#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sft s ASP 3 N 0.00 0.07 0.04 6.41 -4.77 -1.26 -4.63 116.67 112.52 1sft s ASP 3 Ca 0.00 -1.05 -0.06 0.00 -3.30 0.00 0.00 52.55 48.14 1sft s ASP 3 Cb 0.00 0.60 -0.01 0.00 -1.09 0.00 0.00 42.92 42.42 1sft s ASP 3 CO 0.00 -1.17 0.12 0.72 0.70 0.00 0.00 175.17 175.54 1sft s PHE 4 N -3.81 0.17 -0.20 2.11 -0.71 -1.26 -4.86 117.98 109.41 1sft s PHE 4 Ca 0.24 -0.45 0.12 0.00 -1.04 0.00 0.00 56.93 55.80 1sft s PHE 4 Cb -0.00 -0.12 0.43 0.00 -1.21 0.00 0.00 43.02 42.12 1sft s PHE 4 CO 0.11 -0.38 1.21 0.72 -1.34 0.00 0.00 175.22 175.54 1sft n HIS 5 N 0.76 0.39 -3.90 3.49 8.25 -1.26 -4.98 115.22 117.96 1sft n HIS 5 Ca -0.19 -1.53 -0.11 0.00 -0.26 0.00 0.00 57.72 55.64 1sft n HIS 5 Cb 0.59 -0.25 -0.12 0.00 1.12 0.00 0.00 29.99 31.32 1sft n HIS 5 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 1sft s ARG 6 N -3.04 0.24 -1.32 -0.41 3.52 -1.26 -5.07 118.95 111.61 1sft s ARG 6 Ca 0.39 -0.28 -0.06 0.00 -0.13 0.00 0.00 55.73 55.66 1sft s ARG 6 Cb 0.38 0.09 0.10 0.00 -1.56 0.00 0.00 34.95 33.96 1sft s ARG 6 CO -0.06 -0.04 2.46 -0.25 -0.81 0.00 0.00 175.30 176.59 1sft n ASP 7 N 2.19 8.07 -3.79 -2.12 8.00 -1.26 -4.78 116.55 122.86 1sft n ASP 7 Ca -0.19 -3.09 -0.17 0.00 0.71 0.00 0.00 54.79 52.05 1sft n ASP 7 Cb 0.57 -1.37 -0.16 0.00 -0.02 0.00 0.00 41.12 40.13 1sft n ASP 7 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1sft s THR 8 N -0.89 0.12 -0.05 -3.53 2.01 -1.26 -2.32 115.64 109.72 1sft s THR 8 Ca 0.56 0.15 -0.24 0.00 0.31 0.00 0.00 61.69 62.46 1sft s THR 8 Cb 0.19 -0.24 0.05 0.00 0.01 0.00 0.00 72.50 72.51 1sft s THR 8 CO -0.10 0.14 0.54 -1.66 -0.69 0.00 0.00 174.62 172.86 1sft s TRP 9 N 1.20 -0.49 0.18 4.92 -2.14 -0.65 -4.38 118.94 117.58 1sft s TRP 9 Ca -0.07 0.86 -0.04 0.00 2.66 0.00 0.00 56.10 59.51 1sft s TRP 9 Cb -0.13 0.29 -0.05 0.00 -3.10 0.00 0.00 33.47 30.47 1sft s TRP 9 CO -0.02 -0.51 0.41 0.00 -2.66 0.00 0.00 176.95 174.16 1sft s ALA 10 N -1.11 3.77 -0.09 2.67 0.00 0.12 -0.79 121.76 126.33 1sft s ALA 10 Ca -0.11 -0.62 0.04 0.00 0.00 0.00 0.00 51.96 51.28 1sft s ALA 10 Cb -0.02 -2.13 -0.01 0.00 0.00 0.00 0.00 23.12 20.97 1sft s ALA 10 CO 0.07 0.56 -0.23 -1.21 0.00 0.00 0.00 175.76 174.95 1sft s GLU 11 N -2.93 2.90 -0.19 0.00 2.02 -0.61 -1.19 118.70 118.70 1sft s GLU 11 Ca 0.41 -0.86 -0.02 0.00 0.02 0.00 0.00 54.97 54.52 1sft s GLU 11 Cb -0.12 -2.29 -0.00 0.00 0.10 0.00 0.00 34.13 31.82 1sft s GLU 11 CO 0.26 0.26 -0.10 0.08 0.02 0.00 0.00 175.26 175.78 1sft s VAL 12 N 0.14 2.94 -0.65 2.63 1.01 0.45 -1.38 120.40 125.55 1sft s VAL 12 Ca -0.12 -0.65 -0.21 0.00 0.00 0.00 0.00 61.98 61.00 1sft s VAL 12 Cb -0.16 -2.30 0.09 0.00 0.00 0.00 0.00 36.38 34.01 1sft s VAL 12 CO 0.07 0.48 0.87 -0.62 0.00 0.00 0.00 175.10 175.89 1sft s ASP 13 N 1.19 6.22 0.54 3.32 -1.08 -0.05 -1.17 116.67 125.63 1sft s ASP 13 Ca 0.02 -1.27 0.32 0.00 -0.52 0.00 0.00 52.55 51.10 1sft s ASP 13 Cb -0.14 -2.37 1.24 0.00 -1.46 0.00 0.00 42.92 40.19 1sft s ASP 13 CO -0.04 -1.28 1.94 -0.07 0.52 0.00 0.00 175.17 176.24 1sft h LEU 14 N 10.70 0.00 -0.88 -1.34 3.38 -1.21 -2.13 115.31 123.83 1sft h LEU 14 Ca -0.25 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.64 1sft h LEU 14 Cb 1.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 1sft h LEU 14 CO 1.14 0.01 -0.02 0.44 0.09 0.00 0.00 178.44 180.10 1sft h ASP 15 N 0.00 0.77 -0.52 -0.43 3.32 -1.91 0.17 116.42 117.82 1sft h ASP 15 Ca -0.00 -0.20 -0.06 0.00 0.02 0.00 0.00 57.03 56.79 1sft h ASP 15 Cb 0.57 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.90 1sft h ASP 15 CO 0.00 0.85 0.09 0.00 -1.72 0.00 0.00 179.24 178.46 1sft h ALA 16 N 1.23 0.69 -0.73 3.45 0.00 -1.74 -1.39 119.26 120.78 1sft h ALA 16 Ca 0.14 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 1sft h ALA 16 Cb 0.48 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1sft h ALA 16 CO 0.02 0.43 0.21 0.82 0.00 0.00 0.00 179.25 180.73 1sft h ILE 17 N 0.75 1.26 0.17 0.00 2.04 -1.35 -1.84 117.51 118.55 1sft h ILE 17 Ca 0.16 -0.93 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 1sft h ILE 17 Cb 0.40 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 36.96 1sft h ILE 17 CO 0.01 0.36 -0.08 0.22 0.00 0.00 0.00 178.15 178.66 1sft h TYR 18 N 1.09 -0.22 -0.65 1.37 5.03 -0.35 -2.45 116.97 120.79 1sft h TYR 18 Ca 0.23 -0.01 0.06 0.00 2.58 0.00 0.00 58.73 61.59 1sft h TYR 18 Cb 0.33 0.07 -0.04 0.00 1.55 0.00 0.00 36.73 38.64 1sft h TYR 18 CO 0.03 -0.12 0.43 -0.44 -1.32 0.00 0.00 178.16 176.73 1sft h ASP 19 N -0.25 0.59 0.32 -2.11 3.32 -1.15 -0.78 116.42 116.36 1sft h ASP 19 Ca -0.02 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.90 1sft h ASP 19 Cb 0.19 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1sft h ASP 19 CO 0.04 0.39 -0.51 0.78 -1.72 0.00 0.00 179.24 178.22 1sft h ASN 20 N 0.67 0.23 0.07 6.45 2.35 -1.12 -2.22 115.58 122.01 1sft h ASN 20 Ca 0.28 -0.11 -0.16 0.00 -0.55 0.00 0.00 56.30 55.76 1sft h ASN 20 Cb 0.23 -0.07 0.02 0.00 0.05 0.00 0.00 38.32 38.55 1sft h ASN 20 CO -0.08 0.70 -0.65 0.58 -1.65 0.00 0.00 177.43 176.33 1sft h VAL 21 N 0.17 1.50 -0.03 2.81 2.07 -0.94 -3.26 116.25 118.56 1sft h VAL 21 Ca 0.01 -2.32 -0.07 0.00 0.82 0.00 0.00 66.70 65.14 1sft h VAL 21 Cb 0.96 2.96 -0.01 0.00 -1.52 0.00 0.00 31.29 33.68 1sft h VAL 21 CO 0.08 0.66 -0.31 -0.08 0.02 0.00 0.00 177.57 177.94 1sft h GLU 22 N -0.32 0.06 -0.28 1.57 4.81 -1.17 -1.37 114.58 117.89 1sft h GLU 22 Ca -0.10 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 58.99 1sft h GLU 22 Cb 1.44 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.81 1sft h GLU 22 CO 0.12 0.37 -0.33 -0.91 -0.73 0.00 0.00 179.01 177.53 1sft h ASN 23 N 0.06 0.62 -0.31 1.04 -0.26 -1.52 -1.60 115.58 113.60 1sft h ASN 23 Ca 0.01 -0.25 -0.15 0.00 -0.56 0.00 0.00 56.30 55.35 1sft h ASN 23 Cb 0.57 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 37.66 1sft h ASN 23 CO 0.04 0.90 -0.38 0.25 -1.06 0.00 0.00 177.43 177.18 1sft h LEU 24 N 0.50 0.92 -2.08 1.61 5.85 -1.52 -1.81 115.31 118.78 1sft h LEU 24 Ca 0.06 -0.42 0.09 0.00 0.84 0.00 0.00 57.88 58.45 1sft h LEU 24 Cb 0.81 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 1sft h LEU 24 CO 0.07 1.19 0.27 -0.09 -0.34 0.00 0.00 178.44 179.53 1sft h ARG 25 N 0.71 0.00 0.11 1.25 9.65 -1.12 0.20 114.38 125.18 1sft h ARG 25 Ca 0.06 0.00 -0.16 0.00 -1.10 0.00 0.00 59.98 58.78 1sft h ARG 25 Cb 0.96 0.00 0.02 0.00 -1.39 0.00 0.00 29.97 29.56 1sft h ARG 25 CO 0.09 0.00 -0.68 0.00 2.80 0.00 0.00 179.97 182.18 1sft h ARG 26 N 0.00 0.26 0.00 0.20 3.08 -0.99 -3.37 114.38 113.55 1sft h ARG 26 Ca 0.15 -0.43 0.00 0.00 0.07 0.00 0.00 59.98 59.77 1sft h ARG 26 Cb 0.68 0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.89 1sft h ARG 26 CO -0.00 1.20 0.00 1.25 -1.07 0.00 0.00 179.97 181.35 1sft h LEU 27 N -0.46 0.00 -9.90 3.04 7.12 -0.29 -3.45 115.31 111.38 1sft h LEU 27 Ca -0.12 0.00 -0.59 0.00 0.13 0.00 0.00 57.88 57.30 1sft h LEU 27 Cb 1.53 0.00 -0.04 0.00 -0.53 0.00 0.00 40.66 41.62 1sft h LEU 27 CO 0.13 0.00 -0.32 -0.76 -0.13 0.00 0.00 178.44 177.36 1sft s LEU 28 N -5.67 4.30 0.24 2.25 1.43 0.55 -5.00 118.68 116.77 1sft s LEU 28 Ca 0.04 0.60 -0.29 0.00 -1.03 0.00 0.00 54.13 53.45 1sft s LEU 28 Cb 0.09 -3.15 -0.15 0.00 0.03 0.00 0.00 46.19 43.00 1sft s LEU 28 CO 0.54 0.11 0.91 -0.81 0.23 0.00 0.00 176.35 177.32 1sft n PRO 29 N 0.37 0.93 0.21 1.29 -0.04 -1.26 -4.91 135.00 131.59 1sft n PRO 29 Ca -0.05 0.33 0.18 0.00 -0.04 0.00 0.00 63.50 63.92 1sft n PRO 29 Cb 0.52 -1.62 0.80 0.00 -0.04 0.00 0.00 33.50 33.15 1sft n PRO 29 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1sft h ASP 30 N 1.98 0.00 0.59 3.54 5.19 -1.96 -0.20 116.42 125.56 1sft h ASP 30 Ca -0.37 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 55.88 1sft h ASP 30 Cb 1.37 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.86 1sft h ASP 30 CO 0.61 0.00 -0.70 -2.24 -3.12 0.00 0.00 179.24 173.80 1sft h ASP 31 N 0.00 0.10 -3.41 6.45 2.03 -1.96 -3.46 116.42 116.17 1sft h ASP 31 Ca 0.10 -0.07 -0.59 0.00 -0.73 0.00 0.00 57.03 55.74 1sft h ASP 31 Cb 0.81 -0.03 -0.09 0.00 -0.83 0.00 0.00 39.33 39.18 1sft h ASP 31 CO -0.00 0.76 0.09 -0.89 -1.03 0.00 0.00 179.24 178.17 1sft s THR 32 N -3.49 5.04 0.44 1.15 2.01 -0.09 -4.90 115.64 115.80 1sft s THR 32 Ca -0.02 1.17 -0.11 0.00 0.31 0.00 0.00 61.69 63.04 1sft s THR 32 Cb 0.12 -3.93 -0.06 0.00 0.01 0.00 0.00 72.50 68.63 1sft s THR 32 CO 0.79 0.14 0.81 -1.00 -0.69 0.00 0.00 174.62 174.67 1sft s HIS 33 N 1.74 3.49 -0.17 4.92 3.76 -0.71 -4.86 115.29 123.45 1sft s HIS 33 Ca 0.29 1.09 -0.03 0.00 -0.15 0.00 0.00 55.06 56.26 1sft s HIS 33 Cb -0.16 -2.49 -0.02 0.00 1.11 0.00 0.00 32.58 31.03 1sft s HIS 33 CO 0.11 -0.19 -0.07 0.42 -0.85 0.00 0.00 174.74 174.16 1sft s ILE 34 N -2.49 3.43 -0.41 0.60 1.01 -1.26 -2.13 121.20 119.95 1sft s ILE 34 Ca 0.52 -0.51 -0.12 0.00 0.00 0.00 0.00 60.65 60.55 1sft s ILE 34 Cb -0.10 -2.50 0.05 0.00 0.01 0.00 0.00 42.46 39.91 1sft s ILE 34 CO 0.34 0.48 0.27 -0.32 0.00 0.00 0.00 174.94 175.70 1sft s MET 35 N 0.75 2.81 0.09 2.79 -2.45 -0.07 -1.46 119.30 121.76 1sft s MET 35 Ca -0.03 -1.23 -0.30 0.00 -1.25 0.00 0.00 55.69 52.88 1sft s MET 35 Cb -0.15 -3.85 -0.06 0.00 1.25 0.00 0.00 34.83 32.03 1sft s MET 35 CO 0.02 -0.84 1.08 0.00 1.05 0.00 0.00 175.02 176.33 1sft s ALA 36 N 1.55 3.31 -0.29 4.11 0.00 -0.37 -0.22 121.76 129.84 1sft s ALA 36 Ca 0.03 0.72 -0.12 0.00 0.00 0.00 0.00 51.96 52.59 1sft s ALA 36 Cb -0.21 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.50 1sft s ALA 36 CO 0.06 -0.25 0.22 0.08 0.00 0.00 0.00 175.76 175.87 1sft s VAL 37 N 0.45 5.29 -0.14 0.00 1.01 -0.43 -1.44 120.40 125.15 1sft s VAL 37 Ca 0.52 0.12 0.15 0.00 0.00 0.00 0.00 61.98 62.77 1sft s VAL 37 Cb -0.26 -3.59 0.33 0.00 0.00 0.00 0.00 36.38 32.86 1sft s VAL 37 CO 0.31 0.18 1.17 0.55 0.00 0.00 0.00 175.10 177.30 1sft n VAL 38 N 5.08 1.62 -1.19 2.92 3.14 0.07 -4.73 118.33 125.24 1sft n VAL 38 Ca -0.13 -2.31 -0.32 0.00 -2.96 0.00 0.00 64.34 58.62 1sft n VAL 38 Cb 0.51 -0.03 0.11 0.00 -1.06 0.00 0.00 33.84 33.37 1sft n VAL 38 CO 0.00 0.00 0.00 -1.59 -6.46 0.00 0.00 176.83 168.78 1sft s LYS 39 N -2.42 1.98 -1.19 1.45 -2.85 -1.19 -1.82 119.74 113.70 1sft s LYS 39 Ca 0.32 1.35 -0.04 0.00 -1.00 0.00 0.00 55.97 56.60 1sft s LYS 39 Cb 0.30 -1.85 -0.02 0.00 -2.06 0.00 0.00 37.83 34.20 1sft s LYS 39 CO -0.04 -1.88 0.85 0.00 0.10 0.00 0.00 175.35 174.38 1sft n ALA 40 N -3.50 -2.20 -3.91 0.59 0.00 -1.26 -1.56 120.51 108.67 1sft n ALA 40 Ca 0.10 -0.07 -0.28 0.00 0.00 0.00 0.00 53.44 53.20 1sft n ALA 40 Cb 0.52 -3.31 0.01 0.00 0.00 0.00 0.00 19.45 16.67 1sft n ALA 40 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1sft n ASN 41 N -3.07 -2.73 -3.84 0.00 5.15 -1.26 -1.24 115.26 108.27 1sft n ASN 41 Ca -0.21 -0.87 -0.29 0.00 -0.60 0.00 0.00 54.58 52.61 1sft n ASN 41 Cb 0.65 -3.60 0.01 0.00 -0.53 0.00 0.00 39.78 36.31 1sft n ASN 41 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1sft n ALA 42 N -4.48 -2.26 -3.43 5.20 0.00 -0.75 -0.86 120.51 113.93 1sft n ALA 42 Ca -0.11 -0.27 -0.22 0.00 0.00 0.00 0.00 53.44 52.84 1sft n ALA 42 Cb 0.59 -2.59 0.07 0.00 0.00 0.00 0.00 19.45 17.52 1sft n ALA 42 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1sft n TYR 43 N -4.35 -2.54 -0.99 0.00 4.02 -0.49 -1.87 117.16 110.95 1sft n TYR 43 Ca -0.22 0.87 0.00 0.00 -0.01 0.00 0.00 57.90 58.55 1sft n TYR 43 Cb 0.64 -4.65 0.00 0.00 -0.02 0.00 0.00 39.34 35.32 1sft n TYR 43 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1sft n GLY 44 N -1.83 0.50 0.01 2.72 0.00 -0.37 -3.81 105.19 102.41 1sft n GLY 44 Ca -0.01 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.11 1sft n GLY 44 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1sft n HIS 45 N -2.75 0.00 0.00 1.61 8.25 -0.78 -4.87 115.22 116.68 1sft n HIS 45 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1sft n HIS 45 Cb 0.05 -0.38 0.00 0.00 1.12 0.00 0.00 29.99 30.78 1sft n HIS 45 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1sft n GLY 46 N 1.42 2.42 0.13 -1.41 0.00 -0.04 -4.84 105.19 102.87 1sft n GLY 46 Ca -0.03 -0.85 -0.13 0.00 0.00 0.00 0.00 46.02 45.02 1sft n GLY 46 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1sft h ASP 47 N 0.00 -0.24 -0.30 1.61 2.03 -1.88 -1.93 116.42 115.70 1sft h ASP 47 Ca 0.00 0.02 -0.07 0.00 -0.73 0.00 0.00 57.03 56.25 1sft h ASP 47 Cb 0.00 0.08 -0.01 0.00 -0.83 0.00 0.00 39.33 38.57 1sft h ASP 47 CO 0.00 -0.14 -0.09 -0.37 -1.03 0.00 0.00 179.24 177.61 1sft h VAL 48 N -0.21 1.28 -0.59 4.15 -1.51 -1.96 -0.52 116.25 116.90 1sft h VAL 48 Ca 0.00 -1.14 -0.04 0.00 -1.23 0.00 0.00 66.70 64.29 1sft h VAL 48 Cb 0.20 1.40 -0.03 0.00 -2.13 0.00 0.00 31.29 30.73 1sft h VAL 48 CO -0.02 0.36 0.20 1.56 -1.23 0.00 0.00 177.57 178.45 1sft h GLN 49 N 0.36 0.87 0.19 5.19 7.50 -1.92 -0.70 115.11 126.61 1sft h GLN 49 Ca 0.07 -0.15 -0.25 0.00 0.50 0.00 0.00 58.65 58.82 1sft h GLN 49 Cb 0.58 -0.14 0.03 0.00 0.05 0.00 0.00 27.48 27.99 1sft h GLN 49 CO 0.03 0.74 -1.13 0.28 -1.50 0.00 0.00 178.83 177.26 1sft h VAL 50 N 0.85 1.39 -0.37 -0.54 2.07 -1.34 -2.94 116.25 115.37 1sft h VAL 50 Ca 0.20 -2.60 0.03 0.00 0.82 0.00 0.00 66.70 65.15 1sft h VAL 50 Cb 0.22 3.11 -0.03 0.00 -1.52 0.00 0.00 31.29 33.07 1sft h VAL 50 CO -0.01 0.76 0.17 0.00 0.02 0.00 0.00 177.57 178.50 1sft h ALA 51 N 0.10 0.45 -0.06 1.67 0.00 -0.81 -0.74 119.26 119.86 1sft h ALA 51 Ca -0.20 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.75 1sft h ALA 51 Cb 1.87 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.60 1sft h ALA 51 CO 0.20 -0.20 -0.08 -0.09 0.00 0.00 0.00 179.25 179.08 1sft h ARG 52 N 0.35 -0.10 -0.97 0.00 2.43 -1.26 -1.43 114.38 113.41 1sft h ARG 52 Ca 0.16 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.37 1sft h ARG 52 Cb 0.08 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.60 1sft h ARG 52 CO -0.12 -0.07 0.64 1.15 -1.51 0.00 0.00 179.97 180.05 1sft h THR 53 N -0.11 1.18 -0.10 0.20 2.02 -1.31 -1.93 112.91 112.86 1sft h THR 53 Ca 0.05 -0.42 -0.21 0.00 0.77 0.00 0.00 66.41 66.59 1sft h THR 53 Cb 0.18 -0.16 0.01 0.00 -1.74 0.00 0.00 68.15 66.43 1sft h THR 53 CO -0.12 0.23 -0.80 0.00 0.37 0.00 0.00 175.52 175.19 1sft h ALA 54 N 1.43 0.40 -0.28 6.16 0.00 -0.87 -2.05 119.26 124.05 1sft h ALA 54 Ca 0.38 -0.62 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 1sft h ALA 54 Cb -0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1sft h ALA 54 CO -0.11 0.72 -0.16 -0.07 0.00 0.00 0.00 179.25 179.64 1sft h LEU 55 N 0.41 0.47 -1.45 0.00 3.38 -0.94 -1.66 115.31 115.52 1sft h LEU 55 Ca -0.06 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 1sft h LEU 55 Cb 1.42 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 1sft h LEU 55 CO 0.15 0.65 -0.17 -0.33 0.09 0.00 0.00 178.44 178.84 1sft h GLU 56 N 0.44 0.14 0.00 1.13 5.08 -1.18 -3.06 114.58 117.14 1sft h GLU 56 Ca 0.08 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1sft h GLU 56 Cb 0.53 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1sft h GLU 56 CO 0.03 0.32 -0.20 0.00 -1.00 0.00 0.00 179.01 178.17 1sft n ALA 57 N -2.49 2.61 0.00 3.43 0.00 -0.70 -4.91 120.51 118.45 1sft n ALA 57 Ca -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1sft n ALA 57 Cb 0.28 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.37 1sft n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sft n GLY 58 N 1.40 0.39 3.76 0.00 0.00 -0.95 -4.04 105.19 105.76 1sft n GLY 58 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 1sft n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sft s ALA 59 N -0.30 3.34 -0.17 4.61 0.00 -0.76 -4.53 121.76 123.96 1sft s ALA 59 Ca 0.00 0.96 0.16 0.00 0.00 0.00 0.00 51.96 53.08 1sft s ALA 59 Cb 0.00 -3.36 -0.23 0.00 0.00 0.00 0.00 23.12 19.53 1sft s ALA 59 CO 0.00 -0.32 0.42 -1.13 0.00 0.00 0.00 175.76 174.72 1sft n SER 60 N 0.77 1.21 -4.17 0.00 3.41 -0.54 -4.38 113.62 109.92 1sft n SER 60 Ca 0.01 -0.18 -0.11 0.00 -0.26 0.00 0.00 58.87 58.34 1sft n SER 60 Cb 0.45 1.59 -0.10 0.00 -0.26 0.00 0.00 64.21 65.89 1sft n SER 60 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1sft s ARG 61 N -2.98 0.91 0.22 4.33 0.52 -1.08 -4.28 118.95 116.59 1sft s ARG 61 Ca -0.03 -1.41 0.08 0.00 -0.52 0.00 0.00 55.73 53.84 1sft s ARG 61 Cb 0.11 -0.02 -0.05 0.00 0.52 0.00 0.00 34.95 35.50 1sft s ARG 61 CO 0.66 -0.14 -0.14 -0.51 0.02 0.00 0.00 175.30 175.19 1sft s LEU 62 N -3.07 2.55 -0.05 2.53 1.43 0.01 -1.24 118.68 120.86 1sft s LEU 62 Ca 0.18 -1.04 -0.04 0.00 -1.03 0.00 0.00 54.13 52.20 1sft s LEU 62 Cb 0.07 -0.70 0.01 0.00 0.03 0.00 0.00 46.19 45.60 1sft s LEU 62 CO -0.01 -0.17 0.12 0.00 0.23 0.00 0.00 176.35 176.52 1sft s ALA 63 N -2.94 -0.30 0.37 4.21 0.00 -0.52 -1.72 121.76 120.85 1sft s ALA 63 Ca 0.24 0.34 0.04 0.00 0.00 0.00 0.00 51.96 52.58 1sft s ALA 63 Cb -0.01 -0.20 -0.06 0.00 0.00 0.00 0.00 23.12 22.86 1sft s ALA 63 CO 0.08 -0.06 0.06 0.08 0.00 0.00 0.00 175.76 175.92 1sft s VAL 64 N 0.07 1.25 -0.11 0.00 1.01 -0.77 -0.75 120.40 121.10 1sft s VAL 64 Ca -0.00 -2.00 0.03 0.00 0.00 0.00 0.00 61.98 60.01 1sft s VAL 64 Cb -0.01 -2.72 -0.24 0.00 0.00 0.00 0.00 36.38 33.41 1sft s VAL 64 CO 0.00 0.00 0.41 0.00 0.00 0.00 0.00 175.10 175.51 1sft n ALA 65 N -0.82 1.22 -3.05 5.51 0.00 -1.26 -1.43 120.51 120.68 1sft n ALA 65 Ca -0.05 -0.76 -0.09 0.00 0.00 0.00 0.00 53.44 52.54 1sft n ALA 65 Cb 0.66 -0.66 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1sft n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1sft s PHE 66 N -2.57 0.39 0.42 0.00 -0.71 -1.26 -2.00 117.98 112.26 1sft s PHE 66 Ca -0.15 -0.74 0.14 0.00 -1.04 0.00 0.00 56.93 55.14 1sft s PHE 66 Cb 0.07 0.11 1.02 0.00 -1.21 0.00 0.00 43.02 43.02 1sft s PHE 66 CO 0.78 -0.92 1.94 1.25 -1.34 0.00 0.00 175.22 176.93 1sft h LEU 67 N 2.32 0.41 -1.13 -1.99 5.85 -1.95 -2.47 115.31 116.34 1sft h LEU 67 Ca -0.28 0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.40 1sft h LEU 67 Cb 1.25 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 1sft h LEU 67 CO 0.39 0.22 -0.26 0.44 -0.34 0.00 0.00 178.44 178.89 1sft h ASP 68 N 0.44 0.00 0.14 1.25 5.19 -1.99 -2.52 116.42 118.93 1sft h ASP 68 Ca 0.35 0.00 -0.17 0.00 -0.62 0.00 0.00 57.03 56.59 1sft h ASP 68 Cb 0.73 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.24 1sft h ASP 68 CO -0.11 0.26 -0.61 -0.33 -3.12 0.00 0.00 179.24 175.33 1sft h GLU 69 N 0.00 0.47 -0.17 3.56 5.08 -1.87 -2.03 114.58 119.63 1sft h GLU 69 Ca -0.00 -0.33 -0.14 0.00 -1.00 0.00 0.00 59.36 57.89 1sft h GLU 69 Cb 0.75 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1sft h GLU 69 CO 0.03 0.94 -0.43 0.00 -1.00 0.00 0.00 179.01 178.56 1sft h ALA 70 N 0.98 0.28 0.00 3.43 0.00 -1.56 -2.73 119.26 119.67 1sft h ALA 70 Ca -0.01 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.39 1sft h ALA 70 Cb 1.16 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1sft h ALA 70 CO 0.11 0.41 -0.21 -0.07 0.00 0.00 0.00 179.25 179.49 1sft h LEU 71 N 0.25 0.00 -0.48 0.00 3.38 -1.50 -1.05 115.31 115.92 1sft h LEU 71 Ca -0.00 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.79 1sft h LEU 71 Cb 1.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 1sft h LEU 71 CO 0.09 0.21 -0.72 0.00 0.09 0.00 0.00 178.44 178.11 1sft h ALA 72 N 1.79 0.69 -0.32 1.53 0.00 -1.32 -1.83 119.26 119.79 1sft h ALA 72 Ca -0.00 -0.61 -0.16 0.00 0.00 0.00 0.00 54.91 54.13 1sft h ALA 72 Cb 0.38 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1sft h ALA 72 CO 0.03 0.79 -0.44 -0.07 0.00 0.00 0.00 179.25 179.56 1sft h LEU 73 N 0.18 0.91 -1.34 0.00 3.38 -0.91 -3.07 115.31 114.46 1sft h LEU 73 Ca -0.02 -0.44 -0.03 0.00 0.09 0.00 0.00 57.88 57.48 1sft h LEU 73 Cb 1.28 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 1sft h LEU 73 CO 0.11 1.21 0.10 0.03 0.09 0.00 0.00 178.44 179.98 1sft h ARG 74 N 0.67 0.55 0.00 1.13 2.47 -1.29 -2.37 114.38 115.53 1sft h ARG 74 Ca 0.04 -0.09 -0.01 0.00 -1.26 0.00 0.00 59.98 58.67 1sft h ARG 74 Cb 1.03 -0.10 -0.00 0.00 -1.65 0.00 0.00 29.97 29.25 1sft h ARG 74 CO 0.10 0.50 -0.03 1.49 0.56 0.00 0.00 179.97 182.59 1sft h GLU 75 N 0.54 0.00 -0.68 0.04 4.81 -1.24 -2.80 114.58 115.25 1sft h GLU 75 Ca 0.13 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1sft h GLU 75 Cb 0.20 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.58 1sft h GLU 75 CO -0.00 0.03 0.00 1.63 -0.73 0.00 0.00 179.01 179.93 1sft n LYS 76 N -3.12 2.81 -0.03 1.92 5.02 -1.05 -4.96 118.16 118.75 1sft n LYS 76 Ca 0.01 -2.51 0.00 0.00 -2.02 0.00 0.00 58.31 53.80 1sft n LYS 76 Cb 0.37 -1.61 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 1sft n LYS 76 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1sft n GLY 77 N 1.47 0.44 3.70 0.72 0.00 -1.06 -5.05 105.19 105.41 1sft n GLY 77 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 1sft n GLY 77 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sft s ILE 78 N -2.07 4.60 -0.00 -0.61 -1.09 -0.92 -4.89 121.20 116.21 1sft s ILE 78 Ca 0.00 1.87 0.00 0.00 -2.23 0.00 0.00 60.65 60.29 1sft s ILE 78 Cb 0.00 -4.20 0.00 0.00 -1.58 0.00 0.00 42.46 36.68 1sft s ILE 78 CO 0.00 0.06 1.00 -0.62 -1.23 0.00 0.00 174.94 174.15 1sft n GLU 79 N 4.57 2.98 -1.94 2.79 1.02 -1.26 -4.14 120.64 124.66 1sft n GLU 79 Ca 0.08 -1.50 -0.32 0.00 -0.02 0.00 0.00 57.16 55.41 1sft n GLU 79 Cb 0.49 -1.00 0.01 0.00 -0.02 0.00 0.00 31.44 30.92 1sft n GLU 79 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sft s ALA 80 N -1.00 2.83 0.29 0.62 0.00 -1.26 -5.00 121.76 118.23 1sft s ALA 80 Ca 0.00 0.20 -0.29 0.00 0.00 0.00 0.00 51.96 51.87 1sft s ALA 80 Cb 0.00 -3.17 -0.13 0.00 0.00 0.00 0.00 23.12 19.81 1sft s ALA 80 CO 0.00 -0.81 1.23 -2.30 0.00 0.00 0.00 175.76 173.88 1sft n PRO 81 N -2.37 1.82 -3.86 0.00 -0.02 -1.26 -4.86 135.00 124.45 1sft n PRO 81 Ca 0.08 0.64 -0.25 0.00 -2.02 0.00 0.00 63.50 61.95 1sft n PRO 81 Cb 0.53 -2.17 -0.17 0.00 -0.02 0.00 0.00 33.50 31.67 1sft n PRO 81 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1sft s ILE 82 N -0.77 0.76 -0.18 4.25 1.01 -1.26 -0.81 121.20 124.21 1sft s ILE 82 Ca 0.61 -0.12 -0.13 0.00 0.00 0.00 0.00 60.65 61.01 1sft s ILE 82 Cb -0.65 -0.83 -0.05 0.00 0.01 0.00 0.00 42.46 40.94 1sft s ILE 82 CO 0.58 0.32 0.24 -0.22 0.00 0.00 0.00 174.94 175.86 1sft s LEU 83 N 1.80 4.23 -0.35 2.97 2.96 -0.70 -0.84 118.68 128.74 1sft s LEU 83 Ca 0.05 0.40 -0.26 0.00 -0.22 0.00 0.00 54.13 54.10 1sft s LEU 83 Cb -0.12 -2.28 0.01 0.00 0.50 0.00 0.00 46.19 44.30 1sft s LEU 83 CO -0.07 0.12 0.91 -0.69 -1.32 0.00 0.00 176.35 175.30 1sft s VAL 84 N 0.48 4.62 0.14 1.68 1.01 -0.32 -1.84 120.40 126.16 1sft s VAL 84 Ca 0.13 1.22 0.21 0.00 0.00 0.00 0.00 61.98 63.55 1sft s VAL 84 Cb -0.12 -4.31 0.19 0.00 0.00 0.00 0.00 36.38 32.14 1sft s VAL 84 CO 0.02 -0.49 1.78 -0.07 0.00 0.00 0.00 175.10 176.34 1sft h LEU 85 N 9.97 0.00 0.00 3.92 3.38 -1.41 -2.73 115.31 128.44 1sft h LEU 85 Ca -0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1sft h LEU 85 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1sft h LEU 85 CO 0.97 0.29 0.00 0.61 0.09 0.00 0.00 178.44 180.40 1sft n GLY 86 N 0.21 1.60 3.94 0.83 0.00 -0.85 -4.84 105.19 106.09 1sft n GLY 86 Ca 0.00 -1.91 -0.24 0.00 0.00 0.00 0.00 46.02 43.87 1sft n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sft s ALA 87 N -2.71 3.74 0.17 4.61 0.00 -1.26 -4.38 121.76 121.93 1sft s ALA 87 Ca 0.00 -0.94 -0.02 0.00 0.00 0.00 0.00 51.96 51.00 1sft s ALA 87 Cb 0.00 -2.04 -0.04 0.00 0.00 0.00 0.00 23.12 21.04 1sft s ALA 87 CO 0.00 0.07 0.12 -1.54 0.00 0.00 0.00 175.76 174.42 1sft s SER 88 N -3.92 0.20 0.10 0.00 1.04 -1.26 -4.61 113.70 105.26 1sft s SER 88 Ca 0.39 -1.25 -0.26 0.00 0.48 0.00 0.00 55.95 55.31 1sft s SER 88 Cb -0.10 0.36 -0.07 0.00 0.10 0.00 0.00 66.02 66.31 1sft s SER 88 CO 0.34 -0.81 0.79 -0.13 0.98 0.00 0.00 173.24 174.42 1sft s ARG 89 N -4.09 4.55 0.46 4.02 0.52 -1.26 -4.96 118.95 118.20 1sft s ARG 89 Ca 0.30 1.15 0.19 0.00 -0.52 0.00 0.00 55.73 56.85 1sft s ARG 89 Cb 0.07 -3.32 1.18 0.00 0.52 0.00 0.00 34.95 33.39 1sft s ARG 89 CO 0.06 0.39 1.94 -1.35 0.02 0.00 0.00 175.30 176.36 1sft h PRO 90 N 5.12 0.26 0.00 3.54 0.11 -1.95 0.85 132.00 139.93 1sft h PRO 90 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1sft h PRO 90 Cb 1.21 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1sft h PRO 90 CO 0.69 0.17 0.00 0.00 -0.21 0.00 0.00 178.00 178.65 1sft n ALA 91 N -2.57 1.62 0.32 -0.75 0.00 -1.26 -2.51 120.51 115.36 1sft n ALA 91 Ca 0.13 -0.03 0.07 0.00 0.00 0.00 0.00 53.44 53.61 1sft n ALA 91 Cb 0.58 -1.23 0.11 0.00 0.00 0.00 0.00 19.45 18.90 1sft n ALA 91 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1sft n ASP 92 N -1.57 2.53 0.25 0.00 8.00 0.29 -4.46 116.55 121.59 1sft n ASP 92 Ca 0.03 -1.73 0.09 0.00 0.71 0.00 0.00 54.79 53.88 1sft n ASP 92 Cb 0.16 -0.10 0.65 0.00 -0.02 0.00 0.00 41.12 41.81 1sft n ASP 92 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1sft h ALA 93 N 2.75 1.79 -0.06 2.24 0.00 -1.51 -2.37 119.26 122.10 1sft h ALA 93 Ca 0.00 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1sft h ALA 93 Cb 0.67 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1sft h ALA 93 CO 0.00 0.08 -0.47 0.00 0.00 0.00 0.00 179.25 178.86 1sft h ALA 94 N 1.94 1.11 -0.17 0.00 0.00 -1.82 -1.61 119.26 118.71 1sft h ALA 94 Ca -0.00 -0.44 -0.22 0.00 0.00 0.00 0.00 54.91 54.25 1sft h ALA 94 Cb 0.12 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.84 1sft h ALA 94 CO 0.01 0.62 -0.75 1.25 0.00 0.00 0.00 179.25 180.37 1sft h LEU 95 N 0.11 0.95 -0.64 0.00 5.85 -1.80 -2.55 115.31 117.24 1sft h LEU 95 Ca 0.01 -0.61 -0.05 0.00 0.84 0.00 0.00 57.88 58.07 1sft h LEU 95 Cb 0.87 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 1sft h LEU 95 CO 0.07 1.41 0.21 0.00 -0.34 0.00 0.00 178.44 179.79 1sft h ALA 96 N 0.58 0.83 -0.19 1.25 0.00 -1.31 -2.70 119.26 117.73 1sft h ALA 96 Ca -0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1sft h ALA 96 Cb 1.38 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1sft h ALA 96 CO 0.16 0.49 0.06 0.00 0.00 0.00 0.00 179.25 179.95 1sft h ALA 97 N 1.08 0.25 0.00 0.00 0.00 -1.30 0.28 119.26 119.56 1sft h ALA 97 Ca 0.21 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1sft h ALA 97 Cb 0.27 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1sft h ALA 97 CO -0.01 -0.12 -0.18 0.37 0.00 0.00 0.00 179.25 179.31 1sft h GLN 98 N 0.13 0.00 -0.26 0.00 4.15 -1.40 -1.98 115.11 115.75 1sft h GLN 98 Ca 0.06 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.48 1sft h GLN 98 Cb 0.24 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.93 1sft h GLN 98 CO -0.00 0.18 0.00 1.04 -1.93 0.00 0.00 178.83 178.12 1sft n GLN 99 N -4.05 2.44 -3.62 1.69 1.13 -1.02 -4.98 117.38 108.96 1sft n GLN 99 Ca -0.02 -2.15 -0.22 0.00 -1.94 0.00 0.00 57.00 52.67 1sft n GLN 99 Cb 0.26 -1.50 0.06 0.00 0.11 0.00 0.00 30.24 29.18 1sft n GLN 99 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1sft n ARG 100 N 1.43 -6.57 -3.78 -1.09 1.74 -0.53 -5.00 116.66 102.86 1sft n ARG 100 Ca 0.18 0.76 -0.36 0.00 -0.77 0.00 0.00 57.85 57.65 1sft n ARG 100 Cb 0.60 -5.68 -0.10 0.00 -1.02 0.00 0.00 32.46 26.26 1sft n ARG 100 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1sft s ILE 101 N -3.40 4.96 0.33 0.55 1.01 0.87 -4.40 121.20 121.12 1sft s ILE 101 Ca 0.31 0.04 -0.26 0.00 0.00 0.00 0.00 60.65 60.74 1sft s ILE 101 Cb -0.14 -3.30 -0.10 0.00 0.01 0.00 0.00 42.46 38.93 1sft s ILE 101 CO 0.76 0.37 0.95 0.00 0.00 0.00 0.00 174.94 177.02 1sft s ALA 102 N 1.05 3.20 0.04 9.38 0.00 -0.02 -4.34 121.76 131.06 1sft s ALA 102 Ca 0.06 0.52 0.07 0.00 0.00 0.00 0.00 51.96 52.61 1sft s ALA 102 Cb -0.14 -3.18 -0.03 0.00 0.00 0.00 0.00 23.12 19.77 1sft s ALA 102 CO 0.04 0.17 -0.18 -0.51 0.00 0.00 0.00 175.76 175.28 1sft s LEU 103 N -2.08 2.60 0.18 0.00 1.43 -0.43 -1.17 118.68 119.20 1sft s LEU 103 Ca 0.50 -0.42 -0.30 0.00 -1.03 0.00 0.00 54.13 52.88 1sft s LEU 103 Cb -0.18 -1.51 -0.07 0.00 0.03 0.00 0.00 46.19 44.45 1sft s LEU 103 CO 0.24 0.26 0.97 -0.89 0.23 0.00 0.00 176.35 177.16 1sft s THR 104 N -0.92 4.21 0.04 5.49 2.01 -1.03 -1.39 115.64 124.05 1sft s THR 104 Ca 0.14 2.01 0.06 0.00 0.31 0.00 0.00 61.69 64.21 1sft s THR 104 Cb -0.10 -4.28 -0.02 0.00 0.01 0.00 0.00 72.50 68.10 1sft s THR 104 CO 0.05 0.39 -0.17 0.54 -0.69 0.00 0.00 174.62 174.75 1sft s VAL 105 N -0.58 1.33 0.00 3.82 0.11 -0.02 -4.82 120.40 120.25 1sft s VAL 105 Ca 0.45 -1.05 0.00 0.00 -2.93 0.00 0.00 61.98 58.44 1sft s VAL 105 Cb -0.25 -1.18 0.00 0.00 -1.53 0.00 0.00 36.38 33.42 1sft s VAL 105 CO 0.32 0.10 0.00 2.22 -3.33 0.00 0.00 175.10 174.41 1sft n PHE 106 N 1.93 0.00 -4.24 1.54 -1.74 -1.26 -1.05 117.46 112.65 1sft n PHE 106 Ca -0.17 0.00 -0.17 0.00 -0.56 0.00 0.00 57.45 56.55 1sft n PHE 106 Cb 0.54 0.01 -0.14 0.00 1.52 0.00 0.00 39.48 41.40 1sft n PHE 106 CO 0.00 0.00 0.00 1.03 -0.56 0.00 0.00 176.76 177.23 1sft s ARG 107 N 0.00 0.55 0.27 3.97 0.52 -1.26 -3.97 118.95 119.03 1sft s ARG 107 Ca 0.00 -0.27 0.06 0.00 -0.52 0.00 0.00 55.73 55.01 1sft s ARG 107 Cb 0.00 -0.52 0.37 0.00 0.52 0.00 0.00 34.95 35.32 1sft s ARG 107 CO 0.00 0.14 1.64 0.66 0.02 0.00 0.00 175.30 177.76 1sft h SER 108 N 5.91 0.24 0.90 0.23 4.64 -1.95 -2.60 113.55 120.92 1sft h SER 108 Ca -0.29 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1sft h SER 108 Cb 1.19 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1sft h SER 108 CO 0.50 0.70 0.00 -2.24 -0.87 0.00 0.00 176.83 174.91 1sft h ASP 109 N 0.17 0.00 0.15 4.97 3.04 -1.99 -2.04 116.42 120.72 1sft h ASP 109 Ca 0.01 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 53.79 1sft h ASP 109 Cb 0.95 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.24 1sft h ASP 109 CO 0.08 0.00 -0.07 -0.25 -2.04 0.00 0.00 179.24 176.95 1sft h TRP 110 N 0.00 -0.19 -0.42 4.15 7.01 -1.90 -2.29 115.95 122.32 1sft h TRP 110 Ca 0.00 -0.00 -0.02 0.00 2.11 0.00 0.00 58.89 60.97 1sft h TRP 110 Cb 0.45 0.06 -0.02 0.00 -2.10 0.00 0.00 29.16 27.55 1sft h TRP 110 CO 0.00 -0.03 0.18 -0.07 -2.79 0.00 0.00 178.44 175.73 1sft h LEU 111 N -0.30 0.57 -1.11 0.65 3.38 -1.53 0.12 115.31 117.09 1sft h LEU 111 Ca -0.02 -0.15 0.19 0.00 0.09 0.00 0.00 57.88 57.99 1sft h LEU 111 Cb 0.24 -0.15 -0.10 0.00 0.09 0.00 0.00 40.66 40.74 1sft h LEU 111 CO 0.03 0.56 0.61 -0.33 0.09 0.00 0.00 178.44 179.41 1sft h GLU 112 N 0.53 0.67 0.16 1.13 5.08 -1.34 0.61 114.58 121.43 1sft h GLU 112 Ca 0.14 -0.04 -0.29 0.00 -1.00 0.00 0.00 59.36 58.17 1sft h GLU 112 Cb 0.16 -0.15 0.02 0.00 0.50 0.00 0.00 28.75 29.28 1sft h GLU 112 CO -0.01 0.45 -1.30 1.49 -1.00 0.00 0.00 179.01 178.64 1sft h GLU 113 N 0.69 0.39 -0.14 2.33 4.81 -0.85 -3.07 114.58 118.75 1sft h GLU 113 Ca 0.56 -0.63 -0.10 0.00 -0.13 0.00 0.00 59.36 59.06 1sft h GLU 113 Cb 0.97 0.23 -0.01 0.00 0.63 0.00 0.00 28.75 30.57 1sft h GLU 113 CO -0.34 1.29 -0.37 0.00 -0.73 0.00 0.00 179.01 178.86 1sft h ALA 114 N 0.44 1.12 -0.44 2.92 0.00 0.21 -3.09 119.26 120.42 1sft h ALA 114 Ca -0.17 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.27 1sft h ALA 114 Cb 2.00 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.68 1sft h ALA 114 CO 0.23 0.57 -0.04 0.77 0.00 0.00 0.00 179.25 180.78 1sft h SER 115 N 0.25 0.72 0.08 0.00 0.02 -0.92 0.16 113.55 113.86 1sft h SER 115 Ca 0.03 -0.18 -0.11 0.00 -0.84 0.00 0.00 61.79 60.69 1sft h SER 115 Cb 0.77 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 1sft h SER 115 CO 0.06 0.81 -0.35 0.00 -1.14 0.00 0.00 176.83 176.21 1sft h ALA 116 N 1.27 1.07 0.00 3.77 0.00 -1.45 -3.30 119.26 120.62 1sft h ALA 116 Ca 0.13 -0.39 -0.23 0.00 0.00 0.00 0.00 54.91 54.43 1sft h ALA 116 Cb 0.48 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1sft h ALA 116 CO 0.02 0.58 -1.38 -0.07 0.00 0.00 0.00 179.25 178.41 1sft h LEU 117 N 0.32 0.00 -8.20 0.00 3.38 -1.44 -3.45 115.31 105.91 1sft h LEU 117 Ca 0.04 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.36 1sft h LEU 117 Cb 0.77 0.00 -0.34 0.00 0.09 0.00 0.00 40.66 41.19 1sft h LEU 117 CO 0.06 0.84 -0.86 -0.47 0.09 0.00 0.00 178.44 178.10 1sft s TYR 118 N -2.74 2.44 -0.02 1.13 5.04 0.01 -5.00 117.35 118.21 1sft s TYR 118 Ca -0.02 -1.12 0.09 0.00 -2.44 0.00 0.00 57.07 53.58 1sft s TYR 118 Cb 0.08 -1.66 -0.15 0.00 0.35 0.00 0.00 41.96 40.59 1sft s TYR 118 CO 0.81 -0.50 0.19 -1.13 -1.34 0.00 0.00 175.55 173.59 1sft n SER 119 N 3.88 2.81 0.00 4.32 3.41 -1.26 -4.59 113.62 122.19 1sft n SER 119 Ca -0.20 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 1sft n SER 119 Cb 0.52 1.37 0.00 0.00 -0.26 0.00 0.00 64.21 65.84 1sft n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1sft n GLY 120 N 2.00 0.48 0.01 5.00 0.00 -1.26 -4.83 105.19 106.58 1sft n GLY 120 Ca -0.03 -1.66 0.11 0.00 0.00 0.00 0.00 46.02 44.44 1sft n GLY 120 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1sft n PRO 121 N 0.00 0.06 -2.50 1.61 -0.04 -1.26 -5.08 135.00 127.79 1sft n PRO 121 Ca 0.00 -0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.08 1sft n PRO 121 Cb 0.00 -1.52 -0.04 0.00 -0.04 0.00 0.00 33.50 31.90 1sft n PRO 121 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1sft s PHE 122 N -3.04 3.33 0.60 0.54 0.40 -1.26 -5.03 117.98 113.52 1sft s PHE 122 Ca 0.08 1.65 -0.17 0.00 -0.60 0.00 0.00 56.93 57.89 1sft s PHE 122 Cb 0.16 -3.19 -0.03 0.00 0.51 0.00 0.00 43.02 40.47 1sft s PHE 122 CO 0.79 -0.67 1.11 -1.25 0.70 0.00 0.00 175.22 175.91 1sft s PRO 123 N -2.19 3.11 -0.16 0.24 0.04 -1.26 -4.87 135.00 129.90 1sft s PRO 123 Ca 0.54 1.46 0.01 0.00 0.04 0.00 0.00 61.00 63.05 1sft s PRO 123 Cb -0.25 -1.99 0.02 0.00 0.04 0.00 0.00 34.50 32.32 1sft s PRO 123 CO 0.32 -1.02 -0.16 0.42 0.04 0.00 0.00 177.00 176.60 1sft s ILE 124 N -2.11 1.72 -0.20 0.56 1.01 0.50 -4.76 121.20 117.92 1sft s ILE 124 Ca 0.69 -0.73 -0.20 0.00 0.00 0.00 0.00 60.65 60.42 1sft s ILE 124 Cb -0.21 -1.59 -0.03 0.00 0.01 0.00 0.00 42.46 40.64 1sft s ILE 124 CO 0.34 0.48 0.57 -1.00 0.00 0.00 0.00 174.94 175.33 1sft s HIS 125 N 1.43 3.37 -0.07 3.97 3.76 -1.26 -1.76 115.29 124.73 1sft s HIS 125 Ca 0.05 0.84 -0.00 0.00 -0.15 0.00 0.00 55.06 55.80 1sft s HIS 125 Cb -0.13 -2.73 -0.03 0.00 1.11 0.00 0.00 32.58 30.80 1sft s HIS 125 CO -0.11 -0.14 -0.02 -0.06 -0.85 0.00 0.00 174.74 173.56 1sft s PHE 126 N 1.76 3.07 -0.23 1.40 0.08 -0.32 -1.31 117.98 122.42 1sft s PHE 126 Ca 0.26 0.12 -0.03 0.00 0.12 0.00 0.00 56.93 57.40 1sft s PHE 126 Cb -0.16 -1.74 0.01 0.00 -0.57 0.00 0.00 43.02 40.56 1sft s PHE 126 CO 0.10 0.42 -0.05 -1.01 -0.10 0.00 0.00 175.22 174.58 1sft s HIS 127 N -0.88 3.00 -0.40 0.36 3.76 -0.49 -1.75 115.29 118.89 1sft s HIS 127 Ca 0.14 -1.19 -0.29 0.00 -0.15 0.00 0.00 55.06 53.57 1sft s HIS 127 Cb -0.11 -2.09 0.01 0.00 1.11 0.00 0.00 32.58 31.50 1sft s HIS 127 CO 0.03 -0.63 1.40 -1.17 -0.85 0.00 0.00 174.74 173.52 1sft s LEU 128 N 1.42 3.63 0.28 0.89 2.96 -0.35 -0.84 118.68 126.67 1sft s LEU 128 Ca 0.04 0.88 -0.28 0.00 -0.22 0.00 0.00 54.13 54.55 1sft s LEU 128 Cb -0.15 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 42.90 1sft s LEU 128 CO -0.04 -1.39 0.94 -0.75 -1.32 0.00 0.00 176.35 173.80 1sft s LYS 129 N 4.83 4.71 -0.11 1.98 2.47 -0.21 -1.45 119.74 131.96 1sft s LYS 129 Ca 0.61 1.40 0.03 0.00 -1.56 0.00 0.00 55.97 56.44 1sft s LYS 129 Cb -0.14 -3.02 0.01 0.00 -1.46 0.00 0.00 37.83 33.21 1sft s LYS 129 CO 0.31 0.39 -0.20 -1.64 0.16 0.00 0.00 175.35 174.38 1sft s MET 130 N -1.64 2.70 -0.41 4.03 -1.94 0.18 -2.13 119.30 120.08 1sft s MET 130 Ca 0.46 -0.75 -0.24 0.00 -1.71 0.00 0.00 55.69 53.45 1sft s MET 130 Cb -0.22 -2.14 0.02 0.00 2.01 0.00 0.00 34.83 34.50 1sft s MET 130 CO 0.28 0.06 0.86 0.34 -0.01 0.00 0.00 175.02 176.54 1sft s ASP 131 N 0.65 6.54 -0.14 3.03 -1.08 -0.41 -4.23 116.67 121.01 1sft s ASP 131 Ca -0.13 0.25 -0.03 0.00 -0.52 0.00 0.00 52.55 52.12 1sft s ASP 131 Cb -0.16 -2.43 -0.24 0.00 -1.46 0.00 0.00 42.92 38.63 1sft s ASP 131 CO 0.03 -0.90 0.26 0.35 0.52 0.00 0.00 175.17 175.44 1sft n THR 132 N 6.10 1.71 -0.96 1.71 -2.24 -1.26 -4.66 114.28 114.67 1sft n THR 132 Ca 0.05 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 1sft n THR 132 Cb 0.48 -1.60 0.00 0.00 -2.10 0.00 0.00 70.33 67.11 1sft n THR 132 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sft n GLY 133 N 2.01 0.30 0.10 3.38 0.00 -1.26 -4.83 105.19 104.88 1sft n GLY 133 Ca -0.34 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.67 1sft n GLY 133 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1sft h MET 134 N 0.00 0.00 -0.14 1.61 4.05 -1.90 -3.46 114.93 115.09 1sft h MET 134 Ca 0.00 0.00 -0.06 0.00 -0.28 0.00 0.00 59.70 59.36 1sft h MET 134 Cb 0.30 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.07 1sft h MET 134 CO 0.00 0.43 -0.06 0.41 0.23 0.00 0.00 176.91 177.93 1sft n GLY 135 N 1.38 0.44 0.00 1.39 0.00 -1.26 -4.94 105.19 102.20 1sft n GLY 135 Ca -0.07 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1sft n GLY 135 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1sft n ARG 136 N -0.76 0.00 -4.30 1.61 0.63 -1.26 -5.06 116.66 107.52 1sft n ARG 136 Ca -0.03 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 56.62 1sft n ARG 136 Cb 0.37 -0.06 -0.06 0.00 0.45 0.00 0.00 32.46 33.15 1sft n ARG 136 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1sft s LEU 137 N -1.04 2.76 0.00 6.15 1.43 -1.26 -5.11 118.68 121.60 1sft s LEU 137 Ca 0.00 -1.31 0.00 0.00 -1.03 0.00 0.00 54.13 51.79 1sft s LEU 137 Cb 0.00 -1.12 0.00 0.00 0.03 0.00 0.00 46.19 45.10 1sft s LEU 137 CO 0.00 -0.75 0.00 0.61 0.23 0.00 0.00 176.35 176.44 1sft n GLY 138 N -1.34 3.34 3.83 -3.19 0.00 -1.26 -4.18 105.19 102.38 1sft n GLY 138 Ca -0.07 -1.79 -0.35 0.00 0.00 0.00 0.00 46.02 43.81 1sft n GLY 138 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sft s VAL 139 N -2.20 4.64 0.00 1.61 0.11 -0.91 -4.53 120.40 119.13 1sft s VAL 139 Ca 0.00 1.12 0.00 0.00 -2.93 0.00 0.00 61.98 60.17 1sft s VAL 139 Cb 0.00 -3.78 0.00 0.00 -1.53 0.00 0.00 36.38 31.07 1sft s VAL 139 CO 0.00 0.11 0.00 0.29 -3.33 0.00 0.00 175.10 172.17 1sft n LYS 140 N 0.45 2.48 -4.26 1.54 5.02 -1.26 -1.29 118.16 120.84 1sft n LYS 140 Ca -0.01 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.05 1sft n LYS 140 Cb 0.52 -0.92 -0.07 0.00 -0.02 0.00 0.00 35.03 34.54 1sft n LYS 140 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1sft s ASP 141 N -2.32 4.75 0.10 4.39 1.01 -1.26 -5.04 116.67 118.30 1sft s ASP 141 Ca 0.00 -0.56 -0.20 0.00 0.71 0.00 0.00 52.55 52.50 1sft s ASP 141 Cb 0.00 -0.96 -0.09 0.00 1.01 0.00 0.00 42.92 42.88 1sft s ASP 141 CO 0.00 -0.00 1.71 -0.08 0.21 0.00 0.00 175.17 177.00 1sft h GLU 142 N 1.84 0.25 0.00 8.23 4.81 -2.00 -2.89 114.58 124.83 1sft h GLU 142 Ca -0.45 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1sft h GLU 142 Cb 1.25 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.58 1sft h GLU 142 CO 0.60 0.24 0.00 -1.91 -0.73 0.00 0.00 179.01 177.21 1sft n GLU 143 N -4.92 0.23 0.09 1.92 2.13 -1.26 -1.89 120.64 116.95 1sft n GLU 143 Ca -0.04 0.21 -0.14 0.00 0.66 0.00 0.00 57.16 57.85 1sft n GLU 143 Cb 0.07 -1.78 -0.10 0.00 0.27 0.00 0.00 31.44 29.90 1sft n GLU 143 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1sft h GLU 144 N 0.00 0.31 0.16 5.31 4.39 -1.99 -2.83 114.58 119.93 1sft h GLU 144 Ca 0.00 -0.44 -0.01 0.00 0.34 0.00 0.00 59.36 59.26 1sft h GLU 144 Cb 0.69 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.49 1sft h GLU 144 CO 0.00 1.16 -0.08 1.15 -1.16 0.00 0.00 179.01 180.09 1sft h THR 145 N 0.12 0.98 -1.00 1.13 2.02 -1.15 -2.96 112.91 112.05 1sft h THR 145 Ca -0.11 -0.77 0.20 0.00 0.77 0.00 0.00 66.41 66.51 1sft h THR 145 Cb 1.81 1.43 -0.11 0.00 -1.74 0.00 0.00 68.15 69.55 1sft h THR 145 CO 0.19 0.17 0.61 0.11 0.37 0.00 0.00 175.52 176.97 1sft h LYS 146 N -0.59 0.67 -0.06 6.66 1.57 -1.52 -1.12 116.57 122.18 1sft h LYS 146 Ca -0.02 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.62 1sft h LYS 146 Cb 0.45 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1sft h LYS 146 CO 0.04 0.44 -0.41 -0.09 -0.57 0.00 0.00 179.45 178.86 1sft h ARG 147 N 0.69 0.12 0.05 3.15 1.12 -1.43 0.67 114.38 118.74 1sft h ARG 147 Ca 0.58 -0.06 -0.00 0.00 -1.11 0.00 0.00 59.98 59.39 1sft h ARG 147 Cb 1.01 -0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.97 1sft h ARG 147 CO -0.37 0.52 -0.02 0.82 -3.11 0.00 0.00 179.97 177.80 1sft h ILE 148 N 0.11 1.32 -0.56 1.20 2.04 -1.18 -0.87 117.51 119.56 1sft h ILE 148 Ca 0.01 -1.45 0.07 0.00 1.00 0.00 0.00 64.86 64.49 1sft h ILE 148 Cb 0.77 2.25 -0.06 0.00 -0.74 0.00 0.00 36.82 39.04 1sft h ILE 148 CO 0.06 0.35 0.23 0.58 0.00 0.00 0.00 178.15 179.37 1sft h VAL 149 N -0.74 0.84 -0.56 1.67 2.07 -1.06 -0.26 116.25 118.21 1sft h VAL 149 Ca -0.01 -0.15 -0.07 0.00 0.82 0.00 0.00 66.70 67.30 1sft h VAL 149 Cb 0.63 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 1sft h VAL 149 CO 0.01 0.08 0.09 0.00 0.02 0.00 0.00 177.57 177.77 1sft h ALA 150 N 1.36 0.74 0.00 1.67 0.00 -0.90 0.97 119.26 123.10 1sft h ALA 150 Ca 0.27 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1sft h ALA 150 Cb 0.28 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1sft h ALA 150 CO -0.25 0.48 -0.16 -0.07 0.00 0.00 0.00 179.25 179.25 1sft h LEU 151 N 0.81 0.00 0.15 0.00 3.38 -0.45 -2.50 115.31 116.70 1sft h LEU 151 Ca 0.17 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.92 1sft h LEU 151 Cb 0.41 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.18 1sft h LEU 151 CO 0.01 0.16 -0.98 0.40 0.09 0.00 0.00 178.44 178.12 1sft h ILE 152 N 0.00 1.41 -0.77 1.22 2.04 -0.35 -3.24 117.51 117.83 1sft h ILE 152 Ca -0.00 -2.53 0.04 0.00 1.00 0.00 0.00 64.86 63.36 1sft h ILE 152 Cb 0.51 3.11 -0.05 0.00 -0.74 0.00 0.00 36.82 39.65 1sft h ILE 152 CO 0.02 0.73 0.49 -0.08 0.00 0.00 0.00 178.15 179.30 1sft h GLU 153 N -0.31 0.91 0.00 2.37 4.57 -0.76 -1.91 114.58 119.45 1sft h GLU 153 Ca -0.18 -0.05 -0.04 0.00 -1.18 0.00 0.00 59.36 57.91 1sft h GLU 153 Cb 1.72 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 30.10 1sft h GLU 153 CO 0.15 0.60 -0.18 -0.09 -1.18 0.00 0.00 179.01 178.31 1sft h ARG 154 N 0.94 0.00 -5.56 1.92 2.43 -1.59 -3.44 114.38 109.08 1sft h ARG 154 Ca 0.31 0.00 -0.62 0.00 -0.81 0.00 0.00 59.98 58.87 1sft h ARG 154 Cb 0.04 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 29.50 1sft h ARG 154 CO -0.12 0.18 -0.39 -1.58 -1.51 0.00 0.00 179.97 176.55 1sft s HIS 155 N -3.80 3.53 0.46 2.20 2.46 -0.72 -4.99 115.29 114.43 1sft s HIS 155 Ca -0.00 0.58 0.13 0.00 0.47 0.00 0.00 55.06 56.23 1sft s HIS 155 Cb 0.11 -2.19 1.09 0.00 -0.13 0.00 0.00 32.58 31.46 1sft s HIS 155 CO 0.61 0.44 2.07 -1.00 -2.47 0.00 0.00 174.74 174.40 1sft h PRO 156 N 5.93 0.27 -0.02 2.88 0.13 -1.85 -3.15 132.00 136.20 1sft h PRO 156 Ca -0.46 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1sft h PRO 156 Cb 1.19 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1sft h PRO 156 CO 0.69 0.18 -0.17 0.72 -0.23 0.00 0.00 178.00 179.19 1sft n HIS 157 N -4.49 0.00 -3.55 1.56 8.25 -1.26 -4.94 115.22 110.79 1sft n HIS 157 Ca 0.03 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.13 1sft n HIS 157 Cb 0.18 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.22 1sft n HIS 157 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1sft s PHE 158 N -1.81 3.45 -0.06 4.41 0.40 -1.19 -0.37 117.98 122.81 1sft s PHE 158 Ca 0.19 0.56 0.03 0.00 -0.60 0.00 0.00 56.93 57.11 1sft s PHE 158 Cb 0.15 -2.33 0.00 0.00 0.51 0.00 0.00 43.02 41.36 1sft s PHE 158 CO 0.34 0.22 -0.16 0.08 0.70 0.00 0.00 175.22 176.40 1sft s VAL 159 N 0.52 1.41 -0.61 -0.44 1.01 -0.72 -4.70 120.40 116.87 1sft s VAL 159 Ca 0.15 -0.67 -0.19 0.00 0.00 0.00 0.00 61.98 61.27 1sft s VAL 159 Cb -0.13 -1.24 0.10 0.00 0.00 0.00 0.00 36.38 35.11 1sft s VAL 159 CO 0.03 0.41 0.73 -0.22 0.00 0.00 0.00 175.10 176.06 1sft s LEU 160 N 0.35 5.33 0.05 3.92 2.96 -1.26 -1.18 118.68 128.85 1sft s LEU 160 Ca -0.11 -1.43 0.05 0.00 -0.22 0.00 0.00 54.13 52.42 1sft s LEU 160 Cb -0.14 -2.31 -0.24 0.00 0.50 0.00 0.00 46.19 44.00 1sft s LEU 160 CO 0.04 -1.13 1.03 -0.08 -1.32 0.00 0.00 176.35 174.89 1sft h GLU 161 N 9.19 0.08 -3.01 1.98 4.81 -1.69 -3.43 114.58 122.52 1sft h GLU 161 Ca -0.28 -0.14 -0.03 0.00 -0.13 0.00 0.00 59.36 58.78 1sft h GLU 161 Cb 1.08 0.05 0.01 0.00 0.63 0.00 0.00 28.75 30.52 1sft h GLU 161 CO 1.10 0.93 0.28 0.20 -0.73 0.00 0.00 179.01 180.79 1sft s GLY 162 N -4.85 0.42 0.06 1.92 0.00 -1.14 -1.76 107.32 101.97 1sft s GLY 162 Ca -0.03 -0.80 -0.20 0.00 0.00 0.00 0.00 44.72 43.69 1sft s GLY 162 CO 0.83 -0.33 0.47 0.48 0.00 0.00 0.00 173.10 174.55 1sft s LEU 163 N -3.08 0.12 0.14 0.66 2.34 -0.50 -1.22 118.68 117.14 1sft s LEU 163 Ca 0.16 0.07 -0.25 0.00 0.06 0.00 0.00 54.13 54.17 1sft s LEU 163 Cb -0.05 1.98 0.07 0.00 -0.56 0.00 0.00 46.19 47.62 1sft s LEU 163 CO 0.12 -0.72 0.79 -0.72 -1.06 0.00 0.00 176.35 174.76 1sft s TYR 164 N -2.61 -0.32 0.28 3.48 1.13 -0.53 -2.02 117.35 116.76 1sft s TYR 164 Ca -0.04 0.06 0.02 0.00 -1.41 0.00 0.00 57.07 55.69 1sft s TYR 164 Cb -0.01 0.60 -0.04 0.00 -1.10 0.00 0.00 41.96 41.42 1sft s TYR 164 CO -0.03 -0.84 0.14 -0.08 -2.51 0.00 0.00 175.55 172.22 1sft s THR 165 N -3.51 0.37 -0.03 -3.49 -1.32 -1.11 0.48 115.64 107.03 1sft s THR 165 Ca 0.07 -2.00 0.01 0.00 -1.21 0.00 0.00 61.69 58.56 1sft s THR 165 Cb -0.02 -2.55 0.02 0.00 -1.51 0.00 0.00 72.50 68.44 1sft s THR 165 CO -0.04 0.00 -0.02 -2.28 -2.21 0.00 0.00 174.62 170.07 1sft s HIS 166 N -3.70 0.41 -0.14 9.09 2.46 -1.26 -4.25 115.29 117.90 1sft s HIS 166 Ca 0.37 -0.06 -0.20 0.00 0.47 0.00 0.00 55.06 55.64 1sft s HIS 166 Cb 0.06 -0.43 -0.03 0.00 -0.13 0.00 0.00 32.58 32.05 1sft s HIS 166 CO 0.16 -0.12 0.57 -0.06 -2.47 0.00 0.00 174.74 172.83 1sft s PHE 167 N 0.77 3.47 0.24 3.88 0.08 -1.26 -4.56 117.98 120.59 1sft s PHE 167 Ca -0.08 0.96 -0.02 0.00 0.12 0.00 0.00 56.93 57.91 1sft s PHE 167 Cb -0.11 -2.69 0.27 0.00 -0.57 0.00 0.00 43.02 39.91 1sft s PHE 167 CO -0.01 0.02 1.66 0.00 -0.10 0.00 0.00 175.22 176.79 1sft h ALA 168 N 7.05 0.95 -0.15 5.36 0.00 -1.96 -3.37 119.26 127.15 1sft h ALA 168 Ca -0.37 -0.37 -0.15 0.00 0.00 0.00 0.00 54.91 54.02 1sft h ALA 168 Cb 1.17 -0.14 -0.21 0.00 0.00 0.00 0.00 17.79 18.62 1sft h ALA 168 CO 0.76 0.61 -0.75 0.25 0.00 0.00 0.00 179.25 180.12 1sft n THR 169 N -4.11 1.56 0.29 0.00 -2.24 -1.26 -4.81 114.28 103.72 1sft n THR 169 Ca -0.00 -2.74 0.18 0.00 -2.27 0.00 0.00 64.05 59.22 1sft n THR 169 Cb 0.43 0.10 0.79 0.00 -2.10 0.00 0.00 70.33 69.56 1sft n THR 169 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1sft h ALA 170 N 1.31 1.00 0.00 6.98 0.00 -1.95 -2.83 119.26 123.77 1sft h ALA 170 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1sft h ALA 170 Cb 1.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1sft h ALA 170 CO 0.15 0.00 -0.12 0.38 0.00 0.00 0.00 179.25 179.67 1sft h ASP 171 N 0.00 0.00 -3.05 0.00 2.03 -1.91 -3.40 116.42 110.09 1sft h ASP 171 Ca 0.00 -0.01 -0.56 0.00 -0.73 0.00 0.00 57.03 55.73 1sft h ASP 171 Cb 0.40 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 38.87 1sft h ASP 171 CO 0.00 0.01 0.76 -1.61 -1.03 0.00 0.00 179.24 177.37 1sft s GLU 172 N -3.18 4.31 0.28 4.15 2.02 -1.07 -3.84 118.70 121.38 1sft s GLU 172 Ca 0.08 1.60 -0.04 0.00 0.02 0.00 0.00 54.97 56.62 1sft s GLU 172 Cb 0.08 -3.63 0.56 0.00 0.10 0.00 0.00 34.13 31.24 1sft s GLU 172 CO 0.66 -0.53 1.58 0.28 0.02 0.00 0.00 175.26 177.26 1sft h VAL 173 N 5.23 0.07 -2.89 2.63 2.07 -1.88 -3.34 116.25 118.14 1sft h VAL 173 Ca -0.29 -0.01 -0.56 0.00 0.82 0.00 0.00 66.70 66.66 1sft h VAL 173 Cb 1.13 0.05 -0.05 0.00 -1.52 0.00 0.00 31.29 30.91 1sft h VAL 173 CO 0.92 0.00 1.16 0.21 0.02 0.00 0.00 177.57 179.88 1sft s ASN 174 N -5.15 6.07 -0.06 0.57 3.04 -1.26 -4.92 114.94 113.23 1sft s ASN 174 Ca -0.14 0.75 0.05 0.00 0.04 0.00 0.00 52.86 53.57 1sft s ASN 174 Cb 0.27 -2.54 0.26 0.00 -1.54 0.00 0.00 41.25 37.70 1sft s ASN 174 CO 0.77 -1.67 0.98 0.35 -3.04 0.00 0.00 177.10 174.50 1sft n THR 175 N 7.12 0.78 0.09 -5.21 -2.24 -1.25 -4.47 114.28 109.10 1sft n THR 175 Ca 0.17 -0.44 -0.03 0.00 -2.27 0.00 0.00 64.05 61.48 1sft n THR 175 Cb 0.48 -0.28 -0.07 0.00 -2.10 0.00 0.00 70.33 68.37 1sft n THR 175 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1sft h ASP 176 N 1.37 0.00 0.75 3.42 5.19 -1.91 -0.33 116.42 124.91 1sft h ASP 176 Ca 0.00 0.00 -0.25 0.00 -0.62 0.00 0.00 57.03 56.16 1sft h ASP 176 Cb 0.84 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 40.31 1sft h ASP 176 CO 0.13 0.81 -1.33 0.22 -3.12 0.00 0.00 179.24 175.95 1sft h TYR 177 N 0.00 0.04 0.08 4.55 3.20 -1.94 -3.12 116.97 119.78 1sft h TYR 177 Ca -0.02 -0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.83 1sft h TYR 177 Cb 1.63 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.89 1sft h TYR 177 CO 0.00 1.03 -0.11 0.35 -1.64 0.00 0.00 178.16 177.79 1sft h PHE 178 N 0.01 -0.28 0.00 -3.82 3.57 -1.79 -1.66 116.94 112.96 1sft h PHE 178 Ca -0.14 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.36 1sft h PHE 178 Cb 1.89 0.11 0.00 0.00 2.79 0.00 0.00 35.95 40.74 1sft h PHE 178 CO 0.01 -0.17 0.00 0.66 -2.23 0.00 0.00 178.31 176.58 1sft h SER 179 N -0.23 0.00 -0.09 0.41 4.64 -1.16 -0.64 113.55 116.49 1sft h SER 179 Ca 0.02 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.13 1sft h SER 179 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1sft h SER 179 CO -0.05 0.00 -0.70 0.22 -0.87 0.00 0.00 176.83 175.43 1sft h TYR 180 N 0.00 0.95 -0.18 4.77 3.20 -1.40 -2.77 116.97 121.54 1sft h TYR 180 Ca 0.00 -0.39 -0.20 0.00 3.14 0.00 0.00 58.73 61.28 1sft h TYR 180 Cb 0.46 -0.16 0.01 0.00 1.54 0.00 0.00 36.73 38.58 1sft h TYR 180 CO 0.00 1.20 -0.65 1.96 -1.64 0.00 0.00 178.16 179.03 1sft h GLN 181 N 0.51 0.76 -0.74 1.82 4.20 -0.77 -1.53 115.11 119.36 1sft h GLN 181 Ca -0.03 -0.58 -0.04 0.00 0.06 0.00 0.00 58.65 58.07 1sft h GLN 181 Cb 1.31 0.11 -0.03 0.00 0.30 0.00 0.00 27.48 29.16 1sft h GLN 181 CO 0.14 1.19 0.32 -0.92 -0.67 0.00 0.00 178.83 178.90 1sft h TYR 182 N 0.48 1.09 -0.20 2.96 3.20 -1.19 -0.68 116.97 122.63 1sft h TYR 182 Ca -0.03 -0.07 -0.08 0.00 3.14 0.00 0.00 58.73 61.69 1sft h TYR 182 Cb 1.28 -0.33 -0.00 0.00 1.54 0.00 0.00 36.73 39.21 1sft h TYR 182 CO 0.09 0.82 -0.17 1.15 -1.64 0.00 0.00 178.16 178.42 1sft h THR 183 N 1.05 1.32 -1.00 1.81 2.02 -1.52 -1.94 112.91 114.66 1sft h THR 183 Ca 0.25 -1.30 0.08 0.00 0.77 0.00 0.00 66.41 66.21 1sft h THR 183 Cb 0.17 1.72 -0.07 0.00 -1.74 0.00 0.00 68.15 68.23 1sft h THR 183 CO -0.03 0.40 0.64 -0.09 0.37 0.00 0.00 175.52 176.81 1sft h ARG 184 N 0.15 1.09 0.29 6.66 1.12 -0.96 -2.53 114.38 120.20 1sft h ARG 184 Ca 0.04 -0.07 -0.01 0.00 -1.11 0.00 0.00 59.98 58.83 1sft h ARG 184 Cb 0.70 -0.24 0.00 0.00 -0.01 0.00 0.00 29.97 30.41 1sft h ARG 184 CO 0.04 0.72 -0.14 0.35 -3.11 0.00 0.00 179.97 177.83 1sft h PHE 185 N 1.12 -0.36 -0.67 2.20 3.57 -1.02 -0.41 116.94 121.36 1sft h PHE 185 Ca 0.45 -0.01 0.19 0.00 3.53 0.00 0.00 57.97 62.14 1sft h PHE 185 Cb 0.26 0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 1sft h PHE 185 CO -0.00 -0.08 0.56 -0.07 -2.23 0.00 0.00 178.31 176.48 1sft h LEU 186 N -0.63 0.00 0.17 0.59 3.38 -1.09 0.12 115.31 117.84 1sft h LEU 186 Ca -0.04 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.64 1sft h LEU 186 Cb 0.45 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.21 1sft h LEU 186 CO 0.07 0.00 -1.39 -0.74 0.09 0.00 0.00 178.44 176.46 1sft h HIS 187 N 0.00 0.65 0.00 1.13 2.76 -1.24 -3.35 115.15 115.09 1sft h HIS 187 Ca 0.32 -0.47 -0.04 0.00 -2.20 0.00 0.00 60.37 57.97 1sft h HIS 187 Cb 1.43 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 30.36 1sft h HIS 187 CO 0.00 1.54 -0.20 0.52 -1.30 0.00 0.00 177.93 178.49 1sft h MET 188 N -0.12 0.00 0.00 5.26 2.86 0.93 -2.56 114.93 121.31 1sft h MET 188 Ca -0.27 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 1sft h MET 188 Cb 1.91 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.57 1sft h MET 188 CO 0.15 0.20 0.00 -0.07 1.06 0.00 0.00 176.91 178.25 1sft h LEU 189 N 0.00 0.00 -0.29 1.22 3.38 -1.37 -1.76 115.31 116.50 1sft h LEU 189 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1sft h LEU 189 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1sft h LEU 189 CO 0.03 0.00 -0.17 -0.62 0.09 0.00 0.00 178.44 177.77 1sft n GLU 190 N -2.68 0.67 0.00 1.13 -0.58 -0.96 -3.47 120.64 114.75 1sft n GLU 190 Ca -0.02 -0.29 0.13 0.00 -0.42 0.00 0.00 57.16 56.57 1sft n GLU 190 Cb 0.07 -1.49 0.48 0.00 -0.57 0.00 0.00 31.44 29.93 1sft n GLU 190 CO 0.00 0.00 0.00 0.91 -0.48 0.00 0.00 177.13 177.56 1sft n TRP 191 N -0.91 0.00 -3.54 -0.32 8.01 -0.66 -4.77 117.44 115.24 1sft n TRP 191 Ca 0.13 0.00 -0.37 0.00 -1.31 0.00 0.00 57.50 55.95 1sft n TRP 191 Cb 0.30 -0.26 -0.06 0.00 -2.01 0.00 0.00 31.31 29.28 1sft n TRP 191 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 1sft s LEU 192 N -2.74 4.34 0.12 -0.99 1.43 -1.23 -4.54 118.68 115.07 1sft s LEU 192 Ca 0.20 0.69 -0.26 0.00 -1.03 0.00 0.00 54.13 53.73 1sft s LEU 192 Cb 0.19 -2.44 -0.06 0.00 0.03 0.00 0.00 46.19 43.91 1sft s LEU 192 CO 0.56 0.20 1.63 1.55 0.23 0.00 0.00 176.35 180.52 1sft h PRO 193 N 5.83 -0.41 -4.70 1.29 0.13 -1.88 -3.43 132.00 128.83 1sft h PRO 193 Ca -0.46 0.03 -0.51 0.00 -0.87 0.00 0.00 66.00 64.18 1sft h PRO 193 Cb 1.19 0.09 -0.33 0.00 0.13 0.00 0.00 31.00 32.09 1sft h PRO 193 CO 0.69 -0.27 -0.82 -1.54 -0.23 0.00 0.00 178.00 175.83 1sft s SER 194 N -4.87 1.79 -0.18 1.44 1.04 -1.26 -5.11 113.70 106.55 1sft s SER 194 Ca -0.15 -0.30 -0.29 0.00 0.48 0.00 0.00 55.95 55.69 1sft s SER 194 Cb 0.09 -0.73 -0.04 0.00 0.10 0.00 0.00 66.02 65.44 1sft s SER 194 CO 0.66 0.06 1.72 -0.60 0.98 0.00 0.00 173.24 176.06 1sft s ARG 195 N 0.49 3.79 0.98 4.02 3.52 -1.26 -5.01 118.95 125.47 1sft s ARG 195 Ca -0.11 1.85 -0.12 0.00 -0.13 0.00 0.00 55.73 57.21 1sft s ARG 195 Cb -0.14 -4.08 0.18 0.00 -1.56 0.00 0.00 34.95 29.34 1sft s ARG 195 CO 0.03 -1.31 1.08 -2.14 -0.81 0.00 0.00 175.30 172.15 1sft s PRO 196 N 4.79 0.56 0.55 5.12 0.02 -1.26 -4.96 135.00 139.83 1sft s PRO 196 Ca 0.77 0.81 0.30 0.00 0.02 0.00 0.00 61.00 62.90 1sft s PRO 196 Cb -0.28 -1.73 1.61 0.00 0.02 0.00 0.00 34.50 34.12 1sft s PRO 196 CO 0.31 -2.71 2.13 -1.00 -0.33 0.00 0.00 177.00 175.40 1sft h PRO 197 N -1.89 0.00 -4.12 5.54 0.13 -1.79 -3.40 132.00 126.47 1sft h PRO 197 Ca -0.53 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.02 1sft h PRO 197 Cb 1.30 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 32.05 1sft h PRO 197 CO 0.53 0.08 -0.78 -0.51 -0.23 0.00 0.00 178.00 177.09 1sft s LEU 198 N -7.16 2.07 -0.16 1.56 1.43 -0.72 -4.99 118.68 110.70 1sft s LEU 198 Ca -0.03 -1.01 0.01 0.00 -1.03 0.00 0.00 54.13 52.07 1sft s LEU 198 Cb 0.13 -0.99 0.01 0.00 0.03 0.00 0.00 46.19 45.37 1sft s LEU 198 CO 0.56 -0.24 -0.18 -0.69 0.23 0.00 0.00 176.35 176.02 1sft s VAL 199 N 1.55 2.30 0.00 -1.59 1.01 -1.26 -1.41 120.40 121.00 1sft s VAL 199 Ca -0.04 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.06 1sft s VAL 199 Cb -0.18 -1.96 -0.01 0.00 0.00 0.00 0.00 36.38 34.24 1sft s VAL 199 CO -0.07 0.53 0.01 -1.38 0.00 0.00 0.00 175.10 174.19 1sft s HIS 200 N 1.03 0.08 0.00 5.22 -3.43 -0.86 -2.25 115.29 115.08 1sft s HIS 200 Ca -0.01 -0.15 0.00 0.00 -0.80 0.00 0.00 55.06 54.09 1sft s HIS 200 Cb -0.14 -0.06 0.00 0.00 -1.43 0.00 0.00 32.58 30.94 1sft s HIS 200 CO -0.05 -0.08 0.00 0.00 -2.00 0.00 0.00 174.74 172.60 1sft s ALA 202 N -1.16 3.43 0.72 0.00 0.00 -1.26 -4.15 121.76 119.34 1sft s ALA 202 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 51.96 51.91 1sft s ALA 202 Cb 0.00 -2.91 0.02 0.00 0.00 0.00 0.00 23.12 20.23 1sft s ALA 202 CO 0.00 -0.23 0.12 0.27 0.00 0.00 0.00 175.76 175.92 1sft n ASN 203 N 4.17 0.07 -0.32 0.00 0.23 -1.26 -1.27 115.26 116.88 1sft n ASN 203 Ca -0.02 -1.08 0.11 0.00 -0.53 0.00 0.00 54.58 53.05 1sft n ASN 203 Cb 0.51 -0.08 0.32 0.00 -2.08 0.00 0.00 39.78 38.44 1sft n ASN 203 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1sft h SER 204 N -0.12 0.78 0.41 0.53 0.02 -1.91 -2.74 113.55 110.52 1sft h SER 204 Ca -0.04 0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 1sft h SER 204 Cb 0.12 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.57 1sft h SER 204 CO 0.03 0.38 -0.20 0.00 -1.14 0.00 0.00 176.83 175.90 1sft h ALA 205 N 1.58 -0.55 0.00 3.77 0.00 -1.91 -2.03 119.26 120.12 1sft h ALA 205 Ca 0.49 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 1sft h ALA 205 Cb 0.69 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1sft h ALA 205 CO -0.26 -0.71 -0.01 0.00 0.00 0.00 0.00 179.25 178.27 1sft h ALA 206 N -0.25 1.00 0.00 0.00 0.00 -1.77 -1.29 119.26 116.96 1sft h ALA 206 Ca -0.06 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.60 1sft h ALA 206 Cb 0.52 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1sft h ALA 206 CO 0.09 0.01 -1.37 0.66 0.00 0.00 0.00 179.25 178.64 1sft h SER 207 N 0.00 0.00 1.00 0.00 4.64 -1.49 -1.10 113.55 116.60 1sft h SER 207 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1sft h SER 207 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1sft h SER 207 CO 0.00 0.95 -0.70 -0.07 -0.87 0.00 0.00 176.83 176.14 1sft h LEU 208 N 0.00 0.00 0.06 5.97 3.38 -1.30 -3.26 115.31 120.16 1sft h LEU 208 Ca -0.16 -0.12 -0.34 0.00 0.09 0.00 0.00 57.88 57.35 1sft h LEU 208 Cb 1.86 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.58 1sft h LEU 208 CO 0.10 0.06 -1.87 0.54 0.09 0.00 0.00 178.44 177.36 1sft n ARG 209 N -2.38 0.68 -3.04 1.13 5.12 -0.49 -4.38 116.66 113.29 1sft n ARG 209 Ca 0.02 0.35 -0.22 0.00 -1.93 0.00 0.00 57.85 56.07 1sft n ARG 209 Cb 0.48 -1.68 -0.03 0.00 -1.16 0.00 0.00 32.46 30.07 1sft n ARG 209 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 1sft n PHE 210 N -3.81 2.12 0.19 -1.55 3.72 -0.42 -5.00 117.46 112.70 1sft n PHE 210 Ca -0.35 -3.86 0.12 0.00 -0.05 0.00 0.00 57.45 53.31 1sft n PHE 210 Cb 0.92 -0.44 0.66 0.00 -0.94 0.00 0.00 39.48 39.67 1sft n PHE 210 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1sft h PRO 211 N 2.98 0.00 0.04 -1.08 0.13 -1.68 -1.28 132.00 131.11 1sft h PRO 211 Ca 0.11 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.95 1sft h PRO 211 Cb 0.75 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.85 1sft h PRO 211 CO 0.66 0.00 -1.66 0.38 -0.23 0.00 0.00 178.00 177.15 1sft h ASP 212 N 0.00 0.13 -1.90 1.44 3.04 -1.91 -3.38 116.42 113.84 1sft h ASP 212 Ca 0.00 -0.24 -0.74 0.00 -3.24 0.00 0.00 57.03 52.80 1sft h ASP 212 Cb 0.04 -0.04 -0.25 0.00 -1.04 0.00 0.00 39.33 38.04 1sft h ASP 212 CO 0.00 1.21 1.04 0.54 -2.04 0.00 0.00 179.24 179.99 1sft n ARG 213 N -3.21 3.42 0.00 4.15 1.74 -0.48 -3.96 116.66 118.32 1sft n ARG 213 Ca -0.18 -3.63 0.00 0.00 -0.77 0.00 0.00 57.85 53.27 1sft n ARG 213 Cb 1.04 -2.32 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 1sft n ARG 213 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1sft n THR 214 N -0.15 0.06 0.00 0.55 -2.24 -1.25 -4.90 114.28 106.35 1sft n THR 214 Ca 0.52 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 62.04 1sft n THR 214 Cb 0.28 1.43 0.00 0.00 -2.10 0.00 0.00 70.33 69.94 1sft n THR 214 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1sft n PHE 215 N -0.03 0.00 -0.87 4.78 3.72 -1.25 -3.70 117.46 120.11 1sft n PHE 215 Ca 0.00 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.48 1sft n PHE 215 Cb 0.16 0.00 0.13 0.00 -0.94 0.00 0.00 39.48 38.84 1sft n PHE 215 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1sft n ASN 216 N 5.32 2.52 -3.66 4.37 2.04 -0.95 -4.87 115.26 120.03 1sft n ASN 216 Ca 0.00 -2.88 -0.07 0.00 -0.44 0.00 0.00 54.58 51.19 1sft n ASN 216 Cb 0.00 -0.37 -0.08 0.00 -2.53 0.00 0.00 39.78 36.80 1sft n ASN 216 CO 0.00 0.00 0.00 -0.32 -0.44 0.00 0.00 177.26 176.50 1sft s MET 217 N -2.52 0.57 -0.17 -3.83 0.00 -1.22 -1.74 119.30 110.38 1sft s MET 217 Ca 0.28 1.13 -0.08 0.00 0.00 0.00 0.00 55.69 57.02 1sft s MET 217 Cb 0.24 0.23 -0.04 0.00 0.00 0.00 0.00 34.83 35.26 1sft s MET 217 CO 0.04 -0.17 0.09 0.08 0.00 0.00 0.00 175.02 175.05 1sft s VAL 218 N 1.86 5.02 -0.16 10.11 1.01 -0.91 -4.21 120.40 133.13 1sft s VAL 218 Ca -0.08 0.05 -0.16 0.00 0.00 0.00 0.00 61.98 61.78 1sft s VAL 218 Cb -0.08 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 1sft s VAL 218 CO -0.17 0.48 0.39 -0.13 0.00 0.00 0.00 175.10 175.67 1sft s ARG 219 N 0.13 4.27 -0.21 2.72 0.52 -0.39 -0.89 118.95 125.10 1sft s ARG 219 Ca 0.06 0.26 0.01 0.00 -0.52 0.00 0.00 55.73 55.55 1sft s ARG 219 Cb -0.12 -3.46 0.04 0.00 0.52 0.00 0.00 34.95 31.94 1sft s ARG 219 CO 0.00 0.13 -0.12 0.12 0.02 0.00 0.00 175.30 175.45 1sft s PHE 220 N 0.75 2.68 0.00 -0.53 5.36 0.69 -3.10 117.98 123.83 1sft s PHE 220 Ca 0.21 -1.77 0.00 0.00 -0.96 0.00 0.00 56.93 54.41 1sft s PHE 220 Cb -0.14 -1.76 0.00 0.00 -0.34 0.00 0.00 43.02 40.78 1sft s PHE 220 CO 0.07 -0.79 0.00 0.41 -1.46 0.00 0.00 175.22 173.46 1sft n GLY 221 N 4.61 0.60 0.35 13.12 0.00 -1.26 -1.31 105.19 121.31 1sft n GLY 221 Ca -0.16 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.94 1sft n GLY 221 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1sft h ILE 222 N 0.00 0.99 0.00 -0.61 6.09 -1.90 -0.13 117.51 121.95 1sft h ILE 222 Ca 0.00 -0.23 0.00 0.00 -1.37 0.00 0.00 64.86 63.26 1sft h ILE 222 Cb 0.00 0.25 0.00 0.00 0.47 0.00 0.00 36.82 37.54 1sft h ILE 222 CO 0.00 0.12 0.00 0.00 -3.07 0.00 0.00 178.15 175.20 1sft h ALA 223 N 1.63 1.00 -0.35 0.18 0.00 -1.91 -1.85 119.26 117.96 1sft h ALA 223 Ca 0.31 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.14 1sft h ALA 223 Cb 0.33 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1sft h ALA 223 CO -0.10 0.00 -0.11 1.98 0.00 0.00 0.00 179.25 181.02 1sft h MET 224 N 0.00 0.61 -0.00 0.00 1.85 -1.31 -1.39 114.93 114.69 1sft h MET 224 Ca 0.00 -0.18 0.00 0.00 -0.61 0.00 0.00 59.70 58.91 1sft h MET 224 Cb 0.44 -0.06 0.00 0.00 0.43 0.00 0.00 31.60 32.40 1sft h MET 224 CO 0.00 0.71 -0.06 0.66 -0.40 0.00 0.00 176.91 177.81 1sft n TYR 225 N -4.19 0.00 -0.52 1.39 4.01 -0.71 -4.37 117.16 112.76 1sft n TYR 225 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 1sft n TYR 225 Cb 0.33 -0.24 0.00 0.00 -0.31 0.00 0.00 39.34 39.13 1sft n TYR 225 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1sft n GLY 226 N 1.29 0.70 3.42 2.72 0.00 -0.52 -3.07 105.19 109.73 1sft n GLY 226 Ca 0.14 -0.55 -0.33 0.00 0.00 0.00 0.00 46.02 45.28 1sft n GLY 226 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sft s LEU 227 N 0.00 2.66 0.22 0.99 1.43 -1.15 -4.32 118.68 118.51 1sft s LEU 227 Ca 0.00 -0.27 -0.30 0.00 -1.03 0.00 0.00 54.13 52.53 1sft s LEU 227 Cb 0.00 -1.55 -0.08 0.00 0.03 0.00 0.00 46.19 44.59 1sft s LEU 227 CO 0.00 0.28 1.06 0.00 0.23 0.00 0.00 176.35 177.93 1sft s ALA 228 N -0.36 3.37 0.32 4.21 0.00 -1.26 -3.38 121.76 124.67 1sft s ALA 228 Ca 0.03 0.79 0.09 0.00 0.00 0.00 0.00 51.96 52.87 1sft s ALA 228 Cb -0.12 -3.31 0.95 0.00 0.00 0.00 0.00 23.12 20.63 1sft s ALA 228 CO 0.02 -0.11 1.61 -1.35 0.00 0.00 0.00 175.76 175.93 1sft h PRO 229 N 4.55 0.10 -3.77 0.00 0.11 -1.97 -3.44 132.00 127.58 1sft h PRO 229 Ca -0.45 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.56 1sft h PRO 229 Cb 1.21 -0.02 -0.14 0.00 0.11 0.00 0.00 31.00 32.15 1sft h PRO 229 CO 0.70 0.07 -0.38 -1.54 -0.21 0.00 0.00 178.00 176.64 1sft s SER 230 N -4.89 0.11 0.36 -2.05 1.04 -1.26 -4.97 113.70 102.04 1sft s SER 230 Ca -0.11 -0.61 0.15 0.00 0.48 0.00 0.00 55.95 55.85 1sft s SER 230 Cb 0.30 0.33 1.03 0.00 0.10 0.00 0.00 66.02 67.77 1sft s SER 230 CO 0.78 -0.70 1.72 -0.65 0.98 0.00 0.00 173.24 175.37 1sft h PRO 231 N 2.86 0.43 -0.44 4.02 0.11 -1.94 -3.20 132.00 133.85 1sft h PRO 231 Ca -0.34 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.66 1sft h PRO 231 Cb 1.20 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1sft h PRO 231 CO 0.55 0.29 -0.09 0.78 -0.21 0.00 0.00 178.00 179.32 1sft h GLY 232 N 0.45 0.85 2.00 -0.55 0.00 -1.97 -3.06 103.07 100.80 1sft h GLY 232 Ca 0.66 -0.63 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1sft h GLY 232 CO -0.43 0.58 0.00 1.19 0.00 0.00 0.00 176.54 177.88 1sft h ILE 233 N 0.72 0.00 -0.56 2.60 2.10 -1.65 -3.41 117.51 117.31 1sft h ILE 233 Ca 0.12 -0.71 0.11 0.00 1.08 0.00 0.00 64.86 65.47 1sft h ILE 233 Cb 0.57 1.70 -0.09 0.00 -1.09 0.00 0.00 36.82 37.91 1sft h ILE 233 CO 0.04 0.00 0.03 0.11 -1.08 0.00 0.00 178.15 177.25 1sft h LYS 234 N 0.00 0.15 -0.85 2.19 1.57 -1.58 -2.14 116.57 115.92 1sft h LYS 234 Ca 0.00 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1sft h LYS 234 Cb 0.84 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.11 1sft h LYS 234 CO 0.00 0.10 0.03 -0.35 -0.57 0.00 0.00 179.45 178.66 1sft n PRO 235 N -5.22 2.49 0.00 3.15 -0.04 -1.26 -3.54 135.00 130.58 1sft n PRO 235 Ca 0.07 -1.28 0.02 0.00 -0.04 0.00 0.00 63.50 62.27 1sft n PRO 235 Cb 0.31 -1.78 -0.00 0.00 -0.04 0.00 0.00 33.50 31.98 1sft n PRO 235 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1sft n LEU 236 N 0.21 0.65 -4.77 1.53 4.77 -0.80 -5.06 117.00 113.52 1sft n LEU 236 Ca 0.13 -0.71 -0.39 0.00 -0.03 0.00 0.00 56.01 55.00 1sft n LEU 236 Cb 0.67 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.71 1sft n LEU 236 CO 0.15 0.14 0.49 -0.76 -1.33 0.00 0.00 177.39 176.08 1sft s LEU 237 N -1.40 4.58 0.33 2.23 1.02 -1.23 -4.83 118.68 119.39 1sft s LEU 237 Ca 0.03 1.63 0.17 0.00 0.02 0.00 0.00 54.13 55.98 1sft s LEU 237 Cb 0.03 -3.30 0.43 0.00 0.02 0.00 0.00 46.19 43.37 1sft s LEU 237 CO 0.10 0.19 1.61 1.55 0.02 0.00 0.00 176.35 179.83 1sft h PRO 238 N 4.46 0.00 -4.97 1.29 0.13 -1.94 -3.45 132.00 127.52 1sft h PRO 238 Ca -0.47 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.34 1sft h PRO 238 Cb 1.21 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.19 1sft h PRO 238 CO 0.67 0.44 -0.69 1.52 -0.23 0.00 0.00 178.00 179.71 1sft s TYR 239 N -3.33 1.29 0.18 1.56 1.13 -1.26 -5.14 117.35 111.77 1sft s TYR 239 Ca 0.02 -0.87 -0.31 0.00 -1.41 0.00 0.00 57.07 54.50 1sft s TYR 239 Cb 0.10 -0.70 -0.09 0.00 -1.10 0.00 0.00 41.96 40.16 1sft s TYR 239 CO 0.71 -0.03 1.40 -1.25 -2.51 0.00 0.00 175.55 173.87 1sft s PRO 240 N -3.82 4.32 0.01 -3.49 0.04 -1.26 -5.04 135.00 125.76 1sft s PRO 240 Ca 0.21 2.16 -0.24 0.00 0.04 0.00 0.00 61.00 63.17 1sft s PRO 240 Cb 0.04 -3.19 -0.05 0.00 0.04 0.00 0.00 34.50 31.35 1sft s PRO 240 CO 0.03 -0.39 0.71 -0.51 0.04 0.00 0.00 177.00 176.87 1sft s LEU 241 N 0.36 4.42 -0.05 -3.56 1.43 -1.26 -4.93 118.68 115.09 1sft s LEU 241 Ca 0.61 1.33 -0.15 0.00 -1.03 0.00 0.00 54.13 54.90 1sft s LEU 241 Cb -0.39 -3.13 -0.05 0.00 0.03 0.00 0.00 46.19 42.65 1sft s LEU 241 CO 0.36 0.02 0.38 -0.54 0.23 0.00 0.00 176.35 176.80 1sft s LYS 242 N 0.04 3.99 -0.09 1.70 3.01 -1.26 -4.97 119.74 122.17 1sft s LYS 242 Ca 0.36 0.33 -0.27 0.00 -1.01 0.00 0.00 55.97 55.39 1sft s LYS 242 Cb -0.19 -3.28 -0.02 0.00 -1.01 0.00 0.00 37.83 33.32 1sft s LYS 242 CO 0.21 0.55 0.88 -2.00 0.51 0.00 0.00 175.35 175.50 1sft s GLU 243 N -0.60 4.42 -0.04 1.68 2.12 -1.26 -3.85 118.70 121.17 1sft s GLU 243 Ca 0.22 1.17 0.14 0.00 0.36 0.00 0.00 54.97 56.86 1sft s GLU 243 Cb -0.16 -3.51 -0.22 0.00 0.26 0.00 0.00 34.13 30.51 1sft s GLU 243 CO 0.11 -0.16 0.61 0.00 -0.54 0.00 0.00 175.26 175.28 1sft n ALA 244 N 4.50 1.60 -2.80 6.30 0.00 -1.18 -4.86 120.51 124.07 1sft n ALA 244 Ca 0.04 -0.80 -0.35 0.00 0.00 0.00 0.00 53.44 52.33 1sft n ALA 244 Cb 0.50 -0.78 -0.08 0.00 0.00 0.00 0.00 19.45 19.09 1sft n ALA 244 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1sft s PHE 245 N -2.66 3.40 0.17 0.00 2.19 -1.26 -0.88 117.98 118.95 1sft s PHE 245 Ca -0.05 0.31 0.02 0.00 0.33 0.00 0.00 56.93 57.53 1sft s PHE 245 Cb 0.08 -2.03 -0.05 0.00 -1.31 0.00 0.00 43.02 39.71 1sft s PHE 245 CO 0.82 0.42 0.01 -1.54 1.83 0.00 0.00 175.22 176.76 1sft s SER 246 N -0.21 1.13 -0.04 6.13 1.04 -0.48 -4.75 113.70 116.52 1sft s SER 246 Ca 0.09 -1.18 0.01 0.00 0.48 0.00 0.00 55.95 55.35 1sft s SER 246 Cb -0.12 0.14 0.02 0.00 0.10 0.00 0.00 66.02 66.16 1sft s SER 246 CO 0.01 -0.59 -0.03 -0.22 0.98 0.00 0.00 173.24 173.40 1sft s LEU 247 N -3.16 1.23 0.13 2.42 2.96 -0.27 -1.58 118.68 120.41 1sft s LEU 247 Ca 0.24 -0.09 0.04 0.00 -0.22 0.00 0.00 54.13 54.09 1sft s LEU 247 Cb 0.06 -0.37 -0.04 0.00 0.50 0.00 0.00 46.19 46.33 1sft s LEU 247 CO 0.04 -0.08 -0.09 -1.00 -1.32 0.00 0.00 176.35 173.90 1sft s HIS 248 N 1.02 1.15 0.37 5.38 3.76 0.03 -1.42 115.29 125.58 1sft s HIS 248 Ca -0.10 -0.81 -0.08 0.00 -0.15 0.00 0.00 55.06 53.92 1sft s HIS 248 Cb -0.14 -0.60 0.03 0.00 1.11 0.00 0.00 32.58 32.97 1sft s HIS 248 CO -0.01 0.01 0.63 0.45 -0.85 0.00 0.00 174.74 174.97 1sft s SER 249 N -3.13 0.52 0.02 1.40 0.15 -0.06 -1.64 113.70 110.97 1sft s SER 249 Ca 0.15 -1.34 0.01 0.00 0.70 0.00 0.00 55.95 55.47 1sft s SER 249 Cb 0.03 0.76 -0.02 0.00 -1.71 0.00 0.00 66.02 65.09 1sft s SER 249 CO -0.01 -1.50 -0.04 -0.13 1.20 0.00 0.00 173.24 172.76 1sft s ARG 250 N -2.65 0.33 0.15 5.44 0.52 -0.98 -0.52 118.95 121.24 1sft s ARG 250 Ca 0.23 -0.56 -0.31 0.00 -0.52 0.00 0.00 55.73 54.57 1sft s ARG 250 Cb -0.03 -0.01 -0.10 0.00 0.52 0.00 0.00 34.95 35.33 1sft s ARG 250 CO 0.16 -0.02 1.68 -0.51 0.02 0.00 0.00 175.30 176.64 1sft s LEU 251 N -1.28 4.38 -0.00 2.53 1.43 0.58 -4.24 118.68 122.07 1sft s LEU 251 Ca -0.12 2.70 0.08 0.00 -1.03 0.00 0.00 54.13 55.76 1sft s LEU 251 Cb -0.09 -3.58 -0.09 0.00 0.03 0.00 0.00 46.19 42.46 1sft s LEU 251 CO -0.01 -0.92 0.30 1.33 0.23 0.00 0.00 176.35 177.29 1sft n VAL 252 N 4.26 0.00 -3.70 -1.59 0.24 -0.33 -1.06 118.33 116.15 1sft n VAL 252 Ca 0.16 -0.29 -0.14 0.00 -2.04 0.00 0.00 64.34 62.03 1sft n VAL 252 Cb 0.38 0.86 -0.07 0.00 -1.47 0.00 0.00 33.84 33.53 1sft n VAL 252 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1sft s HIS 253 N -1.91 -0.27 -0.05 6.34 5.65 -1.22 -4.97 115.29 118.87 1sft s HIS 253 Ca 0.02 0.36 -0.04 0.00 0.25 0.00 0.00 55.06 55.65 1sft s HIS 253 Cb 0.06 0.18 0.02 0.00 -1.18 0.00 0.00 32.58 31.65 1sft s HIS 253 CO 0.32 -0.48 0.12 0.08 -0.65 0.00 0.00 174.74 174.13 1sft s VAL 254 N -1.72 -0.02 -0.10 0.89 1.01 -1.26 -1.27 120.40 117.93 1sft s VAL 254 Ca -0.10 0.06 -0.19 0.00 0.00 0.00 0.00 61.98 61.75 1sft s VAL 254 Cb -0.03 -0.19 0.04 0.00 0.00 0.00 0.00 36.38 36.21 1sft s VAL 254 CO 0.03 0.02 0.46 -1.59 0.00 0.00 0.00 175.10 174.02 1sft s LYS 255 N 0.41 0.69 -0.30 2.72 -2.85 -0.48 -4.97 119.74 114.96 1sft s LYS 255 Ca -0.03 0.28 -0.20 0.00 -1.00 0.00 0.00 55.97 55.02 1sft s LYS 255 Cb -0.04 0.32 -0.01 0.00 -2.06 0.00 0.00 37.83 36.04 1sft s LYS 255 CO -0.02 -0.16 0.64 0.21 0.10 0.00 0.00 175.35 176.12 1sft s LYS 256 N -0.58 3.93 0.04 1.78 2.20 -1.26 -0.48 119.74 125.38 1sft s LYS 256 Ca -0.07 0.35 -0.19 0.00 -0.36 0.00 0.00 55.97 55.70 1sft s LYS 256 Cb -0.03 -3.72 -0.06 0.00 -1.51 0.00 0.00 37.83 32.51 1sft s LYS 256 CO 0.04 -0.55 0.55 -0.51 -0.36 0.00 0.00 175.35 174.51 1sft s LEU 257 N 2.61 4.49 0.43 5.43 1.43 0.77 -4.98 118.68 128.86 1sft s LEU 257 Ca 0.26 1.19 -0.10 0.00 -1.03 0.00 0.00 54.13 54.45 1sft s LEU 257 Cb -0.15 -2.85 -0.06 0.00 0.03 0.00 0.00 46.19 43.16 1sft s LEU 257 CO 0.11 0.24 0.79 -1.10 0.23 0.00 0.00 176.35 176.62 1sft s GLN 258 N -0.88 3.73 0.48 1.70 -1.52 -1.26 -2.86 119.66 119.05 1sft s GLN 258 Ca 0.28 0.44 -0.22 0.00 -1.95 0.00 0.00 55.36 53.91 1sft s GLN 258 Cb -0.19 -2.37 -0.09 0.00 -0.22 0.00 0.00 33.01 30.14 1sft s GLN 258 CO 0.18 -0.10 0.91 -2.30 -0.25 0.00 0.00 175.29 173.73 1sft n PRO 259 N -1.56 1.09 -0.75 2.91 -0.02 -1.24 -2.52 135.00 132.91 1sft n PRO 259 Ca 0.02 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 1sft n PRO 259 Cb 0.54 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 1sft n PRO 259 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1sft n GLY 260 N 1.32 1.28 3.76 -1.23 0.00 -0.37 -4.96 105.19 104.99 1sft n GLY 260 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1sft n GLY 260 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1sft s GLU 261 N -0.08 4.45 0.09 1.61 2.02 -1.05 -4.82 118.70 120.91 1sft s GLU 261 Ca 0.00 0.99 -0.02 0.00 0.02 0.00 0.00 54.97 55.96 1sft s GLU 261 Cb 0.00 -3.32 -0.05 0.00 0.10 0.00 0.00 34.13 30.86 1sft s GLU 261 CO 0.00 0.41 0.27 0.15 0.02 0.00 0.00 175.26 176.11 1sft s LYS 262 N -0.46 3.50 -0.07 1.61 1.02 -1.26 -0.57 119.74 123.51 1sft s LYS 262 Ca 0.35 -0.31 0.01 0.00 0.02 0.00 0.00 55.97 56.05 1sft s LYS 262 Cb -0.21 -2.97 0.02 0.00 -0.52 0.00 0.00 37.83 34.15 1sft s LYS 262 CO 0.22 0.56 -0.09 0.08 -0.92 0.00 0.00 175.35 175.20 1sft s VAL 263 N -1.56 0.93 0.00 3.17 1.01 -0.83 -5.01 120.40 118.12 1sft s VAL 263 Ca 0.37 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.03 1sft s VAL 263 Cb -0.13 -0.90 0.00 0.00 0.00 0.00 0.00 36.38 35.35 1sft s VAL 263 CO 0.27 0.32 0.00 -0.24 0.00 0.00 0.00 175.10 175.45 1sft n SER 264 N 4.17 -2.79 -4.75 3.32 2.88 -1.26 -3.76 113.62 111.43 1sft n SER 264 Ca -0.20 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 56.92 1sft n SER 264 Cb 0.51 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.95 1sft n SER 264 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1sft s TYR 265 N 0.00 3.05 0.00 0.66 2.02 -1.26 -1.98 117.35 119.84 1sft s TYR 265 Ca 0.00 1.16 0.00 0.00 -0.37 0.00 0.00 57.07 57.86 1sft s TYR 265 Cb 0.00 -3.76 0.00 0.00 -0.40 0.00 0.00 41.96 37.80 1sft s TYR 265 CO 0.00 -2.36 0.00 0.41 -1.57 0.00 0.00 175.55 172.03 1sft n GLY 266 N 1.81 0.61 3.84 0.71 0.00 -1.26 -3.97 105.19 106.93 1sft n GLY 266 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1sft n GLY 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sft n ALA 267 N 1.00 -1.16 1.58 4.61 0.00 -0.83 -4.84 120.51 120.86 1sft n ALA 267 Ca 0.00 0.01 0.14 0.00 0.00 0.00 0.00 53.44 53.59 1sft n ALA 267 Cb 0.03 -3.00 0.79 0.00 0.00 0.00 0.00 19.45 17.27 1sft n ALA 267 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1sft n THR 268 N -4.08 0.04 -5.24 0.00 -2.24 -1.25 -4.63 114.28 96.87 1sft n THR 268 Ca 0.05 0.01 -0.32 0.00 -2.27 0.00 0.00 64.05 61.52 1sft n THR 268 Cb 0.50 -0.55 -0.17 0.00 -2.10 0.00 0.00 70.33 68.02 1sft n THR 268 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1sft s TYR 269 N -2.29 2.48 -0.11 4.78 5.04 -1.25 -4.88 117.35 121.13 1sft s TYR 269 Ca 0.35 -0.81 0.02 0.00 -2.44 0.00 0.00 57.07 54.20 1sft s TYR 269 Cb 0.20 -1.63 -0.01 0.00 0.35 0.00 0.00 41.96 40.86 1sft s TYR 269 CO 0.38 -0.27 -0.18 0.99 -1.34 0.00 0.00 175.55 175.13 1sft s THR 270 N -0.02 2.61 0.01 4.34 2.01 -1.26 -1.97 115.64 121.35 1sft s THR 270 Ca -0.08 -0.83 -0.30 0.00 0.31 0.00 0.00 61.69 60.79 1sft s THR 270 Cb -0.15 -2.05 -0.04 0.00 0.01 0.00 0.00 72.50 70.27 1sft s THR 270 CO 0.05 0.55 1.13 0.00 -0.69 0.00 0.00 174.62 175.66 1sft s ALA 271 N 0.20 3.36 -0.22 7.40 0.00 0.27 -4.92 121.76 127.84 1sft s ALA 271 Ca -0.11 0.68 0.13 0.00 0.00 0.00 0.00 51.96 52.66 1sft s ALA 271 Cb -0.16 -3.43 -0.23 0.00 0.00 0.00 0.00 23.12 19.30 1sft s ALA 271 CO 0.06 -0.47 -0.02 0.94 0.00 0.00 0.00 175.76 176.27 1sft n GLN 272 N 4.31 0.68 -1.16 0.00 -0.06 -1.26 -1.23 117.38 118.65 1sft n GLN 272 Ca 0.09 0.04 0.00 0.00 -2.00 0.00 0.00 57.00 55.13 1sft n GLN 272 Cb 0.48 -1.52 0.00 0.00 -4.06 0.00 0.00 30.24 25.14 1sft n GLN 272 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 1sft n THR 273 N -2.91 0.00 -2.96 1.69 -2.24 -1.26 -4.70 114.28 101.90 1sft n THR 273 Ca -0.37 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 60.98 1sft n THR 273 Cb 1.11 -0.21 -0.05 0.00 -2.10 0.00 0.00 70.33 69.08 1sft n THR 273 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1sft s GLU 274 N -0.80 3.23 -0.04 -0.78 2.02 -1.26 -3.71 118.70 117.36 1sft s GLU 274 Ca 0.00 -0.57 0.06 0.00 0.02 0.00 0.00 54.97 54.48 1sft s GLU 274 Cb 0.00 -4.09 -0.02 0.00 0.10 0.00 0.00 34.13 30.12 1sft s GLU 274 CO 0.00 -1.43 -0.22 -1.21 0.02 0.00 0.00 175.26 172.43 1sft s GLU 275 N 3.46 2.35 -0.21 1.61 2.02 -1.14 -5.01 118.70 121.77 1sft s GLU 275 Ca 0.24 -0.84 -0.14 0.00 0.02 0.00 0.00 54.97 54.24 1sft s GLU 275 Cb -0.16 -2.19 -0.04 0.00 0.10 0.00 0.00 34.13 31.84 1sft s GLU 275 CO 0.15 0.54 0.33 -1.58 0.02 0.00 0.00 175.26 174.72 1sft s TRP 276 N -0.55 3.35 -0.11 1.61 0.52 -1.26 -0.16 118.94 122.34 1sft s TRP 276 Ca 0.08 0.49 0.03 0.00 0.02 0.00 0.00 56.10 56.71 1sft s TRP 276 Cb -0.11 -2.45 -0.01 0.00 -1.15 0.00 0.00 33.47 29.75 1sft s TRP 276 CO 0.00 0.01 -0.19 0.42 0.02 0.00 0.00 176.95 177.21 1sft s ILE 277 N 1.25 2.48 0.01 2.03 -1.09 0.37 -2.03 121.20 124.23 1sft s ILE 277 Ca 0.15 -0.87 0.03 0.00 -2.23 0.00 0.00 60.65 57.73 1sft s ILE 277 Cb -0.14 -1.99 -0.03 0.00 -1.58 0.00 0.00 42.46 38.72 1sft s ILE 277 CO 0.07 0.55 -0.05 -0.83 -1.23 0.00 0.00 174.94 173.45 1sft s GLY 278 N 0.25 1.79 -0.18 6.18 0.00 -0.40 -1.39 107.32 113.57 1sft s GLY 278 Ca -0.13 -1.01 -0.07 0.00 0.00 0.00 0.00 44.72 43.51 1sft s GLY 278 CO 0.07 -0.88 0.05 -1.59 0.00 0.00 0.00 173.10 170.75 1sft s THR 279 N -1.03 4.70 0.00 0.90 2.01 -0.40 -1.19 115.64 120.63 1sft s THR 279 Ca 0.18 -0.07 0.06 0.00 0.31 0.00 0.00 61.69 62.17 1sft s THR 279 Cb -0.11 -3.11 -0.03 0.00 0.01 0.00 0.00 72.50 69.26 1sft s THR 279 CO 0.09 0.46 -0.17 0.27 -0.69 0.00 0.00 174.62 174.58 1sft s ILE 280 N 0.37 2.85 -1.38 1.82 -4.36 -0.60 -1.19 121.20 118.71 1sft s ILE 280 Ca 0.02 -1.00 -0.07 0.00 -0.26 0.00 0.00 60.65 59.34 1sft s ILE 280 Cb -0.13 -2.15 0.08 0.00 1.25 0.00 0.00 42.46 41.51 1sft s ILE 280 CO 0.00 0.45 2.46 -0.81 0.24 0.00 0.00 174.94 177.28 1sft n PRO 281 N 1.89 4.30 -4.02 0.37 -0.04 -1.26 -2.49 135.00 133.76 1sft n PRO 281 Ca -0.16 -3.20 -0.12 0.00 -0.04 0.00 0.00 63.50 59.98 1sft n PRO 281 Cb 0.52 -2.70 -0.12 0.00 -0.04 0.00 0.00 33.50 31.16 1sft n PRO 281 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1sft s ILE 282 N -0.27 0.29 0.00 0.52 2.07 -0.88 -4.68 121.20 118.24 1sft s ILE 282 Ca 0.56 -0.72 0.00 0.00 -1.41 0.00 0.00 60.65 59.08 1sft s ILE 282 Cb 0.18 -0.36 0.00 0.00 0.13 0.00 0.00 42.46 42.41 1sft s ILE 282 CO -0.08 -0.29 0.00 0.61 -1.91 0.00 0.00 174.94 173.27 1sft n GLY 283 N 1.99 2.81 0.25 1.50 0.00 -1.25 -2.57 105.19 107.92 1sft n GLY 283 Ca -0.20 -0.90 0.13 0.00 0.00 0.00 0.00 46.02 45.06 1sft n GLY 283 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1sft h TYR 284 N 0.35 0.00 0.00 1.61 -0.00 -0.85 -0.68 116.97 117.40 1sft h TYR 284 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1sft h TYR 284 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.73 1sft h TYR 284 CO 0.00 0.13 0.00 0.00 -0.00 0.00 0.00 178.16 178.29 1sft n ALA 285 N -2.18 1.87 1.10 0.10 0.00 -0.63 -1.39 120.51 119.39 1sft n ALA 285 Ca 0.00 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.50 1sft n ALA 285 Cb 0.36 -1.32 0.35 0.00 0.00 0.00 0.00 19.45 18.85 1sft n ALA 285 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1sft n ASP 286 N -1.58 2.06 0.00 0.00 8.00 -0.28 -4.60 116.55 120.16 1sft n ASP 286 Ca 0.04 -1.74 0.00 0.00 0.71 0.00 0.00 54.79 53.80 1sft n ASP 286 Cb 0.23 -0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.23 1sft n ASP 286 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1sft n GLY 287 N 1.22 0.77 3.46 0.44 0.00 -0.48 -2.05 105.19 108.54 1sft n GLY 287 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 1sft n GLY 287 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1sft s TRP 288 N -2.96 3.49 0.74 1.61 -0.11 -1.09 -4.61 118.94 116.00 1sft s TRP 288 Ca 0.00 -2.07 -0.15 0.00 1.22 0.00 0.00 56.10 55.09 1sft s TRP 288 Cb 0.00 -4.29 0.04 0.00 -1.50 0.00 0.00 33.47 27.72 1sft s TRP 288 CO 0.00 -1.39 1.23 -0.51 -4.62 0.00 0.00 176.95 171.66 1sft s LEU 289 N 1.60 3.32 0.56 5.86 1.43 -1.26 -2.67 118.68 127.52 1sft s LEU 289 Ca 0.41 2.44 0.24 0.00 -1.03 0.00 0.00 54.13 56.20 1sft s LEU 289 Cb -0.03 -4.60 1.51 0.00 0.03 0.00 0.00 46.19 43.10 1sft s LEU 289 CO -0.01 -2.36 2.11 0.03 0.23 0.00 0.00 176.35 176.35 1sft h ARG 290 N -0.29 0.00 0.00 1.70 3.08 -1.93 -0.94 114.38 115.99 1sft h ARG 290 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.57 1sft h ARG 290 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.36 1sft h ARG 290 CO 0.49 0.00 0.00 -2.13 -1.07 0.00 0.00 179.97 177.26 1sft n ARG 291 N -4.14 0.05 -0.03 0.04 0.63 -1.26 -2.55 116.66 109.40 1sft n ARG 291 Ca 0.02 0.40 0.07 0.00 -0.92 0.00 0.00 57.85 57.41 1sft n ARG 291 Cb 0.29 -1.62 0.35 0.00 0.45 0.00 0.00 32.46 31.93 1sft n ARG 291 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1sft n LEU 292 N -1.72 0.44 -0.36 6.15 4.77 -0.36 -4.33 117.00 121.60 1sft n LEU 292 Ca 0.02 -0.20 0.26 0.00 -0.03 0.00 0.00 56.01 56.06 1sft n LEU 292 Cb 0.12 -0.04 0.52 0.00 -2.33 0.00 0.00 43.42 41.69 1sft n LEU 292 CO 0.10 0.10 1.18 -0.61 -1.33 0.00 0.00 177.39 176.83 1sft h GLN 293 N 0.55 0.30 -0.64 3.23 4.15 -1.71 -1.23 115.11 119.75 1sft h GLN 293 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.40 1sft h GLN 293 Cb 0.12 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.75 1sft h GLN 293 CO 0.00 0.20 0.00 0.72 -1.93 0.00 0.00 178.83 177.82 1sft n HIS 294 N -4.84 1.58 -3.06 3.99 8.25 -1.26 -4.34 115.22 115.54 1sft n HIS 294 Ca 0.31 -0.60 -0.29 0.00 -0.26 0.00 0.00 57.72 56.88 1sft n HIS 294 Cb 1.05 -0.32 -0.03 0.00 1.12 0.00 0.00 29.99 31.81 1sft n HIS 294 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1sft s PHE 295 N -2.09 3.48 -0.25 4.41 5.36 -0.47 -4.76 117.98 123.66 1sft s PHE 295 Ca 0.49 0.84 -0.14 0.00 -0.96 0.00 0.00 56.93 57.16 1sft s PHE 295 Cb 0.33 -2.28 -0.04 0.00 -0.34 0.00 0.00 43.02 40.70 1sft s PHE 295 CO 0.21 0.01 0.35 -1.01 -1.46 0.00 0.00 175.22 173.32 1sft s HIS 296 N -2.26 3.28 0.61 10.12 3.76 -1.26 -1.67 115.29 127.86 1sft s HIS 296 Ca 0.48 0.42 0.07 0.00 -0.15 0.00 0.00 55.06 55.88 1sft s HIS 296 Cb -0.10 -2.53 0.10 0.00 1.11 0.00 0.00 32.58 31.16 1sft s HIS 296 CO 0.32 -0.15 0.84 0.14 -0.85 0.00 0.00 174.74 175.03 1sft s VAL 297 N 1.81 2.12 -0.14 -0.90 -7.23 -0.48 -4.81 120.40 110.77 1sft s VAL 297 Ca 0.15 -0.91 0.00 0.00 -1.81 0.00 0.00 61.98 59.41 1sft s VAL 297 Cb -0.15 -2.21 -0.01 0.00 0.56 0.00 0.00 36.38 34.57 1sft s VAL 297 CO 0.09 0.00 -0.15 -0.76 -0.31 0.00 0.00 175.10 173.97 1sft s LEU 298 N -4.78 2.54 -0.10 1.32 1.43 -0.11 -0.87 118.68 118.11 1sft s LEU 298 Ca 0.63 -0.42 -0.02 0.00 -1.03 0.00 0.00 54.13 53.30 1sft s LEU 298 Cb -0.05 -1.57 0.04 0.00 0.03 0.00 0.00 46.19 44.63 1sft s LEU 298 CO 0.40 0.13 0.01 -0.69 0.23 0.00 0.00 176.35 176.43 1sft s VAL 299 N 0.56 0.37 -1.25 -1.59 1.01 -0.26 -0.74 120.40 118.51 1sft s VAL 299 Ca -0.09 -0.03 -0.03 0.00 0.00 0.00 0.00 61.98 61.83 1sft s VAL 299 Cb -0.16 -0.63 -0.01 0.00 0.00 0.00 0.00 36.38 35.58 1sft s VAL 299 CO 0.04 0.13 0.76 -0.67 0.00 0.00 0.00 175.10 175.36 1sft n ASP 300 N 5.14 -2.27 0.00 3.32 2.03 -1.26 -2.45 116.55 121.06 1sft n ASP 300 Ca -0.07 -0.81 0.00 0.00 0.52 0.00 0.00 54.79 54.42 1sft n ASP 300 Cb 0.49 -4.20 0.00 0.00 -0.72 0.00 0.00 41.12 36.70 1sft n ASP 300 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1sft n GLY 301 N -1.51 0.72 3.33 0.27 0.00 -1.26 -4.98 105.19 101.77 1sft n GLY 301 Ca -0.25 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.48 1sft n GLY 301 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1sft s GLN 302 N -0.27 1.69 0.27 1.61 1.11 -1.03 -4.63 119.66 118.42 1sft s GLN 302 Ca 0.00 -1.10 -0.30 0.00 0.01 0.00 0.00 55.36 53.97 1sft s GLN 302 Cb 0.00 -1.88 -0.10 0.00 -1.01 0.00 0.00 33.01 30.02 1sft s GLN 302 CO 0.00 0.48 1.41 0.15 0.01 0.00 0.00 175.29 177.34 1sft s LYS 303 N -1.31 4.28 -0.07 2.91 1.02 -1.26 -1.10 119.74 124.20 1sft s LYS 303 Ca 0.11 2.30 -0.03 0.00 0.02 0.00 0.00 55.97 58.37 1sft s LYS 303 Cb -0.10 -3.09 0.04 0.00 -0.52 0.00 0.00 37.83 34.16 1sft s LYS 303 CO 0.02 -0.37 0.15 0.00 -0.92 0.00 0.00 175.35 174.23 1sft s ALA 304 N -0.32 -0.28 0.35 5.17 0.00 -0.05 -4.89 121.76 121.74 1sft s ALA 304 Ca 0.57 0.70 -0.23 0.00 0.00 0.00 0.00 51.96 53.00 1sft s ALA 304 Cb -0.42 -0.50 -0.10 0.00 0.00 0.00 0.00 23.12 22.11 1sft s ALA 304 CO 0.47 -0.19 0.90 -1.25 0.00 0.00 0.00 175.76 175.68 1sft s PRO 305 N 1.27 4.37 -0.16 0.00 0.04 -1.25 -1.38 135.00 137.88 1sft s PRO 305 Ca -0.08 1.14 -0.27 0.00 0.04 0.00 0.00 61.00 61.83 1sft s PRO 305 Cb -0.12 -2.57 -0.01 0.00 0.04 0.00 0.00 34.50 31.85 1sft s PRO 305 CO -0.06 0.18 0.90 0.42 0.04 0.00 0.00 177.00 178.48 1sft s ILE 306 N -1.83 4.83 -0.07 0.56 1.01 -0.67 -0.59 121.20 124.45 1sft s ILE 306 Ca 0.54 1.78 0.02 0.00 0.00 0.00 0.00 60.65 62.99 1sft s ILE 306 Cb -0.14 -4.20 -0.03 0.00 0.01 0.00 0.00 42.46 38.10 1sft s ILE 306 CO 0.19 -0.00 -0.12 0.54 0.00 0.00 0.00 174.94 175.55 1sft s VAL 307 N 2.25 3.23 0.07 2.92 0.11 -0.41 -4.47 120.40 124.09 1sft s VAL 307 Ca 0.41 -0.65 0.00 0.00 -2.93 0.00 0.00 61.98 58.81 1sft s VAL 307 Cb -0.17 -2.29 0.00 0.00 -1.53 0.00 0.00 36.38 32.39 1sft s VAL 307 CO 0.13 0.58 0.00 0.61 -3.33 0.00 0.00 175.10 173.09 1sft n GLY 308 N 2.50 -1.88 3.77 6.54 0.00 -1.26 -4.38 105.19 110.48 1sft n GLY 308 Ca -0.17 -1.45 -0.37 0.00 0.00 0.00 0.00 46.02 44.02 1sft n GLY 308 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sft s ARG 309 N -1.94 3.81 -0.03 1.61 0.52 -1.26 -4.89 118.95 116.77 1sft s ARG 309 Ca 0.00 1.80 -0.27 0.00 -0.52 0.00 0.00 55.73 56.74 1sft s ARG 309 Cb 0.00 -2.46 -0.03 0.00 0.52 0.00 0.00 34.95 32.97 1sft s ARG 309 CO 0.00 -0.51 0.83 0.42 0.02 0.00 0.00 175.30 176.06 1sft s ILE 310 N -1.51 4.96 0.68 1.52 1.01 -1.26 -4.60 121.20 122.00 1sft s ILE 310 Ca 0.62 1.74 0.01 0.00 0.00 0.00 0.00 60.65 63.02 1sft s ILE 310 Cb -0.29 -4.17 0.11 0.00 0.01 0.00 0.00 42.46 38.11 1sft s ILE 310 CO 0.36 0.21 0.94 0.00 0.00 0.00 0.00 174.94 176.44 1sft h MET 312 N -0.36 0.80 0.00 0.00 4.05 -1.93 -1.28 114.93 116.21 1sft h MET 312 Ca -0.36 -0.19 0.00 0.00 -0.28 0.00 0.00 59.70 58.87 1sft h MET 312 Cb 1.27 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 31.97 1sft h MET 312 CO 0.42 0.76 0.00 -0.25 0.23 0.00 0.00 176.91 178.07 1sft n ASP 313 N -4.25 0.29 -3.80 1.39 8.00 -1.26 -1.60 116.55 115.32 1sft n ASP 313 Ca 0.03 -0.80 -0.11 0.00 0.71 0.00 0.00 54.79 54.63 1sft n ASP 313 Cb 0.26 0.10 -0.08 0.00 -0.02 0.00 0.00 41.12 41.38 1sft n ASP 313 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1sft s GLN 314 N -0.10 0.78 0.24 -1.24 -0.21 -1.06 -2.08 119.66 116.00 1sft s GLN 314 Ca 0.00 -0.64 -0.15 0.00 0.02 0.00 0.00 55.36 54.59 1sft s GLN 314 Cb 0.00 0.33 0.00 0.00 1.00 0.00 0.00 33.01 34.35 1sft s GLN 314 CO 0.00 -0.25 0.51 0.00 -2.12 0.00 0.00 175.29 173.44 1sft s MET 316 N -3.98 1.43 0.08 0.00 -1.94 -1.26 -1.55 119.30 112.08 1sft s MET 316 Ca 0.18 -1.30 0.03 0.00 -1.71 0.00 0.00 55.69 52.90 1sft s MET 316 Cb -0.01 -1.87 -0.03 0.00 2.01 0.00 0.00 34.83 34.93 1sft s MET 316 CO 0.06 0.45 -0.09 0.96 -0.01 0.00 0.00 175.02 176.39 1sft s ILE 317 N -1.03 0.78 -0.38 2.53 -4.36 -0.33 -1.28 121.20 117.13 1sft s ILE 317 Ca 0.13 -1.47 -0.14 0.00 -0.26 0.00 0.00 60.65 58.91 1sft s ILE 317 Cb -0.10 -1.13 0.01 0.00 1.25 0.00 0.00 42.46 42.48 1sft s ILE 317 CO 0.05 -0.52 0.27 -0.60 0.24 0.00 0.00 174.94 174.39 1sft s ARG 318 N -2.45 3.18 0.44 0.37 3.52 0.24 -1.28 118.95 122.97 1sft s ARG 318 Ca 0.01 -0.87 -0.23 0.00 -0.13 0.00 0.00 55.73 54.51 1sft s ARG 318 Cb -0.05 -3.90 -0.08 0.00 -1.56 0.00 0.00 34.95 29.36 1sft s ARG 318 CO -0.00 -0.62 1.09 -0.51 -0.81 0.00 0.00 175.30 174.44 1sft s LEU 319 N 1.69 4.04 0.37 -0.88 1.43 -0.86 -3.93 118.68 120.54 1sft s LEU 319 Ca 0.05 2.12 0.05 0.00 -1.03 0.00 0.00 54.13 55.32 1sft s LEU 319 Cb -0.18 -4.28 0.74 0.00 0.03 0.00 0.00 46.19 42.50 1sft s LEU 319 CO 0.10 -0.71 1.99 1.55 0.23 0.00 0.00 176.35 179.51 1sft h PRO 320 N 2.15 0.72 0.00 1.29 0.13 -1.92 -3.42 132.00 130.95 1sft h PRO 320 Ca -0.49 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 1sft h PRO 320 Cb 1.23 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1sft h PRO 320 CO 0.61 0.47 0.00 0.41 -0.23 0.00 0.00 178.00 179.26 1sft n GLY 321 N -1.45 2.03 3.55 1.56 0.00 -1.26 -4.98 105.19 104.64 1sft n GLY 321 Ca 0.08 -0.77 -0.40 0.00 0.00 0.00 0.00 46.02 44.93 1sft n GLY 321 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1sft s PRO 322 N 0.12 3.30 0.20 1.61 0.04 -1.26 -4.82 135.00 134.18 1sft s PRO 322 Ca 0.00 -0.57 -0.06 0.00 0.04 0.00 0.00 61.00 60.41 1sft s PRO 322 Cb 0.00 -4.74 -0.06 0.00 0.04 0.00 0.00 34.50 29.74 1sft s PRO 322 CO 0.00 -2.27 0.46 -0.51 0.04 0.00 0.00 177.00 174.72 1sft s LEU 323 N 5.81 4.19 0.50 -3.56 1.43 -1.26 -5.07 118.68 120.73 1sft s LEU 323 Ca 0.43 0.70 -0.20 0.00 -1.03 0.00 0.00 54.13 54.03 1sft s LEU 323 Cb -0.05 -3.46 -0.07 0.00 0.03 0.00 0.00 46.19 42.64 1sft s LEU 323 CO 0.04 -0.04 1.10 -2.16 0.23 0.00 0.00 176.35 175.52 1sft s PRO 324 N -2.92 3.61 0.19 1.29 0.04 -1.26 -4.91 135.00 131.04 1sft s PRO 324 Ca 0.43 1.55 -0.31 0.00 0.04 0.00 0.00 61.00 62.71 1sft s PRO 324 Cb -0.11 -2.13 -0.10 0.00 0.04 0.00 0.00 34.50 32.20 1sft s PRO 324 CO 0.25 -0.63 1.55 0.08 0.04 0.00 0.00 177.00 178.29 1sft s VAL 325 N -1.80 2.56 0.00 -0.36 1.01 -1.26 -1.57 120.40 118.98 1sft s VAL 325 Ca 0.69 0.42 0.00 0.00 0.00 0.00 0.00 61.98 63.09 1sft s VAL 325 Cb -0.22 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 32.89 1sft s VAL 325 CO 0.26 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.01 1sft n GLY 326 N 3.33 0.72 3.73 4.51 0.00 -0.22 -4.99 105.19 112.27 1sft n GLY 326 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1sft n GLY 326 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sft s THR 327 N -2.00 2.97 0.05 2.61 2.01 -0.61 -4.61 115.64 116.05 1sft s THR 327 Ca 0.00 0.77 -0.31 0.00 0.31 0.00 0.00 61.69 62.46 1sft s THR 327 Cb 0.00 -3.49 -0.05 0.00 0.01 0.00 0.00 72.50 68.96 1sft s THR 327 CO 0.00 0.10 1.22 -0.75 -0.69 0.00 0.00 174.62 174.51 1sft s LYS 328 N 0.18 4.40 -0.18 4.92 2.20 -1.26 -0.31 119.74 129.69 1sft s LYS 328 Ca 0.61 1.79 -0.04 0.00 -0.36 0.00 0.00 55.97 57.97 1sft s LYS 328 Cb -0.39 -3.38 -0.02 0.00 -1.51 0.00 0.00 37.83 32.52 1sft s LYS 328 CO 0.38 -0.31 -0.02 0.08 -0.36 0.00 0.00 175.35 175.11 1sft s VAL 329 N 1.29 3.86 -0.25 4.02 1.01 0.32 -4.16 120.40 126.49 1sft s VAL 329 Ca 0.59 -0.36 -0.09 0.00 0.00 0.00 0.00 61.98 62.12 1sft s VAL 329 Cb -0.29 -2.72 -0.04 0.00 0.00 0.00 0.00 36.38 33.33 1sft s VAL 329 CO 0.28 0.46 0.12 -0.89 0.00 0.00 0.00 175.10 175.07 1sft s THR 330 N 0.73 4.86 -0.10 3.92 2.01 0.08 -0.88 115.64 126.26 1sft s THR 330 Ca -0.01 0.01 0.05 0.00 0.31 0.00 0.00 61.69 62.05 1sft s THR 330 Cb -0.14 -3.28 -0.24 0.00 0.01 0.00 0.00 72.50 68.85 1sft s THR 330 CO 0.02 0.32 0.45 0.18 -0.69 0.00 0.00 174.62 174.90 1sft n LEU 331 N 4.72 1.59 -3.79 4.42 4.32 -0.50 -0.94 117.00 126.82 1sft n LEU 331 Ca -0.15 0.27 -0.22 0.00 -0.02 0.00 0.00 56.01 55.89 1sft n LEU 331 Cb 0.52 -0.35 -0.17 0.00 -1.62 0.00 0.00 43.42 41.80 1sft n LEU 331 CO 0.33 0.61 -0.38 -0.63 -1.22 0.00 0.00 177.39 176.09 1sft s ILE 332 N -2.57 0.36 -5.00 -0.08 1.01 -1.14 -4.89 121.20 108.90 1sft s ILE 332 Ca -0.14 0.09 0.00 0.00 0.00 0.00 0.00 60.65 60.61 1sft s ILE 332 Cb 0.07 -0.50 0.00 0.00 0.01 0.00 0.00 42.46 42.04 1sft s ILE 332 CO 0.79 0.24 0.00 0.61 0.00 0.00 0.00 174.94 176.58 1sft n GLY 333 N 4.90 0.64 3.28 6.18 0.00 0.29 -1.12 105.19 119.37 1sft n GLY 333 Ca -0.11 -1.68 -0.30 0.00 0.00 0.00 0.00 46.02 43.92 1sft n GLY 333 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1sft s ARG 334 N -2.00 2.11 -0.32 1.61 3.52 -1.26 -1.60 118.95 121.01 1sft s ARG 334 Ca 0.00 -0.88 -0.02 0.00 -0.13 0.00 0.00 55.73 54.70 1sft s ARG 334 Cb 0.00 -1.98 0.12 0.00 -1.56 0.00 0.00 34.95 31.54 1sft s ARG 334 CO 0.00 0.50 0.18 -0.65 -0.81 0.00 0.00 175.30 174.52 1sft s GLN 335 N -0.48 0.39 2.36 5.12 -0.21 -0.49 -5.00 119.66 121.34 1sft s GLN 335 Ca 0.07 -0.95 0.00 0.00 0.02 0.00 0.00 55.36 54.50 1sft s GLN 335 Cb -0.10 -1.21 0.00 0.00 1.00 0.00 0.00 33.01 32.69 1sft s GLN 335 CO 0.00 -1.12 0.00 0.41 -2.12 0.00 0.00 175.29 172.46 1sft n GLY 336 N 4.59 0.36 0.11 3.09 0.00 -1.26 -1.53 105.19 110.55 1sft n GLY 336 Ca 0.04 0.64 -0.16 0.00 0.00 0.00 0.00 46.02 46.54 1sft n GLY 336 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1sft h ASP 337 N 0.00 0.31 -3.08 1.61 3.58 -1.94 -3.47 116.42 113.42 1sft h ASP 337 Ca 0.00 -0.50 -0.59 0.00 0.42 0.00 0.00 57.03 56.36 1sft h ASP 337 Cb 0.00 -0.10 -0.04 0.00 1.72 0.00 0.00 39.33 40.91 1sft h ASP 337 CO 0.00 1.43 -0.36 -1.61 -2.88 0.00 0.00 179.24 175.81 1sft s GLU 338 N -2.61 3.56 0.00 0.28 0.41 -0.58 -5.11 118.70 114.66 1sft s GLU 338 Ca -0.10 -0.20 0.01 0.00 -0.41 0.00 0.00 54.97 54.27 1sft s GLU 338 Cb 0.07 -2.90 -0.01 0.00 -1.78 0.00 0.00 34.13 29.51 1sft s GLU 338 CO 0.83 0.50 -0.05 0.54 -0.49 0.00 0.00 175.26 176.60 1sft s VAL 339 N -1.63 0.37 -0.13 2.63 0.11 -1.26 -1.39 120.40 119.10 1sft s VAL 339 Ca 0.39 -0.33 0.03 0.00 -2.93 0.00 0.00 61.98 59.14 1sft s VAL 339 Cb -0.12 -0.34 0.00 0.00 -1.53 0.00 0.00 36.38 34.39 1sft s VAL 339 CO 0.26 0.02 -0.21 -0.63 -3.33 0.00 0.00 175.10 171.20 1sft s ILE 340 N -0.31 2.19 0.41 7.04 1.01 -0.63 -4.99 121.20 125.93 1sft s ILE 340 Ca -0.00 -0.95 0.08 0.00 0.00 0.00 0.00 60.65 59.78 1sft s ILE 340 Cb -0.03 -1.87 -0.02 0.00 0.01 0.00 0.00 42.46 40.55 1sft s ILE 340 CO -0.00 0.55 0.39 -0.94 0.00 0.00 0.00 174.94 174.93 1sft s SER 341 N 0.65 5.11 0.37 3.58 1.04 -1.26 -0.55 113.70 122.64 1sft s SER 341 Ca -0.11 -0.70 0.09 0.00 0.48 0.00 0.00 55.95 55.72 1sft s SER 341 Cb -0.16 -0.60 0.71 0.00 0.10 0.00 0.00 66.02 66.06 1sft s SER 341 CO 0.02 -0.64 1.86 0.40 0.98 0.00 0.00 173.24 175.85 1sft h ILE 342 N 1.01 1.22 0.00 -1.02 2.04 -1.97 -0.90 117.51 117.89 1sft h ILE 342 Ca -0.41 -1.01 -0.02 0.00 1.00 0.00 0.00 64.86 64.41 1sft h ILE 342 Cb 1.27 1.39 -0.00 0.00 -0.74 0.00 0.00 36.82 38.73 1sft h ILE 342 CO 0.56 0.31 -0.10 0.44 0.00 0.00 0.00 178.15 179.36 1sft h ASP 343 N 0.18 0.00 -0.13 1.72 3.32 -1.94 -0.21 116.42 119.36 1sft h ASP 343 Ca 0.03 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.86 1sft h ASP 343 Cb 0.51 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.07 1sft h ASP 343 CO 0.04 0.10 -0.75 0.44 -1.72 0.00 0.00 179.24 177.35 1sft h ASP 344 N 0.00 0.91 -0.36 6.45 3.32 -1.56 -2.23 116.42 122.95 1sft h ASP 344 Ca -0.00 -0.58 -0.12 0.00 0.02 0.00 0.00 57.03 56.34 1sft h ASP 344 Cb 0.22 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1sft h ASP 344 CO 0.01 1.38 -0.26 0.58 -1.72 0.00 0.00 179.24 179.23 1sft h VAL 345 N 0.54 1.29 -0.42 -1.35 2.07 -1.02 -2.97 116.25 114.39 1sft h VAL 345 Ca -0.04 -1.42 -0.05 0.00 0.82 0.00 0.00 66.70 66.01 1sft h VAL 345 Cb 1.37 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 32.53 1sft h VAL 345 CO 0.15 0.47 0.05 0.00 0.02 0.00 0.00 177.57 178.26 1sft h ALA 346 N 0.77 1.31 -0.13 1.67 0.00 -1.06 -1.34 119.26 120.48 1sft h ALA 346 Ca 0.07 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.81 1sft h ALA 346 Cb 0.83 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1sft h ALA 346 CO 0.07 0.48 -0.06 -0.09 0.00 0.00 0.00 179.25 179.65 1sft h ARG 347 N 0.62 -0.04 -0.16 0.00 2.43 -1.26 0.16 114.38 116.13 1sft h ARG 347 Ca 0.14 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.21 1sft h ARG 347 Cb 0.31 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 1sft h ARG 347 CO 0.01 -0.03 -0.32 1.25 -1.51 0.00 0.00 179.97 179.37 1sft h HIS 348 N -0.04 0.37 -0.02 2.20 2.76 -1.30 -1.89 115.15 117.22 1sft h HIS 348 Ca 0.07 -0.08 0.00 0.00 -2.20 0.00 0.00 60.37 58.16 1sft h HIS 348 Cb 0.15 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.02 1sft h HIS 348 CO -0.19 0.61 0.00 1.28 -1.30 0.00 0.00 177.93 178.33 1sft n LEU 349 N -4.09 1.15 -3.73 0.26 4.77 -0.54 -4.90 117.00 109.92 1sft n LEU 349 Ca -0.01 -0.39 -0.25 0.00 -0.03 0.00 0.00 56.01 55.32 1sft n LEU 349 Cb 0.43 -0.01 0.05 0.00 -2.33 0.00 0.00 43.42 41.56 1sft n LEU 349 CO 0.41 0.20 0.12 -0.62 -1.33 0.00 0.00 177.39 176.17 1sft n GLU 350 N -0.09 -6.29 -2.92 3.23 1.02 0.37 -5.00 120.64 110.95 1sft n GLU 350 Ca 0.20 0.70 -0.10 0.00 -0.02 0.00 0.00 57.16 57.93 1sft n GLU 350 Cb 0.29 -5.60 -0.02 0.00 -0.02 0.00 0.00 31.44 26.09 1sft n GLU 350 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1sft n THR 351 N -4.66 0.00 -3.39 2.62 -2.24 -0.14 -5.04 114.28 101.44 1sft n THR 351 Ca -0.06 -0.86 -0.31 0.00 -2.27 0.00 0.00 64.05 60.55 1sft n THR 351 Cb 0.58 0.24 -0.04 0.00 -2.10 0.00 0.00 70.33 69.00 1sft n THR 351 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1sft s ILE 352 N -1.86 4.97 0.50 2.28 -4.36 -1.26 -4.37 121.20 117.11 1sft s ILE 352 Ca 0.03 0.31 0.23 0.00 -0.26 0.00 0.00 60.65 60.97 1sft s ILE 352 Cb 0.00 -3.66 0.40 0.00 1.25 0.00 0.00 42.46 40.45 1sft s ILE 352 CO 0.02 -0.16 1.96 -0.55 0.24 0.00 0.00 174.94 176.45 1sft h ASN 353 N 2.23 0.11 -0.77 4.36 7.08 -1.91 -0.34 115.58 126.34 1sft h ASN 353 Ca -0.47 0.01 0.20 0.00 -3.08 0.00 0.00 56.30 52.96 1sft h ASN 353 Cb 1.18 -0.02 -0.04 0.00 -2.08 0.00 0.00 38.32 37.36 1sft h ASN 353 CO 0.68 0.06 0.54 1.88 -2.08 0.00 0.00 177.43 178.50 1sft h TYR 354 N 0.12 0.19 0.00 4.14 -1.99 -1.96 -0.38 116.97 117.10 1sft h TYR 354 Ca 0.31 0.01 -0.15 0.00 2.00 0.00 0.00 58.73 60.89 1sft h TYR 354 Cb 1.05 -0.06 -0.02 0.00 2.00 0.00 0.00 36.73 39.70 1sft h TYR 354 CO -0.00 0.06 -0.73 1.49 -0.00 0.00 0.00 178.16 178.98 1sft h GLU 355 N 0.15 0.00 0.39 4.88 4.81 -1.47 -3.38 114.58 119.97 1sft h GLU 355 Ca 0.38 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.59 1sft h GLU 355 Cb 1.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 1sft h GLU 355 CO -0.06 0.73 -0.19 0.28 -0.73 0.00 0.00 179.01 179.04 1sft h VAL 356 N 0.00 0.36 0.00 0.32 2.07 -1.18 -2.82 116.25 115.00 1sft h VAL 356 Ca -0.01 -0.64 -0.03 0.00 0.82 0.00 0.00 66.70 66.84 1sft h VAL 356 Cb 1.53 0.56 -0.00 0.00 -1.52 0.00 0.00 31.29 31.86 1sft h VAL 356 CO 0.09 0.08 -0.12 1.55 0.02 0.00 0.00 177.57 179.19 1sft h PRO 357 N -1.01 0.00 -0.19 1.57 0.13 -1.77 -1.53 132.00 129.21 1sft h PRO 357 Ca -0.05 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.05 1sft h PRO 357 Cb 0.53 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.65 1sft h PRO 357 CO 0.09 0.12 -0.01 0.00 -0.23 0.00 0.00 178.00 177.97 1sft h THR 359 N 0.27 0.00 -2.58 0.00 2.02 -1.01 -3.45 112.91 108.17 1sft h THR 359 Ca 0.06 -0.93 -0.55 0.00 0.77 0.00 0.00 66.41 65.76 1sft h THR 359 Cb 0.20 1.51 -0.01 0.00 -1.74 0.00 0.00 68.15 68.11 1sft h THR 359 CO 0.00 0.00 1.12 -0.63 0.37 0.00 0.00 175.52 176.38 1sft s ILE 360 N -3.32 3.51 0.89 3.11 -1.09 -1.09 -3.93 121.20 119.28 1sft s ILE 360 Ca 0.01 0.61 -0.13 0.00 -2.23 0.00 0.00 60.65 58.91 1sft s ILE 360 Cb 0.09 -3.41 0.16 0.00 -1.58 0.00 0.00 42.46 37.72 1sft s ILE 360 CO 0.77 -0.07 1.25 -0.94 -1.23 0.00 0.00 174.94 174.71 1sft s SER 361 N 3.67 3.65 0.56 3.58 1.04 -0.87 -4.93 113.70 120.40 1sft s SER 361 Ca 0.76 0.37 0.30 0.00 0.48 0.00 0.00 55.95 57.86 1sft s SER 361 Cb -0.34 -0.59 1.46 0.00 0.10 0.00 0.00 66.02 66.66 1sft s SER 361 CO 0.31 -2.40 1.89 0.10 0.98 0.00 0.00 173.24 174.12 1sft h TYR 362 N -1.36 0.00 0.00 5.02 -0.00 -1.91 -0.40 116.97 118.32 1sft h TYR 362 Ca -0.44 0.00 -0.00 0.00 -0.00 0.00 0.00 58.73 58.28 1sft h TYR 362 Cb 1.27 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 38.00 1sft h TYR 362 CO -0.63 0.00 -0.02 -0.09 -0.00 0.00 0.00 178.16 177.43 1sft h ARG 363 N 0.00 0.00 -4.73 0.10 2.43 -1.92 -3.35 114.38 106.92 1sft h ARG 363 Ca 0.34 0.00 -0.67 0.00 -0.81 0.00 0.00 59.98 58.83 1sft h ARG 363 Cb 1.49 0.00 -0.19 0.00 -0.42 0.00 0.00 29.97 30.85 1sft h ARG 363 CO -0.00 0.02 -0.49 0.08 -1.51 0.00 0.00 179.97 178.06 1sft s VAL 364 N -4.03 5.23 0.52 0.20 1.01 -0.16 -4.93 120.40 118.24 1sft s VAL 364 Ca -0.03 -0.21 -0.22 0.00 0.00 0.00 0.00 61.98 61.52 1sft s VAL 364 Cb 0.12 -3.68 -0.06 0.00 0.00 0.00 0.00 36.38 32.76 1sft s VAL 364 CO 0.48 0.01 1.23 -2.65 0.00 0.00 0.00 175.10 174.17 1sft n PRO 365 N 5.09 1.54 -3.97 2.72 -0.02 -1.26 -4.71 135.00 134.39 1sft n PRO 365 Ca -0.13 0.57 -0.35 0.00 -2.02 0.00 0.00 63.50 61.57 1sft n PRO 365 Cb 0.50 -2.41 -0.11 0.00 -0.02 0.00 0.00 33.50 31.46 1sft n PRO 365 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1sft s ARG 366 N -2.66 3.87 -0.16 -0.52 3.00 -0.75 0.11 118.95 121.84 1sft s ARG 366 Ca 0.70 -0.39 -0.04 0.00 0.00 0.00 0.00 55.73 55.99 1sft s ARG 366 Cb -0.45 -3.23 -0.03 0.00 0.00 0.00 0.00 34.95 31.24 1sft s ARG 366 CO 0.51 0.14 -0.01 0.42 0.00 0.00 0.00 175.30 176.36 1sft s ILE 367 N 0.72 4.12 -0.08 1.52 1.01 -0.33 -0.68 121.20 127.48 1sft s ILE 367 Ca 0.03 -0.28 -0.01 0.00 0.00 0.00 0.00 60.65 60.40 1sft s ILE 367 Cb -0.13 -2.82 -0.03 0.00 0.01 0.00 0.00 42.46 39.49 1sft s ILE 367 CO 0.02 0.49 -0.02 -0.36 0.00 0.00 0.00 174.94 175.07 1sft s PHE 368 N 0.31 3.09 -0.08 3.97 0.08 0.83 -0.41 117.98 125.76 1sft s PHE 368 Ca -0.02 0.14 0.04 0.00 0.12 0.00 0.00 56.93 57.21 1sft s PHE 368 Cb -0.14 -1.76 0.00 0.00 -0.57 0.00 0.00 43.02 40.56 1sft s PHE 368 CO 0.02 0.43 -0.21 -0.06 -0.10 0.00 0.00 175.22 175.30 1sft s PHE 369 N -0.87 2.23 -0.05 0.36 0.40 -0.31 -1.35 117.98 118.39 1sft s PHE 369 Ca 0.13 -0.84 -0.06 0.00 -0.60 0.00 0.00 56.93 55.55 1sft s PHE 369 Cb -0.11 -1.51 0.01 0.00 0.51 0.00 0.00 43.02 41.92 1sft s PHE 369 CO 0.02 -0.34 0.17 0.50 0.70 0.00 0.00 175.22 176.28 1sft s ARG 370 N 0.31 0.27 -1.59 0.44 6.06 -0.79 -0.64 118.95 123.01 1sft s ARG 370 Ca -0.14 0.11 -0.16 0.00 -2.50 0.00 0.00 55.73 53.04 1sft s ARG 370 Cb -0.16 0.12 0.12 0.00 0.06 0.00 0.00 34.95 35.09 1sft s ARG 370 CO 0.07 -0.04 0.81 0.72 -2.50 0.00 0.00 175.30 174.35 1sft n HIS 371 N 2.66 -1.93 -1.55 5.12 8.25 -1.26 -1.89 115.22 124.62 1sft n HIS 371 Ca -0.15 0.78 -0.18 0.00 -0.26 0.00 0.00 57.72 57.91 1sft n HIS 371 Cb 0.58 -3.25 -0.08 0.00 1.12 0.00 0.00 29.99 28.36 1sft n HIS 371 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1sft n LYS 372 N -4.37 -1.29 -4.21 -0.41 5.02 -1.26 -4.99 118.16 106.65 1sft n LYS 372 Ca 0.06 1.15 -0.18 0.00 -2.02 0.00 0.00 58.31 57.31 1sft n LYS 372 Cb 0.51 -5.43 -0.12 0.00 -0.02 0.00 0.00 35.03 29.97 1sft n LYS 372 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1sft s ARG 373 N -3.59 0.93 -0.09 1.97 0.52 -0.79 -5.09 118.95 112.81 1sft s ARG 373 Ca 0.00 -1.11 -0.30 0.00 -0.52 0.00 0.00 55.73 53.81 1sft s ARG 373 Cb 0.00 -0.88 -0.05 0.00 0.52 0.00 0.00 34.95 34.54 1sft s ARG 373 CO 0.00 0.18 1.62 0.42 0.02 0.00 0.00 175.30 177.54 1sft s ILE 374 N -1.72 3.65 -0.18 1.52 1.01 -1.26 -1.88 121.20 122.34 1sft s ILE 374 Ca 0.04 0.78 -0.15 0.00 0.00 0.00 0.00 60.65 61.32 1sft s ILE 374 Cb -0.07 -3.53 -0.10 0.00 0.01 0.00 0.00 42.46 38.77 1sft s ILE 374 CO 0.03 -0.10 -0.07 0.80 0.00 0.00 0.00 174.94 175.60 1sft n MET 375 N 7.17 0.51 -3.69 2.79 1.56 -0.45 -4.95 117.12 120.05 1sft n MET 375 Ca 0.17 0.50 -0.14 0.00 -0.27 0.00 0.00 57.70 57.96 1sft n MET 375 Cb 0.43 -1.68 -0.08 0.00 2.15 0.00 0.00 33.22 34.04 1sft n MET 375 CO 0.00 0.00 0.00 -2.00 -0.73 0.00 0.00 175.97 173.24 1sft s GLU 376 N -2.36 0.75 -0.18 2.12 2.12 -1.17 -5.00 118.70 114.98 1sft s GLU 376 Ca -0.23 0.03 -0.04 0.00 0.36 0.00 0.00 54.97 55.09 1sft s GLU 376 Cb 0.05 0.34 -0.02 0.00 0.26 0.00 0.00 34.13 34.76 1sft s GLU 376 CO 0.39 -0.21 -0.04 0.08 -0.54 0.00 0.00 175.26 174.95 1sft s VAL 377 N -1.09 3.75 -0.38 3.70 1.01 -1.26 -0.12 120.40 126.01 1sft s VAL 377 Ca -0.11 -0.39 -0.06 0.00 0.00 0.00 0.00 61.98 61.42 1sft s VAL 377 Cb -0.04 -2.66 0.08 0.00 0.00 0.00 0.00 36.38 33.76 1sft s VAL 377 CO 0.05 0.47 0.18 -0.60 0.00 0.00 0.00 175.10 175.20 1sft s ARG 378 N 0.72 2.40 -0.33 2.72 3.52 0.14 -3.20 118.95 124.92 1sft s ARG 378 Ca -0.02 -1.49 -0.05 0.00 -0.13 0.00 0.00 55.73 54.04 1sft s ARG 378 Cb -0.14 -3.58 0.04 0.00 -1.56 0.00 0.00 34.95 29.71 1sft s ARG 378 CO 0.02 -0.89 0.08 1.21 -0.81 0.00 0.00 175.30 174.91 1sft s ASN 379 N 1.79 5.20 0.51 -2.12 3.04 -1.26 -1.80 114.94 120.30 1sft s ASN 379 Ca 0.02 -1.20 0.22 0.00 0.04 0.00 0.00 52.86 51.94 1sft s ASN 379 Cb -0.22 -1.83 1.37 0.00 -1.54 0.00 0.00 41.25 39.03 1sft s ASN 379 CO -0.00 -0.32 2.10 0.00 -3.04 0.00 0.00 177.10 175.84 1sft h ALA 380 N 8.16 1.58 -0.01 1.71 0.00 -1.89 -3.49 119.26 125.31 1sft h ALA 380 Ca -0.22 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1sft h ALA 380 Cb 1.08 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1sft h ALA 380 CO 0.59 0.12 0.00 0.44 0.00 0.00 0.00 179.25 180.40