#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ews s LYS 2 N 0.00 2.19 -0.09 3.17 1.02 0.13 -1.13 119.74 125.03 2ews s LYS 2 Ca 0.00 -0.89 0.02 0.00 0.02 0.00 0.00 55.97 55.12 2ews s LYS 2 Cb 0.00 -2.19 0.01 0.00 -0.52 0.00 0.00 37.83 35.13 2ews s LYS 2 CO 0.00 0.57 -0.14 0.08 -0.92 0.00 0.00 175.35 174.94 2ews s VAL 3 N -0.78 1.39 -0.14 3.17 1.01 -0.20 -0.71 120.40 124.14 2ews s VAL 3 Ca 0.12 -0.59 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 2ews s VAL 3 Cb -0.10 -1.27 -0.01 0.00 0.00 0.00 0.00 36.38 35.00 2ews s VAL 3 CO 0.02 0.42 -0.12 -0.83 0.00 0.00 0.00 175.10 174.59 2ews s GLY 4 N 0.87 1.55 -0.04 4.51 0.00 -0.25 -0.53 107.32 113.43 2ews s GLY 4 Ca -0.10 -0.94 0.03 0.00 0.00 0.00 0.00 44.72 43.71 2ews s GLY 4 CO 0.01 -0.08 -0.10 -0.42 0.00 0.00 0.00 173.10 172.50 2ews s ILE 5 N 0.54 0.90 -0.37 0.90 1.01 0.37 -0.31 121.20 124.24 2ews s ILE 5 Ca -0.08 -0.41 -0.01 0.00 0.00 0.00 0.00 60.65 60.15 2ews s ILE 5 Cb -0.16 -0.81 0.09 0.00 0.01 0.00 0.00 42.46 41.60 2ews s ILE 5 CO 0.04 0.28 0.13 -0.62 0.00 0.00 0.00 174.94 174.76 2ews s ASP 6 N 0.30 5.08 -0.90 3.58 -1.08 0.32 -0.57 116.67 123.39 2ews s ASP 6 Ca -0.06 -1.85 -0.14 0.00 -0.52 0.00 0.00 52.55 49.98 2ews s ASP 6 Cb -0.10 -1.77 0.21 0.00 -1.46 0.00 0.00 42.92 39.80 2ews s ASP 6 CO 0.01 -0.44 0.89 0.00 0.52 0.00 0.00 175.17 176.15 2ews s ALA 7 N 1.13 4.07 0.95 3.66 0.00 0.58 -0.91 121.76 131.24 2ews s ALA 7 Ca 0.05 -3.32 -0.13 0.00 0.00 0.00 0.00 51.96 48.56 2ews s ALA 7 Cb -0.21 -3.63 0.21 0.00 0.00 0.00 0.00 23.12 19.48 2ews s ALA 7 CO -0.04 -2.39 1.25 0.41 0.00 0.00 0.00 175.76 174.98 2ews n GLY 8 N 4.02 -1.09 0.27 0.00 0.00 -0.72 -0.10 105.19 107.57 2ews n GLY 8 Ca 0.18 -1.77 0.17 0.00 0.00 0.00 0.00 46.02 44.60 2ews n GLY 8 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2ews h GLY 9 N -1.51 0.00 0.00 -0.02 0.00 -1.96 -3.38 103.07 96.21 2ews h GLY 9 Ca -0.40 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.88 2ews h GLY 9 CO 0.31 0.00 -1.13 2.41 0.00 0.00 0.00 176.54 178.13 2ews n THR 10 N -3.04 0.16 -4.38 4.70 -1.04 -1.26 -4.81 114.28 104.61 2ews n THR 10 Ca 0.01 -0.03 -0.29 0.00 -2.04 0.00 0.00 64.05 61.70 2ews n THR 10 Cb 0.31 -1.54 -0.13 0.00 -1.82 0.00 0.00 70.33 67.15 2ews n THR 10 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2ews s LEU 11 N -6.15 2.38 -0.27 -4.42 1.43 -1.26 -0.70 118.68 109.69 2ews s LEU 11 Ca -0.04 -0.73 -0.04 0.00 -1.03 0.00 0.00 54.13 52.30 2ews s LEU 11 Cb 0.01 -1.27 0.02 0.00 0.03 0.00 0.00 46.19 44.99 2ews s LEU 11 CO 0.04 0.18 0.00 -0.63 0.23 0.00 0.00 176.35 176.17 2ews s ILE 12 N -1.10 3.34 -0.21 -0.59 1.01 0.22 -1.76 121.20 122.12 2ews s ILE 12 Ca 0.15 -0.91 -0.12 0.00 0.00 0.00 0.00 60.65 59.77 2ews s ILE 12 Cb -0.10 -2.72 -0.05 0.00 0.01 0.00 0.00 42.46 39.60 2ews s ILE 12 CO 0.07 0.13 0.22 -0.54 0.00 0.00 0.00 174.94 174.82 2ews s LYS 13 N 1.39 4.16 -0.08 2.79 3.01 -0.09 -0.94 119.74 129.99 2ews s LYS 13 Ca 0.01 -0.09 0.04 0.00 -1.01 0.00 0.00 55.97 54.92 2ews s LYS 13 Cb -0.17 -3.48 -0.00 0.00 -1.01 0.00 0.00 37.83 33.17 2ews s LYS 13 CO -0.01 0.14 -0.22 0.42 0.51 0.00 0.00 175.35 176.19 2ews s ILE 14 N 0.79 1.87 -0.21 2.17 1.01 0.95 -0.52 121.20 127.26 2ews s ILE 14 Ca 0.12 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 59.86 2ews s ILE 14 Cb -0.13 -1.62 0.03 0.00 0.01 0.00 0.00 42.46 40.76 2ews s ILE 14 CO 0.03 0.52 -0.16 -0.69 0.00 0.00 0.00 174.94 174.64 2ews s VAL 15 N 0.25 2.06 -0.18 2.92 1.01 0.58 -0.76 120.40 126.29 2ews s VAL 15 Ca -0.14 -1.16 -0.09 0.00 0.00 0.00 0.00 61.98 60.58 2ews s VAL 15 Cb -0.16 -1.98 -0.05 0.00 0.00 0.00 0.00 36.38 34.19 2ews s VAL 15 CO 0.07 0.33 0.14 -1.10 0.00 0.00 0.00 175.10 174.54 2ews s GLN 16 N 1.24 4.00 -0.05 2.72 -0.21 -0.04 -1.09 119.66 126.23 2ews s GLN 16 Ca 0.00 -0.17 0.04 0.00 0.02 0.00 0.00 55.36 55.24 2ews s GLN 16 Cb -0.15 -3.36 0.00 0.00 1.00 0.00 0.00 33.01 30.49 2ews s GLN 16 CO -0.10 0.42 -0.17 -2.00 -2.12 0.00 0.00 175.29 171.33 2ews s GLU 17 N 0.00 1.84 -0.28 2.91 2.12 0.11 0.05 118.70 125.45 2ews s GLU 17 Ca 0.10 -0.58 -0.22 0.00 0.36 0.00 0.00 54.97 54.63 2ews s GLU 17 Cb -0.11 -1.56 0.12 0.00 0.26 0.00 0.00 34.13 32.83 2ews s GLU 17 CO -0.00 0.19 0.94 -1.14 -0.54 0.00 0.00 175.26 174.71 2ews s GLN 18 N 0.18 0.53 -1.37 4.30 0.74 -0.75 -0.69 119.66 122.60 2ews s GLN 18 Ca -0.07 0.74 -0.06 0.00 0.05 0.00 0.00 55.36 56.02 2ews s GLN 18 Cb -0.13 0.21 0.03 0.00 1.10 0.00 0.00 33.01 34.23 2ews s GLN 18 CO 0.03 -0.08 0.44 -0.25 -0.55 0.00 0.00 175.29 174.88 2ews n ASP 19 N 2.91 -4.71 -3.42 6.67 8.00 -1.26 -1.83 116.55 122.91 2ews n ASP 19 Ca -0.15 -0.25 -0.20 0.00 0.71 0.00 0.00 54.79 54.90 2ews n ASP 19 Cb 0.57 -3.87 0.06 0.00 -0.02 0.00 0.00 41.12 37.86 2ews n ASP 19 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2ews n ASN 20 N -2.29 -5.06 -3.53 -2.24 3.02 -1.26 -5.01 115.26 98.89 2ews n ASN 20 Ca -0.08 -0.78 -0.02 0.00 -0.03 0.00 0.00 54.58 53.67 2ews n ASN 20 Cb 0.59 -4.68 -0.05 0.00 -0.61 0.00 0.00 39.78 35.03 2ews n ASN 20 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2ews s GLN 21 N -5.05 0.50 -0.09 3.52 -0.21 -0.76 -5.16 119.66 112.40 2ews s GLN 21 Ca 0.34 1.19 -0.01 0.00 0.02 0.00 0.00 55.36 56.90 2ews s GLN 21 Cb -0.07 0.57 -0.03 0.00 1.00 0.00 0.00 33.01 34.48 2ews s GLN 21 CO 0.77 -0.34 -0.04 -0.98 -2.12 0.00 0.00 175.29 172.58 2ews s ARG 22 N 2.79 2.97 -0.10 2.91 1.70 -1.26 -1.81 118.95 126.16 2ews s ARG 22 Ca 0.02 -0.50 -0.00 0.00 -0.47 0.00 0.00 55.73 54.78 2ews s ARG 22 Cb -0.13 -2.70 -0.03 0.00 -0.57 0.00 0.00 34.95 31.52 2ews s ARG 22 CO -0.18 0.60 -0.08 0.99 -1.08 0.00 0.00 175.30 175.56 2ews s THR 23 N -0.63 3.61 -0.08 4.99 2.01 0.11 -4.94 115.64 120.70 2ews s THR 23 Ca 0.10 -0.49 -0.04 0.00 0.31 0.00 0.00 61.69 61.56 2ews s THR 23 Cb -0.12 -2.50 -0.04 0.00 0.01 0.00 0.00 72.50 69.85 2ews s THR 23 CO 0.02 0.56 0.10 -0.36 -0.69 0.00 0.00 174.62 174.25 2ews s PHE 24 N -0.34 3.44 -0.08 4.92 0.40 -1.26 -0.86 117.98 124.20 2ews s PHE 24 Ca 0.05 0.38 -0.08 0.00 -0.60 0.00 0.00 56.93 56.67 2ews s PHE 24 Cb -0.12 -1.86 0.02 0.00 0.51 0.00 0.00 43.02 41.57 2ews s PHE 24 CO 0.02 0.64 0.23 0.15 0.70 0.00 0.00 175.22 176.96 2ews s LYS 25 N -1.20 0.29 -0.04 0.44 1.02 0.06 -5.01 119.74 115.30 2ews s LYS 25 Ca 0.17 0.28 0.04 0.00 0.02 0.00 0.00 55.97 56.49 2ews s LYS 25 Cb -0.12 0.14 -0.00 0.00 -0.52 0.00 0.00 37.83 37.33 2ews s LYS 25 CO 0.07 -0.04 -0.17 0.99 -0.92 0.00 0.00 175.35 175.28 2ews s THR 26 N 0.03 1.41 0.08 2.17 2.01 -1.26 -0.04 115.64 120.04 2ews s THR 26 Ca -0.01 -0.71 0.02 0.00 0.31 0.00 0.00 61.69 61.31 2ews s THR 26 Cb -0.02 -1.22 -0.03 0.00 0.01 0.00 0.00 72.50 71.24 2ews s THR 26 CO 0.00 0.41 -0.08 -1.61 -0.69 0.00 0.00 174.62 172.65 2ews s GLU 27 N 0.04 0.73 0.41 4.92 0.41 -0.12 -4.99 118.70 120.10 2ews s GLU 27 Ca -0.04 -1.09 -0.23 0.00 -0.41 0.00 0.00 54.97 53.21 2ews s GLU 27 Cb -0.11 -0.31 -0.10 0.00 -1.78 0.00 0.00 34.13 31.83 2ews s GLU 27 CO 0.02 0.03 0.99 -0.51 -0.49 0.00 0.00 175.26 175.30 2ews s LEU 28 N -2.38 4.06 0.51 1.80 1.43 -1.26 0.71 118.68 123.56 2ews s LEU 28 Ca 0.03 1.85 0.28 0.00 -1.03 0.00 0.00 54.13 55.26 2ews s LEU 28 Cb -0.02 -4.34 1.35 0.00 0.03 0.00 0.00 46.19 43.21 2ews s LEU 28 CO -0.02 -0.40 2.01 0.74 0.23 0.00 0.00 176.35 178.91 2ews h THR 29 N 2.07 0.45 0.00 5.49 2.02 -1.21 -1.42 112.91 120.31 2ews h THR 29 Ca -0.48 -0.67 0.00 0.00 0.77 0.00 0.00 66.41 66.03 2ews h THR 29 Cb 1.20 1.47 0.00 0.00 -1.74 0.00 0.00 68.15 69.08 2ews h THR 29 CO 0.62 0.13 0.00 0.07 0.37 0.00 0.00 175.52 176.70 2ews h LYS 30 N 0.00 0.00 -0.67 6.66 2.10 -1.91 -2.21 116.57 120.55 2ews h LYS 30 Ca -0.00 0.00 -0.33 0.00 -2.00 0.00 0.00 60.65 58.32 2ews h LYS 30 Cb 0.46 0.00 -0.19 0.00 -0.90 0.00 0.00 32.23 31.59 2ews h LYS 30 CO 0.02 0.00 0.28 0.09 -2.00 0.00 0.00 179.45 177.83 2ews n ASN 31 N -3.04 3.29 -0.24 7.07 3.02 -0.54 -4.68 115.26 120.15 2ews n ASN 31 Ca -0.00 -3.63 0.09 0.00 -0.03 0.00 0.00 54.58 51.01 2ews n ASN 31 Cb 0.24 -0.73 0.35 0.00 -0.61 0.00 0.00 39.78 39.03 2ews n ASN 31 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 2ews h ILE 32 N 1.18 0.94 0.00 2.41 2.10 -1.44 -0.71 117.51 121.99 2ews h ILE 32 Ca 0.40 -0.26 -0.02 0.00 1.08 0.00 0.00 64.86 66.06 2ews h ILE 32 Cb 2.25 0.12 -0.00 0.00 -1.09 0.00 0.00 36.82 38.10 2ews h ILE 32 CO 0.73 0.14 -0.09 0.44 -1.08 0.00 0.00 178.15 178.29 2ews h ASP 33 N 0.76 0.00 0.16 2.19 3.32 -1.86 -0.37 116.42 120.62 2ews h ASP 33 Ca 0.38 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.29 2ews h ASP 33 Cb 0.46 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 2ews h ASP 33 CO -0.15 0.09 -0.53 -0.61 -1.72 0.00 0.00 179.24 176.31 2ews h GLN 34 N 0.00 0.40 -0.27 3.56 4.15 -1.50 -1.20 115.11 120.25 2ews h GLN 34 Ca -0.00 -0.25 -0.14 0.00 0.77 0.00 0.00 58.65 59.03 2ews h GLN 34 Cb 0.16 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.87 2ews h GLN 34 CO 0.01 0.83 -0.42 0.28 -1.93 0.00 0.00 178.83 177.60 2ews h VAL 35 N 0.31 1.30 0.07 2.39 2.07 -0.94 -1.41 116.25 120.04 2ews h VAL 35 Ca 0.01 -1.60 -0.00 0.00 0.82 0.00 0.00 66.70 65.92 2ews h VAL 35 Cb 1.04 1.54 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 2ews h VAL 35 CO 0.09 0.51 -0.03 0.58 0.02 0.00 0.00 177.57 178.74 2ews h VAL 36 N 0.54 0.99 -0.68 2.57 2.07 -0.75 -1.19 116.25 119.80 2ews h VAL 36 Ca 0.04 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.38 2ews h VAL 36 Cb 0.96 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 2ews h VAL 36 CO 0.09 0.05 0.43 -0.08 0.02 0.00 0.00 177.57 178.08 2ews h GLU 37 N -0.19 0.83 -0.83 1.57 4.57 -1.14 -1.86 114.58 117.54 2ews h GLU 37 Ca -0.01 -0.05 0.05 0.00 -1.18 0.00 0.00 59.36 58.17 2ews h GLU 37 Cb 0.16 -0.19 -0.06 0.00 -0.16 0.00 0.00 28.75 28.50 2ews h GLU 37 CO 0.02 0.55 0.52 2.35 -1.18 0.00 0.00 179.01 181.26 2ews h TRP 38 N 0.86 0.96 -0.46 0.92 7.01 -1.07 -2.34 115.95 121.82 2ews h TRP 38 Ca 0.26 0.03 -0.05 0.00 2.11 0.00 0.00 58.89 61.24 2ews h TRP 38 Cb -0.03 -0.31 -0.02 0.00 -2.10 0.00 0.00 29.16 26.70 2ews h TRP 38 CO -0.04 0.51 0.10 -0.07 -2.79 0.00 0.00 178.44 176.15 2ews h LEU 39 N 0.97 0.71 -1.78 0.65 3.38 -0.57 -3.03 115.31 115.64 2ews h LEU 39 Ca 0.35 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 2ews h LEU 39 Cb 0.10 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 2ews h LEU 39 CO -0.15 0.77 -0.09 0.78 0.09 0.00 0.00 178.44 179.84 2ews h ASN 40 N 0.62 0.00 -0.49 -0.43 2.35 -0.93 -2.31 115.58 114.39 2ews h ASN 40 Ca 0.14 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 2ews h ASN 40 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.72 2ews h ASN 40 CO 0.00 0.09 0.00 0.00 -1.65 0.00 0.00 177.43 175.88 2ews n GLN 41 N -3.36 3.92 -4.48 0.81 6.02 -0.92 -4.90 117.38 114.47 2ews n GLN 41 Ca -0.01 -2.50 -0.24 0.00 -0.01 0.00 0.00 57.00 54.24 2ews n GLN 41 Cb 0.27 -2.03 -0.13 0.00 1.02 0.00 0.00 30.24 29.36 2ews n GLN 41 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 2ews s GLN 42 N -2.26 1.23 -0.40 -1.09 2.00 -0.87 -5.07 119.66 113.20 2ews s GLN 42 Ca 0.44 -0.99 -0.17 0.00 -2.00 0.00 0.00 55.36 52.63 2ews s GLN 42 Cb 0.32 -1.38 0.01 0.00 0.80 0.00 0.00 33.01 32.76 2ews s GLN 42 CO 0.15 0.34 0.45 -1.14 -0.50 0.00 0.00 175.29 174.59 2ews s GLN 43 N -1.42 3.24 -0.11 1.67 2.00 -1.26 -5.00 119.66 118.77 2ews s GLN 43 Ca 0.06 -0.61 0.03 0.00 -2.00 0.00 0.00 55.36 52.84 2ews s GLN 43 Cb -0.09 -3.92 -0.00 0.00 0.80 0.00 0.00 33.01 29.79 2ews s GLN 43 CO 0.03 -0.79 -0.22 0.42 -0.50 0.00 0.00 175.29 174.22 2ews s ILE 44 N 2.21 2.19 0.01 -2.34 1.01 -1.26 -4.22 121.20 118.80 2ews s ILE 44 Ca 0.14 -0.96 -0.27 0.00 0.00 0.00 0.00 60.65 59.56 2ews s ILE 44 Cb -0.17 -1.86 -0.15 0.00 0.01 0.00 0.00 42.46 40.30 2ews s ILE 44 CO 0.14 0.55 1.15 -0.08 0.00 0.00 0.00 174.94 176.70 2ews h GLU 45 N 6.84 -0.82 -4.06 2.79 4.57 -1.54 -3.46 114.58 118.90 2ews h GLU 45 Ca -0.23 0.06 -0.30 0.00 -1.18 0.00 0.00 59.36 57.71 2ews h GLU 45 Cb 1.23 0.19 -0.29 0.00 -0.16 0.00 0.00 28.75 29.71 2ews h GLU 45 CO 0.50 -0.51 -0.74 0.15 -1.18 0.00 0.00 179.01 177.22 2ews s LYS 46 N -4.72 0.30 -0.17 1.92 -0.14 -1.25 -5.06 119.74 110.63 2ews s LYS 46 Ca -0.14 -0.10 0.01 0.00 -1.36 0.00 0.00 55.97 54.38 2ews s LYS 46 Cb 0.02 -0.32 0.01 0.00 -1.68 0.00 0.00 37.83 35.86 2ews s LYS 46 CO 0.45 0.04 -0.19 -1.17 -0.76 0.00 0.00 175.35 173.72 2ews s LEU 47 N 0.10 2.21 -0.11 3.17 2.96 -1.26 -1.03 118.68 124.72 2ews s LEU 47 Ca -0.01 -0.60 0.03 0.00 -0.22 0.00 0.00 54.13 53.33 2ews s LEU 47 Cb -0.03 -1.50 -0.00 0.00 0.50 0.00 0.00 46.19 45.16 2ews s LEU 47 CO -0.00 0.03 -0.22 0.00 -1.32 0.00 0.00 176.35 174.84 2ews s LEU 49 N 0.41 2.48 0.31 0.00 1.43 0.87 -0.48 118.68 123.70 2ews s LEU 49 Ca -0.16 -0.91 -0.19 0.00 -1.03 0.00 0.00 54.13 51.84 2ews s LEU 49 Cb -0.17 -0.86 0.03 0.00 0.03 0.00 0.00 46.19 45.21 2ews s LEU 49 CO 0.07 -0.04 0.72 0.28 0.23 0.00 0.00 176.35 177.61 2ews s THR 50 N -2.25 0.00 0.00 5.49 -1.32 0.26 -0.82 115.64 117.00 2ews s THR 50 Ca 0.19 -1.03 0.00 0.00 -1.21 0.00 0.00 61.69 59.64 2ews s THR 50 Cb -0.05 -2.25 0.00 0.00 -1.51 0.00 0.00 72.50 68.69 2ews s THR 50 CO 0.08 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.10 2ews n GLY 51 N -0.48 2.04 0.29 6.08 0.00 -1.26 -0.30 105.19 111.56 2ews n GLY 51 Ca -0.05 -1.92 0.20 0.00 0.00 0.00 0.00 46.02 44.24 2ews n GLY 51 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2ews h GLY 52 N 0.00 0.00 -2.06 -0.02 0.00 -1.82 -2.66 103.07 96.51 2ews h GLY 52 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2ews h GLY 52 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.24 2ews n ASN 53 N -2.93 4.10 -0.32 0.19 3.02 0.86 -4.57 115.26 115.60 2ews n ASN 53 Ca -0.02 -2.69 -0.02 0.00 -0.03 0.00 0.00 54.58 51.83 2ews n ASN 53 Cb 0.13 -0.50 0.11 0.00 -0.61 0.00 0.00 39.78 38.90 2ews n ASN 53 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ews h ALA 54 N 2.57 1.14 -0.86 5.41 0.00 -1.62 -2.47 119.26 123.43 2ews h ALA 54 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2ews h ALA 54 Cb 1.37 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 2ews h ALA 54 CO 0.21 0.43 0.51 0.78 0.00 0.00 0.00 179.25 181.18 2ews h GLY 55 N 1.11 1.25 1.11 0.00 0.00 -1.83 -0.20 103.07 104.50 2ews h GLY 55 Ca 0.34 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 2ews h GLY 55 CO -0.11 0.51 0.54 -2.08 0.00 0.00 0.00 176.54 175.40 2ews h VAL 56 N 1.18 1.24 -0.06 4.60 2.07 -1.77 -1.21 116.25 122.30 2ews h VAL 56 Ca 0.31 -0.50 -0.20 0.00 0.82 0.00 0.00 66.70 67.12 2ews h VAL 56 Cb -0.03 -0.01 0.01 0.00 -1.52 0.00 0.00 31.29 29.73 2ews h VAL 56 CO -0.06 0.25 -0.75 0.40 0.02 0.00 0.00 177.57 177.43 2ews h ILE 57 N 1.21 1.33 -0.43 4.57 2.04 -1.33 -3.31 117.51 121.58 2ews h ILE 57 Ca 0.32 -2.04 -0.01 0.00 1.00 0.00 0.00 64.86 64.13 2ews h ILE 57 Cb -0.07 2.30 -0.02 0.00 -0.74 0.00 0.00 36.82 38.29 2ews h ILE 57 CO -0.06 0.62 0.24 0.00 0.00 0.00 0.00 178.15 178.96 2ews h ALA 58 N 0.43 0.55 0.00 1.87 0.00 -0.69 -2.79 119.26 118.64 2ews h ALA 58 Ca -0.08 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2ews h ALA 58 Cb 1.41 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2ews h ALA 58 CO 0.15 0.07 0.00 -0.85 0.00 0.00 0.00 179.25 178.62 2ews n GLU 59 N -4.72 0.44 -0.01 0.00 0.28 -0.49 -3.25 120.64 112.89 2ews n GLU 59 Ca 0.01 0.05 0.00 0.00 -0.16 0.00 0.00 57.16 57.06 2ews n GLU 59 Cb 0.07 -1.50 0.01 0.00 1.43 0.00 0.00 31.44 31.45 2ews n GLU 59 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2ews n ASN 60 N -1.20 1.87 -4.91 -1.84 3.02 -1.07 -5.05 115.26 106.08 2ews n ASN 60 Ca 0.13 -1.83 -0.23 0.00 -0.03 0.00 0.00 54.58 52.62 2ews n ASN 60 Cb 0.15 -0.01 -0.01 0.00 -0.61 0.00 0.00 39.78 39.31 2ews n ASN 60 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2ews s ILE 61 N -0.83 2.11 -0.18 2.41 -4.36 -1.12 -4.97 121.20 114.26 2ews s ILE 61 Ca 0.01 -1.37 0.17 0.00 -0.26 0.00 0.00 60.65 59.20 2ews s ILE 61 Cb 0.01 -2.48 0.51 0.00 1.25 0.00 0.00 42.46 41.74 2ews s ILE 61 CO 0.01 0.00 1.40 -0.46 0.24 0.00 0.00 174.94 176.13 2ews n ASN 62 N -1.74 3.70 -4.14 4.36 0.23 -1.26 -4.99 115.26 111.42 2ews n ASN 62 Ca 0.03 -3.05 -0.12 0.00 -0.53 0.00 0.00 54.58 50.91 2ews n ASN 62 Cb 0.63 -0.54 -0.11 0.00 -2.08 0.00 0.00 39.78 37.69 2ews n ASN 62 CO 0.00 0.00 0.00 0.27 -0.93 0.00 0.00 177.26 176.60 2ews s ILE 63 N -2.85 0.68 0.85 1.53 -4.36 -1.26 -5.15 121.20 110.64 2ews s ILE 63 Ca 0.41 -1.62 -0.11 0.00 -0.26 0.00 0.00 60.65 59.08 2ews s ILE 63 Cb 0.34 -1.29 0.10 0.00 1.25 0.00 0.00 42.46 42.86 2ews s ILE 63 CO 0.08 -0.67 1.09 -2.16 0.24 0.00 0.00 174.94 173.52 2ews s PRO 64 N -2.96 1.64 -0.06 0.37 0.04 -1.26 -5.05 135.00 127.72 2ews s PRO 64 Ca 0.04 1.01 -0.05 0.00 0.04 0.00 0.00 61.00 62.04 2ews s PRO 64 Cb -0.01 -1.84 0.02 0.00 0.04 0.00 0.00 34.50 32.71 2ews s PRO 64 CO -0.02 -2.03 0.15 0.00 0.04 0.00 0.00 177.00 175.14 2ews s ALA 65 N -2.90 -0.35 -0.24 8.56 0.00 -1.26 -4.58 121.76 120.98 2ews s ALA 65 Ca 0.63 0.50 -0.19 0.00 0.00 0.00 0.00 51.96 52.90 2ews s ALA 65 Cb -0.18 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.61 2ews s ALA 65 CO 0.57 -0.10 0.58 -0.65 0.00 0.00 0.00 175.76 176.16 2ews s GLN 66 N 0.38 4.12 -0.09 0.00 -0.21 -0.65 -4.95 119.66 118.28 2ews s GLN 66 Ca -0.03 0.47 -0.02 0.00 0.02 0.00 0.00 55.36 55.80 2ews s GLN 66 Cb -0.04 -3.63 -0.03 0.00 1.00 0.00 0.00 33.01 30.31 2ews s GLN 66 CO -0.02 -0.33 0.02 0.42 -2.12 0.00 0.00 175.29 173.26 2ews s ILE 67 N 2.24 4.44 0.12 1.08 1.01 -1.26 -0.09 121.20 128.74 2ews s ILE 67 Ca 0.25 -0.20 0.06 0.00 0.00 0.00 0.00 60.65 60.76 2ews s ILE 67 Cb -0.16 -2.87 -0.04 0.00 0.01 0.00 0.00 42.46 39.40 2ews s ILE 67 CO 0.09 0.60 -0.15 -0.36 0.00 0.00 0.00 174.94 175.13 2ews s PHE 68 N -0.90 1.46 0.07 3.97 0.40 0.00 -4.94 117.98 118.04 2ews s PHE 68 Ca 0.14 -0.53 -0.31 0.00 -0.60 0.00 0.00 56.93 55.63 2ews s PHE 68 Cb -0.11 -0.76 -0.07 0.00 0.51 0.00 0.00 43.02 42.58 2ews s PHE 68 CO 0.03 0.16 1.44 0.08 0.70 0.00 0.00 175.22 177.63 2ews s VAL 69 N -2.00 3.37 0.27 -0.44 1.01 -1.26 -4.43 120.40 116.91 2ews s VAL 69 Ca 0.09 0.90 -0.00 0.00 0.00 0.00 0.00 61.98 62.97 2ews s VAL 69 Cb -0.06 -3.58 0.27 0.00 0.00 0.00 0.00 36.38 33.02 2ews s VAL 69 CO 0.03 0.04 1.83 1.05 0.00 0.00 0.00 175.10 178.05 2ews h GLU 70 N 7.36 0.93 -0.56 2.72 4.11 -1.94 -2.32 114.58 124.87 2ews h GLU 70 Ca -0.41 -0.06 -0.04 0.00 0.07 0.00 0.00 59.36 58.93 2ews h GLU 70 Cb 1.20 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 2ews h GLU 70 CO 0.89 0.62 0.21 0.74 0.07 0.00 0.00 179.01 181.53 2ews h PHE 71 N 0.96 0.87 -0.10 2.06 0.04 -1.99 0.76 116.94 119.55 2ews h PHE 71 Ca 0.48 -0.07 -0.15 0.00 2.80 0.00 0.00 57.97 61.02 2ews h PHE 71 Cb 0.45 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 38.34 2ews h PHE 71 CO -0.02 0.72 -0.60 -0.44 -0.60 0.00 0.00 178.31 177.37 2ews h ASP 72 N 0.78 0.37 -0.19 2.17 3.32 -1.92 -1.17 116.42 119.78 2ews h ASP 72 Ca 0.19 -0.21 -0.03 0.00 0.02 0.00 0.00 57.03 57.00 2ews h ASP 72 Cb 0.23 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 2ews h ASP 72 CO -0.01 0.89 0.01 0.00 -1.72 0.00 0.00 179.24 178.41 2ews h ALA 73 N 1.12 0.26 -0.19 3.45 0.00 -1.17 -0.96 119.26 121.76 2ews h ALA 73 Ca -0.01 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.73 2ews h ALA 73 Cb 1.12 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 2ews h ALA 73 CO 0.10 -0.05 0.05 0.00 0.00 0.00 0.00 179.25 179.35 2ews h ALA 74 N 0.80 0.20 -0.48 0.00 0.00 -0.78 0.88 119.26 119.87 2ews h ALA 74 Ca 0.06 0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.05 2ews h ALA 74 Cb 0.36 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 2ews h ALA 74 CO 0.01 -0.38 0.19 1.03 0.00 0.00 0.00 179.25 180.10 2ews h SER 75 N 0.14 0.22 -0.30 0.00 0.87 -1.08 0.19 113.55 113.59 2ews h SER 75 Ca 0.08 0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.65 2ews h SER 75 Cb 0.06 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 2ews h SER 75 CO -0.09 0.16 0.03 -0.61 -0.53 0.00 0.00 176.83 175.79 2ews h GLN 76 N 0.38 0.50 -0.67 2.24 5.75 -0.74 -1.83 115.11 120.74 2ews h GLN 76 Ca 0.23 -0.14 0.00 0.00 -0.15 0.00 0.00 58.65 58.59 2ews h GLN 76 Cb 0.21 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 28.67 2ews h GLN 76 CO -0.21 0.62 0.44 0.78 -2.65 0.00 0.00 178.83 177.80 2ews h GLY 77 N 0.31 0.94 0.98 2.39 0.00 -0.42 -2.27 103.07 105.01 2ews h GLY 77 Ca 0.09 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 2ews h GLY 77 CO 0.01 0.35 0.28 -2.00 0.00 0.00 0.00 176.54 175.18 2ews h LEU 78 N 0.91 0.68 -1.00 3.11 5.85 -0.53 -1.79 115.31 122.54 2ews h LEU 78 Ca 0.24 -0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.90 2ews h LEU 78 Cb -0.09 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 40.70 2ews h LEU 78 CO -0.05 0.59 0.65 1.23 -0.34 0.00 0.00 178.44 180.52 2ews h GLY 79 N 0.72 1.48 0.82 3.75 0.00 -1.02 0.22 103.07 109.04 2ews h GLY 79 Ca 0.19 -0.50 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 2ews h GLY 79 CO -0.03 0.41 0.03 -2.22 0.00 0.00 0.00 176.54 174.73 2ews h ILE 80 N 1.25 1.21 -0.74 2.60 2.04 -1.01 -2.52 117.51 120.35 2ews h ILE 80 Ca 0.41 -0.67 -0.06 0.00 1.00 0.00 0.00 64.86 65.54 2ews h ILE 80 Cb 0.04 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 2ews h ILE 80 CO -0.14 0.20 0.23 -0.07 0.00 0.00 0.00 178.15 178.38 2ews h LEU 81 N 0.03 1.06 0.17 1.44 3.38 -0.94 -1.98 115.31 118.48 2ews h LEU 81 Ca 0.04 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.82 2ews h LEU 81 Cb 0.28 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2ews h LEU 81 CO 0.00 0.98 -0.19 -0.07 0.09 0.00 0.00 178.44 179.26 2ews h LEU 82 N 1.09 -0.50 -0.99 1.67 3.38 -0.87 -1.43 115.31 117.66 2ews h LEU 82 Ca 0.24 0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.28 2ews h LEU 82 Cb 0.30 0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.17 2ews h LEU 82 CO -0.01 -0.28 0.65 0.11 0.09 0.00 0.00 178.44 179.01 2ews h LYS 83 N -0.40 1.25 0.00 1.13 1.57 -1.33 -1.04 116.57 117.75 2ews h LYS 83 Ca 0.00 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 2ews h LYS 83 Cb 0.38 -0.28 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 2ews h LYS 83 CO -0.06 0.83 -0.09 0.93 -0.57 0.00 0.00 179.45 180.50 2ews h GLU 84 N 1.29 0.00 -0.46 3.15 5.08 -1.00 -2.51 114.58 120.13 2ews h GLU 84 Ca 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 2ews h GLU 84 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 2ews h GLU 84 CO -0.11 0.09 0.00 1.04 -1.00 0.00 0.00 179.01 179.03 2ews n GLN 85 N -3.44 4.16 -0.96 2.33 6.02 -0.51 -4.96 117.38 120.02 2ews n GLN 85 Ca -0.01 -3.04 0.00 0.00 -0.01 0.00 0.00 57.00 53.93 2ews n GLN 85 Cb 0.24 -2.10 0.00 0.00 1.02 0.00 0.00 30.24 29.40 2ews n GLN 85 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ews n GLY 86 N 0.23 0.87 3.67 1.08 0.00 -0.94 -5.03 105.19 105.06 2ews n GLY 86 Ca 0.25 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.89 2ews n GLY 86 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2ews s HIS 87 N -3.44 3.38 -0.62 1.61 3.76 -0.51 -4.99 115.29 114.48 2ews s HIS 87 Ca 0.00 0.73 0.04 0.00 -0.15 0.00 0.00 55.06 55.68 2ews s HIS 87 Cb 0.00 -2.61 0.16 0.00 1.11 0.00 0.00 32.58 31.24 2ews s HIS 87 CO 0.00 -0.05 0.41 0.34 -0.85 0.00 0.00 174.74 174.59 2ews s ASP 88 N 1.07 4.38 -0.09 1.40 2.15 -1.26 -3.60 116.67 120.72 2ews s ASP 88 Ca 0.22 -3.51 -0.11 0.00 0.43 0.00 0.00 52.55 49.59 2ews s ASP 88 Cb -0.15 -1.51 -0.05 0.00 -0.30 0.00 0.00 42.92 40.91 2ews s ASP 88 CO 0.09 -0.14 0.25 -0.76 -0.17 0.00 0.00 175.17 174.44 2ews s LEU 89 N -0.94 4.39 0.29 -1.34 1.43 -1.26 -4.99 118.68 116.26 2ews s LEU 89 Ca 0.23 0.63 0.15 0.00 -1.03 0.00 0.00 54.13 54.11 2ews s LEU 89 Cb -0.11 -2.28 0.21 0.00 0.03 0.00 0.00 46.19 44.04 2ews s LEU 89 CO -0.12 0.33 1.51 0.00 0.23 0.00 0.00 176.35 178.31 2ews h ALA 90 N 5.17 0.73 -1.95 4.21 0.00 -1.96 -3.48 119.26 121.98 2ews h ALA 90 Ca -0.52 -0.47 0.19 0.00 0.00 0.00 0.00 54.91 54.11 2ews h ALA 90 Cb 1.21 -0.08 -0.15 0.00 0.00 0.00 0.00 17.79 18.78 2ews h ALA 90 CO 0.62 0.65 0.63 0.16 0.00 0.00 0.00 179.25 181.31 2ews s ASP 91 N -6.48 -0.22 -0.15 0.00 3.84 -1.26 -3.39 116.67 109.00 2ews s ASP 91 Ca 0.03 -0.09 -0.35 0.00 -0.00 0.00 0.00 52.55 52.14 2ews s ASP 91 Cb 0.09 0.30 0.15 0.00 -1.38 0.00 0.00 42.92 42.08 2ews s ASP 91 CO 0.74 -0.51 1.37 -0.72 -0.00 0.00 0.00 175.17 176.04 2ews s TYR 92 N -2.85 -0.03 -0.12 2.11 -0.85 -0.57 -4.62 117.35 110.42 2ews s TYR 92 Ca 0.09 -0.00 -0.06 0.00 -0.52 0.00 0.00 57.07 56.58 2ews s TYR 92 Cb -0.00 0.51 -0.04 0.00 0.38 0.00 0.00 41.96 42.81 2ews s TYR 92 CO -0.05 -0.08 0.09 0.42 -1.52 0.00 0.00 175.55 174.40 2ews s ILE 93 N -2.15 5.07 -0.07 -3.49 -1.09 -0.42 -0.13 121.20 118.93 2ews s ILE 93 Ca 0.13 0.05 0.03 0.00 -2.23 0.00 0.00 60.65 58.63 2ews s ILE 93 Cb 0.03 -3.21 0.01 0.00 -1.58 0.00 0.00 42.46 37.72 2ews s ILE 93 CO -0.05 0.59 -0.16 0.72 -1.23 0.00 0.00 174.94 174.81 2ews s PHE 94 N -0.74 1.78 -0.26 3.97 -0.12 0.68 0.37 117.98 123.66 2ews s PHE 94 Ca 0.13 -0.65 -0.06 0.00 -0.05 0.00 0.00 56.93 56.29 2ews s PHE 94 Cb -0.12 -1.24 -0.01 0.00 -0.63 0.00 0.00 43.02 41.02 2ews s PHE 94 CO 0.03 -0.29 0.05 0.00 -0.05 0.00 0.00 175.22 174.96 2ews s ALA 95 N 0.45 3.04 -0.67 1.99 0.00 -0.12 -0.92 121.76 125.53 2ews s ALA 95 Ca -0.13 -1.28 -0.18 0.00 0.00 0.00 0.00 51.96 50.37 2ews s ALA 95 Cb -0.15 -2.02 0.13 0.00 0.00 0.00 0.00 23.12 21.07 2ews s ALA 95 CO 0.05 -0.67 0.76 1.21 0.00 0.00 0.00 175.76 177.11 2ews s ASN 96 N 1.53 6.34 -1.07 0.00 3.84 0.07 -1.37 114.94 124.28 2ews s ASN 96 Ca 0.05 -1.76 -0.18 0.00 0.21 0.00 0.00 52.86 51.17 2ews s ASN 96 Cb -0.16 -2.29 0.11 0.00 -0.55 0.00 0.00 41.25 38.36 2ews s ASN 96 CO 0.01 -1.00 1.36 -0.69 -2.79 0.00 0.00 177.10 174.00 2ews s VAL 97 N 2.17 4.53 0.00 -5.21 1.01 0.17 -2.45 120.40 120.63 2ews s VAL 97 Ca 0.15 -1.71 0.00 0.00 0.00 0.00 0.00 61.98 60.42 2ews s VAL 97 Cb -0.20 -4.94 0.00 0.00 0.00 0.00 0.00 36.38 31.25 2ews s VAL 97 CO 0.01 -1.71 0.00 0.61 0.00 0.00 0.00 175.10 174.01 2ews n GLY 98 N 5.45 1.25 0.26 4.51 0.00 -1.26 -2.74 105.19 112.66 2ews n GLY 98 Ca 0.33 -0.19 -0.05 0.00 0.00 0.00 0.00 46.02 46.11 2ews n GLY 98 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2ews h THR 99 N 0.00 1.13 -3.74 2.61 2.02 -1.93 0.21 112.91 113.21 2ews h THR 99 Ca 0.00 -0.29 -0.08 0.00 0.77 0.00 0.00 66.41 66.81 2ews h THR 99 Cb 0.00 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 66.60 2ews h THR 99 CO 0.00 0.16 -0.06 0.61 0.37 0.00 0.00 175.52 176.60 2ews n GLY 100 N -1.28 4.07 3.13 2.16 0.00 -1.26 -1.05 105.19 110.95 2ews n GLY 100 Ca 0.06 -2.11 -0.29 0.00 0.00 0.00 0.00 46.02 43.68 2ews n GLY 100 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ews s THR 101 N -1.44 1.69 -0.08 2.61 2.01 -0.43 -4.51 115.64 115.48 2ews s THR 101 Ca 0.01 -0.79 0.02 0.00 0.31 0.00 0.00 61.69 61.25 2ews s THR 101 Cb 0.00 -1.49 -0.02 0.00 0.01 0.00 0.00 72.50 71.00 2ews s THR 101 CO 0.01 0.48 -0.15 -0.55 -0.69 0.00 0.00 174.62 173.72 2ews s SER 102 N 0.58 3.93 -0.11 3.53 0.15 -1.02 -0.37 113.70 120.39 2ews s SER 102 Ca -0.15 -0.27 0.01 0.00 0.70 0.00 0.00 55.95 56.24 2ews s SER 102 Cb -0.17 -1.12 -0.02 0.00 -1.71 0.00 0.00 66.02 63.01 2ews s SER 102 CO 0.05 0.27 -0.14 -0.76 1.20 0.00 0.00 173.24 173.86 2ews s LEU 103 N -0.29 2.69 0.02 3.45 1.43 0.20 -0.75 118.68 125.43 2ews s LEU 103 Ca 0.02 -0.31 0.03 0.00 -1.03 0.00 0.00 54.13 52.84 2ews s LEU 103 Cb -0.13 -1.59 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 2ews s LEU 103 CO 0.03 0.21 -0.10 -1.00 0.23 0.00 0.00 176.35 175.72 2ews s HIS 104 N 0.10 0.86 -0.22 0.29 3.76 -0.10 -0.87 115.29 119.12 2ews s HIS 104 Ca -0.06 -0.27 -0.06 0.00 -0.15 0.00 0.00 55.06 54.52 2ews s HIS 104 Cb -0.15 -0.53 -0.03 0.00 1.11 0.00 0.00 32.58 32.99 2ews s HIS 104 CO 0.05 -0.01 0.03 -0.47 -0.85 0.00 0.00 174.74 173.49 2ews s TYR 105 N -0.62 3.08 -0.32 1.40 5.04 -0.74 -0.23 117.35 124.98 2ews s TYR 105 Ca 0.00 -0.39 -0.08 0.00 -2.44 0.00 0.00 57.07 54.17 2ews s TYR 105 Cb -0.06 -2.14 0.02 0.00 0.35 0.00 0.00 41.96 40.12 2ews s TYR 105 CO 0.00 -0.24 0.11 0.12 -1.34 0.00 0.00 175.55 174.20 2ews s PHE 106 N 1.17 3.18 -1.76 4.97 5.36 0.81 -2.65 117.98 129.06 2ews s PHE 106 Ca 0.04 -1.01 0.31 0.00 -0.96 0.00 0.00 56.93 55.31 2ews s PHE 106 Cb -0.14 -2.30 1.74 0.00 -0.34 0.00 0.00 43.02 41.98 2ews s PHE 106 CO 0.02 -0.60 2.15 -0.40 -1.46 0.00 0.00 175.22 174.93 2ews n ASP 107 N 4.89 0.02 0.00 6.13 3.85 -0.95 -1.51 116.55 128.98 2ews n ASP 107 Ca -0.14 -0.65 0.00 0.00 -0.71 0.00 0.00 54.79 53.30 2ews n ASP 107 Cb 0.47 -0.12 0.00 0.00 -1.35 0.00 0.00 41.12 40.12 2ews n ASP 107 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2ews n GLY 108 N 1.12 1.31 0.47 6.12 0.00 -1.22 -4.67 105.19 108.32 2ews n GLY 108 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2ews n GLY 108 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ews n GLN 109 N -0.46 0.00 -4.19 1.61 6.02 -1.26 -5.02 117.38 114.07 2ews n GLN 109 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.86 2ews n GLN 109 Cb 0.00 -0.53 -0.09 0.00 1.02 0.00 0.00 30.24 30.64 2ews n GLN 109 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2ews s SER 110 N -3.80 0.30 0.26 1.08 1.04 -1.26 -5.12 113.70 106.20 2ews s SER 110 Ca 0.00 -1.40 0.12 0.00 0.48 0.00 0.00 55.95 55.15 2ews s SER 110 Cb 0.00 0.42 -0.05 0.00 0.10 0.00 0.00 66.02 66.49 2ews s SER 110 CO 0.00 -0.89 -0.19 0.00 0.98 0.00 0.00 173.24 173.14 2ews s GLN 111 N -4.06 1.70 -0.09 4.02 1.03 -1.26 -2.24 119.66 118.76 2ews s GLN 111 Ca 0.38 -1.69 -0.11 0.00 0.04 0.00 0.00 55.36 53.98 2ews s GLN 111 Cb 0.06 -1.82 0.03 0.00 0.03 0.00 0.00 33.01 31.31 2ews s GLN 111 CO 0.14 0.35 0.29 -0.98 -2.54 0.00 0.00 175.29 172.54 2ews s ARG 112 N -3.35 0.42 -0.12 9.60 1.70 -1.09 -4.99 118.95 121.12 2ews s ARG 112 Ca 0.28 0.25 -0.29 0.00 -0.47 0.00 0.00 55.73 55.50 2ews s ARG 112 Cb -0.06 0.20 -0.01 0.00 -0.57 0.00 0.00 34.95 34.51 2ews s ARG 112 CO 0.14 -0.07 1.02 0.50 -1.08 0.00 0.00 175.30 175.81 2ews s ARG 113 N -0.21 4.40 0.00 3.89 3.52 -1.26 -1.78 118.95 127.50 2ews s ARG 113 Ca -0.03 1.40 0.05 0.00 -0.13 0.00 0.00 55.73 57.01 2ews s ARG 113 Cb -0.03 -3.56 0.08 0.00 -1.56 0.00 0.00 34.95 29.88 2ews s ARG 113 CO 0.01 -0.36 0.86 1.33 -0.81 0.00 0.00 175.30 176.33 2ews n VAL 114 N 4.66 0.45 0.00 7.11 0.24 -0.05 -4.96 118.33 125.79 2ews n VAL 114 Ca 0.09 -0.73 0.00 0.00 -2.04 0.00 0.00 64.34 61.67 2ews n VAL 114 Cb 0.48 0.83 0.00 0.00 -1.47 0.00 0.00 33.84 33.68 2ews n VAL 114 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2ews n GLY 115 N 0.11 1.34 3.37 7.63 0.00 -1.05 -4.97 105.19 111.62 2ews n GLY 115 Ca 0.04 -0.78 -0.11 0.00 0.00 0.00 0.00 46.02 45.17 2ews n GLY 115 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ews s GLY 116 N 0.00 -0.46 -0.03 -0.02 0.00 -1.26 0.59 107.32 106.14 2ews s GLY 116 Ca 0.00 0.25 -0.30 0.00 0.00 0.00 0.00 44.72 44.68 2ews s GLY 116 CO 0.00 -0.04 0.66 -1.50 0.00 0.00 0.00 173.10 172.22 2ews s ILE 117 N -3.72 0.00 -2.00 0.90 2.07 0.50 -4.98 121.20 113.97 2ews s ILE 117 Ca 0.02 -0.02 0.18 0.00 -1.41 0.00 0.00 60.65 59.42 2ews s ILE 117 Cb 0.00 -0.99 0.53 0.00 0.13 0.00 0.00 42.46 42.13 2ews s ILE 117 CO -0.12 -0.01 1.57 0.61 -1.91 0.00 0.00 174.94 175.08 2ews n GLY 118 N 0.83 -0.78 3.57 1.50 0.00 -1.26 -1.31 105.19 107.74 2ews n GLY 118 Ca -0.19 -0.12 -0.40 0.00 0.00 0.00 0.00 46.02 45.31 2ews n GLY 118 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ews s THR 119 N -2.00 5.13 0.00 2.61 -4.23 -1.26 -4.69 115.64 111.20 2ews s THR 119 Ca 0.28 0.36 0.00 0.00 -1.18 0.00 0.00 61.69 61.15 2ews s THR 119 Cb 0.13 -3.81 0.00 0.00 1.34 0.00 0.00 72.50 70.16 2ews s THR 119 CO 0.21 -0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.89 2ews n GLY 120 N 4.78 1.63 0.35 3.99 0.00 -1.26 -3.92 105.19 110.76 2ews n GLY 120 Ca -0.08 -0.39 0.07 0.00 0.00 0.00 0.00 46.02 45.62 2ews n GLY 120 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2ews h GLY 121 N 0.00 0.93 1.40 -0.02 0.00 -0.57 -2.09 103.07 102.73 2ews h GLY 121 Ca 0.00 -0.29 -0.05 0.00 0.00 0.00 0.00 47.33 46.98 2ews h GLY 121 CO 0.00 0.21 0.07 -1.33 0.00 0.00 0.00 176.54 175.50 2ews h GLY 122 N 0.73 0.80 1.07 4.60 0.00 -1.21 -1.49 103.07 107.58 2ews h GLY 122 Ca 0.31 -0.48 -0.16 0.00 0.00 0.00 0.00 47.33 47.01 2ews h GLY 122 CO -0.10 0.45 -0.42 1.98 0.00 0.00 0.00 176.54 178.45 2ews h MET 123 N 0.71 0.82 -0.41 4.80 -1.53 -1.59 0.39 114.93 118.11 2ews h MET 123 Ca 0.15 -0.48 0.05 0.00 -3.44 0.00 0.00 59.70 55.98 2ews h MET 123 Cb 0.33 0.04 -0.04 0.00 -0.55 0.00 0.00 31.60 31.38 2ews h MET 123 CO 0.01 1.11 0.16 0.82 0.14 0.00 0.00 176.91 179.14 2ews h ILE 124 N 0.59 0.90 -0.07 1.77 2.04 -1.05 0.26 117.51 121.95 2ews h ILE 124 Ca 0.03 -0.11 -0.03 0.00 1.00 0.00 0.00 64.86 65.75 2ews h ILE 124 Cb 1.01 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 37.63 2ews h ILE 124 CO 0.10 0.06 -0.07 1.56 0.00 0.00 0.00 178.15 179.80 2ews h GLN 125 N 0.33 0.16 0.45 2.37 4.20 -1.18 -1.07 115.11 120.37 2ews h GLN 125 Ca 0.19 -0.09 -0.02 0.00 0.06 0.00 0.00 58.65 58.79 2ews h GLN 125 Cb 0.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.94 2ews h GLN 125 CO -0.18 0.61 -0.22 0.78 -0.67 0.00 0.00 178.83 179.15 2ews h GLY 126 N -0.28 -0.63 1.34 3.46 0.00 0.07 0.19 103.07 107.23 2ews h GLY 126 Ca 0.01 0.23 0.01 0.00 0.00 0.00 0.00 47.33 47.58 2ews h GLY 126 CO 0.02 -0.23 0.44 -2.00 0.00 0.00 0.00 176.54 174.77 2ews h LEU 127 N -0.70 0.77 -0.76 3.11 5.85 -0.65 -1.39 115.31 121.53 2ews h LEU 127 Ca -0.06 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.69 2ews h LEU 127 Cb 0.46 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 2ews h LEU 127 CO 0.10 0.56 0.46 1.23 -0.34 0.00 0.00 178.44 180.45 2ews h GLY 128 N 0.91 1.12 0.93 3.75 0.00 -1.15 -1.54 103.07 107.09 2ews h GLY 128 Ca 0.25 -0.33 -0.05 0.00 0.00 0.00 0.00 47.33 47.20 2ews h GLY 128 CO -0.05 0.24 0.06 -1.82 0.00 0.00 0.00 176.54 174.96 2ews h TYR 129 N 0.85 0.70 -0.31 5.60 3.20 0.09 -2.06 116.97 125.04 2ews h TYR 129 Ca 0.33 -0.10 0.02 0.00 3.14 0.00 0.00 58.73 62.11 2ews h TYR 129 Cb 0.13 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.20 2ews h TYR 129 CO -0.05 0.69 0.20 -0.07 -1.64 0.00 0.00 178.16 177.30 2ews h LEU 130 N 0.49 0.30 0.00 2.82 3.38 -0.69 0.72 115.31 122.34 2ews h LEU 130 Ca 0.12 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2ews h LEU 130 Cb 0.38 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2ews h LEU 130 CO 0.01 0.22 -0.61 0.18 0.09 0.00 0.00 178.44 178.32 2ews n LEU 131 N -4.49 0.60 0.00 1.67 4.77 -0.64 -4.56 117.00 114.35 2ews n LEU 131 Ca 0.02 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 2ews n LEU 131 Cb 0.11 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 2ews n LEU 131 CO 0.35 0.14 -0.00 -1.54 -1.33 0.00 0.00 177.39 175.01 2ews n SER 132 N -1.52 0.00 -1.19 -1.43 3.41 -0.79 -4.85 113.62 107.24 2ews n SER 132 Ca 0.05 -0.01 -0.15 0.00 -0.26 0.00 0.00 58.87 58.51 2ews n SER 132 Cb 0.34 0.02 -0.06 0.00 -0.26 0.00 0.00 64.21 64.25 2ews n SER 132 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2ews n GLN 133 N -0.02 -1.04 -3.57 4.33 -0.06 0.25 -4.98 117.38 112.29 2ews n GLN 133 Ca 0.00 0.98 -0.37 0.00 -2.00 0.00 0.00 57.00 55.61 2ews n GLN 133 Cb 0.00 -5.13 -0.10 0.00 -4.06 0.00 0.00 30.24 20.95 2ews n GLN 133 CO 0.00 0.00 0.00 0.42 -0.20 0.00 0.00 177.06 177.28 2ews s ILE 134 N -2.57 5.30 -0.21 1.69 1.01 -1.26 -4.96 121.20 120.22 2ews s ILE 134 Ca 0.00 0.28 0.16 0.00 0.00 0.00 0.00 60.65 61.10 2ews s ILE 134 Cb 0.00 -3.56 -0.24 0.00 0.01 0.00 0.00 42.46 38.67 2ews s ILE 134 CO 0.00 0.28 0.04 0.35 0.00 0.00 0.00 174.94 175.61 2ews n THR 135 N 4.65 1.40 -2.19 2.92 -2.24 -1.26 -4.21 114.28 113.35 2ews n THR 135 Ca -0.13 -0.83 -0.43 0.00 -2.27 0.00 0.00 64.05 60.39 2ews n THR 135 Cb 0.52 -0.56 -0.02 0.00 -2.10 0.00 0.00 70.33 68.17 2ews n THR 135 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ews s ASP 136 N -5.59 6.72 0.21 3.42 -1.08 -1.26 -4.93 116.67 114.16 2ews s ASP 136 Ca -0.12 1.89 -0.10 0.00 -0.52 0.00 0.00 52.55 53.70 2ews s ASP 136 Cb 0.06 -2.54 0.28 0.00 -1.46 0.00 0.00 42.92 39.26 2ews s ASP 136 CO 0.81 -0.93 1.71 0.22 0.52 0.00 0.00 175.17 177.50 2ews h TYR 137 N 9.23 0.22 -0.49 -5.34 3.20 -1.99 0.19 116.97 121.99 2ews h TYR 137 Ca -0.33 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.52 2ews h TYR 137 Cb 1.14 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 39.38 2ews h TYR 137 CO 0.86 -0.01 0.12 -0.22 -1.64 0.00 0.00 178.16 177.27 2ews h LYS 138 N 0.27 0.79 -0.41 1.82 3.64 -1.96 -0.92 116.57 119.81 2ews h LYS 138 Ca 0.30 -0.19 -0.01 0.00 -1.27 0.00 0.00 60.65 59.48 2ews h LYS 138 Cb 0.44 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 2ews h LYS 138 CO -0.38 0.77 0.20 0.37 -2.27 0.00 0.00 179.45 178.14 2ews h GLN 139 N 0.68 0.58 0.64 1.90 4.15 -1.85 0.17 115.11 121.37 2ews h GLN 139 Ca 0.15 -0.08 -0.02 0.00 0.77 0.00 0.00 58.65 59.47 2ews h GLN 139 Cb 0.33 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.91 2ews h GLN 139 CO 0.00 0.51 -0.43 1.25 -1.93 0.00 0.00 178.83 178.23 2ews h LEU 140 N 0.52 -1.11 -0.50 -2.39 5.85 -0.80 -2.04 115.31 114.84 2ews h LEU 140 Ca 0.14 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 2ews h LEU 140 Cb 0.11 0.34 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2ews h LEU 140 CO -0.02 -0.65 0.21 0.71 -0.34 0.00 0.00 178.44 178.35 2ews h THR 141 N -1.02 1.21 -0.39 1.05 1.35 -1.10 -2.51 112.91 111.49 2ews h THR 141 Ca -0.08 -0.64 0.06 0.00 -0.55 0.00 0.00 66.41 65.20 2ews h THR 141 Cb 0.84 0.70 -0.05 0.00 -1.73 0.00 0.00 68.15 67.91 2ews h THR 141 CO 0.05 0.24 0.07 0.44 -0.25 0.00 0.00 175.52 176.07 2ews h ASP 142 N 0.66 -0.02 -0.69 5.36 3.32 -0.65 -2.41 116.42 122.00 2ews h ASP 142 Ca 0.17 0.07 0.02 0.00 0.02 0.00 0.00 57.03 57.31 2ews h ASP 142 Cb 0.18 0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.79 2ews h ASP 142 CO -0.02 0.03 0.45 -0.03 -1.72 0.00 0.00 179.24 177.95 2ews h MET 143 N 0.19 0.86 0.00 3.56 4.05 -1.26 -2.84 114.93 119.50 2ews h MET 143 Ca 0.19 -0.05 -0.02 0.00 -0.28 0.00 0.00 59.70 59.54 2ews h MET 143 Cb 0.23 -0.19 -0.00 0.00 -0.80 0.00 0.00 31.60 30.83 2ews h MET 143 CO -0.26 0.57 -0.09 0.00 0.23 0.00 0.00 176.91 177.36 2ews h ALA 144 N 1.28 1.78 -0.99 0.39 0.00 -0.99 -3.21 119.26 117.52 2ews h ALA 144 Ca 0.27 -0.08 0.17 0.00 0.00 0.00 0.00 54.91 55.27 2ews h ALA 144 Cb -0.04 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.64 2ews h ALA 144 CO -0.08 0.11 0.62 1.96 0.00 0.00 0.00 179.25 181.86 2ews h GLN 145 N 0.00 0.76 -0.65 0.00 1.08 -1.24 -2.25 115.11 112.81 2ews h GLN 145 Ca -0.00 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 2ews h GLN 145 Cb 0.17 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 2ews h GLN 145 CO 0.01 0.50 0.00 0.72 -0.95 0.00 0.00 178.83 179.11 2ews n HIS 146 N -4.69 0.92 -1.85 2.96 8.25 -1.21 -4.93 115.22 114.67 2ews n HIS 146 Ca 0.21 -0.45 -0.33 0.00 -0.26 0.00 0.00 57.72 56.90 2ews n HIS 146 Cb 0.53 -0.02 0.03 0.00 1.12 0.00 0.00 29.99 31.65 2ews n HIS 146 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2ews s GLY 147 N -0.98 2.13 -0.15 -1.41 0.00 -0.85 -4.90 107.32 101.16 2ews s GLY 147 Ca 0.44 0.48 -0.00 0.00 0.00 0.00 0.00 44.72 45.64 2ews s GLY 147 CO 0.29 0.82 -0.14 -0.35 0.00 0.00 0.00 173.10 173.72 2ews s ASP 148 N -2.68 3.83 0.00 1.64 -1.08 -1.26 -4.87 116.67 112.25 2ews s ASP 148 Ca 0.66 -0.42 0.24 0.00 -0.52 0.00 0.00 52.55 52.51 2ews s ASP 148 Cb -0.19 -1.59 0.23 0.00 -1.46 0.00 0.00 42.92 39.91 2ews s ASP 148 CO 0.40 0.10 1.22 0.54 0.52 0.00 0.00 175.17 177.96 2ews n ARG 149 N 3.95 0.28 -0.10 4.34 1.74 -1.26 -4.56 116.66 121.05 2ews n ARG 149 Ca -0.19 -0.20 0.16 0.00 -0.77 0.00 0.00 57.85 56.86 2ews n ARG 149 Cb 0.52 -1.50 0.57 0.00 -1.02 0.00 0.00 32.46 31.03 2ews n ARG 149 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 2ews h ASN 150 N 0.49 0.26 0.30 0.55 2.35 -1.95 0.29 115.58 117.88 2ews h ASN 150 Ca 0.00 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2ews h ASN 150 Cb 0.53 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.86 2ews h ASN 150 CO 0.00 0.14 -0.21 0.35 -1.65 0.00 0.00 177.43 176.06 2ews n THR 151 N -4.44 0.00 -0.08 2.81 -2.24 -1.26 -4.32 114.28 104.75 2ews n THR 151 Ca 0.12 -0.10 -0.13 0.00 -2.27 0.00 0.00 64.05 61.68 2ews n THR 151 Cb 0.53 0.19 -0.06 0.00 -2.10 0.00 0.00 70.33 68.89 2ews n THR 151 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2ews n ILE 152 N -0.80 0.85 -3.52 2.28 5.41 -0.23 -3.42 119.36 119.94 2ews n ILE 152 Ca 0.13 -0.28 -0.38 0.00 1.00 0.00 0.00 62.75 63.21 2ews n ILE 152 Cb 0.32 -1.29 -0.06 0.00 -0.71 0.00 0.00 39.64 37.90 2ews n ILE 152 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 2ews s ASP 153 N -5.82 6.79 -0.28 4.38 -0.00 -0.08 -0.61 116.67 121.06 2ews s ASP 153 Ca -0.21 0.94 -0.14 0.00 -0.00 0.00 0.00 52.55 53.15 2ews s ASP 153 Cb 0.06 -2.24 -0.04 0.00 -0.00 0.00 0.00 42.92 40.71 2ews s ASP 153 CO 0.32 0.33 0.31 -0.22 -0.00 0.00 0.00 175.17 175.90 2ews s LEU 154 N -1.10 4.09 0.41 1.23 2.96 -0.32 -4.48 118.68 121.47 2ews s LEU 154 Ca 0.24 0.12 0.08 0.00 -0.22 0.00 0.00 54.13 54.34 2ews s LEU 154 Cb -0.16 -2.32 -0.03 0.00 0.50 0.00 0.00 46.19 44.18 2ews s LEU 154 CO 0.13 -0.16 0.29 -0.54 -1.32 0.00 0.00 176.35 174.75 2ews s LYS 155 N 1.96 2.40 0.24 1.98 1.02 -1.26 -0.29 119.74 125.80 2ews s LYS 155 Ca 0.12 -1.67 -0.05 0.00 0.02 0.00 0.00 55.97 54.38 2ews s LYS 155 Cb -0.16 -2.20 0.26 0.00 -0.52 0.00 0.00 37.83 35.21 2ews s LYS 155 CO 0.10 -0.16 1.83 0.28 -0.92 0.00 0.00 175.35 176.48 2ews h VAL 156 N 1.21 1.25 -1.02 3.17 2.07 -0.97 -1.88 116.25 120.07 2ews h VAL 156 Ca -0.42 -0.74 0.28 0.00 0.82 0.00 0.00 66.70 66.64 2ews h VAL 156 Cb 1.26 0.31 -0.06 0.00 -1.52 0.00 0.00 31.29 31.28 2ews h VAL 156 CO 0.63 0.31 0.70 0.03 0.02 0.00 0.00 177.57 179.26 2ews h ARG 157 N 1.09 0.15 0.16 1.57 3.08 -1.39 -1.00 114.38 118.05 2ews h ARG 157 Ca 0.26 -0.01 -0.25 0.00 0.07 0.00 0.00 59.98 60.05 2ews h ARG 157 Cb 0.16 -0.03 0.02 0.00 0.08 0.00 0.00 29.97 30.20 2ews h ARG 157 CO -0.03 0.10 -1.15 0.45 -1.07 0.00 0.00 179.97 178.27 2ews h HIS 158 N 0.16 0.63 0.00 3.04 3.86 -1.65 -3.52 115.15 117.68 2ews h HIS 158 Ca 0.51 -0.46 0.00 0.00 -1.16 0.00 0.00 60.37 59.26 2ews h HIS 158 Cb 1.74 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 30.19 2ews h HIS 158 CO -0.00 1.44 0.00 -0.89 0.86 0.00 0.00 177.93 179.34 2ews n ILE 159 N -3.96 0.00 -1.81 2.45 5.41 -0.38 -5.05 119.36 116.02 2ews n ILE 159 Ca -0.18 0.47 0.00 0.00 1.00 0.00 0.00 62.75 64.04 2ews n ILE 159 Cb 0.92 -1.08 0.00 0.00 -0.71 0.00 0.00 39.64 38.77 2ews n ILE 159 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 2ews n ILE 167 N -0.27 -9.83 -1.87 1.39 -5.35 -1.26 -4.90 119.36 97.27 2ews n ILE 167 Ca 0.00 2.21 -0.39 0.00 -0.27 0.00 0.00 62.75 64.30 2ews n ILE 167 Cb 0.00 -4.91 0.02 0.00 -1.74 0.00 0.00 39.64 33.01 2ews n ILE 167 CO 0.00 0.00 0.00 -2.84 -1.76 0.00 0.00 176.55 171.95 2ews s PRO 168 N -1.17 3.51 0.22 6.28 0.02 -1.26 -4.87 135.00 137.73 2ews s PRO 168 Ca 0.00 2.24 0.17 0.00 0.02 0.00 0.00 61.00 63.43 2ews s PRO 168 Cb 0.00 -2.48 0.84 0.00 0.02 0.00 0.00 34.50 32.88 2ews s PRO 168 CO 0.00 -0.90 1.51 0.41 -0.33 0.00 0.00 177.00 177.69 2ews n GLY 169 N 0.64 -0.88 0.04 0.52 0.00 -1.26 -1.63 105.19 102.61 2ews n GLY 169 Ca 0.07 0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.32 2ews n GLY 169 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ews n ASP 170 N -2.03 0.25 -4.75 1.61 8.00 -1.26 -1.22 116.55 117.14 2ews n ASP 170 Ca -0.00 0.54 -0.41 0.00 0.71 0.00 0.00 54.79 55.63 2ews n ASP 170 Cb 0.08 -0.60 -0.04 0.00 -0.02 0.00 0.00 41.12 40.54 2ews n ASP 170 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2ews s LEU 171 N -3.49 4.51 -0.20 0.64 1.43 -0.65 -4.89 118.68 116.02 2ews s LEU 171 Ca 0.10 2.24 -0.27 0.00 -1.03 0.00 0.00 54.13 55.17 2ews s LEU 171 Cb 0.14 -3.62 -0.00 0.00 0.03 0.00 0.00 46.19 42.74 2ews s LEU 171 CO 0.45 -0.22 0.94 -0.89 0.23 0.00 0.00 176.35 176.85 2ews s THR 172 N -0.72 4.78 0.03 5.49 2.01 -1.26 -0.65 115.64 125.31 2ews s THR 172 Ca 0.47 1.83 -0.17 0.00 0.31 0.00 0.00 61.69 64.13 2ews s THR 172 Cb -0.32 -4.22 -0.29 0.00 0.01 0.00 0.00 72.50 67.68 2ews s THR 172 CO 0.39 -0.08 1.06 0.00 -0.69 0.00 0.00 174.62 175.30 2ews h ALA 173 N 7.43 -0.02 -2.52 7.40 0.00 -0.90 -3.46 119.26 127.19 2ews h ALA 173 Ca -0.24 -0.73 -0.13 0.00 0.00 0.00 0.00 54.91 53.81 2ews h ALA 173 Cb 1.10 0.10 -0.29 0.00 0.00 0.00 0.00 17.79 18.70 2ews h ALA 173 CO 0.90 0.58 -0.41 0.00 0.00 0.00 0.00 179.25 180.32 2ews s ALA 174 N -2.90 -1.03 0.23 0.00 0.00 -0.37 -5.03 121.76 112.65 2ews s ALA 174 Ca -0.11 1.33 -0.30 0.00 0.00 0.00 0.00 51.96 52.88 2ews s ALA 174 Cb 0.04 -1.30 -0.09 0.00 0.00 0.00 0.00 23.12 21.77 2ews s ALA 174 CO 0.90 -0.79 1.28 -0.80 0.00 0.00 0.00 175.76 176.36 2ews s ASN 175 N 2.57 6.92 0.00 0.00 -0.87 -1.26 -1.18 114.94 121.12 2ews s ASN 175 Ca 0.00 2.43 0.00 0.00 -1.57 0.00 0.00 52.86 53.72 2ews s ASN 175 Cb -0.12 -2.62 0.00 0.00 -0.02 0.00 0.00 41.25 38.49 2ews s ASN 175 CO -0.12 -0.48 0.00 0.49 -2.57 0.00 0.00 177.10 174.41 2ews n PHE 176 N 2.19 0.00 1.92 2.20 3.01 -1.16 -4.86 117.46 120.76 2ews n PHE 176 Ca 0.04 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.57 2ews n PHE 176 Cb 0.43 -1.26 0.40 0.00 -0.01 0.00 0.00 39.48 39.04 2ews n PHE 176 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2ews n GLY 177 N -0.70 -0.96 0.00 1.37 0.00 -0.79 -3.17 105.19 100.94 2ews n GLY 177 Ca 0.00 -0.08 0.06 0.00 0.00 0.00 0.00 46.02 45.99 2ews n GLY 177 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2ews n HIS 178 N -0.72 0.00 -0.21 1.61 -0.00 0.23 -4.56 115.22 111.57 2ews n HIS 178 Ca 0.10 0.00 -0.03 0.00 0.46 0.00 0.00 57.72 58.26 2ews n HIS 178 Cb 0.05 -0.15 0.04 0.00 -0.12 0.00 0.00 29.99 29.81 2ews n HIS 178 CO 0.00 0.00 0.00 0.28 0.46 0.00 0.00 176.34 177.08 2ews h VAL 179 N 0.00 0.25 0.00 3.57 2.07 -1.48 0.24 116.25 120.89 2ews h VAL 179 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2ews h VAL 179 Cb 0.41 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 2ews h VAL 179 CO 0.00 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.77 2ews n LEU 180 N -5.45 0.00 -0.30 2.57 4.77 -1.26 -1.05 117.00 116.27 2ews n LEU 180 Ca 0.06 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.08 2ews n LEU 180 Cb 0.35 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.47 2ews n LEU 180 CO 0.02 0.00 0.35 1.41 -1.33 0.00 0.00 177.39 177.84 2ews n HIS 181 N -0.68 0.00 -2.75 -1.77 8.25 0.82 -4.66 115.22 114.43 2ews n HIS 181 Ca 0.03 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.45 2ews n HIS 181 Cb 0.02 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.17 2ews n HIS 181 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2ews n HIS 182 N 0.32 1.31 0.27 4.41 8.25 -0.22 -4.87 115.22 124.69 2ews n HIS 182 Ca 0.05 -2.35 0.03 0.00 -0.26 0.00 0.00 57.72 55.18 2ews n HIS 182 Cb 0.20 -0.28 0.15 0.00 1.12 0.00 0.00 29.99 31.18 2ews n HIS 182 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2ews n LEU 183 N -0.44 0.00 0.05 2.41 4.77 -1.22 -0.25 117.00 122.32 2ews n LEU 183 Ca 0.09 0.30 0.01 0.00 -0.03 0.00 0.00 56.01 56.38 2ews n LEU 183 Cb 0.81 -0.30 -0.06 0.00 -2.33 0.00 0.00 43.42 41.54 2ews n LEU 183 CO 0.15 -0.24 -0.16 -2.24 -1.33 0.00 0.00 177.39 173.57 2ews h ASP 184 N 0.00 0.00 -3.55 -1.43 3.04 -1.91 -3.48 116.42 109.09 2ews h ASP 184 Ca 0.00 0.00 -0.45 0.00 -3.24 0.00 0.00 57.03 53.34 2ews h ASP 184 Cb 0.06 0.00 0.19 0.00 -1.04 0.00 0.00 39.33 38.54 2ews h ASP 184 CO 0.00 0.55 0.09 0.00 -2.04 0.00 0.00 179.24 177.84 2ews s ALA 185 N -2.95 0.18 -0.62 4.15 0.00 0.65 -4.99 121.76 118.18 2ews s ALA 185 Ca -0.02 -0.17 -0.09 0.00 0.00 0.00 0.00 51.96 51.68 2ews s ALA 185 Cb 0.09 -3.21 0.16 0.00 0.00 0.00 0.00 23.12 20.16 2ews s ALA 185 CO 0.80 -3.40 0.50 0.34 0.00 0.00 0.00 175.76 174.00 2ews s ASP 186 N -2.89 5.87 -1.11 0.00 3.68 -1.26 -4.99 116.67 115.98 2ews s ASP 186 Ca 0.67 -2.42 -0.23 0.00 2.13 0.00 0.00 52.55 52.71 2ews s ASP 186 Cb -0.22 -2.02 -0.05 0.00 -1.45 0.00 0.00 42.92 39.17 2ews s ASP 186 CO 0.62 -0.57 1.89 -0.36 0.13 0.00 0.00 175.17 176.88 2ews s PHE 187 N 0.60 2.03 0.59 -5.34 0.40 -1.26 -4.92 117.98 110.07 2ews s PHE 187 Ca 0.12 0.22 -0.17 0.00 -0.60 0.00 0.00 56.93 56.51 2ews s PHE 187 Cb -0.20 -4.13 -0.04 0.00 0.51 0.00 0.00 43.02 39.16 2ews s PHE 187 CO -0.04 -1.46 1.08 0.95 0.70 0.00 0.00 175.22 176.45 2ews s THR 188 N 9.71 3.57 0.27 0.64 -4.23 -1.26 -4.82 115.64 119.52 2ews s THR 188 Ca 0.66 0.80 0.01 0.00 -1.18 0.00 0.00 61.69 61.97 2ews s THR 188 Cb -0.02 -3.30 0.26 0.00 1.34 0.00 0.00 72.50 70.77 2ews s THR 188 CO 0.07 -0.38 1.75 -0.65 -0.54 0.00 0.00 174.62 174.87 2ews h PRO 189 N 0.58 0.58 -0.57 3.99 0.11 -1.91 -0.81 132.00 133.97 2ews h PRO 189 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2ews h PRO 189 Cb 1.23 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 2ews h PRO 189 CO 0.57 0.39 0.36 1.03 -0.21 0.00 0.00 178.00 180.14 2ews h SER 190 N 0.60 0.67 -0.21 -2.05 0.87 -1.92 -1.73 113.55 109.78 2ews h SER 190 Ca 0.49 -0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.94 2ews h SER 190 Cb 0.75 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.53 2ews h SER 190 CO -0.39 0.51 -0.14 0.78 -0.53 0.00 0.00 176.83 177.05 2ews h ASN 191 N 0.77 0.49 -0.62 6.23 2.35 -1.47 -2.49 115.58 120.85 2ews h ASN 191 Ca 0.21 -0.44 -0.01 0.00 -0.55 0.00 0.00 56.30 55.52 2ews h ASN 191 Cb -0.06 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.15 2ews h ASN 191 CO -0.04 0.83 0.37 0.11 -1.65 0.00 0.00 177.43 177.04 2ews h LYS 192 N 0.17 0.85 -0.45 0.81 1.57 -1.11 -2.13 116.57 116.28 2ews h LYS 192 Ca 0.04 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.67 2ews h LYS 192 Cb 0.66 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 2ews h LYS 192 CO 0.04 0.62 -0.03 -0.07 -0.57 0.00 0.00 179.45 179.43 2ews h LEU 193 N 0.84 0.73 -0.93 2.94 3.38 -1.33 -1.75 115.31 119.20 2ews h LEU 193 Ca 0.22 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 2ews h LEU 193 Cb -0.01 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 2ews h LEU 193 CO -0.04 0.82 0.30 0.00 0.09 0.00 0.00 178.44 179.61 2ews h ALA 194 N 1.26 1.15 -0.20 1.53 0.00 -1.06 -0.43 119.26 121.51 2ews h ALA 194 Ca 0.13 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 2ews h ALA 194 Cb 0.48 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2ews h ALA 194 CO 0.02 0.62 -0.35 0.00 0.00 0.00 0.00 179.25 179.54 2ews h ALA 195 N 1.27 1.03 0.05 0.00 0.00 -0.87 0.17 119.26 120.91 2ews h ALA 195 Ca 0.25 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2ews h ALA 195 Cb 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2ews h ALA 195 CO -0.02 0.59 -0.02 0.28 0.00 0.00 0.00 179.25 180.08 2ews h VAL 196 N 0.37 1.08 -0.68 0.00 2.07 -0.54 -0.86 116.25 117.69 2ews h VAL 196 Ca 0.04 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 2ews h VAL 196 Cb 0.79 1.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 2ews h VAL 196 CO 0.06 0.10 0.41 0.40 0.02 0.00 0.00 177.57 178.57 2ews h ILE 197 N -0.24 1.19 -0.01 4.57 2.04 -0.96 -1.93 117.51 122.16 2ews h ILE 197 Ca -0.01 -0.41 -0.00 0.00 1.00 0.00 0.00 64.86 65.44 2ews h ILE 197 Cb 0.22 0.23 -0.00 0.00 -0.74 0.00 0.00 36.82 36.53 2ews h ILE 197 CO 0.01 0.20 0.01 1.23 0.00 0.00 0.00 178.15 179.60 2ews h GLY 198 N 0.96 0.02 1.30 5.37 0.00 -0.13 0.08 103.07 110.68 2ews h GLY 198 Ca 0.24 -0.01 -0.12 0.00 0.00 0.00 0.00 47.33 47.45 2ews h GLY 198 CO -0.05 0.01 -0.21 -0.24 0.00 0.00 0.00 176.54 176.05 2ews h VAL 199 N -0.02 1.27 -0.09 4.60 3.04 -0.90 -0.01 116.25 124.14 2ews h VAL 199 Ca 0.01 -1.32 -0.01 0.00 -1.01 0.00 0.00 66.70 64.37 2ews h VAL 199 Cb 0.04 1.18 -0.00 0.00 -2.01 0.00 0.00 31.29 30.50 2ews h VAL 199 CO -0.00 0.45 0.04 0.58 -1.01 0.00 0.00 177.57 177.62 2ews h VAL 200 N 0.71 1.14 -0.42 1.51 2.07 -1.25 -0.34 116.25 119.68 2ews h VAL 200 Ca 0.10 -0.43 0.02 0.00 0.82 0.00 0.00 66.70 67.20 2ews h VAL 200 Cb 0.73 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 2ews h VAL 200 CO 0.06 0.13 0.25 1.23 0.02 0.00 0.00 177.57 179.25 2ews h GLY 201 N -0.02 0.58 0.94 2.17 0.00 -0.80 -1.65 103.07 104.30 2ews h GLY 201 Ca 0.03 -0.19 -0.04 0.00 0.00 0.00 0.00 47.33 47.13 2ews h GLY 201 CO -0.00 0.17 0.10 0.83 0.00 0.00 0.00 176.54 177.64 2ews h GLU 202 N 0.51 0.67 -0.29 4.80 5.08 -0.86 -0.76 114.58 123.72 2ews h GLU 202 Ca 0.16 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2ews h GLU 202 Cb -0.01 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 2ews h GLU 202 CO -0.07 0.69 0.18 0.28 -1.00 0.00 0.00 179.01 179.09 2ews h VAL 203 N 0.54 1.10 -0.12 3.13 2.07 -0.95 0.36 116.25 122.38 2ews h VAL 203 Ca 0.13 -0.23 0.03 0.00 0.82 0.00 0.00 66.70 67.45 2ews h VAL 203 Cb 0.32 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 2ews h VAL 203 CO 0.00 0.10 -0.04 0.58 0.02 0.00 0.00 177.57 178.23 2ews h VAL 204 N 0.38 0.85 -0.57 2.57 2.07 -1.20 -0.48 116.25 119.87 2ews h VAL 204 Ca 0.11 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.61 2ews h VAL 204 Cb 0.00 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 2ews h VAL 204 CO -0.02 0.00 0.31 0.74 0.02 0.00 0.00 177.57 178.62 2ews h THR 205 N -0.02 1.19 -0.74 2.57 2.02 -0.78 0.26 112.91 117.40 2ews h THR 205 Ca 0.06 -0.48 -0.02 0.00 0.77 0.00 0.00 66.41 66.75 2ews h THR 205 Cb 0.11 0.47 -0.04 0.00 -1.74 0.00 0.00 68.15 66.96 2ews h THR 205 CO -0.14 0.20 0.40 0.74 0.37 0.00 0.00 175.52 177.10 2ews h THR 206 N 0.76 1.22 -0.28 3.16 2.02 0.15 0.91 112.91 120.86 2ews h THR 206 Ca 0.20 -0.56 -0.09 0.00 0.77 0.00 0.00 66.41 66.73 2ews h THR 206 Cb 0.05 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.68 2ews h THR 206 CO -0.03 0.25 -0.17 0.24 0.37 0.00 0.00 175.52 176.18 2ews h MET 207 N 1.04 0.61 -0.12 6.66 2.86 -0.72 -2.67 114.93 122.58 2ews h MET 207 Ca 0.26 -0.28 0.01 0.00 -2.06 0.00 0.00 59.70 57.64 2ews h MET 207 Cb 0.04 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 2ews h MET 207 CO -0.04 0.86 0.04 0.00 1.06 0.00 0.00 176.91 178.83 2ews h ALA 208 N 0.73 0.13 0.00 6.32 0.00 -0.14 -1.99 119.26 124.32 2ews h ALA 208 Ca 0.06 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2ews h ALA 208 Cb 0.70 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 2ews h ALA 208 CO 0.05 -0.41 -0.13 -0.84 0.00 0.00 0.00 179.25 177.91 2ews h ILE 209 N 0.10 0.36 0.09 0.00 -0.00 -0.90 -0.45 117.51 116.71 2ews h ILE 209 Ca 0.05 -0.82 -0.00 0.00 -0.00 0.00 0.00 64.86 64.08 2ews h ILE 209 Cb 0.03 1.61 0.00 0.00 -0.00 0.00 0.00 36.82 38.46 2ews h ILE 209 CO -0.06 0.13 -0.04 0.74 -0.00 0.00 0.00 178.15 178.92 2ews h THR 210 N 0.00 1.15 0.00 0.16 2.02 -1.07 -1.80 112.91 113.37 2ews h THR 210 Ca -0.00 -0.99 -0.07 0.00 0.77 0.00 0.00 66.41 66.12 2ews h THR 210 Cb 0.60 1.77 -0.01 0.00 -1.74 0.00 0.00 68.15 68.77 2ews h THR 210 CO 0.02 0.24 -0.34 -0.37 0.37 0.00 0.00 175.52 175.43 2ews h VAL 211 N -0.59 1.12 -0.68 3.16 -1.51 -1.22 -1.14 116.25 115.39 2ews h VAL 211 Ca -0.01 -1.22 -0.02 0.00 -1.23 0.00 0.00 66.70 64.22 2ews h VAL 211 Cb 0.48 1.68 -0.03 0.00 -2.13 0.00 0.00 31.29 31.29 2ews h VAL 211 CO 0.02 0.33 0.34 0.00 -1.23 0.00 0.00 177.57 177.03 2ews h ALA 212 N 1.66 0.88 -0.05 5.19 0.00 -0.98 0.11 119.26 126.07 2ews h ALA 212 Ca -0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2ews h ALA 212 Cb 0.65 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 2ews h ALA 212 CO 0.04 0.43 0.01 -0.09 0.00 0.00 0.00 179.25 179.64 2ews h ARG 213 N 0.95 0.08 -0.70 0.00 2.43 -0.81 0.75 114.38 117.08 2ews h ARG 213 Ca 0.24 -0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.48 2ews h ARG 213 Cb 0.10 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.57 2ews h ARG 213 CO -0.03 0.33 0.32 1.49 -1.51 0.00 0.00 179.97 180.57 2ews h GLU 214 N -0.18 0.53 -0.64 0.20 4.81 -0.87 -1.59 114.58 116.84 2ews h GLU 214 Ca 0.01 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2ews h GLU 214 Cb 0.29 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.55 2ews h GLU 214 CO 0.00 0.35 0.00 1.19 -0.73 0.00 0.00 179.01 179.82 2ews n PHE 215 N -4.91 1.70 -3.93 0.92 3.01 0.34 -4.96 117.46 109.63 2ews n PHE 215 Ca 0.11 -0.60 -0.40 0.00 1.01 0.00 0.00 57.45 57.57 2ews n PHE 215 Cb 0.29 -0.41 0.02 0.00 -0.01 0.00 0.00 39.48 39.38 2ews n PHE 215 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2ews n LYS 216 N 0.63 -0.74 -4.02 -1.08 5.02 -0.47 -5.01 118.16 112.49 2ews n LYS 216 Ca 0.24 0.23 -0.12 0.00 -2.02 0.00 0.00 58.31 56.64 2ews n LYS 216 Cb 1.01 -3.24 -0.12 0.00 -0.02 0.00 0.00 35.03 32.67 2ews n LYS 216 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2ews s THR 217 N -3.55 0.31 -1.49 -0.18 -1.32 0.13 -5.03 115.64 104.52 2ews s THR 217 Ca 0.45 -0.74 0.12 0.00 -1.21 0.00 0.00 61.69 60.31 2ews s THR 217 Cb -0.22 -0.37 0.12 0.00 -1.51 0.00 0.00 72.50 70.52 2ews s THR 217 CO 0.93 -0.29 0.92 -1.84 -2.21 0.00 0.00 174.62 172.13 2ews n GLU 218 N 1.96 0.90 -3.47 7.08 0.28 -1.26 -4.15 120.64 121.98 2ews n GLU 218 Ca -0.20 -1.31 -0.37 0.00 -0.16 0.00 0.00 57.16 55.11 2ews n GLU 218 Cb 0.56 -1.24 -0.06 0.00 1.43 0.00 0.00 31.44 32.13 2ews n GLU 218 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 2ews s ASN 219 N -1.02 6.66 -0.13 -1.84 0.01 -1.26 0.65 114.94 118.01 2ews s ASN 219 Ca 0.15 0.78 -0.02 0.00 -0.71 0.00 0.00 52.86 53.07 2ews s ASN 219 Cb 0.11 -2.24 0.04 0.00 0.41 0.00 0.00 41.25 39.57 2ews s ASN 219 CO 0.16 0.17 -0.00 -0.63 -1.51 0.00 0.00 177.10 175.29 2ews s ILE 220 N -0.15 0.57 -0.20 0.60 1.01 0.01 -1.29 121.20 121.74 2ews s ILE 220 Ca 0.22 -0.22 -0.10 0.00 0.00 0.00 0.00 60.65 60.55 2ews s ILE 220 Cb -0.15 -0.83 -0.05 0.00 0.01 0.00 0.00 42.46 41.44 2ews s ILE 220 CO 0.10 0.10 0.12 -0.69 0.00 0.00 0.00 174.94 174.57 2ews s VAL 221 N 1.87 5.32 -0.18 2.92 1.01 0.16 -0.73 120.40 130.77 2ews s VAL 221 Ca 0.03 0.16 -0.05 0.00 0.00 0.00 0.00 61.98 62.12 2ews s VAL 221 Cb -0.14 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 32.78 2ews s VAL 221 CO -0.07 0.44 -0.01 -0.31 0.00 0.00 0.00 175.10 175.15 2ews s TYR 222 N 0.42 3.05 0.24 5.22 1.51 -0.25 -0.95 117.35 126.59 2ews s TYR 222 Ca 0.07 -0.36 0.04 0.00 -1.01 0.00 0.00 57.07 55.81 2ews s TYR 222 Cb -0.11 -2.03 -0.01 0.00 -0.11 0.00 0.00 41.96 39.69 2ews s TYR 222 CO -0.01 -0.13 0.14 0.44 -1.11 0.00 0.00 175.55 174.88 2ews n ILE 223 N 3.89 0.00 0.00 2.71 -5.35 -0.47 -3.62 119.36 116.52 2ews n ILE 223 Ca -0.17 -1.55 0.00 0.00 -0.27 0.00 0.00 62.75 60.76 2ews n ILE 223 Cb 0.52 0.66 0.00 0.00 -1.74 0.00 0.00 39.64 39.08 2ews n ILE 223 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ews n GLY 224 N -0.04 2.78 0.11 3.28 0.00 -1.26 -0.66 105.19 109.41 2ews n GLY 224 Ca 0.00 -1.76 0.12 0.00 0.00 0.00 0.00 46.02 44.39 2ews n GLY 224 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ews n SER 225 N 0.00 0.64 0.26 1.61 7.64 -1.23 -3.45 113.62 119.09 2ews n SER 225 Ca 0.00 0.63 0.18 0.00 1.01 0.00 0.00 58.87 60.69 2ews n SER 225 Cb 0.00 -0.78 0.90 0.00 -1.01 0.00 0.00 64.21 63.32 2ews n SER 225 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2ews h SER 226 N 0.00 0.00 1.13 6.43 0.02 -1.81 0.28 113.55 119.60 2ews h SER 226 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ews h SER 226 Cb 0.44 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.98 2ews h SER 226 CO 0.00 0.00 -0.04 0.49 -1.14 0.00 0.00 176.83 176.14 2ews n PHE 227 N -3.40 0.33 -1.85 3.45 3.01 -1.22 -4.70 117.46 113.08 2ews n PHE 227 Ca 0.00 0.10 -0.42 0.00 1.01 0.00 0.00 57.45 58.14 2ews n PHE 227 Cb 0.31 -0.64 -0.03 0.00 -0.01 0.00 0.00 39.48 39.11 2ews n PHE 227 CO 0.00 0.00 0.00 -1.01 1.01 0.00 0.00 176.76 176.76 2ews s HIS 228 N -3.04 2.36 -1.63 1.38 3.76 0.97 -1.87 115.29 117.21 2ews s HIS 228 Ca 0.12 0.22 -0.01 0.00 -0.15 0.00 0.00 55.06 55.24 2ews s HIS 228 Cb 0.17 -4.04 0.00 0.00 1.11 0.00 0.00 32.58 29.82 2ews s HIS 228 CO 0.57 -4.19 0.11 -1.71 -0.85 0.00 0.00 174.74 168.66 2ews n ASN 229 N 5.55 -5.59 -3.37 1.40 5.15 -1.26 -4.93 115.26 112.20 2ews n ASN 229 Ca 0.16 -0.03 -0.26 0.00 -0.60 0.00 0.00 54.58 53.85 2ews n ASN 229 Cb 0.40 -4.64 -0.10 0.00 -0.53 0.00 0.00 39.78 34.90 2ews n ASN 229 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 2ews s ASN 230 N -2.16 1.50 0.18 1.20 3.84 -0.78 -4.43 114.94 114.28 2ews s ASN 230 Ca 0.06 -2.84 -0.12 0.00 0.21 0.00 0.00 52.86 50.17 2ews s ASN 230 Cb -0.03 -0.29 0.09 0.00 -0.55 0.00 0.00 41.25 40.46 2ews s ASN 230 CO 0.07 -0.19 1.76 0.00 -2.79 0.00 0.00 177.10 175.95 2ews h ALA 231 N 5.85 0.79 -0.34 1.71 0.00 -1.92 -3.08 119.26 122.27 2ews h ALA 231 Ca 0.22 -0.14 0.07 0.00 0.00 0.00 0.00 54.91 55.07 2ews h ALA 231 Cb 0.93 -0.24 -0.07 0.00 0.00 0.00 0.00 17.79 18.41 2ews h ALA 231 CO 0.33 0.36 -0.13 1.25 0.00 0.00 0.00 179.25 181.06 2ews h LEU 232 N 0.84 -0.46 -0.70 0.00 5.85 -1.93 -0.79 115.31 118.12 2ews h LEU 232 Ca 0.21 0.12 0.10 0.00 0.84 0.00 0.00 57.88 59.15 2ews h LEU 232 Cb 0.13 0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.36 2ews h LEU 232 CO -0.02 -0.17 0.33 0.25 -0.34 0.00 0.00 178.44 178.49 2ews h LEU 233 N -0.07 0.40 -0.59 2.25 5.85 -1.88 0.25 115.31 121.52 2ews h LEU 233 Ca 0.17 0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.92 2ews h LEU 233 Cb 0.33 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 2ews h LEU 233 CO -0.39 0.22 0.20 -0.09 -0.34 0.00 0.00 178.44 178.05 2ews h ARG 234 N 0.55 0.91 -0.38 1.25 2.43 -1.36 -2.04 114.38 115.74 2ews h ARG 234 Ca 0.35 -0.19 -0.03 0.00 -0.81 0.00 0.00 59.98 59.30 2ews h ARG 234 Cb 0.40 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 2ews h ARG 234 CO -0.29 0.80 0.11 -0.22 -1.51 0.00 0.00 179.97 178.86 2ews h LYS 235 N 0.83 0.59 -0.00 0.20 1.63 0.06 -0.65 116.57 119.23 2ews h LYS 235 Ca 0.19 -0.13 0.02 0.00 -0.85 0.00 0.00 60.65 59.88 2ews h LYS 235 Cb 0.26 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.77 2ews h LYS 235 CO -0.01 0.61 -0.15 0.28 -3.45 0.00 0.00 179.45 176.73 2ews h VAL 236 N 0.46 0.63 -0.24 2.00 2.07 -0.40 -1.19 116.25 119.58 2ews h VAL 236 Ca 0.12 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.61 2ews h VAL 236 Cb 0.28 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 2ews h VAL 236 CO -0.00 0.00 0.03 -0.37 0.02 0.00 0.00 177.57 177.25 2ews h VAL 237 N -0.25 1.24 0.17 2.57 -1.51 -1.27 -0.91 116.25 116.28 2ews h VAL 237 Ca 0.05 -0.81 0.01 0.00 -1.23 0.00 0.00 66.70 64.72 2ews h VAL 237 Cb 0.32 1.30 -0.02 0.00 -2.13 0.00 0.00 31.29 30.76 2ews h VAL 237 CO -0.15 0.25 -0.20 -0.33 -1.23 0.00 0.00 177.57 175.92 2ews h GLU 238 N 0.20 -0.39 0.11 5.19 5.08 -1.04 0.95 114.58 124.67 2ews h GLU 238 Ca 0.07 0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.47 2ews h GLU 238 Cb 0.35 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 2ews h GLU 238 CO 0.01 -0.26 -0.16 -0.44 -1.00 0.00 0.00 179.01 177.16 2ews h ASP 239 N -0.41 -0.44 -0.52 1.42 3.32 -1.21 -1.15 116.42 117.44 2ews h ASP 239 Ca 0.01 0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 2ews h ASP 239 Cb 0.40 0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.08 2ews h ASP 239 CO -0.07 -0.23 0.31 0.22 -1.72 0.00 0.00 179.24 177.75 2ews h TYR 240 N -0.32 0.70 -0.60 4.55 3.20 -1.07 0.11 116.97 123.54 2ews h TYR 240 Ca 0.02 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.83 2ews h TYR 240 Cb 0.33 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 2ews h TYR 240 CO -0.16 0.48 0.16 1.15 -1.64 0.00 0.00 178.16 178.15 2ews h THR 241 N 0.74 1.25 0.03 1.81 2.02 -0.38 0.59 112.91 118.97 2ews h THR 241 Ca 0.19 -0.89 -0.00 0.00 0.77 0.00 0.00 66.41 66.49 2ews h THR 241 Cb -0.01 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.07 2ews h THR 241 CO -0.04 0.33 -0.01 0.58 0.37 0.00 0.00 175.52 176.75 2ews h VAL 242 N 0.87 1.16 -0.60 3.16 2.07 -0.27 -0.60 116.25 122.04 2ews h VAL 242 Ca 0.19 -0.58 0.12 0.00 0.82 0.00 0.00 66.70 67.25 2ews h VAL 242 Cb 0.33 1.55 -0.10 0.00 -1.52 0.00 0.00 31.29 31.55 2ews h VAL 242 CO -0.00 0.15 0.04 -0.07 0.02 0.00 0.00 177.57 177.71 2ews h LEU 243 N -0.29 -0.19 -0.46 2.57 3.38 -0.52 0.48 115.31 120.27 2ews h LEU 243 Ca -0.00 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2ews h LEU 243 Cb 0.28 0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.26 2ews h LEU 243 CO 0.01 -0.08 0.00 0.54 0.09 0.00 0.00 178.44 179.00 2ews n ARG 244 N -5.23 0.99 -2.15 1.13 5.12 0.17 -4.90 116.66 111.80 2ews n ARG 244 Ca 0.09 0.00 -0.05 0.00 -1.93 0.00 0.00 57.85 55.96 2ews n ARG 244 Cb 0.34 -1.23 -0.00 0.00 -1.16 0.00 0.00 32.46 30.41 2ews n ARG 244 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2ews n GLY 245 N 0.27 0.22 3.46 -0.13 0.00 0.17 -5.04 105.19 104.13 2ews n GLY 245 Ca 0.00 -0.67 -0.22 0.00 0.00 0.00 0.00 46.02 45.13 2ews n GLY 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ews s LYS 247 N -3.87 3.45 0.24 0.00 1.02 0.21 -3.75 119.74 117.03 2ews s LYS 247 Ca 0.34 -0.64 -0.15 0.00 0.02 0.00 0.00 55.97 55.54 2ews s LYS 247 Cb 0.08 -3.54 -0.08 0.00 -0.52 0.00 0.00 37.83 33.76 2ews s LYS 247 CO 0.15 -0.36 0.66 -1.25 -0.92 0.00 0.00 175.35 173.63 2ews s PRO 248 N 1.63 4.05 -0.13 -1.68 0.04 -1.26 -0.81 135.00 136.84 2ews s PRO 248 Ca 0.05 0.63 -0.03 0.00 0.04 0.00 0.00 61.00 61.70 2ews s PRO 248 Cb -0.17 -2.72 0.05 0.00 0.04 0.00 0.00 34.50 31.70 2ews s PRO 248 CO 0.06 0.33 0.03 0.71 0.04 0.00 0.00 177.00 178.18 2ews s TYR 249 N -1.69 0.67 0.07 0.56 1.51 0.09 -4.92 117.35 113.62 2ews s TYR 249 Ca 0.46 -0.41 -0.13 0.00 -1.01 0.00 0.00 57.07 55.98 2ews s TYR 249 Cb -0.13 -0.84 -0.06 0.00 -0.11 0.00 0.00 41.96 40.82 2ews s TYR 249 CO 0.19 -0.45 0.44 -0.47 -1.11 0.00 0.00 175.55 174.15 2ews s TYR 250 N 1.98 3.64 -0.17 2.71 5.04 -1.26 -1.09 117.35 128.20 2ews s TYR 250 Ca 0.02 0.92 -0.01 0.00 -2.44 0.00 0.00 57.07 55.57 2ews s TYR 250 Cb -0.15 -2.25 -0.00 0.00 0.35 0.00 0.00 41.96 39.91 2ews s TYR 250 CO -0.07 0.54 -0.13 0.08 -1.34 0.00 0.00 175.55 174.63 2ews s VAL 251 N -1.30 2.75 0.20 3.14 1.01 -1.24 -4.97 120.40 119.99 2ews s VAL 251 Ca 0.31 -0.73 -0.31 0.00 0.00 0.00 0.00 61.98 61.25 2ews s VAL 251 Cb -0.15 -2.18 -0.10 0.00 0.00 0.00 0.00 36.38 33.95 2ews s VAL 251 CO 0.17 0.50 1.48 -1.61 0.00 0.00 0.00 175.10 175.64 2ews s GLU 252 N 1.02 4.25 -1.87 2.72 0.41 -1.26 -1.27 118.70 122.70 2ews s GLU 252 Ca -0.01 2.30 0.00 0.00 -0.41 0.00 0.00 54.97 56.85 2ews s GLU 252 Cb -0.15 -3.14 0.00 0.00 -1.78 0.00 0.00 34.13 29.06 2ews s GLU 252 CO -0.03 -0.49 0.00 0.09 -0.49 0.00 0.00 175.26 174.34 2ews n ASN 253 N 3.13 -5.78 0.28 -0.19 3.02 -1.26 -4.84 115.26 109.62 2ews n ASN 253 Ca 0.10 0.11 0.17 0.00 -0.03 0.00 0.00 54.58 54.92 2ews n ASN 253 Cb 0.40 -4.88 0.81 0.00 -0.61 0.00 0.00 39.78 35.50 2ews n ASN 253 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 2ews h GLY 254 N 0.00 0.00 2.00 7.41 0.00 -1.54 -1.88 103.07 109.05 2ews h GLY 254 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 2ews h GLY 254 CO 0.59 0.00 0.00 0.00 0.00 0.00 0.00 176.54 177.13 2ews h ALA 255 N 1.94 1.00 -0.52 3.60 0.00 -1.82 -1.86 119.26 121.60 2ews h ALA 255 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2ews h ALA 255 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2ews h ALA 255 CO 0.01 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.45 2ews n PHE 256 N -2.92 1.29 -0.30 0.00 3.01 -0.71 -4.45 117.46 113.38 2ews n PHE 256 Ca -0.01 -0.50 -0.01 0.00 1.01 0.00 0.00 57.45 57.94 2ews n PHE 256 Cb 0.18 -0.24 0.11 0.00 -0.01 0.00 0.00 39.48 39.52 2ews n PHE 256 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 2ews h SER 257 N 3.31 0.84 0.02 4.37 0.02 -1.48 -0.75 113.55 119.88 2ews h SER 257 Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ews h SER 257 Cb 1.30 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.66 2ews h SER 257 CO 0.22 0.57 -0.01 1.23 -1.14 0.00 0.00 176.83 177.70 2ews h GLY 258 N 0.99 -0.03 0.92 -3.77 0.00 -1.78 0.10 103.07 99.50 2ews h GLY 258 Ca 0.34 0.01 0.02 0.00 0.00 0.00 0.00 47.33 47.70 2ews h GLY 258 CO -0.14 -0.01 0.31 0.00 0.00 0.00 0.00 176.54 176.70 2ews h ALA 259 N 0.72 0.64 -0.50 3.60 0.00 -1.79 0.49 119.26 122.41 2ews h ALA 259 Ca -0.00 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 2ews h ALA 259 Cb 0.24 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2ews h ALA 259 CO 0.00 0.03 -0.19 0.82 0.00 0.00 0.00 179.25 179.91 2ews h ILE 260 N 0.63 1.27 -0.69 0.00 2.04 -1.13 -2.44 117.51 117.18 2ews h ILE 260 Ca 0.20 -1.35 -0.07 0.00 1.00 0.00 0.00 64.86 64.63 2ews h ILE 260 Cb -0.02 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 2ews h ILE 260 CO -0.07 0.47 0.17 1.23 0.00 0.00 0.00 178.15 179.95 2ews h GLY 261 N 0.89 1.19 1.00 5.37 0.00 -0.41 -1.42 103.07 109.69 2ews h GLY 261 Ca 0.12 -0.75 0.00 0.00 0.00 0.00 0.00 47.33 46.70 2ews h GLY 261 CO 0.06 0.70 0.35 0.00 0.00 0.00 0.00 176.54 177.65 2ews h ALA 262 N 1.08 0.69 -0.69 3.60 0.00 -0.76 -1.05 119.26 122.13 2ews h ALA 262 Ca 0.22 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2ews h ALA 262 Cb 0.37 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2ews h ALA 262 CO 0.00 0.15 0.34 -0.07 0.00 0.00 0.00 179.25 179.67 2ews h LEU 263 N 0.74 0.90 -1.28 0.00 3.38 -1.23 -2.70 115.31 115.12 2ews h LEU 263 Ca 0.20 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 2ews h LEU 263 Cb -0.05 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 2ews h LEU 263 CO -0.04 0.77 -0.23 0.22 0.09 0.00 0.00 178.44 179.25 2ews h TYR 264 N 0.96 0.22 0.00 1.13 5.03 -0.77 -2.80 116.97 120.74 2ews h TYR 264 Ca 0.24 -0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.51 2ews h TYR 264 Cb 0.11 -0.06 0.00 0.00 1.55 0.00 0.00 36.73 38.33 2ews h TYR 264 CO 0.00 0.42 0.00 1.28 -1.32 0.00 0.00 178.16 178.55 2ews n LEU 265 N -4.19 0.00 -4.72 2.82 4.77 -0.44 -4.90 117.00 110.34 2ews n LEU 265 Ca -0.01 0.21 -0.43 0.00 -0.03 0.00 0.00 56.01 55.75 2ews n LEU 265 Cb 0.34 -0.21 -0.01 0.00 -2.33 0.00 0.00 43.42 41.20 2ews n LEU 265 CO 0.39 -0.00 1.08 -1.84 -1.33 0.00 0.00 177.39 175.69 2ews n GLU 266 N -1.21 2.36 0.00 3.23 0.28 -1.06 -5.09 120.64 119.15 2ews n GLU 266 Ca 0.17 0.84 0.12 0.00 -0.16 0.00 0.00 57.16 58.12 2ews n GLU 266 Cb 0.21 -2.53 0.11 0.00 1.43 0.00 0.00 31.44 30.66 2ews n GLU 266 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60