca 0.44 -0.11 -0.05 0.00 -0.13 0.00 0.00 59.36 59.51 1tui h GLU 151 Cb 0.48 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.68 1tui h GLU 151 CO -0.29 0.65 0.17 0.52 -0.73 0.00 0.00 179.01 179.34 1tui h MET 152 N 0.78 0.91 -0.28 1.92 2.86 0.35 0.21 114.93 121.68 1tui h MET 152 Ca 0.20 -0.18 0.02 0.00 -2.06 0.00 0.00 59.70 57.68 1tui h MET 152 Cb 0.09 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.58 1tui h MET 152 CO -0.03 0.80 0.14 0.93 1.06 0.00 0.00 176.91 179.81 1tui h GLU 153 N 0.88 0.28 0.51 1.72 5.08 0.81 -0.62 114.58 123.25 1tui h GLU 153 Ca 0.20 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 1tui h GLU 153 Cb 0.27 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1tui h GLU 153 CO -0.01 0.19 -0.26 0.28 -1.00 0.00 0.00 179.01 178.21 1tui h VAL 154 N 0.29 0.47 -0.95 3.13 2.07 0.08 -1.44 116.25 119.89 1tui h VAL 154 Ca 0.12 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.77 1tui h VAL 154 Cb 0.04 0.47 -0.09 0.00 -1.52 0.00 0.00 31.29 30.20 1tui h VAL 154 CO -0.08 0.00 0.57 0.03 0.02 0.00 0.00 177.57 178.11 1tui h ARG 155 N -0.70 0.85 -0.26 1.57 3.08 -0.18 0.24 114.38 118.98 1tui h ARG 155 Ca -0.07 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 59.88 1tui h ARG 155 Cb 0.55 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1tui h ARG 155 CO 0.10 0.56 -0.05 0.22 -1.07 0.00 0.00 179.97 179.74 1tui h ASP 156 N 0.88 0.38 -0.30 7.04 3.58 -0.81 0.60 116.42 127.80 1tui h ASP 156 Ca 0.48 -0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.85 1tui h ASP 156 Cb 0.54 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.48 1tui h ASP 156 CO -0.29 0.48 0.13 -0.07 -2.88 0.00 0.00 179.24 176.61 1tui h LEU 157 N 0.39 0.40 -1.37 2.28 3.38 0.52 -1.03 115.31 119.89 1tui h LEU 157 Ca 0.08 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1tui h LEU 157 Cb 0.34 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1tui h LEU 157 CO 0.01 0.44 0.41 -0.07 0.09 0.00 0.00 178.44 179.32 1tui h LEU 158 N 0.34 0.73 -1.09 1.67 3.38 -0.20 0.52 115.31 120.66 1tui h LEU 158 Ca 0.10 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 1tui h LEU 158 Cb 0.16 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1tui h LEU 158 CO -0.01 0.53 -0.37 0.78 0.09 0.00 0.00 178.44 179.47 1tui h ASN 159 N 0.85 0.00 0.63 -0.43 2.35 -0.69 0.59 115.58 118.87 1tui h ASN 159 Ca 0.23 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.91 1tui h ASN 159 Cb -0.08 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1tui h ASN 159 CO -0.05 0.37 -0.33 1.56 -1.65 0.00 0.00 177.43 177.33 1tui h GLN 160 N 0.00 0.00 -0.36 0.81 4.20 0.14 -2.71 115.11 117.19 1tui h GLN 160 Ca -0.00 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.58 1tui h GLN 160 Cb 0.81 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.52 1tui h GLN 160 CO 0.05 0.33 0.01 0.66 -0.67 0.00 0.00 178.83 179.21 1tui n TYR 161 N -3.70 1.17 -0.59 2.96 4.01 -0.97 -4.93 117.16 115.10 1tui n TYR 161 Ca -0.01 -1.30 0.00 0.00 -0.16 0.00 0.00 57.90 56.43 1tui n TYR 161 Cb 0.43 -0.45 0.00 0.00 -0.31 0.00 0.00 39.34 39.01 1tui n TYR 161 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1tui n GLU 162 N -0.86 0.00 -1.25 -0.72 1.02 -0.88 -4.90 120.64 113.05 1tui n GLU 162 Ca 0.30 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 57.12 1tui n GLU 162 Cb 1.02 -2.55 0.10 0.00 -0.02 0.00 0.00 31.44 30.00 1tui n GLU 162 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1tui s PHE 163 N -3.17 2.17 -1.24 -0.32 0.08 0.20 -4.84 117.98 110.87 1tui s PHE 163 Ca 0.00 1.63 -0.16 0.00 0.12 0.00 0.00 56.93 58.52 1tui s PHE 163 Cb 0.00 -3.28 0.11 0.00 -0.57 0.00 0.00 43.02 39.28 1tui s PHE 163 CO 0.00 -2.30 1.58 -1.25 -0.10 0.00 0.00 175.22 173.16 1tui s PRO 164 N -4.38 4.00 0.42 0.24 0.04 -1.26 -3.84 135.00 130.23 1tui s PRO 164 Ca 0.68 -2.20 0.13 0.00 0.04 0.00 0.00 61.00 59.64 1tui s PRO 164 Cb -0.23 -5.31 0.92 0.00 0.04 0.00 0.00 34.50 29.91 1tui s PRO 164 CO 0.51 -2.04 1.96 0.78 0.04 0.00 0.00 177.00 178.25 1tui h GLY 165 N 11.32 0.09 2.00 0.56 0.00 -1.80 -1.39 103.07 113.85 1tui h GLY 165 Ca 0.38 -0.05 -0.04 0.00 0.00 0.00 0.00 47.33 47.61 1tui h GLY 165 CO 1.36 0.05 -0.19 -0.55 0.00 0.00 0.00 176.54 177.21 1tui h ASP 166 N 0.08 0.00 0.00 0.19 3.32 -1.84 -3.29 116.42 114.88 1tui h ASP 166 Ca 0.02 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.71 1tui h ASP 166 Cb 0.35 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.83 1tui h ASP 166 CO 0.02 0.19 -2.34 -0.62 -1.72 0.00 0.00 179.24 174.77 1tui n GLU 167 N -4.10 0.82 -0.62 3.56 1.02 -0.59 -5.03 120.64 115.70 1tui n GLU 167 Ca -0.02 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.81 1tui n GLU 167 Cb 0.26 -1.50 0.19 0.00 -0.02 0.00 0.00 31.44 30.38 1tui n GLU 167 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 1tui n VAL 168 N -2.75 0.00 -3.38 2.62 0.24 -0.81 -4.92 118.33 109.32 1tui n VAL 168 Ca -0.32 -0.27 -0.38 0.00 -2.04 0.00 0.00 64.34 61.32 1tui n VAL 168 Cb 1.12 -0.83 -0.07 0.00 -1.47 0.00 0.00 33.84 32.60 1tui n VAL 168 CO 0.00 0.00 0.00 -2.84 -2.14 0.00 0.00 176.83 171.85 1tui s PRO 169 N -4.06 4.25 -0.35 7.34 0.01 -1.26 -4.95 135.00 135.97 1tui s PRO 169 Ca 0.63 0.28 -0.01 0.00 0.01 0.00 0.00 61.00 61.91 1tui s PRO 169 Cb -0.21 -3.48 0.09 0.00 0.01 0.00 0.00 34.50 30.91 1tui s PRO 169 CO 0.64 0.08 0.09 0.08 0.01 0.00 0.00 177.00 177.91 1tui s VAL 170 N 0.92 2.94 -0.21 3.83 1.01 -1.26 -0.24 120.40 127.39 1tui s VAL 170 Ca 0.21 -1.88 -0.12 0.00 0.00 0.00 0.00 61.98 60.19 1tui s VAL 170 Cb -0.14 -2.93 -0.05 0.00 0.00 0.00 0.00 36.38 33.26 1tui s VAL 170 CO 0.08 -0.46 0.21 -0.63 0.00 0.00 0.00 175.10 174.30 1tui s ILE 171 N 1.13 5.34 -0.21 2.22 1.01 -0.36 -4.91 121.20 125.41 1tui s ILE 171 Ca 0.04 0.32 -0.11 0.00 0.00 0.00 0.00 60.65 60.89 1tui s ILE 171 Cb -0.21 -3.55 -0.05 0.00 0.01 0.00 0.00 42.46 38.67 1tui s ILE 171 CO -0.04 0.36 0.19 -0.13 0.00 0.00 0.00 174.94 175.33 1tui s ARG 172 N 0.82 4.15 0.00 2.79 0.52 -1.26 -0.90 118.95 125.06 1tui s ARG 172 Ca 0.11 -0.15 0.00 0.00 -0.52 0.00 0.00 55.73 55.17 1tui s ARG 172 Cb -0.13 -3.48 0.00 0.00 0.52 0.00 0.00 34.95 31.86 1tui s ARG 172 CO 0.03 0.16 0.00 0.41 0.02 0.00 0.00 175.30 175.92 1tui n GLY 173 N 3.85 1.37 2.96 -3.53 0.00 0.52 -4.96 105.19 105.39 1tui n GLY 173 Ca -0.14 -0.90 -0.31 0.00 0.00 0.00 0.00 46.02 44.67 1tui n GLY 173 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1tui s SER 174 N -0.74 4.36 0.29 1.61 0.15 -1.26 -1.77 113.70 116.34 1tui s SER 174 Ca 0.00 -1.70 0.02 0.00 0.70 0.00 0.00 55.95 54.96 1tui s SER 174 Cb 0.00 -1.37 0.46 0.00 -1.71 0.00 0.00 66.02 63.40 1tui s SER 174 CO 0.00 -0.32 1.79 0.00 1.20 0.00 0.00 173.24 175.91 1tui h ALA 175 N 7.81 1.20 0.45 5.45 0.00 -1.94 -2.26 119.26 129.97 1tui h ALA 175 Ca -0.11 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 1tui h ALA 175 Cb 1.03 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 1tui h ALA 175 CO 0.48 0.52 -0.27 1.25 0.00 0.00 0.00 179.25 181.22 1tui h LEU 176 N 0.54 -0.68 -0.59 0.00 6.46 -1.93 -1.41 115.31 117.71 1tui h LEU 176 Ca 0.10 0.04 0.04 0.00 -0.12 0.00 0.00 57.88 57.94 1tui h LEU 176 Cb 0.48 0.20 -0.04 0.00 -0.73 0.00 0.00 40.66 40.57 1tui h LEU 176 CO 0.03 -0.43 0.34 -0.07 -0.62 0.00 0.00 178.44 177.68 1tui h LEU 177 N -0.69 0.53 -0.51 2.25 3.38 -1.95 -1.40 115.31 116.92 1tui h LEU 177 Ca -0.05 0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.94 1tui h LEU 177 Cb 0.56 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 1tui h LEU 177 CO 0.06 0.36 0.33 0.00 0.09 0.00 0.00 178.44 179.28 1tui h ALA 178 N 1.28 0.65 -0.59 1.53 0.00 -1.26 -1.83 119.26 119.05 1tui h ALA 178 Ca 0.25 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1tui h ALA 178 Cb 0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1tui h ALA 178 CO -0.13 0.07 0.36 1.25 0.00 0.00 0.00 179.25 180.80 1tui h LEU 179 N 0.67 0.69 -0.70 0.00 5.85 -0.41 0.12 115.31 121.53 1tui h LEU 179 Ca 0.19 -0.03 -0.14 0.00 0.84 0.00 0.00 57.88 58.74 1tui h LEU 179 Cb -0.05 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 1tui h LEU 179 CO -0.05 0.53 -0.61 -0.08 -0.34 0.00 0.00 178.44 177.88 1tui h GLU 180 N 0.81 0.13 -0.42 1.25 4.22 -0.50 -1.54 114.58 118.51 1tui h GLU 180 Ca 0.21 -0.09 -0.06 0.00 0.08 0.00 0.00 59.36 59.50 1tui h GLU 180 Cb -0.05 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 1tui h GLU 180 CO -0.04 0.70 0.02 0.93 -2.18 0.00 0.00 179.01 178.44 1tui h GLU 181 N 0.09 0.74 -0.01 1.92 4.39 -0.08 0.58 114.58 122.21 1tui h GLU 181 Ca -0.01 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.47 1tui h GLU 181 Cb 1.10 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.68 1tui h GLU 181 CO 0.09 0.80 0.02 0.52 -1.16 0.00 0.00 179.01 179.28 1tui h MET 182 N 0.58 0.00 0.01 2.33 2.86 -0.99 0.46 114.93 120.19 1tui h MET 182 Ca 0.12 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.72 1tui h MET 182 Cb 0.46 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.12 1tui h MET 182 CO 0.02 0.00 -0.19 0.45 1.06 0.00 0.00 176.91 178.25 1tui h HIS 183 N 0.00 0.16 -0.67 -0.22 3.86 0.93 -2.43 115.15 116.79 1tui h HIS 183 Ca 0.00 -0.10 -0.07 0.00 -1.16 0.00 0.00 60.37 59.05 1tui h HIS 183 Cb 0.05 -0.02 -0.03 0.00 1.06 0.00 0.00 27.41 28.48 1tui h HIS 183 CO 0.00 0.95 0.15 0.87 0.86 0.00 0.00 177.93 180.76 1tui h LYS 184 N -0.67 1.08 -2.14 2.45 1.57 0.17 -3.39 116.57 115.64 1tui h LYS 184 Ca -0.03 -0.27 -0.56 0.00 -1.87 0.00 0.00 60.65 57.92 1tui h LYS 184 Cb 1.01 -0.14 -0.38 0.00 0.08 0.00 0.00 32.23 32.81 1tui h LYS 184 CO 0.04 0.97 -1.02 0.09 -0.57 0.00 0.00 179.45 178.96 1tui n ASN 185 N -4.27 -0.31 0.06 0.86 3.02 0.14 -4.97 115.26 109.80 1tui n ASN 185 Ca 0.04 -2.53 0.21 0.00 -0.03 0.00 0.00 54.58 52.27 1tui n ASN 185 Cb 0.26 -0.50 0.66 0.00 -0.61 0.00 0.00 39.78 39.58 1tui n ASN 185 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1tui h PRO 186 N 4.90 0.00 -0.18 3.52 0.11 -1.62 0.98 132.00 139.70 1tui h PRO 186 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1tui h PRO 186 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1tui h PRO 186 CO 0.40 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.82 1tui n LYS 187 N -3.44 2.29 -1.67 1.05 5.02 -1.26 -4.52 118.16 115.63 1tui n LYS 187 Ca 0.09 -1.91 -0.41 0.00 -2.02 0.00 0.00 58.31 54.06 1tui n LYS 187 Cb 0.81 -1.48 0.01 0.00 -0.02 0.00 0.00 35.03 34.36 1tui n LYS 187 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1tui n THR 188 N 1.22 2.55 -4.35 -0.18 -1.04 0.34 -4.98 114.28 107.83 1tui n THR 188 Ca 0.17 -0.50 -0.18 0.00 -2.04 0.00 0.00 64.05 61.49 1tui n THR 188 Cb 0.56 -1.43 -0.06 0.00 -1.82 0.00 0.00 70.33 67.59 1tui n THR 188 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1tui n LYS 189 N 0.06 0.60 -0.86 -2.82 5.02 -1.26 -4.79 118.16 114.10 1tui n LYS 189 Ca 0.08 -2.60 -0.36 0.00 -2.02 0.00 0.00 58.31 53.40 1tui n LYS 189 Cb 0.39 1.53 0.09 0.00 -0.02 0.00 0.00 35.03 37.03 1tui n LYS 189 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1tui n ARG 190 N -0.66 -0.63 0.00 1.97 0.63 -1.26 -1.98 116.66 114.72 1tui n ARG 190 Ca -0.03 -0.18 0.00 0.00 -0.92 0.00 0.00 57.85 56.73 1tui n ARG 190 Cb 0.46 -1.31 0.00 0.00 0.45 0.00 0.00 32.46 32.06 1tui n ARG 190 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1tui n GLY 191 N 2.83 0.00 0.36 5.14 0.00 -1.26 -4.51 105.19 107.75 1tui n GLY 191 Ca -0.01 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1tui n GLY 191 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1tui h GLU 192 N 0.00 -0.79 -6.23 1.61 5.08 -1.82 -3.44 114.58 108.98 1tui h GLU 192 Ca 0.00 0.05 -0.59 0.00 -1.00 0.00 0.00 59.36 57.82 1tui h GLU 192 Cb 0.00 0.18 -0.24 0.00 0.50 0.00 0.00 28.75 29.19 1tui h GLU 192 CO 0.00 -0.53 -0.84 1.21 -1.00 0.00 0.00 179.01 177.85 1tui s ASN 193 N -4.49 2.62 0.10 1.42 2.47 -1.26 -5.05 114.94 110.76 1tui s ASN 193 Ca -0.17 -0.61 -0.19 0.00 0.42 0.00 0.00 52.86 52.31 1tui s ASN 193 Cb 0.04 -0.19 -0.07 0.00 -1.45 0.00 0.00 41.25 39.58 1tui s ASN 193 CO 0.63 0.13 1.64 -0.08 -3.72 0.00 0.00 177.10 175.70 1tui h GLU 194 N 4.48 0.34 -0.31 0.43 4.81 -1.98 0.21 114.58 122.57 1tui h GLU 194 Ca -0.45 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 58.64 1tui h GLU 194 Cb 1.17 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.48 1tui h GLU 194 CO 0.42 0.39 -0.10 -1.49 -0.73 0.00 0.00 179.01 177.49 1tui h TRP 195 N 0.22 0.71 -0.65 0.92 -0.00 -1.95 -2.40 115.95 112.80 1tui h TRP 195 Ca 0.08 -0.16 0.00 0.00 -0.00 0.00 0.00 58.89 58.81 1tui h TRP 195 Cb 0.17 -0.17 -0.03 0.00 -0.00 0.00 0.00 29.16 29.13 1tui h TRP 195 CO -0.01 0.82 0.42 0.28 -0.00 0.00 0.00 178.44 179.95 1tui h VAL 196 N 0.39 1.17 0.00 1.49 2.07 -1.84 -2.40 116.25 117.13 1tui h VAL 196 Ca 0.08 -0.33 -0.05 0.00 0.82 0.00 0.00 66.70 67.22 1tui h VAL 196 Cb 0.60 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1tui h VAL 196 CO 0.04 0.17 -0.22 0.44 0.02 0.00 0.00 177.57 178.02 1tui h ASP 197 N 0.89 0.00 -0.40 0.57 5.19 -0.44 -1.86 116.42 120.37 1tui h ASP 197 Ca 0.24 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.54 1tui h ASP 197 Cb -0.08 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.41 1tui h ASP 197 CO -0.05 0.22 -0.12 0.11 -3.12 0.00 0.00 179.24 176.28 1tui h LYS 198 N 0.00 0.86 -0.74 3.56 1.79 -1.20 0.84 116.57 121.69 1tui h LYS 198 Ca -0.00 -0.30 0.05 0.00 -2.18 0.00 0.00 60.65 58.21 1tui h LYS 198 Cb 0.47 -0.06 -0.05 0.00 -1.58 0.00 0.00 32.23 31.01 1tui h LYS 198 CO 0.03 0.94 0.45 0.82 -1.08 0.00 0.00 179.45 180.60 1tui h ILE 199 N 0.77 1.04 -0.16 1.86 1.08 -1.36 0.27 117.51 121.02 1tui h ILE 199 Ca 0.12 -0.29 -0.03 0.00 -0.39 0.00 0.00 64.86 64.27 1tui h ILE 199 Cb 0.64 0.13 -0.01 0.00 -3.07 0.00 0.00 36.82 34.50 1tui h ILE 199 CO 0.04 0.15 -0.06 -0.50 -0.69 0.00 0.00 178.15 177.10 1tui h TRP 200 N 0.84 0.24 -0.29 1.37 4.06 -0.38 0.20 115.95 121.99 1tui h TRP 200 Ca 0.31 -0.02 -0.13 0.00 2.06 0.00 0.00 58.89 61.12 1tui h TRP 200 Cb 0.11 -0.07 -0.01 0.00 -1.00 0.00 0.00 29.16 28.18 1tui h TRP 200 CO -0.05 0.30 -0.35 0.93 -3.56 0.00 0.00 178.44 175.71 1tui h GLU 201 N 0.23 0.65 0.53 0.49 5.08 0.16 0.23 114.58 121.94 1tui h GLU 201 Ca 0.05 -0.31 -0.03 0.00 -1.00 0.00 0.00 59.36 58.08 1tui h GLU 201 Cb 0.26 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.51 1tui h GLU 201 CO 0.01 0.90 -0.25 1.25 -1.00 0.00 0.00 179.01 179.92 1tui h LEU 202 N 0.54 -0.60 -0.75 1.33 5.85 0.65 0.60 115.31 122.92 1tui h LEU 202 Ca 0.06 -0.01 0.10 0.00 0.84 0.00 0.00 57.88 58.87 1tui h LEU 202 Cb 0.86 0.16 -0.08 0.00 0.37 0.00 0.00 40.66 41.97 1tui h LEU 202 CO 0.07 -0.39 0.39 -0.07 -0.34 0.00 0.00 178.44 178.10 1tui h LEU 203 N -0.78 0.50 -0.70 2.25 3.38 -0.41 0.37 115.31 119.93 1tui h LEU 203 Ca -0.07 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1tui h LEU 203 Cb 0.58 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 1tui h LEU 203 CO 0.12 0.28 0.40 0.44 0.09 0.00 0.00 178.44 179.76 1tui h ASP 204 N 0.64 0.86 -0.53 -0.43 3.32 -0.42 -1.52 116.42 118.33 1tui h ASP 204 Ca 0.38 -0.09 0.07 0.00 0.02 0.00 0.00 57.03 57.41 1tui h ASP 204 Cb 0.41 -0.22 -0.06 0.00 0.22 0.00 0.00 39.33 39.69 1tui h ASP 204 CO -0.28 0.70 0.22 0.00 -1.72 0.00 0.00 179.24 178.16 1tui h ALA 205 N 1.20 0.67 0.81 3.45 0.00 0.19 0.34 119.26 125.92 1tui h ALA 205 Ca 0.25 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 1tui h ALA 205 Cb 0.02 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1tui h ALA 205 CO -0.04 -0.16 -0.47 0.82 0.00 0.00 0.00 179.25 179.40 1tui h ILE 206 N 0.42 0.06 -0.89 0.00 2.04 0.21 0.63 117.51 119.98 1tui h ILE 206 Ca 0.25 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.25 1tui h ILE 206 Cb 0.24 0.06 -0.09 0.00 -0.74 0.00 0.00 36.82 36.29 1tui h ILE 206 CO -0.23 0.00 0.49 0.44 0.00 0.00 0.00 178.15 178.86 1tui h ASP 207 N -1.19 0.64 0.04 1.72 3.32 -0.38 -1.14 116.42 119.44 1tui h ASP 207 Ca -0.11 0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 1tui h ASP 207 Cb 0.94 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.46 1tui h ASP 207 CO 0.13 0.28 -0.02 -0.08 -1.72 0.00 0.00 179.24 177.83 1tui h GLU 208 N 0.71 -0.06 0.00 3.56 4.81 0.05 -3.40 114.58 120.26 1tui h GLU 208 Ca 0.48 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 59.51 1tui h GLU 208 Cb 0.64 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.00 1tui h GLU 208 CO -0.34 0.59 -1.06 1.88 -0.73 0.00 0.00 179.01 179.36 1tui h TYR 209 N -0.84 0.00 -3.64 0.92 0.05 0.37 -3.44 116.97 110.40 1tui h TYR 209 Ca -0.01 0.00 -0.60 0.00 0.05 0.00 0.00 58.73 58.17 1tui h TYR 209 Cb 0.67 0.00 -0.10 0.00 1.01 0.00 0.00 36.73 38.31 1tui h TYR 209 CO 0.16 0.91 0.58 0.42 -1.05 0.00 0.00 178.16 179.18 1tui s ILE 210 N -2.74 4.50 0.50 -2.88 1.01 -0.44 -4.95 121.20 116.20 1tui s ILE 210 Ca 0.00 0.80 -0.22 0.00 0.00 0.00 0.00 60.65 61.23 1tui s ILE 210 Cb 0.09 -4.41 -0.07 0.00 0.01 0.00 0.00 42.46 38.07 1tui s ILE 210 CO 0.81 -0.79 1.14 -2.65 0.00 0.00 0.00 174.94 173.46 1tui n PRO 211 N 7.09 1.45 -3.00 2.79 -0.02 -1.26 -4.82 135.00 137.23 1tui n PRO 211 Ca 0.06 0.53 -0.40 0.00 -2.02 0.00 0.00 63.50 61.67 1tui n PRO 211 Cb 0.48 -2.29 -0.04 0.00 -0.02 0.00 0.00 33.50 31.63 1tui n PRO 211 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1tui s THR 212 N -1.33 5.01 0.63 3.45 -4.23 -1.26 -4.96 115.64 112.95 1tui s THR 212 Ca 0.68 1.54 -0.09 0.00 -1.18 0.00 0.00 61.69 62.64 1tui s THR 212 Cb -0.47 -4.08 -0.01 0.00 1.34 0.00 0.00 72.50 69.28 1tui s THR 212 CO 0.53 0.24 0.99 -2.16 -0.54 0.00 0.00 174.62 173.68 1tui s PRO 213 N 0.78 3.17 0.14 3.99 0.04 -1.26 -5.04 135.00 136.82 1tui s PRO 213 Ca 0.40 0.40 -0.30 0.00 0.04 0.00 0.00 61.00 61.54 1tui s PRO 213 Cb -0.18 -2.14 -0.07 0.00 0.04 0.00 0.00 34.50 32.15 1tui s PRO 213 CO 0.20 -0.72 1.09 0.08 0.04 0.00 0.00 177.00 177.69 1tui s VAL 214 N -3.15 4.04 0.25 -0.36 1.01 -1.26 -4.97 120.40 115.96 1tui s VAL 214 Ca 0.55 1.68 -0.30 0.00 0.00 0.00 0.00 61.98 63.91 1tui s VAL 214 Cb -0.11 -4.07 -0.09 0.00 0.00 0.00 0.00 36.38 32.11 1tui s VAL 214 CO 0.50 0.25 1.11 -0.60 0.00 0.00 0.00 175.10 176.36 1tui s ARG 215 N -0.02 4.61 0.17 2.72 6.06 -1.26 -4.90 118.95 126.32 1tui s ARG 215 Ca 0.51 1.80 -0.25 0.00 -2.50 0.00 0.00 55.73 55.29 1tui s ARG 215 Cb -0.28 -3.21 0.04 0.00 0.06 0.00 0.00 34.95 31.56 1tui s ARG 215 CO 0.33 0.15 1.57 -0.44 -2.50 0.00 0.00 175.30 174.41 1tui h ASP 216 N 4.23 -1.44 -0.22 -2.12 3.32 -1.94 0.15 116.42 118.40 1tui h ASP 216 Ca -0.46 0.24 0.06 0.00 0.02 0.00 0.00 57.03 56.89 1tui h ASP 216 Cb 1.21 0.66 -0.01 0.00 0.22 0.00 0.00 39.33 41.41 1tui h ASP 216 CO 0.69 -0.34 0.80 -0.37 -1.72 0.00 0.00 179.24 178.30 1tui h VAL 217 N -0.23 0.04 -0.00 -1.35 -1.51 -1.89 0.95 116.25 112.26 1tui h VAL 217 Ca 0.18 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.65 1tui h VAL 217 Cb 0.56 0.25 0.00 0.00 -2.13 0.00 0.00 31.29 29.98 1tui h VAL 217 CO -0.67 0.00 -0.86 0.47 -1.23 0.00 0.00 177.57 175.28 1tui n ASP 218 N -2.86 1.09 -4.83 4.19 8.00 0.53 -3.99 116.55 118.67 1tui n ASP 218 Ca 0.04 -0.98 -0.32 0.00 0.71 0.00 0.00 54.79 54.24 1tui n ASP 218 Cb 0.88 0.83 -0.01 0.00 -0.02 0.00 0.00 41.12 42.80 1tui n ASP 218 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1tui s LYS 219 N -2.92 3.60 0.37 -1.24 1.02 0.33 -4.93 119.74 115.97 1tui s LYS 219 Ca 0.10 1.02 -0.26 0.00 0.02 0.00 0.00 55.97 56.85 1tui s LYS 219 Cb 0.17 -2.08 -0.11 0.00 -0.52 0.00 0.00 37.83 35.28 1tui s LYS 219 CO 0.80 -0.57 1.16 -2.30 -0.92 0.00 0.00 175.35 173.53 1tui n PRO 220 N -2.01 1.74 -1.82 -1.68 -0.02 -1.26 -2.98 135.00 126.97 1tui n PRO 220 Ca 0.07 0.62 -0.42 0.00 -2.02 0.00 0.00 63.50 61.75 1tui n PRO 220 Cb 0.54 -2.18 -0.03 0.00 -0.02 0.00 0.00 33.50 31.80 1tui n PRO 220 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1tui s PHE 221 N -1.16 2.92 -0.24 6.00 5.36 -1.25 -4.40 117.98 125.22 1tui s PHE 221 Ca 0.59 0.56 -0.15 0.00 -0.96 0.00 0.00 56.93 56.97 1tui s PHE 221 Cb -0.57 -4.04 0.07 0.00 -0.34 0.00 0.00 43.02 38.13 1tui s PHE 221 CO 0.59 -3.80 0.59 -1.17 -1.46 0.00 0.00 175.22 169.98 1tui s LEU 222 N 0.70 -0.58 -0.10 6.12 2.96 -0.79 0.30 118.68 127.30 1tui s LEU 222 Ca 0.70 1.28 -0.04 0.00 -0.22 0.00 0.00 54.13 55.85 1tui s LEU 222 Cb -0.47 2.03 0.05 0.00 0.50 0.00 0.00 46.19 48.30 1tui s LEU 222 CO 0.36 -0.22 0.21 -0.32 -1.32 0.00 0.00 176.35 175.06 1tui s MET 223 N 1.31 0.15 -0.19 1.98 -2.45 0.30 -1.18 119.30 119.22 1tui s MET 223 Ca -0.08 0.51 -0.18 0.00 -1.25 0.00 0.00 55.69 54.69 1tui s MET 223 Cb -0.06 -0.14 -0.03 0.00 1.25 0.00 0.00 34.83 35.85 1tui s MET 223 CO -0.14 -0.19 0.51 -1.25 1.05 0.00 0.00 175.02 175.00 1tui s PRO 224 N 1.45 4.21 0.12 4.11 0.05 -1.26 0.33 135.00 144.00 1tui s PRO 224 Ca -0.07 0.41 -0.31 0.00 0.05 0.00 0.00 61.00 61.08 1tui s PRO 224 Cb -0.11 -3.55 -0.09 0.00 0.05 0.00 0.00 34.50 30.80 1tui s PRO 224 CO -0.08 -0.11 1.57 0.08 0.05 0.00 0.00 177.00 178.52 1tui s VAL 225 N 1.51 2.88 -0.10 -0.36 1.01 -0.08 -4.55 120.40 120.71 1tui s VAL 225 Ca 0.24 0.53 -0.10 0.00 0.00 0.00 0.00 61.98 62.66 1tui s VAL 225 Cb -0.15 -3.34 -0.05 0.00 0.00 0.00 0.00 36.38 32.84 1tui s VAL 225 CO 0.10 0.02 -0.21 1.21 0.00 0.00 0.00 175.10 176.22 1tui n GLU 226 N 4.60 0.32 -4.22 2.72 2.13 0.59 -1.23 120.64 125.54 1tui n GLU 226 Ca 0.14 0.13 -0.19 0.00 0.66 0.00 0.00 57.16 57.91 1tui n GLU 226 Cb 0.40 -1.06 -0.12 0.00 0.27 0.00 0.00 31.44 30.94 1tui n GLU 226 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1tui s ASP 227 N -6.13 1.93 -0.03 4.31 1.11 -1.15 -4.47 116.67 112.23 1tui s ASP 227 Ca -0.19 -0.72 0.05 0.00 0.18 0.00 0.00 52.55 51.86 1tui s ASP 227 Cb 0.05 -0.07 -0.01 0.00 1.07 0.00 0.00 42.92 43.96 1tui s ASP 227 CO 0.26 -0.10 -0.17 -0.69 1.18 0.00 0.00 175.17 175.65 1tui s VAL 228 N -1.72 1.43 0.06 -1.27 1.01 -1.25 -0.09 120.40 118.57 1tui s VAL 228 Ca 0.04 -0.73 -0.04 0.00 0.00 0.00 0.00 61.98 61.25 1tui s VAL 228 Cb -0.07 -1.22 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 1tui s VAL 228 CO 0.03 0.41 0.06 -0.36 0.00 0.00 0.00 175.10 175.24 1tui s PHE 229 N -0.11 0.36 -0.10 5.22 0.40 0.55 -4.94 117.98 119.36 1tui s PHE 229 Ca -0.00 -0.84 0.03 0.00 -0.60 0.00 0.00 56.93 55.51 1tui s PHE 229 Cb -0.10 -0.25 -0.01 0.00 0.51 0.00 0.00 43.02 43.17 1tui s PHE 229 CO 0.01 -0.43 -0.21 0.95 0.70 0.00 0.00 175.22 176.24 1tui s THR 230 N -3.77 2.38 -0.66 0.64 -4.23 -1.25 0.26 115.64 109.02 1tui s THR 230 Ca 0.05 -0.91 -0.10 0.00 -1.18 0.00 0.00 61.69 59.54 1tui s THR 230 Cb 0.06 -1.93 0.17 0.00 1.34 0.00 0.00 72.50 72.14 1tui s THR 230 CO -0.10 0.55 0.56 -0.63 -0.54 0.00 0.00 174.62 174.46 1tui s ILE 231 N 0.21 4.75 0.00 2.99 1.01 0.49 -4.89 121.20 125.77 1tui s ILE 231 Ca -0.13 -2.34 0.00 0.00 0.00 0.00 0.00 60.65 58.19 1tui s ILE 231 Cb -0.16 -4.02 0.00 0.00 0.01 0.00 0.00 42.46 38.29 1tui s ILE 231 CO 0.07 -0.91 0.00 0.35 0.00 0.00 0.00 174.94 174.44 1tui n THR 232 N 4.20 0.00 0.15 2.92 -2.24 -1.26 0.27 114.28 118.32 1tui n THR 232 Ca 0.04 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.88 1tui n THR 232 Cb 0.42 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.71 1tui n THR 232 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1tui h GLY 233 N 0.00 0.00 0.64 3.38 0.00 -2.06 -3.35 103.07 101.68 1tui h GLY 233 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.06 1tui h GLY 233 CO 0.00 0.00 -1.31 3.21 0.00 0.00 0.00 176.54 178.44 1tui h ARG 234 N 0.00 0.28 0.00 4.80 3.08 0.34 -3.52 114.38 119.37 1tui h ARG 234 Ca -0.02 -0.48 0.00 0.00 0.07 0.00 0.00 59.98 59.55 1tui h ARG 234 Cb 1.27 0.18 0.00 0.00 0.08 0.00 0.00 29.97 31.50 1tui h ARG 234 CO 0.04 1.23 0.00 0.41 -1.07 0.00 0.00 179.97 180.58 1tui n GLY 235 N 1.73 0.22 3.76 0.04 0.00 0.51 -4.88 105.19 106.57 1tui n GLY 235 Ca -0.22 -1.92 -0.39 0.00 0.00 0.00 0.00 46.02 43.49 1tui n GLY 235 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tui s THR 236 N -0.46 4.82 -0.13 2.61 2.01 -1.26 0.19 115.64 123.42 1tui s THR 236 Ca 0.00 1.37 0.00 0.00 0.31 0.00 0.00 61.69 63.38 1tui s THR 236 Cb 0.00 -3.99 0.02 0.00 0.01 0.00 0.00 72.50 68.54 1tui s THR 236 CO 0.00 0.42 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.54 1tui s VAL 237 N -0.28 1.38 -0.20 3.82 1.01 0.74 -1.22 120.40 125.65 1tui s VAL 237 Ca 0.33 -0.52 -0.18 0.00 0.00 0.00 0.00 61.98 61.61 1tui s VAL 237 Cb -0.19 -1.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 1tui s VAL 237 CO 0.19 0.42 0.48 0.00 0.00 0.00 0.00 175.10 176.20 1tui s ALA 238 N 1.43 3.55 0.23 5.51 0.00 -0.25 -0.33 121.76 131.90 1tui s ALA 238 Ca 0.02 -0.45 0.09 0.00 0.00 0.00 0.00 51.96 51.62 1tui s ALA 238 Cb -0.13 -2.76 -0.04 0.00 0.00 0.00 0.00 23.12 20.19 1tui s ALA 238 CO -0.08 -0.41 0.00 0.95 0.00 0.00 0.00 175.76 176.23 1tui s THR 239 N 1.55 3.58 0.00 0.00 -4.23 0.87 -0.34 115.64 117.08 1tui s THR 239 Ca 0.22 -1.71 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 1tui s THR 239 Cb -0.15 -2.87 0.00 0.00 1.34 0.00 0.00 72.50 70.82 1tui s THR 239 CO 0.09 -0.27 0.00 0.61 -0.54 0.00 0.00 174.62 174.51 1tui n GLY 240 N -0.61 3.16 3.74 3.99 0.00 -0.93 -0.30 105.19 114.25 1tui n GLY 240 Ca -0.08 -1.19 -0.40 0.00 0.00 0.00 0.00 46.02 44.34 1tui n GLY 240 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1tui s ARG 241 N -2.21 4.80 0.12 1.61 3.52 -1.26 -2.10 118.95 123.43 1tui s ARG 241 Ca 0.00 1.49 -0.30 0.00 -0.13 0.00 0.00 55.73 56.79 1tui s ARG 241 Cb 0.00 -3.31 -0.06 0.00 -1.56 0.00 0.00 34.95 30.02 1tui s ARG 241 CO 0.00 0.41 1.05 0.42 -0.81 0.00 0.00 175.30 176.37 1tui s ILE 242 N -0.79 4.20 -0.09 4.11 1.01 0.12 -4.30 121.20 125.46 1tui s ILE 242 Ca 0.43 1.80 -0.06 0.00 0.00 0.00 0.00 60.65 62.82 1tui s ILE 242 Cb -0.25 -4.15 -0.27 0.00 0.01 0.00 0.00 42.46 37.80 1tui s ILE 242 CO 0.31 0.26 0.47 -0.33 0.00 0.00 0.00 174.94 175.66 1tui h GLU 243 N 5.64 0.28 -2.45 2.79 5.08 -1.49 -0.41 114.58 124.00 1tui h GLU 243 Ca -0.43 -0.47 -0.07 0.00 -1.00 0.00 0.00 59.36 57.39 1tui h GLU 243 Cb 1.21 0.18 -0.18 0.00 0.50 0.00 0.00 28.75 30.46 1tui h GLU 243 CO 0.74 1.18 0.06 -0.98 -1.00 0.00 0.00 179.01 179.01 1tui s ARG 244 N -2.57 0.98 3.46 2.33 1.70 -0.95 -4.59 118.95 119.32 1tui s ARG 244 Ca -0.19 0.01 0.00 0.00 -0.47 0.00 0.00 55.73 55.08 1tui s ARG 244 Cb 0.06 0.46 0.00 0.00 -0.57 0.00 0.00 34.95 34.90 1tui s ARG 244 CO 0.80 -0.32 0.00 0.41 -1.08 0.00 0.00 175.30 175.10 1tui n GLY 245 N 0.80 -0.02 3.36 3.88 0.00 -1.06 -1.88 105.19 110.26 1tui n GLY 245 Ca -0.19 -1.02 -0.12 0.00 0.00 0.00 0.00 46.02 44.69 1tui n GLY 245 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tui s LYS 246 N 0.00 1.08 -0.02 1.61 0.00 -1.26 0.99 119.74 122.15 1tui s LYS 246 Ca 0.00 -0.48 0.05 0.00 0.00 0.00 0.00 55.97 55.54 1tui s LYS 246 Cb 0.00 0.48 -0.01 0.00 0.00 0.00 0.00 37.83 38.30 1tui s LYS 246 CO 0.00 -0.42 -0.16 0.14 0.00 0.00 0.00 175.35 174.91 1tui s VAL 247 N -3.21 1.27 0.10 1.79 -7.23 0.60 -4.82 120.40 108.90 1tui s VAL 247 Ca -0.01 -0.68 0.05 0.00 -1.81 0.00 0.00 61.98 59.53 1tui s VAL 247 Cb 0.00 -1.07 -0.03 0.00 0.56 0.00 0.00 36.38 35.84 1tui s VAL 247 CO -0.08 0.36 -0.12 -1.59 -0.31 0.00 0.00 175.10 173.36 1tui s LYS 248 N -0.30 0.88 0.83 4.82 -2.85 -1.26 0.44 119.74 122.29 1tui s LYS 248 Ca 0.04 -1.12 -0.14 0.00 -1.00 0.00 0.00 55.97 53.76 1tui s LYS 248 Cb -0.07 -0.71 0.02 0.00 -2.06 0.00 0.00 37.83 35.00 1tui s LYS 248 CO -0.00 0.13 0.63 0.28 0.10 0.00 0.00 175.35 176.50 1tui n VAL 249 N 0.76 1.18 0.00 1.79 0.31 -1.25 -1.88 118.33 119.24 1tui n VAL 249 Ca -0.17 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 63.88 1tui n VAL 249 Cb 0.56 -0.80 0.00 0.00 -0.91 0.00 0.00 33.84 32.70 1tui n VAL 249 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1tui n GLY 250 N 1.35 2.79 3.71 2.92 0.00 -0.03 -4.97 105.19 110.96 1tui n GLY 250 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1tui n GLY 250 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tui s ASP 251 N -2.15 6.66 -0.05 1.61 1.11 -0.79 -4.77 116.67 118.29 1tui s ASP 251 Ca 0.00 2.51 -0.14 0.00 0.18 0.00 0.00 52.55 55.09 1tui s ASP 251 Cb 0.00 -2.59 -0.05 0.00 1.07 0.00 0.00 42.92 41.35 1tui s ASP 251 CO 0.00 -0.79 0.38 -0.70 1.18 0.00 0.00 175.17 175.24 1tui s GLU 252 N 1.41 3.99 0.22 8.23 2.12 -1.26 0.20 118.70 133.61 1tui s GLU 252 Ca 0.69 0.33 -0.00 0.00 0.36 0.00 0.00 54.97 56.35 1tui s GLU 252 Cb -0.41 -3.28 -0.04 0.00 0.26 0.00 0.00 34.13 30.66 1tui s GLU 252 CO 0.31 0.56 0.11 0.14 -0.54 0.00 0.00 175.26 175.84 1tui s VAL 253 N -0.63 0.23 -0.06 3.70 -7.23 -0.32 -4.37 120.40 111.72 1tui s VAL 253 Ca 0.22 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.40 1tui s VAL 253 Cb -0.16 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.24 1tui s VAL 253 CO 0.11 -0.04 -0.03 -1.61 -0.31 0.00 0.00 175.10 173.22 1tui s GLU 254 N -4.10 2.82 -0.40 4.82 2.02 -0.47 -1.50 118.70 121.89 1tui s GLU 254 Ca 0.37 -0.52 -0.14 0.00 0.02 0.00 0.00 54.97 54.70 1tui s GLU 254 Cb 0.07 -2.67 0.02 0.00 0.10 0.00 0.00 34.13 31.66 1tui s GLU 254 CO 0.12 0.67 0.29 0.42 0.02 0.00 0.00 175.26 176.77 1tui s ILE 255 N -0.89 5.18 -0.11 -1.63 1.01 0.28 -0.37 121.20 124.67 1tui s ILE 255 Ca 0.14 -0.66 -0.01 0.00 0.00 0.00 0.00 60.65 60.12 1tui s ILE 255 Cb -0.11 -3.87 -0.03 0.00 0.01 0.00 0.00 42.46 38.46 1tui s ILE 255 CO 0.03 -0.29 -0.06 -0.69 0.00 0.00 0.00 174.94 173.94 1tui s VAL 256 N 1.67 3.72 0.00 2.92 1.01 0.16 -2.47 120.40 127.41 1tui s VAL 256 Ca 0.05 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.58 1tui s VAL 256 Cb -0.19 -2.57 0.00 0.00 0.00 0.00 0.00 36.38 33.62 1tui s VAL 256 CO 0.10 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.36 1tui n GLY 257 N 2.87 2.13 5.00 4.51 0.00 -1.26 0.09 105.19 118.52 1tui n GLY 257 Ca -0.18 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 43.85 1tui n GLY 257 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1tui n LEU 258 N 0.00 0.00 -4.79 0.99 4.77 -0.17 -4.76 117.00 113.03 1tui n LEU 258 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.67 1tui n LEU 258 Cb 0.00 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.17 1tui n LEU 258 CO 0.00 0.00 0.70 0.00 -1.33 0.00 0.00 177.39 176.76 1tui s ALA 259 N 0.00 2.37 -0.26 -1.18 0.00 -1.26 -4.65 121.76 116.77 1tui s ALA 259 Ca 0.00 0.10 0.26 0.00 0.00 0.00 0.00 51.96 52.32 1tui s ALA 259 Cb 0.00 -3.20 1.17 0.00 0.00 0.00 0.00 23.12 21.08 1tui s ALA 259 CO 0.00 -1.59 1.79 -1.00 0.00 0.00 0.00 175.76 174.96 1tui h PRO 260 N -0.99 0.00 -2.97 0.00 0.13 -1.99 -3.45 132.00 122.73 1tui h PRO 260 Ca -0.45 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.64 1tui h PRO 260 Cb 1.23 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.22 1tui h PRO 260 CO 0.55 0.00 0.07 -1.21 -0.23 0.00 0.00 178.00 177.18 1tui s GLU 261 N -3.47 1.12 0.02 0.86 2.02 -1.26 -5.14 118.70 112.85 1tui s GLU 261 Ca 0.02 -0.41 -0.25 0.00 0.02 0.00 0.00 54.97 54.36 1tui s GLU 261 Cb 0.09 0.51 -0.05 0.00 0.10 0.00 0.00 34.13 34.78 1tui s GLU 261 CO 0.38 -0.44 0.76 0.99 0.02 0.00 0.00 175.26 176.98 1tui s THR 262 N -3.13 4.79 0.11 3.63 2.01 -1.26 -4.87 115.64 116.92 1tui s THR 262 Ca -0.02 1.61 0.06 0.00 0.31 0.00 0.00 61.69 63.66 1tui s THR 262 Cb -0.00 -4.11 -0.04 0.00 0.01 0.00 0.00 72.50 68.36 1tui s THR 262 CO -0.07 0.34 -0.05 -0.60 -0.69 0.00 0.00 174.62 173.55 1tui s ARG 263 N 0.13 2.32 0.04 4.92 3.52 -1.03 -4.93 118.95 123.92 1tui s ARG 263 Ca 0.39 -0.97 0.04 0.00 -0.13 0.00 0.00 55.73 55.06 1tui s ARG 263 Cb -0.20 -2.40 -0.04 0.00 -1.56 0.00 0.00 34.95 30.76 1tui s ARG 263 CO 0.22 0.51 -0.06 0.15 -0.81 0.00 0.00 175.30 175.31 1tui s LYS 264 N -2.37 2.46 0.00 5.12 1.02 -1.26 0.99 119.74 125.70 1tui s LYS 264 Ca 0.24 -0.80 0.00 0.00 0.02 0.00 0.00 55.97 55.43 1tui s LYS 264 Cb -0.11 -2.47 0.00 0.00 -0.52 0.00 0.00 37.83 34.73 1tui s LYS 264 CO 0.16 0.57 0.00 0.25 -0.92 0.00 0.00 175.35 175.42 1tui n THR 265 N 1.23 0.00 -4.32 2.17 -2.24 -0.56 -4.98 114.28 105.57 1tui n THR 265 Ca -0.14 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.43 1tui n THR 265 Cb 0.52 0.00 -0.16 0.00 -2.10 0.00 0.00 70.33 68.59 1tui n THR 265 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1tui s VAL 266 N -2.67 0.73 0.10 2.28 1.01 -1.26 -1.17 120.40 119.41 1tui s VAL 266 Ca 0.00 -0.26 -0.31 0.00 0.00 0.00 0.00 61.98 61.41 1tui s VAL 266 Cb 0.00 -0.69 -0.09 0.00 0.00 0.00 0.00 36.38 35.60 1tui s VAL 266 CO 0.00 0.26 1.59 -0.69 0.00 0.00 0.00 175.10 176.25 1tui s VAL 267 N 0.64 2.95 -0.42 2.92 1.01 0.13 -2.29 120.40 125.34 1tui s VAL 267 Ca -0.10 0.54 0.05 0.00 0.00 0.00 0.00 61.98 62.47 1tui s VAL 267 Cb -0.13 -3.35 0.13 0.00 0.00 0.00 0.00 36.38 33.03 1tui s VAL 267 CO 0.01 0.02 1.08 0.35 0.00 0.00 0.00 175.10 176.56 1tui n THR 268 N 4.40 0.93 0.00 3.92 -2.24 0.61 -0.85 114.28 121.05 1tui n THR 268 Ca 0.15 -0.97 0.00 0.00 -2.27 0.00 0.00 64.05 60.96 1tui n THR 268 Cb 0.40 0.54 0.00 0.00 -2.10 0.00 0.00 70.33 69.17 1tui n THR 268 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tui n GLY 269 N -0.03 0.97 1.37 3.38 0.00 -1.23 -4.87 105.19 104.77 1tui n GLY 269 Ca 0.05 0.47 -0.07 0.00 0.00 0.00 0.00 46.02 46.46 1tui n GLY 269 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1tui n VAL 270 N 0.00 0.00 0.00 1.61 0.31 -1.26 0.93 118.33 119.92 1tui n VAL 270 Ca 0.00 -0.63 0.00 0.00 -0.01 0.00 0.00 64.34 63.70 1tui n VAL 270 Cb 0.00 -0.97 0.00 0.00 -0.91 0.00 0.00 33.84 31.96 1tui n VAL 270 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1tui n GLU 271 N -1.52 0.00 -3.54 5.55 2.13 -1.22 -4.60 120.64 117.45 1tui n GLU 271 Ca 0.06 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.75 1tui n GLU 271 Cb 0.21 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 31.87 1tui n GLU 271 CO 0.00 0.00 0.00 1.41 -0.41 0.00 0.00 177.13 178.13 1tui s MET 272 N -1.42 0.80 -1.14 5.31 1.75 -0.23 -2.72 119.30 121.65 1tui s MET 272 Ca 0.00 0.09 -0.07 0.00 -1.25 0.00 0.00 55.69 54.46 1tui s MET 272 Cb 0.00 0.38 0.05 0.00 2.84 0.00 0.00 34.83 38.10 1tui s MET 272 CO 0.00 -0.27 0.34 0.72 -0.65 0.00 0.00 175.02 175.16 1tui n HIS 273 N 0.59 -1.71 0.00 4.11 8.25 -1.26 -1.87 115.22 123.34 1tui n HIS 273 Ca -0.13 0.33 0.00 0.00 -0.26 0.00 0.00 57.72 57.66 1tui n HIS 273 Cb 0.58 -2.71 0.00 0.00 1.12 0.00 0.00 29.99 28.98 1tui n HIS 273 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1tui n ARG 274 N -3.43 0.00 -0.59 -0.41 1.74 -1.26 -4.92 116.66 107.79 1tui n ARG 274 Ca -0.04 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.75 1tui n ARG 274 Cb 0.55 0.00 0.23 0.00 -1.02 0.00 0.00 32.46 32.22 1tui n ARG 274 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1tui s LYS 275 N 0.00 -0.45 0.00 5.56 -0.14 -0.78 -5.02 119.74 118.91 1tui s LYS 275 Ca 0.00 1.02 0.00 0.00 -1.36 0.00 0.00 55.97 55.63 1tui s LYS 275 Cb 0.00 -1.59 0.00 0.00 -1.68 0.00 0.00 37.83 34.56 1tui s LYS 275 CO 0.00 -3.46 0.00 2.41 -0.76 0.00 0.00 175.35 173.54 1tui n THR 276 N -4.76 0.00 0.00 2.17 -1.04 -1.26 -1.07 114.28 108.32 1tui n THR 276 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 1tui n THR 276 Cb 0.54 -1.31 0.00 0.00 -1.82 0.00 0.00 70.33 67.74 1tui n THR 276 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1tui n LEU 277 N 0.00 0.00 0.09 -4.42 7.94 -1.26 -3.91 117.00 115.43 1tui n LEU 277 Ca 0.00 0.00 -0.15 0.00 -1.11 0.00 0.00 56.01 54.75 1tui n LEU 277 Cb 0.00 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 43.87 1tui n LEU 277 CO 0.00 0.00 0.08 1.56 -1.11 0.00 0.00 177.39 177.92 1tui h GLN 278 N 0.00 0.35 -3.68 1.96 7.50 -1.96 -3.41 115.11 115.87 1tui h GLN 278 Ca 0.00 -0.46 -0.22 0.00 0.50 0.00 0.00 58.65 58.48 1tui h GLN 278 Cb 0.00 0.15 -0.27 0.00 0.05 0.00 0.00 27.48 27.41 1tui h GLN 278 CO 0.00 1.15 -0.68 -2.00 -1.50 0.00 0.00 178.83 175.80 1tui s GLU 279 N -3.01 0.07 -0.23 1.46 2.12 -1.26 -3.76 118.70 114.09 1tui s GLU 279 Ca -0.05 -0.02 -0.10 0.00 0.36 0.00 0.00 54.97 55.16 1tui s GLU 279 Cb 0.08 0.03 -0.05 0.00 0.26 0.00 0.00 34.13 34.45 1tui s GLU 279 CO 0.87 -0.01 0.13 0.20 -0.54 0.00 0.00 175.26 175.91 1tui s GLY 280 N -0.13 1.95 0.15 -1.50 0.00 1.50 -4.91 107.32 104.38 1tui s GLY 280 Ca -0.02 -0.87 0.10 0.00 0.00 0.00 0.00 44.72 43.93 1tui s GLY 280 CO -0.00 0.33 -0.22 -0.42 0.00 0.00 0.00 173.10 172.79 1tui s ILE 281 N 0.94 2.02 0.01 0.90 1.01 -1.26 0.22 121.20 125.03 1tui s ILE 281 Ca 0.06 -1.84 -0.39 0.00 0.00 0.00 0.00 60.65 58.48 1tui s ILE 281 Cb -0.13 -1.88 -0.19 0.00 0.01 0.00 0.00 42.46 40.26 1tui s ILE 281 CO 0.03 -0.14 1.13 0.00 0.00 0.00 0.00 174.94 175.97 1tui n ALA 282 N 0.56 -3.09 0.00 9.38 0.00 0.28 0.02 120.51 127.67 1tui n ALA 282 Ca -0.15 0.58 0.00 0.00 0.00 0.00 0.00 53.44 53.87 1tui n ALA 282 Cb 0.55 -1.83 0.00 0.00 0.00 0.00 0.00 19.45 18.18 1tui n ALA 282 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tui n GLY 283 N 1.75 2.07 3.70 0.00 0.00 -0.16 -4.94 105.19 107.61 1tui n GLY 283 Ca 0.20 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1tui n GLY 283 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tui s ASP 284 N 0.23 7.01 -0.80 1.61 1.01 0.10 -4.65 116.67 121.19 1tui s ASP 284 Ca 0.00 1.98 -0.18 0.00 0.71 0.00 0.00 52.55 55.06 1tui s ASP 284 Cb 0.00 -2.57 0.14 0.00 1.01 0.00 0.00 42.92 41.50 1tui s ASP 284 CO 0.00 -0.57 0.91 0.20 0.21 0.00 0.00 175.17 175.92 1tui s ASN 285 N 1.38 6.52 0.00 0.27 0.01 -1.26 0.13 114.94 121.99 1tui s ASN 285 Ca 0.59 -1.99 0.00 0.00 -0.71 0.00 0.00 52.86 50.75 1tui s ASN 285 Cb -0.28 -2.33 0.00 0.00 0.41 0.00 0.00 41.25 39.05 1tui s ASN 285 CO 0.26 -0.97 0.00 1.33 -1.51 0.00 0.00 177.10 176.21 1tui n VAL 286 N 5.14 0.00 -3.68 1.60 0.24 -0.89 -4.79 118.33 115.95 1tui n VAL 286 Ca 0.11 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.31 1tui n VAL 286 Cb 0.47 -0.86 -0.10 0.00 -1.47 0.00 0.00 33.84 31.87 1tui n VAL 286 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1tui s GLY 287 N -0.99 -0.35 0.08 7.63 0.00 -1.10 -2.18 107.32 110.41 1tui s GLY 287 Ca 0.00 1.54 0.09 0.00 0.00 0.00 0.00 44.72 46.35 1tui s GLY 287 CO 0.00 1.98 -0.21 1.08 0.00 0.00 0.00 173.10 175.95 1tui s LEU 288 N 1.87 2.53 -0.41 0.66 1.43 0.54 -3.37 118.68 121.93 1tui s LEU 288 Ca -0.07 -0.54 -0.17 0.00 -1.03 0.00 0.00 54.13 52.32 1tui s LEU 288 Cb -0.10 -1.45 0.02 0.00 0.03 0.00 0.00 46.19 44.69 1tui s LEU 288 CO -0.13 0.22 0.41 -0.76 0.23 0.00 0.00 176.35 176.32 1tui s LEU 289 N -1.74 4.81 -0.02 1.79 1.02 0.26 -1.09 118.68 123.71 1tui s LEU 289 Ca 0.15 -0.61 -0.16 0.00 0.02 0.00 0.00 54.13 53.53 1tui s LEU 289 Cb -0.10 -2.36 -0.05 0.00 0.02 0.00 0.00 46.19 43.69 1tui s LEU 289 CO 0.06 -0.52 0.45 -0.76 0.02 0.00 0.00 176.35 175.60 1tui s LEU 290 N 2.08 4.43 -0.35 1.79 1.43 -0.36 -0.28 118.68 127.42 1tui s LEU 290 Ca 0.11 0.96 -0.14 0.00 -1.03 0.00 0.00 54.13 54.03 1tui s LEU 290 Cb -0.17 -2.66 -0.01 0.00 0.03 0.00 0.00 46.19 43.38 1tui s LEU 290 CO 0.13 0.23 0.31 -0.60 0.23 0.00 0.00 176.35 176.65 1tui s ARG 291 N -0.61 3.49 0.00 1.70 3.52 -0.97 -4.26 118.95 121.82 1tui s ARG 291 Ca 0.25 -0.55 0.00 0.00 -0.13 0.00 0.00 55.73 55.30 1tui s ARG 291 Cb -0.17 -3.82 0.00 0.00 -1.56 0.00 0.00 34.95 29.40 1tui s ARG 291 CO 0.13 -0.52 0.00 0.41 -0.81 0.00 0.00 175.30 174.51 1tui n GLY 292 N 5.03 0.89 3.00 8.12 0.00 -1.26 -4.22 105.19 116.75 1tui n GLY 292 Ca -0.10 -0.58 -0.29 0.00 0.00 0.00 0.00 46.02 45.04 1tui n GLY 292 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tui s VAL 293 N -2.47 1.44 0.93 1.61 1.01 -1.26 -5.08 120.40 116.58 1tui s VAL 293 Ca 0.00 -0.56 -0.11 0.00 0.00 0.00 0.00 61.98 61.31 1tui s VAL 293 Cb 0.00 -1.36 0.15 0.00 0.00 0.00 0.00 36.38 35.17 1tui s VAL 293 CO 0.00 0.44 1.11 -0.94 0.00 0.00 0.00 175.10 175.70 1tui s SER 294 N 1.45 2.93 0.00 3.32 1.04 -1.26 -4.49 113.70 116.70 1tui s SER 294 Ca 0.03 1.89 0.14 0.00 0.48 0.00 0.00 55.95 58.50 1tui s SER 294 Cb -0.13 -2.45 0.77 0.00 0.10 0.00 0.00 66.02 64.31 1tui s SER 294 CO -0.09 -3.04 1.37 -1.14 0.98 0.00 0.00 173.24 171.32 1tui n ARG 295 N -4.18 0.27 -0.12 4.02 0.63 -1.26 -2.01 116.66 114.01 1tui n ARG 295 Ca 0.09 0.11 -0.23 0.00 -0.92 0.00 0.00 57.85 56.90 1tui n ARG 295 Cb 0.53 -1.50 -0.11 0.00 0.45 0.00 0.00 32.46 31.83 1tui n ARG 295 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1tui n GLU 296 N -1.21 0.63 0.05 -0.14 4.71 -1.26 -4.30 120.64 119.12 1tui n GLU 296 Ca 0.08 0.24 0.03 0.00 -0.01 0.00 0.00 57.16 57.49 1tui n GLU 296 Cb 0.10 -1.55 0.16 0.00 -1.01 0.00 0.00 31.44 29.14 1tui n GLU 296 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1tui n GLU 297 N -3.74 0.04 -3.97 3.49 1.02 -0.85 -4.48 120.64 112.14 1tui n GLU 297 Ca -0.47 0.46 -0.16 0.00 -0.02 0.00 0.00 57.16 56.98 1tui n GLU 297 Cb 0.93 -1.74 -0.16 0.00 -0.02 0.00 0.00 31.44 30.45 1tui n GLU 297 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1tui s VAL 298 N -3.00 0.20 0.07 2.62 1.01 -1.23 -4.95 120.40 115.12 1tui s VAL 298 Ca -0.01 0.02 -0.07 0.00 0.00 0.00 0.00 61.98 61.92 1tui s VAL 298 Cb 0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 36.38 36.14 1tui s VAL 298 CO 0.05 0.12 0.14 -1.83 0.00 0.00 0.00 175.10 173.58 1tui s GLU 299 N 0.66 0.74 0.27 2.72 -1.05 -1.26 -4.90 118.70 115.88 1tui s GLU 299 Ca -0.07 -0.91 -0.28 0.00 -0.15 0.00 0.00 54.97 53.56 1tui s GLU 299 Cb -0.10 0.29 -0.15 0.00 -0.44 0.00 0.00 34.13 33.74 1tui s GLU 299 CO -0.01 -0.21 0.90 -2.13 0.95 0.00 0.00 175.26 174.76 1tui n ARG 300 N 0.23 1.04 0.00 -4.83 0.63 -1.26 -1.35 116.66 111.12 1tui n ARG 300 Ca -0.16 0.37 0.00 0.00 -0.92 0.00 0.00 57.85 57.13 1tui n ARG 300 Cb 0.61 -1.65 0.00 0.00 0.45 0.00 0.00 32.46 31.87 1tui n ARG 300 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1tui n GLY 301 N 1.40 3.00 3.91 5.14 0.00 -0.37 -4.98 105.19 113.30 1tui n GLY 301 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1tui n GLY 301 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1tui s GLN 302 N -0.09 1.21 0.12 1.61 -0.21 -0.46 -4.83 119.66 117.01 1tui s GLN 302 Ca 0.00 -0.15 0.06 0.00 0.02 0.00 0.00 55.36 55.30 1tui s GLN 302 Cb 0.00 -1.89 -0.04 0.00 1.00 0.00 0.00 33.01 32.09 1tui s GLN 302 CO 0.00 -2.07 -0.15 0.14 -2.12 0.00 0.00 175.29 171.09 1tui s VAL 303 N -3.71 1.38 -0.10 1.09 -7.23 0.11 -0.90 120.40 111.04 1tui s VAL 303 Ca 0.68 -1.66 -0.01 0.00 -1.81 0.00 0.00 61.98 59.19 1tui s VAL 303 Cb -0.08 -1.50 -0.03 0.00 0.56 0.00 0.00 36.38 35.34 1tui s VAL 303 CO 0.51 -0.34 -0.06 -0.76 -0.31 0.00 0.00 175.10 174.15 1tui s LEU 304 N -2.31 3.21 0.15 1.32 1.43 0.98 0.37 118.68 123.83 1tui s LEU 304 Ca 0.08 -0.06 -0.15 0.00 -1.03 0.00 0.00 54.13 52.97 1tui s LEU 304 Cb -0.06 -1.73 0.03 0.00 0.03 0.00 0.00 46.19 44.46 1tui s LEU 304 CO 0.03 0.29 0.41 0.00 0.23 0.00 0.00 176.35 177.32 1tui s ALA 305 N -0.39 -0.80 -0.04 4.21 0.00 0.50 0.11 121.76 125.36 1tui s ALA 305 Ca 0.06 -0.21 -0.39 0.00 0.00 0.00 0.00 51.96 51.42 1tui s ALA 305 Cb -0.12 0.75 -0.17 0.00 0.00 0.00 0.00 23.12 23.57 1tui s ALA 305 CO 0.02 -0.68 1.37 1.17 0.00 0.00 0.00 175.76 177.64 1tui n LYS 306 N -0.25 0.82 -1.62 0.00 3.00 0.88 -1.37 118.16 119.61 1tui n LYS 306 Ca -0.13 0.30 -0.45 0.00 -0.00 0.00 0.00 58.31 58.02 1tui n LYS 306 Cb 0.63 -1.90 -0.02 0.00 0.00 0.00 0.00 35.03 33.74 1tui n LYS 306 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 1tui n PRO 307 N 2.89 1.60 -0.87 1.64 -0.02 -1.26 -1.03 135.00 137.95 1tui n PRO 307 Ca 0.21 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 1tui n PRO 307 Cb 0.14 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 1tui n PRO 307 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1tui n GLY 308 N 1.39 0.35 0.22 -1.23 0.00 -1.26 -4.89 105.19 99.77 1tui n GLY 308 Ca 0.10 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.24 1tui n GLY 308 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1tui h SER 309 N 0.00 0.00 -5.00 1.61 4.64 -1.39 -3.46 113.55 109.95 1tui h SER 309 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1tui h SER 309 Cb 0.27 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 62.17 1tui h SER 309 CO 0.00 0.00 -0.12 -0.51 -0.87 0.00 0.00 176.83 175.33 1tui s ILE 310 N -3.25 0.04 0.22 0.95 2.07 -1.26 -5.07 121.20 114.91 1tui s ILE 310 Ca 0.07 -0.35 0.11 0.00 -1.41 0.00 0.00 60.65 59.06 1tui s ILE 310 Cb 0.06 -0.79 -0.05 0.00 0.13 0.00 0.00 42.46 41.81 1tui s ILE 310 CO 0.65 -0.19 -0.21 -0.89 -1.91 0.00 0.00 174.94 172.39 1tui s THR 311 N -1.55 2.25 0.19 4.00 2.01 -1.26 -5.02 115.64 116.26 1tui s THR 311 Ca -0.11 -2.18 -0.06 0.00 0.31 0.00 0.00 61.69 59.66 1tui s THR 311 Cb -0.03 -2.14 -0.06 0.00 0.01 0.00 0.00 72.50 70.29 1tui s THR 311 CO 0.04 -0.30 0.44 -2.16 -0.69 0.00 0.00 174.62 171.95 1tui s PRO 312 N -3.11 3.66 0.31 4.92 0.04 -1.26 -1.67 135.00 137.89 1tui s PRO 312 Ca 0.24 -0.01 -0.19 0.00 0.04 0.00 0.00 61.00 61.08 1tui s PRO 312 Cb -0.06 -2.77 0.05 0.00 0.04 0.00 0.00 34.50 31.76 1tui s PRO 312 CO 0.11 0.39 0.82 -1.01 0.04 0.00 0.00 177.00 177.36 1tui s HIS 313 N -1.76 0.01 0.00 0.56 3.76 0.12 -4.83 115.29 113.15 1tui s HIS 313 Ca 0.43 -0.57 0.00 0.00 -0.15 0.00 0.00 55.06 54.77 1tui s HIS 313 Cb -0.12 0.77 0.00 0.00 1.11 0.00 0.00 32.58 34.35 1tui s HIS 313 CO 0.25 -1.34 0.00 0.25 -0.85 0.00 0.00 174.74 173.05 1tui n THR 314 N -0.53 0.00 -4.11 1.30 -2.24 -1.26 -0.11 114.28 107.33 1tui n THR 314 Ca -0.06 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.37 1tui n THR 314 Cb 0.60 -0.02 -0.12 0.00 -2.10 0.00 0.00 70.33 68.69 1tui n THR 314 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1tui s LYS 315 N -0.67 3.68 0.19 -0.78 1.02 -1.26 0.04 119.74 121.95 1tui s LYS 315 Ca 0.00 -0.50 -0.13 0.00 0.02 0.00 0.00 55.97 55.37 1tui s LYS 315 Cb 0.00 -3.08 0.01 0.00 -0.52 0.00 0.00 37.83 34.24 1tui s LYS 315 CO 0.00 0.08 0.40 -0.59 -0.92 0.00 0.00 175.35 174.32 1tui s PHE 316 N 0.84 0.19 0.03 3.18 -0.71 -1.03 -1.82 117.98 118.65 1tui s PHE 316 Ca 0.01 -0.55 0.05 0.00 -1.04 0.00 0.00 56.93 55.40 1tui s PHE 316 Cb -0.14 0.15 -0.03 0.00 -1.21 0.00 0.00 43.02 41.78 1tui s PHE 316 CO 0.02 -0.83 -0.10 -2.00 -1.34 0.00 0.00 175.22 170.97 1tui s GLU 317 N -3.94 2.38 0.00 1.99 2.12 0.26 -1.49 118.70 120.03 1tui s GLU 317 Ca 0.15 -0.82 -0.06 0.00 0.36 0.00 0.00 54.97 54.59 1tui s GLU 317 Cb 0.01 -2.40 -0.00 0.00 0.26 0.00 0.00 34.13 32.00 1tui s GLU 317 CO 0.00 0.57 0.12 0.00 -0.54 0.00 0.00 175.26 175.42 1tui s ALA 318 N -1.00 -0.28 -0.23 6.30 0.00 -0.31 -0.22 121.76 126.01 1tui s ALA 318 Ca 0.17 -0.15 -0.11 0.00 0.00 0.00 0.00 51.96 51.87 1tui s ALA 318 Cb -0.11 0.10 -0.05 0.00 0.00 0.00 0.00 23.12 23.06 1tui s ALA 318 CO 0.08 -0.20 0.19 0.45 0.00 0.00 0.00 175.76 176.28 1tui s SER 319 N -1.32 6.16 0.10 0.00 0.15 -1.02 -1.96 113.70 115.80 1tui s SER 319 Ca -0.14 0.16 0.01 0.00 0.70 0.00 0.00 55.95 56.69 1tui s SER 319 Cb -0.08 -2.12 -0.04 0.00 -1.71 0.00 0.00 66.02 62.07 1tui s SER 319 CO 0.01 0.06 -0.06 -0.69 1.20 0.00 0.00 173.24 173.76 1tui s VAL 320 N 1.05 0.65 -0.05 4.45 1.01 0.10 -1.34 120.40 126.27 1tui s VAL 320 Ca 0.09 -1.93 0.01 0.00 0.00 0.00 0.00 61.98 60.15 1tui s VAL 320 Cb -0.13 -1.70 0.02 0.00 0.00 0.00 0.00 36.38 34.56 1tui s VAL 320 CO 0.05 -0.85 -0.06 -0.47 0.00 0.00 0.00 175.10 173.76 1tui s TYR 321 N -3.65 0.89 -0.22 5.22 5.04 -0.37 -0.37 117.35 123.88 1tui s TYR 321 Ca 0.12 -0.27 -0.06 0.00 -2.44 0.00 0.00 57.07 54.42 1tui s TYR 321 Cb 0.06 -0.74 -0.03 0.00 0.35 0.00 0.00 41.96 41.60 1tui s TYR 321 CO -0.05 -0.20 0.04 0.42 -1.34 0.00 0.00 175.55 174.42 1tui s ILE 322 N 0.85 4.24 0.82 3.14 -1.09 0.55 -1.22 121.20 128.50 1tui s ILE 322 Ca -0.12 -0.21 -0.13 0.00 -2.23 0.00 0.00 60.65 57.96 1tui s ILE 322 Cb -0.15 -2.95 0.07 0.00 -1.58 0.00 0.00 42.46 37.85 1tui s ILE 322 CO 0.01 0.39 1.05 0.18 -1.23 0.00 0.00 174.94 175.34 1tui n LEU 323 N 4.47 3.51 -4.92 2.97 7.99 -0.28 0.76 117.00 131.51 1tui n LEU 323 Ca -0.17 0.55 -0.27 0.00 -0.01 0.00 0.00 56.01 56.12 1tui n LEU 323 Cb 0.52 -1.45 0.06 0.00 -0.11 0.00 0.00 43.42 42.44 1tui n LEU 323 CO 0.32 -2.07 0.63 -0.54 -1.51 0.00 0.00 177.39 174.22 1tui s LYS 324 N -3.95 2.43 0.02 3.23 1.02 -1.26 -2.36 119.74 118.88 1tui s LYS 324 Ca 0.71 -0.06 -0.25 0.00 0.02 0.00 0.00 55.97 56.39 1tui s LYS 324 Cb -0.29 -2.15 -0.18 0.00 -0.52 0.00 0.00 37.83 34.69 1tui s LYS 324 CO 0.54 -1.12 1.43 -0.22 -0.92 0.00 0.00 175.35 175.06 1tui h LYS 325 N -0.56 0.03 -0.65 1.68 3.64 -1.80 0.12 116.57 119.04 1tui h LYS 325 Ca -0.45 -0.01 0.19 0.00 -1.27 0.00 0.00 60.65 59.11 1tui h LYS 325 Cb 1.29 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.09 1tui h LYS 325 CO 0.62 0.34 0.61 1.49 -2.27 0.00 0.00 179.45 180.24 1tui h GLU 326 N -0.29 0.00 -0.52 1.90 4.81 -1.91 0.97 114.58 119.54 1tui h GLU 326 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1tui h GLU 326 Cb 0.33 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.71 1tui h GLU 326 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 179.01 178.67 1tui n GLU 327 N -3.82 2.20 -0.57 1.92 1.02 -0.75 -4.90 120.64 115.75 1tui n GLU 327 Ca 0.13 -1.85 0.00 0.00 -0.02 0.00 0.00 57.16 55.42 1tui n GLU 327 Cb 0.85 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.86 1tui n GLU 327 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1tui n GLY 328 N 1.31 0.68 0.00 0.62 0.00 0.34 -4.79 105.19 103.35 1tui n GLY 328 Ca 0.17 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1tui n GLY 328 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tui n GLY 329 N -2.47 2.45 3.31 -0.02 0.00 0.36 -4.82 105.19 104.00 1tui n GLY 329 Ca 0.00 -2.03 -0.30 0.00 0.00 0.00 0.00 46.02 43.69 1tui n GLY 329 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tui n ARG 330 N 0.00 -2.10 0.00 1.61 1.74 -1.26 -4.56 116.66 112.09 1tui n ARG 330 Ca 0.00 -0.60 0.00 0.00 -0.77 0.00 0.00 57.85 56.48 1tui n ARG 330 Cb 0.00 -1.82 0.00 0.00 -1.02 0.00 0.00 32.46 29.62 1tui n ARG 330 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 1tui n HIS 331 N -4.69 0.00 -4.18 -1.55 1.44 -1.26 -3.46 115.22 101.52 1tui n HIS 331 Ca 0.02 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.61 1tui n HIS 331 Cb 0.59 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.60 1tui n HIS 331 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 1tui s THR 332 N -0.19 0.23 0.00 0.61 -4.23 -1.26 -4.99 115.64 105.81 1tui s THR 332 Ca 0.00 -1.94 0.00 0.00 -1.18 0.00 0.00 61.69 58.57 1tui s THR 332 Cb 0.00 -2.15 0.00 0.00 1.34 0.00 0.00 72.50 71.69 1tui s THR 332 CO 0.00 -0.39 0.00 0.61 -0.54 0.00 0.00 174.62 174.30 1tui n GLY 333 N -0.17 1.06 3.51 3.99 0.00 -1.26 -4.64 105.19 107.70 1tui n GLY 333 Ca -0.04 -2.00 -0.09 0.00 0.00 0.00 0.00 46.02 43.88 1tui n GLY 333 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1tui s PHE 334 N 0.47 0.45 0.53 1.61 -0.12 -0.31 -4.91 117.98 115.69 1tui s PHE 334 Ca 0.00 -0.79 0.00 0.00 -0.05 0.00 0.00 56.93 56.10 1tui s PHE 334 Cb 0.00 0.08 0.00 0.00 -0.63 0.00 0.00 43.02 42.48 1tui s PHE 334 CO 0.00 -0.92 0.04 1.19 -0.05 0.00 0.00 175.22 175.48 1tui n PHE 335 N -0.35 1.07 -2.02 3.49 3.01 -1.26 0.44 117.46 121.84 1tui n PHE 335 Ca -0.02 -2.57 -0.41 0.00 1.01 0.00 0.00 57.45 55.46 1tui n PHE 335 Cb 0.63 -0.36 -0.01 0.00 -0.01 0.00 0.00 39.48 39.72 1tui n PHE 335 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 1tui s THR 336 N -2.89 2.52 0.00 4.37 2.01 -1.26 -1.09 115.64 119.30 1tui s THR 336 Ca 0.03 0.51 0.00 0.00 0.31 0.00 0.00 61.69 62.54 1tui s THR 336 Cb -0.00 -3.32 0.00 0.00 0.01 0.00 0.00 72.50 69.18 1tui s THR 336 CO 0.02 0.12 0.00 0.61 -0.69 0.00 0.00 174.62 174.67 1tui n GLY 337 N 0.69 2.49 3.63 4.40 0.00 0.11 -4.97 105.19 111.54 1tui n GLY 337 Ca 0.01 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.57 1tui n GLY 337 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1tui n TYR 338 N -1.13 1.78 -3.17 1.61 9.36 -0.25 -4.61 117.16 120.76 1tui n TYR 338 Ca 0.00 0.55 -0.20 0.00 3.32 0.00 0.00 57.90 61.57 1tui n TYR 338 Cb 0.00 -2.37 -0.04 0.00 -0.63 0.00 0.00 39.34 36.30 1tui n TYR 338 CO 0.00 0.00 0.00 -2.13 0.22 0.00 0.00 176.86 174.95 1tui n ARG 339 N 1.68 0.86 0.00 2.98 0.63 -1.26 0.39 116.66 121.95 1tui n ARG 339 Ca 0.12 -3.24 0.00 0.00 -0.92 0.00 0.00 57.85 53.81 1tui n ARG 339 Cb 0.30 -1.48 0.00 0.00 0.45 0.00 0.00 32.46 31.72 1tui n ARG 339 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1tui n PRO 340 N 0.77 1.53 -4.81 -0.14 -0.04 -1.19 -4.62 135.00 126.49 1tui n PRO 340 Ca 0.22 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.35 1tui n PRO 340 Cb 0.61 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.94 1tui n PRO 340 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1tui s GLN 341 N 0.00 2.70 -0.25 0.54 -1.52 -0.96 -2.32 119.66 117.85 1tui s GLN 341 Ca 0.00 -0.66 -0.07 0.00 -1.95 0.00 0.00 55.36 52.68 1tui s GLN 341 Cb 0.00 -2.47 -0.03 0.00 -0.22 0.00 0.00 33.01 30.29 1tui s GLN 341 CO 0.00 0.57 0.07 -0.06 -0.25 0.00 0.00 175.29 175.62 1tui s PHE 342 N -0.58 3.09 -0.54 0.91 0.40 0.75 -1.60 117.98 120.41 1tui s PHE 342 Ca 0.08 -0.40 -0.17 0.00 -0.60 0.00 0.00 56.93 55.85 1tui s PHE 342 Cb -0.11 -2.24 0.11 0.00 0.51 0.00 0.00 43.02 41.29 1tui s PHE 342 CO 0.01 -0.34 0.54 -0.47 0.70 0.00 0.00 175.22 175.66 1tui s TYR 343 N 1.60 3.18 -0.36 0.36 5.04 -0.25 0.13 117.35 127.06 1tui s TYR 343 Ca 0.06 -1.13 -0.12 0.00 -2.44 0.00 0.00 57.07 53.44 1tui s TYR 343 Cb -0.15 -3.75 0.01 0.00 0.35 0.00 0.00 41.96 38.41 1tui s TYR 343 CO 0.04 -1.06 0.22 -0.06 -1.34 0.00 0.00 175.55 173.36 1tui s PHE 344 N 1.91 3.22 0.00 4.97 0.08 -0.53 -2.61 117.98 125.02 1tui s PHE 344 Ca 0.06 -0.60 0.00 0.00 0.12 0.00 0.00 56.93 56.51 1tui s PHE 344 Cb -0.27 -2.46 0.00 0.00 -0.57 0.00 0.00 43.02 39.71 1tui s PHE 344 CO 0.05 -0.52 0.00 0.54 -0.10 0.00 0.00 175.22 175.19 1tui n ARG 345 N 5.06 0.00 0.00 0.44 1.74 -1.26 -2.31 116.66 120.32 1tui n ARG 345 Ca -0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.96 1tui n ARG 345 Cb 0.48 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.92 1tui n ARG 345 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1tui n THR 346 N 0.00 0.00 -3.81 0.55 -2.24 -1.26 -5.07 114.28 102.45 1tui n THR 346 Ca 0.00 -0.45 -0.10 0.00 -2.27 0.00 0.00 64.05 61.23 1tui n THR 346 Cb 0.00 0.96 -0.05 0.00 -2.10 0.00 0.00 70.33 69.14 1tui n THR 346 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1tui s THR 347 N -1.08 0.04 0.42 4.28 -4.23 -0.98 -4.85 115.64 109.24 1tui s THR 347 Ca 0.00 -0.98 -0.24 0.00 -1.18 0.00 0.00 61.69 59.29 1tui s THR 347 Cb 0.00 -1.64 -0.09 0.00 1.34 0.00 0.00 72.50 72.11 1tui s THR 347 CO 0.00 -0.20 1.08 -1.81 -0.54 0.00 0.00 174.62 173.16 1tui s ASP 348 N -2.90 6.58 -0.16 3.99 1.01 -1.26 -1.45 116.67 122.48 1tui s ASP 348 Ca 0.11 2.11 -0.06 0.00 0.71 0.00 0.00 52.55 55.43 1tui s ASP 348 Cb 0.01 -2.59 0.07 0.00 1.01 0.00 0.00 42.92 41.42 1tui s ASP 348 CO -0.02 -0.62 0.35 -0.69 0.21 0.00 0.00 175.17 174.39 1tui s VAL 349 N -1.63 -0.46 0.67 -1.27 1.01 0.35 -4.85 120.40 114.23 1tui s VAL 349 Ca 0.60 0.20 -0.17 0.00 0.00 0.00 0.00 61.98 62.61 1tui s VAL 349 Cb -0.24 -0.56 0.00 0.00 0.00 0.00 0.00 36.38 35.59 1tui s VAL 349 CO 0.29 0.08 1.24 -0.89 0.00 0.00 0.00 175.10 175.83 1tui s THR 350 N 2.32 2.28 0.00 3.92 2.01 -1.26 0.27 115.64 125.18 1tui s THR 350 Ca -0.02 0.16 -0.28 0.00 0.31 0.00 0.00 61.69 61.86 1tui s THR 350 Cb -0.11 -2.93 0.07 0.00 0.01 0.00 0.00 72.50 69.53 1tui s THR 350 CO -0.11 -0.05 0.64 -0.83 -0.69 0.00 0.00 174.62 173.57 1tui s GLY 351 N -1.69 -0.56 -0.11 4.40 0.00 -0.98 -1.66 107.32 106.72 1tui s GLY 351 Ca 0.78 1.05 -0.04 0.00 0.00 0.00 0.00 44.72 46.51 1tui s GLY 351 CO 0.40 0.70 0.04 0.14 0.00 0.00 0.00 173.10 174.38 1tui s VAL 352 N -1.84 4.62 0.08 1.40 1.01 -0.56 -3.18 120.40 121.93 1tui s VAL 352 Ca -0.08 -0.12 -0.06 0.00 0.00 0.00 0.00 61.98 61.72 1tui s VAL 352 Cb -0.00 -2.99 -0.05 0.00 0.00 0.00 0.00 36.38 33.34 1tui s VAL 352 CO 0.04 0.58 0.33 -0.69 0.00 0.00 0.00 175.10 175.36 1tui s VAL 353 N -0.65 5.22 -0.16 2.92 1.01 0.16 -1.16 120.40 127.74 1tui s VAL 353 Ca 0.11 0.10 -0.02 0.00 0.00 0.00 0.00 61.98 62.18 1tui s VAL 353 Cb -0.12 -3.61 0.05 0.00 0.00 0.00 0.00 36.38 32.70 1tui s VAL 353 CO 0.02 0.19 0.00 -0.60 0.00 0.00 0.00 175.10 174.72 1tui s ARG 354 N -2.24 0.87 0.39 2.72 3.52 0.22 0.08 118.95 124.50 1tui s ARG 354 Ca 0.35 -0.34 -0.26 0.00 -0.13 0.00 0.00 55.73 55.34 1tui s ARG 354 Cb -0.13 -1.84 -0.09 0.00 -1.56 0.00 0.00 34.95 31.33 1tui s ARG 354 CO 0.21 -0.51 1.27 -0.51 -0.81 0.00 0.00 175.30 174.96 1tui s LEU 355 N 1.81 4.26 0.66 -0.88 1.43 -1.26 -2.44 118.68 122.26 1tui s LEU 355 Ca 0.01 2.60 -0.11 0.00 -1.03 0.00 0.00 54.13 55.59 1tui s LEU 355 Cb -0.16 -3.87 -0.01 0.00 0.03 0.00 0.00 46.19 42.18 1tui s LEU 355 CO -0.07 -0.74 1.05 -2.16 0.23 0.00 0.00 176.35 174.66 1tui s PRO 356 N -2.15 3.17 0.18 1.29 0.04 -1.26 -4.89 135.00 131.38 1tui s PRO 356 Ca 0.55 0.93 -0.33 0.00 0.04 0.00 0.00 61.00 62.19 1tui s PRO 356 Cb -0.37 -2.02 -0.13 0.00 0.04 0.00 0.00 34.50 32.02 1tui s PRO 356 CO 0.48 -0.92 1.62 1.04 0.04 0.00 0.00 177.00 179.26 1tui n GLN 357 N -2.89 2.36 0.00 4.56 3.00 -1.26 0.12 117.38 123.28 1tui n GLN 357 Ca 0.07 0.85 0.00 0.00 -0.01 0.00 0.00 57.00 57.91 1tui n GLN 357 Cb 0.54 -2.64 0.00 0.00 0.00 0.00 0.00 30.24 28.13 1tui n GLN 357 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1tui n GLY 358 N 3.57 2.84 3.66 1.08 0.00 -1.26 -5.02 105.19 110.05 1tui n GLY 358 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1tui n GLY 358 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tui s VAL 359 N -2.60 4.75 0.00 1.61 1.01 0.33 -4.96 120.40 120.54 1tui s VAL 359 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 61.98 61.92 1tui s VAL 359 Cb 0.00 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 33.27 1tui s VAL 359 CO 0.00 0.50 0.00 -0.62 0.00 0.00 0.00 175.10 174.98 1tui n GLU 360 N 3.21 3.50 -3.73 2.72 1.02 -1.26 -4.56 120.64 121.54 1tui n GLU 360 Ca -0.17 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 56.85 1tui n GLU 360 Cb 0.53 -0.96 -0.11 0.00 -0.02 0.00 0.00 31.44 30.88 1tui n GLU 360 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 1tui s MET 361 N -1.91 0.37 -0.06 3.49 0.00 -1.26 -4.46 119.30 115.47 1tui s MET 361 Ca 0.00 0.59 -0.02 0.00 0.00 0.00 0.00 55.69 56.26 1tui s MET 361 Cb 0.00 0.08 -0.04 0.00 0.00 0.00 0.00 34.83 34.87 1tui s MET 361 CO 0.00 -0.10 0.04 0.08 0.00 0.00 0.00 175.02 175.04 1tui s VAL 362 N 0.73 4.56 0.27 10.11 1.01 0.17 -4.87 120.40 132.38 1tui s VAL 362 Ca -0.04 -0.28 0.10 0.00 0.00 0.00 0.00 61.98 61.76 1tui s VAL 362 Cb -0.06 -2.99 -0.05 0.00 0.00 0.00 0.00 36.38 33.29 1tui s VAL 362 CO -0.05 0.51 -0.07 -0.04 0.00 0.00 0.00 175.10 175.45 1tui s MET 363 N -1.23 2.10 0.10 2.72 -1.94 -1.26 -1.16 119.30 118.62 1tui s MET 363 Ca 0.17 -1.52 -0.33 0.00 -1.71 0.00 0.00 55.69 52.31 1tui s MET 363 Cb -0.12 -2.04 -0.12 0.00 2.01 0.00 0.00 34.83 34.56 1tui s MET 363 CO 0.07 0.36 1.75 -2.30 -0.01 0.00 0.00 175.02 174.88 1tui n PRO 364 N -0.77 2.44 0.00 2.03 -0.02 -1.26 -0.88 135.00 136.54 1tui n PRO 364 Ca -0.06 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 1tui n PRO 364 Cb 0.59 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 1tui n PRO 364 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1tui n GLY 365 N 3.96 1.67 3.76 -1.23 0.00 0.23 -4.76 105.19 108.83 1tui n GLY 365 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1tui n GLY 365 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tui s ASP 366 N -1.67 2.84 -0.15 1.61 1.11 -0.06 -4.69 116.67 115.66 1tui s ASP 366 Ca 0.00 0.81 -0.08 0.00 0.18 0.00 0.00 52.55 53.46 1tui s ASP 366 Cb 0.00 -1.24 0.06 0.00 1.07 0.00 0.00 42.92 42.81 1tui s ASP 366 CO 0.00 -2.95 0.36 0.54 1.18 0.00 0.00 175.17 174.30 1tui s ASN 367 N -4.08 -0.34 0.06 0.27 4.22 -1.26 -0.33 114.94 113.48 1tui s ASN 367 Ca 0.67 0.79 -0.01 0.00 -2.14 0.00 0.00 52.86 52.17 1tui s ASN 367 Cb -0.12 0.76 0.00 0.00 1.28 0.00 0.00 41.25 43.17 1tui s ASN 367 CO 0.54 -0.20 0.10 1.33 -2.04 0.00 0.00 177.10 176.83 1tui n VAL 368 N 4.52 0.00 -3.72 3.54 0.24 0.50 -4.95 118.33 118.46 1tui n VAL 368 Ca -0.20 -0.23 -0.17 0.00 -2.04 0.00 0.00 64.34 61.70 1tui n VAL 368 Cb 0.53 0.16 -0.17 0.00 -1.47 0.00 0.00 33.84 32.90 1tui n VAL 368 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1tui s THR 369 N -2.65 -0.08 0.25 3.34 2.01 -1.26 0.00 115.64 117.25 1tui s THR 369 Ca 0.04 0.32 -0.01 0.00 0.31 0.00 0.00 61.69 62.35 1tui s THR 369 Cb -0.00 -0.11 0.00 0.00 0.01 0.00 0.00 72.50 72.40 1tui s THR 369 CO 0.03 0.13 0.34 2.22 -0.69 0.00 0.00 174.62 176.65 1tui n PHE 370 N 4.72 -1.13 -4.00 4.92 1.16 -0.83 -4.49 117.46 117.81 1tui n PHE 370 Ca -0.16 -1.68 -0.22 0.00 -1.87 0.00 0.00 57.45 53.51 1tui n PHE 370 Cb 0.50 0.38 -0.05 0.00 -1.61 0.00 0.00 39.48 38.70 1tui n PHE 370 CO 0.00 0.00 0.00 0.95 -1.87 0.00 0.00 176.76 175.84 1tui s THR 371 N -2.71 3.36 0.05 1.97 -4.23 -1.02 -1.17 115.64 111.88 1tui s THR 371 Ca 0.21 -1.56 -0.04 0.00 -1.18 0.00 0.00 61.69 59.13 1tui s THR 371 Cb -0.01 -3.08 -0.02 0.00 1.34 0.00 0.00 72.50 70.73 1tui s THR 371 CO 0.15 -0.20 0.04 -0.69 -0.54 0.00 0.00 174.62 173.38 1tui s VAL 372 N -2.35 0.17 -0.07 2.29 1.01 -0.56 -0.61 120.40 120.28 1tui s VAL 372 Ca 0.38 -1.38 -0.03 0.00 0.00 0.00 0.00 61.98 60.96 1tui s VAL 372 Cb -0.04 -1.15 0.04 0.00 0.00 0.00 0.00 36.38 35.23 1tui s VAL 372 CO 0.24 -0.76 0.10 -0.70 0.00 0.00 0.00 175.10 173.98 1tui s GLU 373 N -3.20 -0.02 0.40 2.72 2.12 -0.31 -2.47 118.70 117.93 1tui s GLU 373 Ca 0.00 0.38 -0.06 0.00 0.36 0.00 0.00 54.97 55.65 1tui s GLU 373 Cb 0.03 -0.60 -0.05 0.00 0.26 0.00 0.00 34.13 33.77 1tui s GLU 373 CO -0.07 -0.37 0.70 -0.51 -0.54 0.00 0.00 175.26 174.47 1tui s LEU 374 N 2.21 3.84 0.12 2.70 1.43 0.11 -1.50 118.68 127.59 1tui s LEU 374 Ca 0.04 0.90 -0.13 0.00 -1.03 0.00 0.00 54.13 53.91 1tui s LEU 374 Cb -0.13 -3.79 -0.06 0.00 0.03 0.00 0.00 46.19 42.25 1tui s LEU 374 CO -0.05 -0.40 1.45 0.16 0.23 0.00 0.00 176.35 177.74 1tui h ILE 375 N 0.83 1.29 -2.22 -0.59 -0.00 -1.65 -3.44 117.51 111.72 1tui h ILE 375 Ca -0.47 -1.50 -0.56 0.00 -0.00 0.00 0.00 64.86 62.32 1tui h ILE 375 Cb 1.20 1.47 -0.14 0.00 -0.00 0.00 0.00 36.82 39.35 1tui h ILE 375 CO 0.63 0.49 -0.66 -1.59 -0.00 0.00 0.00 178.15 177.02 1tui s LYS 376 N -4.39 1.73 0.83 0.16 -2.85 -1.26 -5.11 119.74 108.84 1tui s LYS 376 Ca -0.12 -1.91 -0.12 0.00 -1.00 0.00 0.00 55.97 52.83 1tui s LYS 376 Cb 0.10 -1.44 0.09 0.00 -2.06 0.00 0.00 37.83 34.52 1tui s LYS 376 CO 0.86 0.05 1.11 -2.14 0.10 0.00 0.00 175.35 175.32 1tui s PRO 377 N -3.69 1.84 -0.02 1.78 0.02 -1.25 -4.71 135.00 128.97 1tui s PRO 377 Ca 0.32 0.57 -0.21 0.00 0.02 0.00 0.00 61.00 61.70 1tui s PRO 377 Cb 0.04 -1.90 0.04 0.00 0.02 0.00 0.00 34.50 32.71 1tui s PRO 377 CO 0.15 -1.78 0.46 0.08 -0.33 0.00 0.00 177.00 175.59 1tui s VAL 378 N -3.17 0.04 -0.61 3.83 1.01 0.85 -1.00 120.40 121.35 1tui s VAL 378 Ca 0.62 -0.29 -0.28 0.00 0.00 0.00 0.00 61.98 62.03 1tui s VAL 378 Cb -0.15 -0.80 0.01 0.00 0.00 0.00 0.00 36.38 35.45 1tui s VAL 378 CO 0.54 -0.16 1.42 0.00 0.00 0.00 0.00 175.10 176.90 1tui s ALA 379 N -1.44 2.74 0.05 5.51 0.00 -1.26 -0.70 121.76 126.67 1tui s ALA 379 Ca -0.11 -0.83 0.08 0.00 0.00 0.00 0.00 51.96 51.09 1tui s ALA 379 Cb -0.03 -4.15 -0.03 0.00 0.00 0.00 0.00 23.12 18.91 1tui s ALA 379 CO 0.05 -3.10 -0.21 -0.51 0.00 0.00 0.00 175.76 172.00 1tui s LEU 380 N 6.24 2.46 -0.01 0.00 1.43 -0.67 -4.98 118.68 123.15 1tui s LEU 380 Ca 0.49 -0.51 -0.10 0.00 -1.03 0.00 0.00 54.13 52.98 1tui s LEU 380 Cb -0.10 -1.43 0.01 0.00 0.03 0.00 0.00 46.19 44.70 1tui s LEU 380 CO 0.22 0.25 0.21 -1.61 0.23 0.00 0.00 176.35 175.65 1tui s GLU 381 N -1.48 0.55 0.20 1.70 2.02 -1.26 -4.37 118.70 116.06 1tui s GLU 381 Ca 0.14 -0.29 -0.32 0.00 0.02 0.00 0.00 54.97 54.52 1tui s GLU 381 Cb -0.10 0.24 -0.15 0.00 0.10 0.00 0.00 34.13 34.21 1tui s GLU 381 CO 0.05 -0.14 1.22 0.39 0.02 0.00 0.00 175.26 176.80 1tui n GLU 382 N 1.44 1.44 0.00 1.61 1.02 -1.26 -0.03 120.64 124.86 1tui n GLU 382 Ca -0.22 0.51 0.00 0.00 -0.02 0.00 0.00 57.16 57.43 1tui n GLU 382 Cb 0.56 -2.04 0.00 0.00 -0.02 0.00 0.00 31.44 29.93 1tui n GLU 382 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1tui n GLY 383 N 1.97 3.35 3.68 0.62 0.00 0.20 -4.96 105.19 110.05 1tui n GLY 383 Ca 0.13 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.66 1tui n GLY 383 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1tui n LEU 384 N 0.00 3.35 -4.91 0.99 7.94 0.95 -4.54 117.00 120.78 1tui n LEU 384 Ca 0.00 0.98 -0.27 0.00 -1.11 0.00 0.00 56.01 55.61 1tui n LEU 384 Cb 0.00 -1.35 0.01 0.00 0.53 0.00 0.00 43.42 42.61 1tui n LEU 384 CO 0.00 -0.09 0.43 -0.13 -1.11 0.00 0.00 177.39 176.50 1tui s ARG 385 N 4.08 3.38 0.26 1.96 0.52 -1.26 0.11 118.95 128.00 1tui s ARG 385 Ca 0.94 0.08 -0.21 0.00 -0.52 0.00 0.00 55.73 56.02 1tui s ARG 385 Cb -0.73 -2.38 0.05 0.00 0.52 0.00 0.00 34.95 32.41 1tui s ARG 385 CO 0.53 -0.29 0.86 -0.59 0.02 0.00 0.00 175.30 175.83 1tui s PHE 386 N -2.75 -0.04 0.18 -0.53 -0.12 -0.57 -4.72 117.98 109.43 1tui s PHE 386 Ca 0.48 -0.43 0.10 0.00 -0.05 0.00 0.00 56.93 57.02 1tui s PHE 386 Cb -0.10 0.73 -0.04 0.00 -0.63 0.00 0.00 43.02 42.97 1tui s PHE 386 CO 0.44 -1.18 -0.20 0.00 -0.05 0.00 0.00 175.22 174.23 1tui s ALA 387 N -3.00 2.20 -0.21 1.99 0.00 -1.07 -1.66 121.76 120.01 1tui s ALA 387 Ca 0.14 -1.57 -0.01 0.00 0.00 0.00 0.00 51.96 50.52 1tui s ALA 387 Cb -0.04 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.87 1tui s ALA 387 CO 0.07 0.28 -0.11 0.42 0.00 0.00 0.00 175.76 176.42 1tui s ILE 388 N -2.02 2.73 0.12 0.00 1.01 0.47 -1.08 121.20 122.41 1tui s ILE 388 Ca 0.18 -0.80 0.10 0.00 0.00 0.00 0.00 60.65 60.14 1tui s ILE 388 Cb -0.06 -2.25 -0.04 0.00 0.01 0.00 0.00 42.46 40.13 1tui s ILE 388 CO 0.08 0.42 -0.26 -0.13 0.00 0.00 0.00 174.94 175.05 1tui s ARG 389 N 1.37 1.41 -0.21 2.79 0.52 -0.63 0.13 118.95 124.32 1tui s ARG 389 Ca 0.04 -1.29 -0.02 0.00 -0.52 0.00 0.00 55.73 53.94 1tui s ARG 389 Cb -0.14 -1.84 0.06 0.00 0.52 0.00 0.00 34.95 33.55 1tui s ARG 389 CO -0.07 0.44 0.01 -1.21 0.02 0.00 0.00 175.30 174.49 1tui s GLU 390 N -1.93 0.96 -1.30 3.54 2.02 0.23 -2.27 118.70 119.95 1tui s GLU 390 Ca 0.13 -0.65 -0.02 0.00 0.02 0.00 0.00 54.97 54.45 1tui s GLU 390 Cb -0.10 -2.26 -0.00 0.00 0.10 0.00 0.00 34.13 31.87 1tui s GLU 390 CO 0.05 -0.65 0.68 0.41 0.02 0.00 0.00 175.26 175.77 1tui n GLY 391 N 4.92 -0.36 3.72 -1.39 0.00 -1.26 -1.34 105.19 109.47 1tui n GLY 391 Ca -0.09 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1tui n GLY 391 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tui n GLY 392 N -1.62 2.75 3.78 -0.02 0.00 -1.26 -4.97 105.19 103.85 1tui n GLY 392 Ca -0.28 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.37 1tui n GLY 392 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tui s ARG 393 N -0.03 4.53 -0.17 1.61 0.52 -0.45 -5.01 118.95 119.95 1tui s ARG 393 Ca 0.00 1.44 -0.24 0.00 -0.52 0.00 0.00 55.73 56.41 1tui s ARG 393 Cb 0.00 -2.84 -0.02 0.00 0.52 0.00 0.00 34.95 32.61 1tui s ARG 393 CO 0.00 0.21 0.77 0.99 0.02 0.00 0.00 175.30 177.29 1tui s THR 394 N -1.53 4.93 -0.65 0.02 2.01 -1.26 -0.60 115.64 118.56 1tui s THR 394 Ca 0.50 1.50 0.09 0.00 0.31 0.00 0.00 61.69 64.09 1tui s THR 394 Cb -0.22 -4.08 -0.05 0.00 0.01 0.00 0.00 72.50 68.17 1tui s THR 394 CO 0.27 0.07 0.50 1.33 -0.69 0.00 0.00 174.62 176.10 1tui n VAL 395 N 4.65 0.00 -3.74 3.82 0.24 0.35 -4.59 118.33 119.06 1tui n VAL 395 Ca 0.02 -0.35 -0.01 0.00 -2.04 0.00 0.00 64.34 61.97 1tui n VAL 395 Cb 0.49 1.06 -0.00 0.00 -1.47 0.00 0.00 33.84 33.91 1tui n VAL 395 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1tui s GLY 396 N -1.58 -0.25 -0.05 7.63 0.00 -0.92 -1.12 107.32 111.03 1tui s GLY 396 Ca 0.06 0.26 -0.03 0.00 0.00 0.00 0.00 44.72 45.00 1tui s GLY 396 CO 0.30 0.62 0.12 0.00 0.00 0.00 0.00 173.10 174.14 1tui s ALA 397 N -2.77 -0.25 0.26 3.20 0.00 -0.35 -0.40 121.76 121.44 1tui s ALA 397 Ca 0.15 0.43 0.05 0.00 0.00 0.00 0.00 51.96 52.59 1tui s ALA 397 Cb 0.01 -0.27 -0.02 0.00 0.00 0.00 0.00 23.12 22.84 1tui s ALA 397 CO 0.00 -0.09 0.17 0.41 0.00 0.00 0.00 175.76 176.25 1tui n GLY 398 N 3.46 3.31 2.93 0.00 0.00 -0.66 -1.23 105.19 113.00 1tui n GLY 398 Ca -0.18 -1.91 -0.17 0.00 0.00 0.00 0.00 46.02 43.76 1tui n GLY 398 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tui s VAL 399 N -2.87 0.41 0.02 1.61 1.01 -0.45 -1.51 120.40 118.61 1tui s VAL 399 Ca 0.24 -0.16 -0.30 0.00 0.00 0.00 0.00 61.98 61.75 1tui s VAL 399 Cb 0.01 -0.38 -0.05 0.00 0.00 0.00 0.00 36.38 35.96 1tui s VAL 399 CO 0.17 0.14 1.31 -0.69 0.00 0.00 0.00 175.10 176.03 1tui s VAL 400 N 0.22 3.84 -0.05 2.92 1.01 0.29 -2.44 120.40 126.20 1tui s VAL 400 Ca -0.02 1.26 0.10 0.00 0.00 0.00 0.00 61.98 63.32 1tui s VAL 400 Cb -0.06 -3.81 -0.15 0.00 0.00 0.00 0.00 36.38 32.36 1tui s VAL 400 CO -0.00 0.03 0.16 0.35 0.00 0.00 0.00 175.10 175.64 1tui n THR 401 N 4.39 0.27 -3.59 3.92 -2.24 0.69 0.58 114.28 118.30 1tui n THR 401 Ca 0.11 -0.32 -0.14 0.00 -2.27 0.00 0.00 64.05 61.43 1tui n THR 401 Cb 0.45 -0.13 -0.06 0.00 -2.10 0.00 0.00 70.33 68.48 1tui n THR 401 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1tui s LYS 402 N -2.56 0.84 -0.06 -0.78 2.20 -0.80 -4.91 119.74 113.67 1tui s LYS 402 Ca -0.04 0.61 -0.08 0.00 -0.36 0.00 0.00 55.97 56.10 1tui s LYS 402 Cb 0.05 0.41 -0.04 0.00 -1.51 0.00 0.00 37.83 36.73 1tui s LYS 402 CO 0.44 -0.18 0.22 0.42 -0.36 0.00 0.00 175.35 175.89 1tui s ILE 403 N -0.31 5.37 0.00 5.43 -1.09 -1.26 0.92 121.20 130.25 1tui s ILE 403 Ca -0.03 0.28 0.00 0.00 -2.23 0.00 0.00 60.65 58.66 1tui s ILE 403 Cb -0.03 -3.51 0.00 0.00 -1.58 0.00 0.00 42.46 37.34 1tui s ILE 403 CO 0.03 0.52 0.00 0.18 -1.23 0.00 0.00 174.94 174.44 1tui n LEU 404 N 1.65 0.00 0.00 2.97 4.77 -0.76 -4.93 117.00 120.70 1tui n LEU 404 Ca -0.16 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 1tui n LEU 404 Cb 0.54 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.63 1tui n LEU 404 CO 0.36 0.00 0.00 -0.62 -1.33 0.00 0.00 177.39 175.80