#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 3.18 -0.10 3.17 1.02 -0.74 0.50 119.74 126.77 2ews s LYS 2 Ca 0.00 -0.67 0.02 0.00 0.02 0.00 0.00 55.97 55.35 2ews s LYS 2 Cb 0.00 -2.59 0.01 0.00 -0.52 0.00 0.00 37.83 34.73 2ews s LYS 2 CO 0.00 0.33 -0.16 0.08 -0.92 0.00 0.00 175.35 174.68 2ews s VAL 3 N 0.04 1.52 -0.14 3.17 1.01 0.96 0.42 120.40 127.38 2ews s VAL 3 Ca -0.04 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.27 2ews s VAL 3 Cb -0.14 -1.37 -0.01 0.00 0.00 0.00 0.00 36.38 34.86 2ews s VAL 3 CO 0.04 0.44 -0.14 -0.83 0.00 0.00 0.00 175.10 174.61 2ews s GLY 4 N 0.79 1.51 -0.05 4.51 0.00 -0.02 -0.74 107.32 113.32 2ews s GLY 4 Ca -0.11 -0.94 0.03 0.00 0.00 0.00 0.00 44.72 43.70 2ews s GLY 4 CO 0.02 -0.14 -0.12 -0.42 0.00 0.00 0.00 173.10 172.43 2ews s ILE 5 N 0.48 1.12 -0.46 0.90 1.01 -0.05 -0.22 121.20 123.99 2ews s ILE 5 Ca -0.10 -0.50 -0.02 0.00 0.00 0.00 0.00 60.65 60.03 2ews s ILE 5 Cb -0.16 -1.01 0.12 0.00 0.01 0.00 0.00 42.46 41.42 2ews s ILE 5 CO 0.05 0.35 0.25 -0.62 0.00 0.00 0.00 174.94 174.96 2ews s ASP 6 N 0.47 5.19 -0.85 3.58 -1.08 0.22 -1.12 116.67 123.08 2ews s ASP 6 Ca -0.11 -2.26 -0.19 0.00 -0.52 0.00 0.00 52.55 49.47 2ews s ASP 6 Cb -0.14 -1.82 0.12 0.00 -1.46 0.00 0.00 42.92 39.63 2ews s ASP 6 CO 0.03 -0.48 1.04 0.00 0.52 0.00 0.00 175.17 176.28 2ews s ALA 7 N 0.81 3.37 0.93 3.66 0.00 0.75 -1.04 121.76 130.23 2ews s ALA 7 Ca 0.11 -2.61 -0.12 0.00 0.00 0.00 0.00 51.96 49.34 2ews s ALA 7 Cb -0.22 -3.95 0.20 0.00 0.00 0.00 0.00 23.12 19.15 2ews s ALA 7 CO -0.04 -2.86 1.23 0.41 0.00 0.00 0.00 175.76 174.50 2ews n GLY 8 N 5.36 -0.89 0.21 0.00 0.00 -0.56 -1.08 105.19 108.23 2ews n GLY 8 Ca 0.16 -1.80 0.07 0.00 0.00 0.00 0.00 46.02 44.45 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 -1.41 0.00 0.00 -0.02 0.00 -1.96 -3.38 103.07 96.30 2ews h GLY 9 Ca -0.40 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 46.80 2ews h GLY 9 CO 0.32 0.00 -1.42 2.41 0.00 0.00 0.00 176.54 177.84 2ews n THR 10 N -3.66 0.42 -4.98 4.70 -1.04 -1.26 -4.78 114.28 103.67 2ews n THR 10 Ca -0.01 -0.11 -0.31 0.00 -2.04 0.00 0.00 64.05 61.58 2ews n THR 10 Cb 0.40 -1.54 -0.15 0.00 -1.82 0.00 0.00 70.33 67.22 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 -6.34 2.27 -0.33 -4.42 1.43 -1.26 -1.02 118.68 109.01 2ews s LEU 11 Ca -0.11 -0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 52.40 2ews s LEU 11 Cb 0.04 -1.37 -0.00 0.00 0.03 0.00 0.00 46.19 44.88 2ews s LEU 11 CO 0.14 0.29 0.18 -0.63 0.23 0.00 0.00 176.35 176.55 2ews s ILE 12 N -0.76 4.75 -0.24 -0.59 1.01 0.12 -1.49 121.20 123.99 2ews s ILE 12 Ca 0.12 -0.45 -0.12 0.00 0.00 0.00 0.00 60.65 60.20 2ews s ILE 12 Cb -0.10 -3.46 -0.05 0.00 0.01 0.00 0.00 42.46 38.86 2ews s ILE 12 CO 0.02 0.00 0.23 -0.54 0.00 0.00 0.00 174.94 174.65 2ews s LYS 13 N 1.63 4.06 -0.14 2.79 3.01 -0.21 -1.15 119.74 129.74 2ews s LYS 13 Ca 0.05 -0.16 0.01 0.00 -1.01 0.00 0.00 55.97 54.86 2ews s LYS 13 Cb -0.17 -3.57 -0.00 0.00 -1.01 0.00 0.00 37.83 33.07 2ews s LYS 13 CO 0.07 -0.03 -0.18 0.42 0.51 0.00 0.00 175.35 176.14 2ews s ILE 14 N 1.32 2.48 -0.11 2.17 1.01 0.11 -0.61 121.20 127.57 2ews s ILE 14 Ca 0.10 -0.84 0.02 0.00 0.00 0.00 0.00 60.65 59.93 2ews s ILE 14 Cb -0.14 -2.02 -0.01 0.00 0.01 0.00 0.00 42.46 40.30 2ews s ILE 14 CO 0.07 0.53 -0.18 -0.69 0.00 0.00 0.00 174.94 174.67 2ews s VAL 15 N 0.68 2.62 -0.19 2.92 1.01 0.69 -1.01 120.40 127.12 2ews s VAL 15 Ca -0.09 -0.83 -0.02 0.00 0.00 0.00 0.00 61.98 61.05 2ews s VAL 15 Cb -0.16 -2.05 -0.00 0.00 0.00 0.00 0.00 36.38 34.17 2ews s VAL 15 CO 0.02 0.54 -0.09 -1.10 0.00 0.00 0.00 175.10 174.47 2ews s GLN 16 N 0.24 3.31 -0.32 2.72 -0.21 -0.71 -0.84 119.66 123.84 2ews s GLN 16 Ca -0.12 -0.68 -0.08 0.00 0.02 0.00 0.00 55.36 54.51 2ews s GLN 16 Cb -0.16 -2.84 0.02 0.00 1.00 0.00 0.00 33.01 31.03 2ews s GLN 16 CO 0.06 -0.11 0.12 -2.00 -2.12 0.00 0.00 175.29 171.24 2ews s GLU 17 N 1.18 2.93 0.00 2.91 2.12 0.17 -1.67 118.70 126.33 2ews s GLU 17 Ca 0.02 -0.98 0.00 0.00 0.36 0.00 0.00 54.97 54.37 2ews s GLU 17 Cb -0.14 -3.48 0.00 0.00 0.26 0.00 0.00 34.13 30.77 2ews s GLU 17 CO -0.03 -0.55 0.00 1.04 -0.54 0.00 0.00 175.26 175.18 2ews n GLN 18 N 4.88 0.87 0.18 4.30 6.02 0.11 -1.79 117.38 131.95 2ews n GLN 18 Ca -0.13 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.74 2ews n GLN 18 Cb 0.47 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.66 2ews n GLN 18 CO 0.00 0.00 0.00 0.38 -1.01 0.00 0.00 177.06 176.43 2ews h ASP 19 N 0.00 -0.43 -0.24 1.08 3.04 -2.00 -3.42 116.42 114.45 2ews h ASP 19 Ca 0.00 -0.12 -0.26 0.00 -3.24 0.00 0.00 57.03 53.41 2ews h ASP 19 Cb 0.00 0.11 -0.19 0.00 -1.04 0.00 0.00 39.33 38.21 2ews h ASP 19 CO 0.00 0.01 -0.52 0.59 -2.04 0.00 0.00 179.24 177.28 2ews n ASN 20 N -5.13 -1.67 -3.68 4.15 3.02 -1.26 -5.09 115.26 105.60 2ews n ASN 20 Ca -0.09 -3.13 -0.10 0.00 -0.03 0.00 0.00 54.58 51.23 2ews n ASN 20 Cb 0.27 1.22 -0.11 0.00 -0.61 0.00 0.00 39.78 40.55 2ews n ASN 20 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2ews s GLN 21 N -0.21 0.31 -0.03 3.52 2.00 -1.26 -5.17 119.66 118.82 2ews s GLN 21 Ca 0.24 0.84 0.07 0.00 -2.00 0.00 0.00 55.36 54.51 2ews s GLN 21 Cb 0.35 0.09 -0.02 0.00 0.80 0.00 0.00 33.01 34.23 2ews s GLN 21 CO -0.06 -0.21 -0.24 -0.98 -0.50 0.00 0.00 175.29 173.30 2ews s ARG 22 N 1.96 2.23 0.10 1.67 1.70 -1.26 0.09 118.95 125.44 2ews s ARG 22 Ca -0.05 -0.89 0.07 0.00 -0.47 0.00 0.00 55.73 54.38 2ews s ARG 22 Cb -0.10 -2.10 -0.04 0.00 -0.57 0.00 0.00 34.95 32.13 2ews s ARG 22 CO -0.12 0.54 -0.09 0.99 -1.08 0.00 0.00 175.30 175.55 2ews s THR 23 N -0.56 3.44 0.12 4.99 2.01 -0.67 -4.95 115.64 120.01 2ews s THR 23 Ca 0.08 -1.22 0.08 0.00 0.31 0.00 0.00 61.69 60.94 2ews s THR 23 Cb -0.11 -2.60 -0.04 0.00 0.01 0.00 0.00 72.50 69.76 2ews s THR 23 CO -0.00 0.13 -0.13 -0.36 -0.69 0.00 0.00 174.62 173.57 2ews s PHE 24 N -1.21 2.66 -0.25 4.92 0.40 -1.26 -1.73 117.98 121.50 2ews s PHE 24 Ca 0.22 -0.20 -0.16 0.00 -0.60 0.00 0.00 56.93 56.18 2ews s PHE 24 Cb -0.11 -1.38 0.07 0.00 0.51 0.00 0.00 43.02 42.11 2ews s PHE 24 CO 0.14 0.43 0.61 0.21 0.70 0.00 0.00 175.22 177.31 2ews s LYS 25 N -2.28 0.65 -0.02 0.44 2.47 -0.18 -5.02 119.74 115.79 2ews s LYS 25 Ca 0.21 1.05 0.06 0.00 -1.56 0.00 0.00 55.97 55.73 2ews s LYS 25 Cb -0.11 0.16 -0.02 0.00 -1.46 0.00 0.00 37.83 36.40 2ews s LYS 25 CO 0.13 -0.14 -0.20 0.99 0.16 0.00 0.00 175.35 176.29 2ews s THR 26 N 1.26 2.57 0.07 3.43 2.01 -1.26 0.04 115.64 123.76 2ews s THR 26 Ca -0.07 -0.97 0.01 0.00 0.31 0.00 0.00 61.69 60.97 2ews s THR 26 Cb -0.06 -1.97 -0.04 0.00 0.01 0.00 0.00 72.50 70.45 2ews s THR 26 CO -0.13 0.55 -0.05 -0.70 -0.69 0.00 0.00 174.62 173.59 2ews s GLU 27 N -0.78 0.67 0.25 4.92 2.56 -0.30 -4.98 118.70 121.03 2ews s GLU 27 Ca 0.11 -1.13 -0.30 0.00 0.00 0.00 0.00 54.97 53.66 2ews s GLU 27 Cb -0.10 -0.08 -0.09 0.00 2.00 0.00 0.00 34.13 35.86 2ews s GLU 27 CO 0.00 -0.03 1.03 -0.51 -0.56 0.00 0.00 175.26 175.19 2ews s LEU 28 N -2.59 4.58 0.58 2.70 1.43 -1.26 0.16 118.68 124.29 2ews s LEU 28 Ca 0.04 2.12 0.31 0.00 -1.03 0.00 0.00 54.13 55.56 2ews s LEU 28 Cb 0.02 -3.62 1.80 0.00 0.03 0.00 0.00 46.19 44.42 2ews s LEU 28 CO -0.05 -0.03 2.22 0.74 0.23 0.00 0.00 176.35 179.47 2ews h THR 29 N 3.20 0.47 0.00 5.49 2.02 -1.38 0.30 112.91 123.01 2ews h THR 29 Ca -0.46 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 66.59 2ews h THR 29 Cb 1.21 1.09 0.00 0.00 -1.74 0.00 0.00 68.15 68.71 2ews h THR 29 CO 0.68 0.03 0.00 0.07 0.37 0.00 0.00 175.52 176.67 2ews h LYS 30 N 0.00 0.00 -0.72 6.66 2.10 -1.90 -2.37 116.57 120.35 2ews h LYS 30 Ca -0.00 0.00 -0.42 0.00 -2.00 0.00 0.00 60.65 58.23 2ews h LYS 30 Cb 0.09 0.00 -0.24 0.00 -0.90 0.00 0.00 32.23 31.18 2ews h LYS 30 CO 0.00 0.00 0.25 0.09 -2.00 0.00 0.00 179.45 177.80 2ews n ASN 31 N -2.81 4.02 0.11 7.07 3.02 0.09 -4.65 115.26 122.13 2ews n ASN 31 Ca 0.01 -3.73 0.03 0.00 -0.03 0.00 0.00 54.58 50.86 2ews n ASN 31 Cb 0.28 -0.74 0.43 0.00 -0.61 0.00 0.00 39.78 39.15 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 1.11 1.14 -0.49 2.41 2.10 -1.48 -1.67 117.51 120.63 2ews h ILE 32 Ca 0.44 -0.54 -0.01 0.00 1.08 0.00 0.00 64.86 65.84 2ews h ILE 32 Cb 1.90 1.03 -0.02 0.00 -1.09 0.00 0.00 36.82 38.64 2ews h ILE 32 CO 0.87 0.18 0.27 0.44 -1.08 0.00 0.00 178.15 178.83 2ews h ASP 33 N 0.26 0.59 0.04 2.19 3.32 -1.86 -1.14 116.42 119.82 2ews h ASP 33 Ca 0.06 -0.03 -0.11 0.00 0.02 0.00 0.00 57.03 56.97 2ews h ASP 33 Cb 0.23 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 2ews h ASP 33 CO 0.01 0.47 -0.34 1.56 -1.72 0.00 0.00 179.24 179.22 2ews h GLN 34 N 0.67 0.42 -0.46 3.56 7.50 -1.68 0.66 115.11 125.79 2ews h GLN 34 Ca 0.17 -0.18 -0.12 0.00 0.50 0.00 0.00 58.65 59.02 2ews h GLN 34 Cb 0.01 -0.01 -0.01 0.00 0.05 0.00 0.00 27.48 27.51 2ews h GLN 34 CO -0.03 0.71 -0.18 0.28 -1.50 0.00 0.00 178.83 178.11 2ews h VAL 35 N 0.36 1.27 -0.11 -0.54 2.07 -1.08 -0.19 116.25 118.04 2ews h VAL 35 Ca 0.04 -1.33 -0.02 0.00 0.82 0.00 0.00 66.70 66.21 2ews h VAL 35 Cb 0.77 1.16 -0.00 0.00 -1.52 0.00 0.00 31.29 31.69 2ews h VAL 35 CO 0.06 0.46 -0.01 0.58 0.02 0.00 0.00 177.57 178.67 2ews h VAL 36 N 0.78 1.27 -0.63 2.57 2.07 -0.99 0.40 116.25 121.72 2ews h VAL 36 Ca 0.11 -0.89 0.12 0.00 0.82 0.00 0.00 66.70 66.85 2ews h VAL 36 Cb 0.75 1.65 -0.09 0.00 -1.52 0.00 0.00 31.29 32.08 2ews h VAL 36 CO 0.06 0.25 0.16 -0.33 0.02 0.00 0.00 177.57 177.74 2ews h GLU 37 N -0.10 0.29 0.56 1.57 5.08 -0.78 -1.20 114.58 119.99 2ews h GLU 37 Ca 0.03 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2ews h GLU 37 Cb 0.40 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2ews h GLU 37 CO 0.01 0.19 -0.39 2.35 -1.00 0.00 0.00 179.01 180.16 2ews h TRP 38 N 0.30 -1.06 -0.57 4.33 7.01 -0.71 -2.92 115.95 122.33 2ews h TRP 38 Ca 0.33 -0.00 0.12 0.00 2.11 0.00 0.00 58.89 61.44 2ews h TRP 38 Cb 0.49 0.39 -0.09 0.00 -2.10 0.00 0.00 29.16 27.85 2ews h TRP 38 CO -0.23 -0.58 0.01 -0.07 -2.79 0.00 0.00 178.44 174.78 2ews h LEU 39 N -0.92 -0.23 -0.82 0.65 3.38 -0.22 -1.90 115.31 115.25 2ews h LEU 39 Ca -0.06 0.14 0.06 0.00 0.09 0.00 0.00 57.88 58.11 2ews h LEU 39 Cb 0.77 0.24 -0.06 0.00 0.09 0.00 0.00 40.66 41.70 2ews h LEU 39 CO 0.03 -0.09 0.50 0.78 0.09 0.00 0.00 178.44 179.75 2ews h ASN 40 N 0.13 0.78 0.00 -0.43 2.35 -1.20 -0.79 115.58 116.43 2ews h ASN 40 Ca 0.30 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 56.07 2ews h ASN 40 Cb 0.47 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.69 2ews h ASN 40 CO -0.48 0.50 0.00 0.00 -1.65 0.00 0.00 177.43 175.80 2ews n GLN 41 N -4.65 0.99 -4.39 0.81 3.00 -0.72 -4.82 117.38 107.59 2ews n GLN 41 Ca 0.12 0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 56.89 2ews n GLN 41 Cb 0.18 -1.35 -0.10 0.00 0.00 0.00 0.00 30.24 28.96 2ews n GLN 41 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.06 175.92 2ews s GLN 42 N -0.70 1.46 -0.42 -1.09 2.00 -0.30 -5.05 119.66 115.55 2ews s GLN 42 Ca 0.00 -1.62 -0.10 0.00 -2.00 0.00 0.00 55.36 51.64 2ews s GLN 42 Cb 0.00 -1.45 0.08 0.00 0.80 0.00 0.00 33.01 32.44 2ews s GLN 42 CO 0.00 0.27 0.27 -0.65 -0.50 0.00 0.00 175.29 174.68 2ews s GLN 43 N -3.37 2.63 -0.15 1.67 -1.52 -1.26 -5.03 119.66 112.63 2ews s GLN 43 Ca 0.24 -1.46 0.01 0.00 -1.95 0.00 0.00 55.36 52.20 2ews s GLN 43 Cb -0.04 -3.81 0.00 0.00 -0.22 0.00 0.00 33.01 28.94 2ews s GLN 43 CO 0.10 -0.97 -0.17 0.42 -0.25 0.00 0.00 175.29 174.42 2ews s ILE 44 N 1.44 2.50 0.21 1.08 1.01 -1.26 -3.84 121.20 122.34 2ews s ILE 44 Ca 0.03 -0.83 0.10 0.00 0.00 0.00 0.00 60.65 59.95 2ews s ILE 44 Cb -0.23 -2.04 -0.08 0.00 0.01 0.00 0.00 42.46 40.12 2ews s ILE 44 CO 0.02 0.52 1.51 -0.08 0.00 0.00 0.00 174.94 176.91 2ews h GLU 45 N 7.29 0.00 -1.94 2.79 4.81 -0.36 -3.46 114.58 123.71 2ews h GLU 45 Ca -0.32 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 58.94 2ews h GLU 45 Cb 1.19 0.00 -0.22 0.00 0.63 0.00 0.00 28.75 30.35 2ews h GLU 45 CO 0.56 0.73 0.08 0.21 -0.73 0.00 0.00 179.01 179.86 2ews s LYS 46 N -3.31 0.67 -0.15 1.92 2.20 -1.09 -5.00 119.74 114.99 2ews s LYS 46 Ca -0.00 1.13 0.00 0.00 -0.36 0.00 0.00 55.97 56.74 2ews s LYS 46 Cb 0.12 0.15 0.03 0.00 -1.51 0.00 0.00 37.83 36.61 2ews s LYS 46 CO 0.78 -0.14 -0.13 -1.17 -0.36 0.00 0.00 175.35 174.33 2ews s LEU 47 N 1.50 1.71 -0.09 5.43 2.96 -1.26 -0.03 118.68 128.89 2ews s LEU 47 Ca -0.09 -0.52 0.04 0.00 -0.22 0.00 0.00 54.13 53.34 2ews s LEU 47 Cb -0.05 -1.15 -0.00 0.00 0.50 0.00 0.00 46.19 45.49 2ews s LEU 47 CO -0.18 -0.08 -0.24 0.00 -1.32 0.00 0.00 176.35 174.54 2ews s LEU 49 N 0.26 2.57 0.28 0.00 1.43 0.88 -0.87 118.68 123.23 2ews s LEU 49 Ca -0.16 -0.96 -0.20 0.00 -1.03 0.00 0.00 54.13 51.77 2ews s LEU 49 Cb -0.17 -1.15 0.04 0.00 0.03 0.00 0.00 46.19 44.94 2ews s LEU 49 CO 0.08 0.06 0.80 0.28 0.23 0.00 0.00 176.35 177.80 2ews s THR 50 N -2.26 0.00 0.00 5.49 -1.32 -0.28 -0.53 115.64 116.74 2ews s THR 50 Ca 0.27 -0.92 0.00 0.00 -1.21 0.00 0.00 61.69 59.84 2ews s THR 50 Cb -0.06 -2.27 0.00 0.00 -1.51 0.00 0.00 72.50 68.67 2ews s THR 50 CO 0.14 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.16 2ews n GLY 51 N -0.49 1.60 0.33 6.08 0.00 -1.26 -0.18 105.19 111.27 2ews n GLY 51 Ca -0.05 -1.85 0.22 0.00 0.00 0.00 0.00 46.02 44.34 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 -2.34 -0.02 0.00 -1.81 -2.44 103.07 96.46 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 -3.11 4.12 -0.15 0.19 3.02 -0.24 -4.52 115.26 114.58 2ews n ASN 53 Ca -0.03 -2.42 -0.05 0.00 -0.03 0.00 0.00 54.58 52.05 2ews n ASN 53 Cb 0.09 -0.48 0.03 0.00 -0.61 0.00 0.00 39.78 38.81 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 3.18 0.57 -1.00 5.41 0.00 -1.60 -2.62 119.26 123.21 2ews h ALA 54 Ca 0.00 0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.02 2ews h ALA 54 Cb 1.25 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.89 2ews h ALA 54 CO 0.16 -0.12 0.64 0.78 0.00 0.00 0.00 179.25 180.71 2ews h GLY 55 N 0.46 1.58 1.00 0.00 0.00 -1.82 0.64 103.07 104.93 2ews h GLY 55 Ca 0.20 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2ews h GLY 55 CO -0.13 0.23 0.40 -2.08 0.00 0.00 0.00 176.54 174.96 2ews h VAL 56 N 1.06 1.17 -0.24 4.60 2.07 -1.79 -1.95 116.25 121.18 2ews h VAL 56 Ca 0.47 -0.34 -0.06 0.00 0.82 0.00 0.00 66.70 67.59 2ews h VAL 56 Cb 0.37 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 2ews h VAL 56 CO -0.23 0.17 -0.09 0.40 0.02 0.00 0.00 177.57 177.85 2ews h ILE 57 N 0.85 1.29 -0.47 4.57 2.04 -1.10 -3.21 117.51 121.47 2ews h ILE 57 Ca 0.23 -1.13 0.05 0.00 1.00 0.00 0.00 64.86 65.01 2ews h ILE 57 Cb -0.07 1.53 -0.04 0.00 -0.74 0.00 0.00 36.82 37.50 2ews h ILE 57 CO -0.05 0.35 0.22 0.00 0.00 0.00 0.00 178.15 178.67 2ews h ALA 58 N 0.74 0.59 -0.01 1.87 0.00 -0.66 -2.29 119.26 119.49 2ews h ALA 58 Ca 0.06 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2ews h ALA 58 Cb 0.57 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2ews h ALA 58 CO 0.03 -0.15 0.00 -0.85 0.00 0.00 0.00 179.25 178.28 2ews n GLU 59 N -4.93 1.07 0.00 0.00 0.28 -0.75 -3.67 120.64 112.63 2ews n GLU 59 Ca 0.04 -0.10 0.00 0.00 -0.16 0.00 0.00 57.16 56.94 2ews n GLU 59 Cb 0.14 -1.35 0.00 0.00 1.43 0.00 0.00 31.44 31.66 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 -0.74 0.49 -4.95 -1.84 3.02 -0.91 -5.04 115.26 105.29 2ews n ASN 60 Ca 0.16 -0.75 -0.23 0.00 -0.03 0.00 0.00 54.58 53.74 2ews n ASN 60 Cb 0.10 0.43 0.02 0.00 -0.61 0.00 0.00 39.78 39.72 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 -0.43 3.46 -2.01 2.41 -4.36 -0.93 -4.99 121.20 114.36 2ews s ILE 61 Ca 0.00 -0.47 0.17 0.00 -0.26 0.00 0.00 60.65 60.09 2ews s ILE 61 Cb 0.00 -3.31 0.48 0.00 1.25 0.00 0.00 42.46 40.88 2ews s ILE 61 CO 0.00 -0.23 1.40 -0.46 0.24 0.00 0.00 174.94 175.89 2ews n ASN 62 N -2.27 2.88 -4.10 4.36 0.23 -1.26 -4.91 115.26 110.19 2ews n ASN 62 Ca 0.04 -2.00 -0.14 0.00 -0.53 0.00 0.00 54.58 51.96 2ews n ASN 62 Cb 0.58 -0.36 -0.11 0.00 -2.08 0.00 0.00 39.78 37.81 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 -1.29 0.70 0.14 1.53 -4.36 -1.26 -5.13 121.20 111.54 2ews s ILE 63 Ca 0.36 -1.24 -0.31 0.00 -0.26 0.00 0.00 60.65 59.20 2ews s ILE 63 Cb 0.19 -0.85 -0.08 0.00 1.25 0.00 0.00 42.46 42.96 2ews s ILE 63 CO 0.25 -0.41 1.37 -2.16 0.24 0.00 0.00 174.94 174.23 2ews s PRO 64 N -1.91 4.34 0.20 0.37 0.04 -1.26 -5.02 135.00 131.75 2ews s PRO 64 Ca -0.05 2.08 0.11 0.00 0.04 0.00 0.00 61.00 63.18 2ews s PRO 64 Cb -0.08 -3.23 -0.04 0.00 0.04 0.00 0.00 34.50 31.19 2ews s PRO 64 CO 0.00 -0.39 -0.22 0.00 0.04 0.00 0.00 177.00 176.44 2ews s ALA 65 N 0.78 2.44 -0.18 8.56 0.00 -1.26 -4.70 121.76 127.40 2ews s ALA 65 Ca 0.62 -1.65 -0.07 0.00 0.00 0.00 0.00 51.96 50.86 2ews s ALA 65 Cb -0.37 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.43 2ews s ALA 65 CO 0.33 0.35 0.06 -0.65 0.00 0.00 0.00 175.76 175.85 2ews s GLN 66 N -2.87 3.97 -0.16 0.00 1.11 -0.84 -4.98 119.66 115.89 2ews s GLN 66 Ca 0.21 -0.35 -0.04 0.00 0.01 0.00 0.00 55.36 55.19 2ews s GLN 66 Cb -0.07 -3.21 -0.03 0.00 -1.01 0.00 0.00 33.01 28.69 2ews s GLN 66 CO 0.10 0.27 -0.02 0.42 0.01 0.00 0.00 175.29 176.06 2ews s ILE 67 N 0.38 4.04 0.26 1.08 1.01 -1.26 -0.09 121.20 126.63 2ews s ILE 67 Ca 0.03 -0.31 0.12 0.00 0.00 0.00 0.00 60.65 60.49 2ews s ILE 67 Cb -0.12 -2.78 -0.05 0.00 0.01 0.00 0.00 42.46 39.52 2ews s ILE 67 CO 0.00 0.49 -0.20 -0.36 0.00 0.00 0.00 174.94 174.87 2ews s PHE 68 N 0.31 2.27 -0.03 3.97 0.40 0.31 -4.97 117.98 120.24 2ews s PHE 68 Ca -0.03 -0.34 -0.30 0.00 -0.60 0.00 0.00 56.93 55.66 2ews s PHE 68 Cb -0.14 -1.01 -0.04 0.00 0.51 0.00 0.00 43.02 42.34 2ews s PHE 68 CO 0.02 0.67 1.26 0.08 0.70 0.00 0.00 175.22 177.95 2ews s VAL 69 N -2.39 4.08 0.25 -0.44 1.01 -1.26 -4.39 120.40 117.25 2ews s VAL 69 Ca 0.28 1.43 -0.04 0.00 0.00 0.00 0.00 61.98 63.65 2ews s VAL 69 Cb -0.05 -3.92 0.22 0.00 0.00 0.00 0.00 36.38 32.62 2ews s VAL 69 CO 0.14 0.01 1.78 -0.08 0.00 0.00 0.00 175.10 176.95 2ews h GLU 70 N 7.50 0.66 -0.36 2.72 4.22 -1.94 0.13 114.58 127.50 2ews h GLU 70 Ca -0.36 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.04 2ews h GLU 70 Cb 1.17 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 2ews h GLU 70 CO 0.88 0.43 0.23 0.74 -2.18 0.00 0.00 179.01 179.12 2ews h PHE 71 N 0.68 0.45 -0.16 0.92 0.04 -1.99 0.18 116.94 117.06 2ews h PHE 71 Ca 0.41 0.01 -0.17 0.00 2.80 0.00 0.00 57.97 61.02 2ews h PHE 71 Cb 0.47 -0.15 -0.00 0.00 2.20 0.00 0.00 35.95 38.47 2ews h PHE 71 CO -0.09 0.29 -0.60 -0.44 -0.60 0.00 0.00 178.31 176.87 2ews h ASP 72 N 0.48 0.61 -0.00 2.17 3.32 -1.85 -1.90 116.42 119.25 2ews h ASP 72 Ca 0.13 -0.34 -0.00 0.00 0.02 0.00 0.00 57.03 56.84 2ews h ASP 72 Cb -0.05 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.32 2ews h ASP 72 CO -0.03 1.07 0.00 0.00 -1.72 0.00 0.00 179.24 178.56 2ews h ALA 73 N 0.94 0.00 -0.39 3.45 0.00 -0.40 -0.76 119.26 122.11 2ews h ALA 73 Ca -0.00 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.85 2ews h ALA 73 Cb 1.15 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 2ews h ALA 73 CO 0.11 -0.41 0.18 0.00 0.00 0.00 0.00 179.25 179.14 2ews h ALA 74 N 0.82 0.48 -0.24 0.00 0.00 -0.64 0.75 119.26 120.44 2ews h ALA 74 Ca 0.00 0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.97 2ews h ALA 74 Cb 0.18 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2ews h ALA 74 CO -0.00 -0.19 0.03 1.03 0.00 0.00 0.00 179.25 180.12 2ews h SER 75 N 0.38 -0.02 0.12 0.00 0.87 -1.20 0.31 113.55 114.01 2ews h SER 75 Ca 0.17 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.77 2ews h SER 75 Cb 0.10 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.12 2ews h SER 75 CO -0.13 0.02 -0.06 -0.61 -0.53 0.00 0.00 176.83 175.51 2ews h GLN 76 N 0.12 -0.17 -0.70 2.24 5.75 -0.76 -0.68 115.11 120.91 2ews h GLN 76 Ca 0.11 0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.58 2ews h GLN 76 Cb 0.12 0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.67 2ews h GLN 76 CO -0.16 -0.11 0.27 0.78 -2.65 0.00 0.00 178.83 176.96 2ews h GLY 77 N -0.17 1.11 0.91 2.39 0.00 -0.59 -2.43 103.07 104.28 2ews h GLY 77 Ca -0.02 -0.59 -0.06 0.00 0.00 0.00 0.00 47.33 46.67 2ews h GLY 77 CO 0.02 0.55 0.00 -2.00 0.00 0.00 0.00 176.54 175.12 2ews h LEU 78 N 1.01 0.60 -2.10 3.11 5.85 -0.21 -1.10 115.31 122.47 2ews h LEU 78 Ca 0.23 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 2ews h LEU 78 Cb 0.20 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.07 2ews h LEU 78 CO -0.02 0.76 -0.05 1.23 -0.34 0.00 0.00 178.44 180.02 2ews h GLY 79 N 0.42 0.00 0.83 3.75 0.00 -0.92 -0.12 103.07 107.03 2ews h GLY 79 Ca 0.10 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.22 2ews h GLY 79 CO 0.02 0.00 -0.88 -2.22 0.00 0.00 0.00 176.54 173.46 2ews h ILE 80 N 0.00 1.45 0.00 2.60 2.04 -1.15 -2.67 117.51 119.77 2ews h ILE 80 Ca -0.00 -2.44 -0.02 0.00 1.00 0.00 0.00 64.86 63.40 2ews h ILE 80 Cb 0.10 3.00 -0.00 0.00 -0.74 0.00 0.00 36.82 39.18 2ews h ILE 80 CO 0.01 0.71 -0.10 -0.07 0.00 0.00 0.00 178.15 178.69 2ews h LEU 81 N -0.19 0.00 0.03 1.44 3.38 -0.33 -1.04 115.31 118.61 2ews h LEU 81 Ca -0.14 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 2ews h LEU 81 Cb 1.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.40 2ews h LEU 81 CO 0.17 0.10 -0.01 -0.07 0.09 0.00 0.00 178.44 178.72 2ews h LEU 82 N 0.00 -0.03 -0.92 1.67 3.38 -1.09 -2.63 115.31 115.69 2ews h LEU 82 Ca -0.00 0.00 0.26 0.00 0.09 0.00 0.00 57.88 58.23 2ews h LEU 82 Cb 0.29 0.01 -0.14 0.00 0.09 0.00 0.00 40.66 40.91 2ews h LEU 82 CO 0.01 0.37 0.36 0.11 0.09 0.00 0.00 178.44 179.39 2ews h LYS 83 N -0.83 0.27 0.71 1.13 1.79 -1.38 -0.12 116.57 118.13 2ews h LYS 83 Ca -0.00 -0.02 -0.03 0.00 -2.18 0.00 0.00 60.65 58.42 2ews h LYS 83 Cb 0.03 -0.06 0.01 0.00 -1.58 0.00 0.00 32.23 30.63 2ews h LYS 83 CO 0.01 0.18 -0.34 0.93 -1.08 0.00 0.00 179.45 179.14 2ews h GLU 84 N 0.28 -0.92 -0.55 3.15 5.08 -1.31 -2.87 114.58 117.43 2ews h GLU 84 Ca 0.61 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 59.03 2ews h GLU 84 Cb 1.27 0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.73 2ews h GLU 84 CO -0.62 -0.61 0.00 1.04 -1.00 0.00 0.00 179.01 177.81 2ews n GLN 85 N -4.80 0.37 -0.98 2.33 6.02 -0.19 -4.77 117.38 115.37 2ews n GLN 85 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.87 2ews n GLN 85 Cb 0.38 -1.20 0.00 0.00 1.02 0.00 0.00 30.24 30.43 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 0.39 0.83 3.50 1.08 0.00 -0.59 -5.00 105.19 105.40 2ews n GLY 86 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -3.31 3.10 -0.41 1.61 3.76 -0.45 -4.95 115.29 114.64 2ews s HIS 87 Ca 0.00 -0.18 -0.06 0.00 -0.15 0.00 0.00 55.06 54.67 2ews s HIS 87 Cb 0.00 -3.20 0.09 0.00 1.11 0.00 0.00 32.58 30.59 2ews s HIS 87 CO 0.00 -0.82 0.22 0.34 -0.85 0.00 0.00 174.74 173.63 2ews s ASP 88 N 1.95 5.42 -0.08 1.40 2.15 -1.26 -3.36 116.67 122.88 2ews s ASP 88 Ca 0.19 -1.74 0.04 0.00 0.43 0.00 0.00 52.55 51.47 2ews s ASP 88 Cb -0.15 -1.90 -0.00 0.00 -0.30 0.00 0.00 42.92 40.57 2ews s ASP 88 CO 0.17 -0.53 -0.22 -0.76 -0.17 0.00 0.00 175.17 173.65 2ews s LEU 89 N 1.29 2.02 0.56 -1.34 1.43 -1.26 -5.01 118.68 116.37 2ews s LEU 89 Ca 0.04 -0.51 0.25 0.00 -1.03 0.00 0.00 54.13 52.89 2ews s LEU 89 Cb -0.23 -1.31 1.63 0.00 0.03 0.00 0.00 46.19 46.31 2ews s LEU 89 CO -0.01 0.16 2.21 0.00 0.23 0.00 0.00 176.35 178.94 2ews h ALA 90 N 6.59 1.66 -1.71 4.21 0.00 -1.97 -3.46 119.26 124.58 2ews h ALA 90 Ca -0.24 -0.01 0.29 0.00 0.00 0.00 0.00 54.91 54.96 2ews h ALA 90 Cb 1.22 -0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.90 2ews h ALA 90 CO 0.47 0.01 0.75 0.16 0.00 0.00 0.00 179.25 180.64 2ews s ASP 91 N -6.45 -0.08 -0.13 0.00 3.84 -1.26 -3.67 116.67 108.92 2ews s ASP 91 Ca -0.05 -0.21 -0.34 0.00 -0.00 0.00 0.00 52.55 51.95 2ews s ASP 91 Cb 0.16 0.24 0.15 0.00 -1.38 0.00 0.00 42.92 42.08 2ews s ASP 91 CO 0.59 -0.45 1.41 -0.72 -0.00 0.00 0.00 175.17 176.00 2ews s TYR 92 N -2.58 -0.01 -0.13 2.11 -0.85 -0.76 -4.60 117.35 110.54 2ews s TYR 92 Ca 0.15 -0.01 -0.02 0.00 -0.52 0.00 0.00 57.07 56.67 2ews s TYR 92 Cb 0.03 0.51 -0.03 0.00 0.38 0.00 0.00 41.96 42.85 2ews s TYR 92 CO -0.02 -0.05 -0.05 0.42 -1.52 0.00 0.00 175.55 174.33 2ews s ILE 93 N -2.08 3.79 -0.02 -3.49 -1.09 -0.58 -0.15 121.20 117.58 2ews s ILE 93 Ca 0.14 -0.41 0.08 0.00 -2.23 0.00 0.00 60.65 58.23 2ews s ILE 93 Cb 0.06 -2.62 -0.02 0.00 -1.58 0.00 0.00 42.46 38.29 2ews s ILE 93 CO -0.06 0.53 -0.25 0.72 -1.23 0.00 0.00 174.94 174.65 2ews s PHE 94 N -0.01 2.27 -0.23 3.97 -0.12 0.11 -0.57 117.98 123.40 2ews s PHE 94 Ca 0.00 -0.44 -0.04 0.00 -0.05 0.00 0.00 56.93 56.41 2ews s PHE 94 Cb -0.13 -1.46 -0.00 0.00 -0.63 0.00 0.00 43.02 40.79 2ews s PHE 94 CO 0.03 -0.05 -0.05 0.00 -0.05 0.00 0.00 175.22 175.10 2ews s ALA 95 N -0.57 2.79 -0.57 1.99 0.00 0.30 -1.49 121.76 124.21 2ews s ALA 95 Ca 0.09 -1.22 -0.17 0.00 0.00 0.00 0.00 51.96 50.65 2ews s ALA 95 Cb -0.10 -1.70 0.12 0.00 0.00 0.00 0.00 23.12 21.44 2ews s ALA 95 CO -0.01 -0.50 0.61 1.21 0.00 0.00 0.00 175.76 177.07 2ews s ASN 96 N 1.45 6.20 -1.08 0.00 3.84 -0.02 -1.48 114.94 123.86 2ews s ASN 96 Ca 0.05 -1.65 -0.16 0.00 0.21 0.00 0.00 52.86 51.31 2ews s ASN 96 Cb -0.15 -2.25 0.15 0.00 -0.55 0.00 0.00 41.25 38.45 2ews s ASN 96 CO -0.04 -0.97 1.29 -0.69 -2.79 0.00 0.00 177.10 173.90 2ews s VAL 97 N 2.08 4.87 0.00 -5.21 1.01 0.88 -1.98 120.40 122.05 2ews s VAL 97 Ca 0.07 -2.12 0.00 0.00 0.00 0.00 0.00 61.98 59.94 2ews s VAL 97 Cb -0.27 -4.85 0.00 0.00 0.00 0.00 0.00 36.38 31.26 2ews s VAL 97 CO 0.04 -1.58 0.00 0.61 0.00 0.00 0.00 175.10 174.18 2ews n GLY 98 N 4.80 0.82 0.12 4.51 0.00 -1.26 -2.74 105.19 111.44 2ews n GLY 98 Ca 0.31 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.22 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 1.15 -3.99 2.61 2.02 -1.93 0.56 112.91 113.32 2ews h THR 99 Ca 0.00 -0.46 0.00 0.00 0.77 0.00 0.00 66.41 66.72 2ews h THR 99 Cb 0.00 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.48 2ews h THR 99 CO 0.00 0.15 0.00 0.61 0.37 0.00 0.00 175.52 176.65 2ews n GLY 100 N -0.75 4.21 3.13 2.16 0.00 -1.26 -1.10 105.19 111.58 2ews n GLY 100 Ca -0.04 -2.21 -0.29 0.00 0.00 0.00 0.00 46.02 43.49 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 -0.98 1.66 -0.06 2.61 2.01 0.14 -4.52 115.64 116.49 2ews s THR 101 Ca 0.00 -0.79 0.03 0.00 0.31 0.00 0.00 61.69 61.24 2ews s THR 101 Cb 0.00 -1.46 -0.02 0.00 0.01 0.00 0.00 72.50 71.02 2ews s THR 101 CO 0.00 0.47 -0.14 -0.55 -0.69 0.00 0.00 174.62 173.72 2ews s SER 102 N 0.50 4.06 -0.13 3.53 0.15 -0.84 -0.17 113.70 120.80 2ews s SER 102 Ca -0.17 -0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.28 2ews s SER 102 Cb -0.17 -0.97 -0.01 0.00 -1.71 0.00 0.00 66.02 63.16 2ews s SER 102 CO 0.06 0.32 -0.14 -0.76 1.20 0.00 0.00 173.24 173.93 2ews s LEU 103 N -0.59 2.65 0.05 3.45 1.43 0.82 -0.84 118.68 125.65 2ews s LEU 103 Ca 0.08 -0.36 0.05 0.00 -1.03 0.00 0.00 54.13 52.87 2ews s LEU 103 Cb -0.11 -1.59 -0.02 0.00 0.03 0.00 0.00 46.19 44.49 2ews s LEU 103 CO 0.01 0.16 -0.13 -1.00 0.23 0.00 0.00 176.35 175.62 2ews s HIS 104 N 0.39 1.13 -0.27 0.29 3.76 -0.55 -0.48 115.29 119.57 2ews s HIS 104 Ca -0.11 -0.38 -0.03 0.00 -0.15 0.00 0.00 55.06 54.39 2ews s HIS 104 Cb -0.16 -0.67 0.02 0.00 1.11 0.00 0.00 32.58 32.89 2ews s HIS 104 CO 0.06 0.03 -0.01 -0.47 -0.85 0.00 0.00 174.74 173.49 2ews s TYR 105 N -0.97 3.11 -0.37 1.40 5.04 0.82 -0.72 117.35 125.66 2ews s TYR 105 Ca -0.00 -1.42 -0.17 0.00 -2.44 0.00 0.00 57.07 53.04 2ews s TYR 105 Cb -0.08 -2.12 0.00 0.00 0.35 0.00 0.00 41.96 40.10 2ews s TYR 105 CO 0.01 -0.69 0.46 0.12 -1.34 0.00 0.00 175.55 174.11 2ews s PHE 106 N 1.37 3.18 -2.07 4.97 5.36 0.78 -1.97 117.98 129.60 2ews s PHE 106 Ca 0.00 -0.04 0.20 0.00 -0.96 0.00 0.00 56.93 56.13 2ews s PHE 106 Cb -0.17 -2.87 1.04 0.00 -0.34 0.00 0.00 43.02 40.68 2ews s PHE 106 CO -0.02 -0.57 1.68 -0.40 -1.46 0.00 0.00 175.22 174.45 2ews n ASP 107 N 5.64 0.43 0.00 6.13 3.85 -0.86 -1.82 116.55 129.91 2ews n ASP 107 Ca -0.06 -1.48 0.00 0.00 -0.71 0.00 0.00 54.79 52.53 2ews n ASP 107 Cb 0.49 -0.03 0.00 0.00 -1.35 0.00 0.00 41.12 40.23 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 0.88 1.71 0.28 6.12 0.00 -1.24 -4.77 105.19 108.18 2ews n GLY 108 Ca 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.16 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 -0.19 0.04 -4.39 1.61 6.02 -1.26 -5.04 117.38 114.17 2ews n GLN 109 Ca 0.00 0.01 -0.20 0.00 -0.01 0.00 0.00 57.00 56.81 2ews n GLN 109 Cb 0.00 -0.44 -0.10 0.00 1.02 0.00 0.00 30.24 30.72 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 -4.43 1.84 0.36 1.08 1.04 -1.26 -5.11 113.70 107.22 2ews s SER 110 Ca -0.02 -1.48 0.01 0.00 0.48 0.00 0.00 55.95 54.94 2ews s SER 110 Cb 0.00 0.23 -0.03 0.00 0.10 0.00 0.00 66.02 66.33 2ews s SER 110 CO 0.03 -0.78 0.55 0.00 0.98 0.00 0.00 173.24 174.02 2ews s GLN 111 N -3.88 3.38 -0.16 4.02 1.03 -1.26 -2.02 119.66 120.77 2ews s GLN 111 Ca 0.34 -0.43 -0.09 0.00 0.04 0.00 0.00 55.36 55.23 2ews s GLN 111 Cb 0.06 -2.67 0.06 0.00 0.03 0.00 0.00 33.01 30.49 2ews s GLN 111 CO 0.15 0.08 0.39 0.50 -2.54 0.00 0.00 175.29 173.87 2ews s ARG 112 N -4.33 0.36 0.04 9.60 3.52 -0.83 -4.96 118.95 122.34 2ews s ARG 112 Ca 0.41 0.75 -0.30 0.00 -0.13 0.00 0.00 55.73 56.46 2ews s ARG 112 Cb -0.10 -0.04 -0.05 0.00 -1.56 0.00 0.00 34.95 33.21 2ews s ARG 112 CO 0.36 -0.16 1.10 0.50 -0.81 0.00 0.00 175.30 176.29 2ews s ARG 113 N 1.39 4.49 0.00 5.12 3.52 -1.26 -0.13 118.95 132.08 2ews s ARG 113 Ca -0.09 1.62 0.00 0.00 -0.13 0.00 0.00 55.73 57.12 2ews s ARG 113 Cb -0.09 -3.40 0.00 0.00 -1.56 0.00 0.00 34.95 29.91 2ews s ARG 113 CO -0.12 -0.16 0.37 1.33 -0.81 0.00 0.00 175.30 175.90 2ews n VAL 114 N 3.89 0.00 -3.62 7.11 0.24 0.37 -4.90 118.33 121.42 2ews n VAL 114 Ca 0.08 -0.43 -0.00 0.00 -2.04 0.00 0.00 64.34 61.94 2ews n VAL 114 Cb 0.48 1.13 -0.01 0.00 -1.47 0.00 0.00 33.84 33.97 2ews n VAL 114 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2ews s GLY 115 N -0.12 -0.37 -0.27 7.63 0.00 -0.94 -4.99 107.32 108.26 2ews s GLY 115 Ca 0.00 0.87 -0.25 0.00 0.00 0.00 0.00 44.72 45.34 2ews s GLY 115 CO 0.00 0.21 0.96 -0.32 0.00 0.00 0.00 173.10 173.95 2ews s GLY 116 N -2.78 -0.25 0.01 0.20 0.00 -1.26 -0.13 107.32 103.12 2ews s GLY 116 Ca 0.13 2.47 -0.04 0.00 0.00 0.00 0.00 44.72 47.28 2ews s GLY 116 CO -0.04 1.75 0.06 -1.50 0.00 0.00 0.00 173.10 173.37 2ews s ILE 117 N 0.15 0.10 -1.86 0.90 1.10 0.76 -4.99 121.20 117.35 2ews s ILE 117 Ca 0.02 -0.83 0.26 0.00 -0.51 0.00 0.00 60.65 59.59 2ews s ILE 117 Cb -0.05 -0.39 0.68 0.00 0.15 0.00 0.00 42.46 42.86 2ews s ILE 117 CO -0.04 -0.46 1.91 0.61 -2.11 0.00 0.00 174.94 174.86 2ews n GLY 118 N 1.46 -0.90 3.62 1.50 0.00 -1.26 -0.69 105.19 108.93 2ews n GLY 118 Ca -0.23 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.14 4.94 0.00 2.61 -4.23 -1.26 -4.65 115.64 110.91 2ews s THR 119 Ca 0.36 1.14 0.00 0.00 -1.18 0.00 0.00 61.69 62.01 2ews s THR 119 Cb 0.18 -3.99 0.00 0.00 1.34 0.00 0.00 72.50 70.03 2ews s THR 119 CO 0.33 -0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.97 2ews n GLY 120 N 4.16 1.79 0.22 3.99 0.00 -1.26 -3.98 105.19 110.11 2ews n GLY 120 Ca 0.01 -0.27 0.03 0.00 0.00 0.00 0.00 46.02 45.78 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 0.17 1.04 -0.02 0.00 -0.81 -1.86 103.07 101.59 2ews h GLY 121 Ca 0.00 -0.11 -0.07 0.00 0.00 0.00 0.00 47.33 47.15 2ews h GLY 121 CO 0.00 0.10 0.12 -1.33 0.00 0.00 0.00 176.54 175.43 2ews h GLY 122 N 0.80 1.11 0.93 4.60 0.00 -1.24 -1.94 103.07 107.33 2ews h GLY 122 Ca 0.03 -0.73 -0.07 0.00 0.00 0.00 0.00 47.33 46.56 2ews h GLY 122 CO 0.03 0.68 -0.04 1.98 0.00 0.00 0.00 176.54 179.19 2ews h MET 123 N 0.95 0.65 -0.47 4.80 -1.53 -1.66 0.91 114.93 118.59 2ews h MET 123 Ca 0.19 -0.23 0.08 0.00 -3.44 0.00 0.00 59.70 56.30 2ews h MET 123 Cb 0.41 -0.05 -0.06 0.00 -0.55 0.00 0.00 31.60 31.35 2ews h MET 123 CO 0.01 0.79 0.09 0.82 0.14 0.00 0.00 176.91 178.76 2ews h ILE 124 N 0.45 0.74 -0.10 1.77 2.04 -1.18 0.42 117.51 121.65 2ews h ILE 124 Ca 0.10 -0.08 -0.04 0.00 1.00 0.00 0.00 64.86 65.84 2ews h ILE 124 Cb 0.52 0.50 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 2ews h ILE 124 CO 0.03 0.04 -0.08 1.56 0.00 0.00 0.00 178.15 179.70 2ews h GLN 125 N 0.22 0.24 0.02 2.37 4.20 -1.15 -0.61 115.11 120.40 2ews h GLN 125 Ca 0.23 -0.12 -0.00 0.00 0.06 0.00 0.00 58.65 58.82 2ews h GLN 125 Cb 0.30 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.08 2ews h GLN 125 CO -0.31 0.63 -0.01 0.78 -0.67 0.00 0.00 178.83 179.25 2ews h GLY 126 N -0.15 -0.03 1.77 3.46 0.00 -0.53 -0.92 103.07 106.66 2ews h GLY 126 Ca 0.02 0.01 -0.14 0.00 0.00 0.00 0.00 47.33 47.22 2ews h GLY 126 CO 0.02 -0.01 -0.58 -2.00 0.00 0.00 0.00 176.54 173.97 2ews h LEU 127 N -0.47 0.27 -0.89 3.11 5.85 -0.31 -2.33 115.31 120.53 2ews h LEU 127 Ca -0.00 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.58 2ews h LEU 127 Cb 0.45 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.35 2ews h LEU 127 CO 0.01 0.79 0.59 1.23 -0.34 0.00 0.00 178.44 180.71 2ews h GLY 128 N 1.45 1.27 0.82 3.75 0.00 -1.08 -1.87 103.07 107.40 2ews h GLY 128 Ca -0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 2ews h GLY 128 CO 0.09 0.44 0.02 -1.82 0.00 0.00 0.00 176.54 175.28 2ews h TYR 129 N 1.20 0.30 -0.00 5.60 3.20 -0.90 -1.85 116.97 124.51 2ews h TYR 129 Ca 0.33 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.16 2ews h TYR 129 Cb -0.11 -0.08 -0.00 0.00 1.54 0.00 0.00 36.73 38.08 2ews h TYR 129 CO -0.01 0.45 0.01 -0.07 -1.64 0.00 0.00 178.16 176.90 2ews h LEU 130 N 0.06 0.00 -0.73 2.82 3.38 -1.01 0.60 115.31 120.43 2ews h LEU 130 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2ews h LEU 130 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2ews h LEU 130 CO 0.00 0.00 -0.47 0.18 0.09 0.00 0.00 178.44 178.24 2ews n LEU 131 N -3.30 1.56 0.00 1.67 4.77 -0.74 -4.68 117.00 116.27 2ews n LEU 131 Ca -0.03 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.24 2ews n LEU 131 Cb 0.08 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2ews n LEU 131 CO 0.22 0.31 0.00 -1.54 -1.33 0.00 0.00 177.39 175.05 2ews n SER 132 N -0.37 0.00 -0.73 -1.43 3.41 -0.72 -4.85 113.62 108.93 2ews n SER 132 Ca 0.07 -0.86 -0.09 0.00 -0.26 0.00 0.00 58.87 57.72 2ews n SER 132 Cb 0.36 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.27 2ews n SER 132 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ews n GLN 133 N 0.00 -1.76 -3.10 4.33 6.02 0.21 -4.94 117.38 118.14 2ews n GLN 133 Ca 0.00 0.83 -0.40 0.00 -0.01 0.00 0.00 57.00 57.42 2ews n GLN 133 Cb 0.21 -5.28 -0.06 0.00 1.02 0.00 0.00 30.24 26.14 2ews n GLN 133 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2ews s ILE 134 N -1.80 5.00 -0.23 5.09 1.01 -1.26 -4.95 121.20 124.06 2ews s ILE 134 Ca 0.00 1.19 -0.01 0.00 0.00 0.00 0.00 60.65 61.83 2ews s ILE 134 Cb 0.00 -3.95 -0.19 0.00 0.01 0.00 0.00 42.46 38.33 2ews s ILE 134 CO 0.00 0.07 -0.10 0.35 0.00 0.00 0.00 174.94 175.27 2ews n THR 135 N 4.89 1.56 -1.80 2.92 -2.24 -1.26 -4.22 114.28 114.13 2ews n THR 135 Ca -0.01 -0.57 -0.42 0.00 -2.27 0.00 0.00 64.05 60.78 2ews n THR 135 Cb 0.49 -1.52 -0.03 0.00 -2.10 0.00 0.00 70.33 67.17 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 -6.69 6.53 0.11 3.42 -1.08 -1.26 -4.92 116.67 112.78 2ews s ASP 136 Ca -0.32 2.54 -0.31 0.00 -0.52 0.00 0.00 52.55 53.93 2ews s ASP 136 Cb 0.09 -2.54 -0.11 0.00 -1.46 0.00 0.00 42.92 38.90 2ews s ASP 136 CO 0.63 -0.99 1.59 0.22 0.52 0.00 0.00 175.17 177.14 2ews h TYR 137 N 9.83 -1.19 -0.94 -5.34 3.20 -1.99 0.46 116.97 121.00 2ews h TYR 137 Ca -0.46 0.03 0.11 0.00 3.14 0.00 0.00 58.73 61.56 2ews h TYR 137 Cb 1.21 0.50 -0.08 0.00 1.54 0.00 0.00 36.73 39.91 2ews h TYR 137 CO 0.90 -0.53 0.57 0.87 -1.64 0.00 0.00 178.16 178.33 2ews h LYS 138 N -0.68 0.88 0.10 1.82 6.56 -1.95 -0.92 116.57 122.39 2ews h LYS 138 Ca 0.01 -0.05 -0.01 0.00 -1.06 0.00 0.00 60.65 59.55 2ews h LYS 138 Cb 0.69 -0.20 0.00 0.00 -0.57 0.00 0.00 32.23 32.15 2ews h LYS 138 CO -0.23 0.58 -0.05 0.37 -2.06 0.00 0.00 179.45 178.07 2ews h GLN 139 N 0.91 -0.13 0.05 3.15 4.15 -1.84 -1.01 115.11 120.39 2ews h GLN 139 Ca 0.46 0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.91 2ews h GLN 139 Cb 0.46 0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.15 2ews h GLN 139 CO -0.27 0.03 -0.16 1.25 -1.93 0.00 0.00 178.83 177.75 2ews h LEU 140 N -0.27 -0.45 -0.88 -2.39 5.85 -0.31 -1.66 115.31 115.20 2ews h LEU 140 Ca -0.01 0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.67 2ews h LEU 140 Cb 0.22 0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 2ews h LEU 140 CO 0.02 -0.22 -0.16 0.71 -0.34 0.00 0.00 178.44 178.45 2ews h THR 141 N -0.29 1.26 -0.03 1.05 1.35 -1.21 -2.94 112.91 112.10 2ews h THR 141 Ca 0.04 -1.18 -0.00 0.00 -0.55 0.00 0.00 66.41 64.72 2ews h THR 141 Cb 0.33 1.15 -0.00 0.00 -1.73 0.00 0.00 68.15 67.90 2ews h THR 141 CO -0.12 0.39 0.01 0.44 -0.25 0.00 0.00 175.52 175.99 2ews h ASP 142 N 0.59 0.04 -0.83 5.36 3.32 -1.01 -2.90 116.42 120.99 2ews h ASP 142 Ca 0.10 -0.19 0.19 0.00 0.02 0.00 0.00 57.03 57.15 2ews h ASP 142 Cb 0.60 -0.01 -0.05 0.00 0.22 0.00 0.00 39.33 40.09 2ews h ASP 142 CO 0.04 0.22 0.56 -0.03 -1.72 0.00 0.00 179.24 178.31 2ews h MET 143 N -0.14 0.29 0.00 3.56 4.05 -1.24 -1.70 114.93 119.75 2ews h MET 143 Ca 0.01 -0.02 -0.05 0.00 -0.28 0.00 0.00 59.70 59.36 2ews h MET 143 Cb 0.19 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 30.92 2ews h MET 143 CO -0.00 0.20 -0.26 0.00 0.23 0.00 0.00 176.91 177.07 2ews h ALA 144 N 1.62 0.83 -0.98 0.39 0.00 -1.34 -3.36 119.26 116.43 2ews h ALA 144 Ca 0.42 -0.23 0.13 0.00 0.00 0.00 0.00 54.91 55.23 2ews h ALA 144 Cb 1.17 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.84 2ews h ALA 144 CO -0.12 0.31 0.62 1.96 0.00 0.00 0.00 179.25 182.02 2ews h GLN 145 N 0.00 0.89 -0.62 0.00 1.08 -1.14 -2.87 115.11 112.45 2ews h GLN 145 Ca -0.00 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.14 2ews h GLN 145 Cb 1.19 -0.20 0.00 0.00 -0.05 0.00 0.00 27.48 28.42 2ews h GLN 145 CO 0.03 0.59 0.00 0.72 -0.95 0.00 0.00 178.83 179.22 2ews n HIS 146 N -4.61 1.90 -2.61 2.96 8.25 -1.26 -4.96 115.22 114.89 2ews n HIS 146 Ca 0.19 -0.66 -0.30 0.00 -0.26 0.00 0.00 57.72 56.69 2ews n HIS 146 Cb 0.39 -0.46 -0.02 0.00 1.12 0.00 0.00 29.99 31.01 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 -0.73 1.78 -0.17 -1.41 0.00 -1.08 -4.89 107.32 100.80 2ews s GLY 147 Ca 0.51 -0.25 -0.04 0.00 0.00 0.00 0.00 44.72 44.94 2ews s GLY 147 CO 0.16 -0.05 -0.03 -0.35 0.00 0.00 0.00 173.10 172.83 2ews s ASP 148 N -3.58 4.73 0.00 1.64 -1.08 -1.26 -4.88 116.67 112.24 2ews s ASP 148 Ca 0.51 -0.18 0.25 0.00 -0.52 0.00 0.00 52.55 52.61 2ews s ASP 148 Cb -0.10 -1.78 0.38 0.00 -1.46 0.00 0.00 42.92 39.95 2ews s ASP 148 CO 0.39 0.12 1.33 0.54 0.52 0.00 0.00 175.17 178.07 2ews n ARG 149 N 3.86 1.15 -0.31 4.34 1.74 -1.26 -4.52 116.66 121.65 2ews n ARG 149 Ca -0.17 -0.84 0.10 0.00 -0.77 0.00 0.00 57.85 56.16 2ews n ARG 149 Cb 0.52 -1.48 0.32 0.00 -1.02 0.00 0.00 32.46 30.79 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 2.05 0.78 0.51 0.55 2.35 -1.94 0.14 115.58 120.02 2ews h ASN 150 Ca 0.00 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2ews h ASN 150 Cb 0.65 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.92 2ews h ASN 150 CO 0.00 0.40 -0.13 0.35 -1.65 0.00 0.00 177.43 176.39 2ews n THR 151 N -4.60 0.00 -0.11 2.81 -2.24 -1.26 -4.22 114.28 104.67 2ews n THR 151 Ca 0.18 -0.04 -0.20 0.00 -2.27 0.00 0.00 64.05 61.72 2ews n THR 151 Cb 0.43 -0.16 -0.08 0.00 -2.10 0.00 0.00 70.33 68.42 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 -1.15 1.19 -3.58 2.28 5.41 -0.53 -3.55 119.36 119.44 2ews n ILE 152 Ca 0.12 -0.36 -0.37 0.00 1.00 0.00 0.00 62.75 63.15 2ews n ILE 152 Cb 0.29 -1.60 -0.06 0.00 -0.71 0.00 0.00 39.64 37.57 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 -6.62 6.69 -0.29 4.38 -0.00 -0.08 -0.36 116.67 120.40 2ews s ASP 153 Ca -0.30 0.83 -0.16 0.00 -0.00 0.00 0.00 52.55 52.92 2ews s ASP 153 Cb 0.10 -2.20 -0.03 0.00 -0.00 0.00 0.00 42.92 40.80 2ews s ASP 153 CO 0.42 0.27 0.44 -0.22 -0.00 0.00 0.00 175.17 176.08 2ews s LEU 154 N -1.41 4.12 0.29 1.23 2.96 -0.74 -4.47 118.68 120.65 2ews s LEU 154 Ca 0.26 0.27 0.06 0.00 -0.22 0.00 0.00 54.13 54.50 2ews s LEU 154 Cb -0.15 -2.51 -0.02 0.00 0.50 0.00 0.00 46.19 44.00 2ews s LEU 154 CO 0.14 -0.27 0.39 -0.54 -1.32 0.00 0.00 176.35 174.75 2ews s LYS 155 N 2.19 3.21 0.31 1.98 -0.14 -1.26 -0.57 119.74 125.45 2ews s LYS 155 Ca 0.17 -0.93 0.00 0.00 -1.36 0.00 0.00 55.97 53.85 2ews s LYS 155 Cb -0.16 -2.80 0.49 0.00 -1.68 0.00 0.00 37.83 33.68 2ews s LYS 155 CO 0.10 0.24 1.89 0.28 -0.76 0.00 0.00 175.35 177.11 2ews h VAL 156 N 1.08 1.20 -0.75 3.17 2.07 -1.17 -1.51 116.25 120.34 2ews h VAL 156 Ca -0.48 -0.63 -0.00 0.00 0.82 0.00 0.00 66.70 66.41 2ews h VAL 156 Cb 1.24 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 31.49 2ews h VAL 156 CO 0.57 0.25 0.46 0.08 0.02 0.00 0.00 177.57 178.95 2ews h ARG 157 N 0.82 1.00 0.00 1.57 0.11 -1.62 -0.48 114.38 115.78 2ews h ARG 157 Ca 0.20 -0.08 0.00 0.00 0.10 0.00 0.00 59.98 60.20 2ews h ARG 157 Cb 0.15 -0.22 0.00 0.00 1.11 0.00 0.00 29.97 31.02 2ews h ARG 157 CO -0.02 0.69 0.00 0.45 0.10 0.00 0.00 179.97 181.19 2ews h HIS 158 N 1.02 0.00 0.00 4.08 3.86 -1.58 -3.52 115.15 119.01 2ews h HIS 158 Ca 0.27 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.48 2ews h HIS 158 Cb -0.06 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.41 2ews h HIS 158 CO 0.00 0.00 -0.22 -0.89 0.86 0.00 0.00 177.93 177.68 2ews n ILE 159 N -2.73 0.36 0.00 2.45 5.41 -0.19 -4.99 119.36 119.67 2ews n ILE 159 Ca -0.01 0.42 0.00 0.00 1.00 0.00 0.00 62.75 64.15 2ews n ILE 159 Cb 0.12 -1.71 0.00 0.00 -0.71 0.00 0.00 39.64 37.34 2ews n ILE 159 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2ews n PRO 168 N -2.95 0.00 -0.17 0.38 -0.02 -1.26 -4.97 135.00 126.01 2ews n PRO 168 Ca -0.03 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.40 2ews n PRO 168 Cb 0.11 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.55 2ews n PRO 168 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ews n GLY 169 N 0.00 -1.40 0.00 -1.23 0.00 -1.26 -1.55 105.19 99.74 2ews n GLY 169 Ca 0.00 0.55 0.07 0.00 0.00 0.00 0.00 46.02 46.64 2ews n GLY 169 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ews n ASP 170 N -4.20 0.00 -4.77 1.61 2.03 -1.26 -1.85 116.55 108.11 2ews n ASP 170 Ca 0.01 -0.65 -0.37 0.00 0.52 0.00 0.00 54.79 54.30 2ews n ASP 170 Cb 0.11 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.51 2ews n ASP 170 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2ews s LEU 171 N -1.80 3.87 -0.29 -2.67 1.43 -0.60 -4.87 118.68 113.75 2ews s LEU 171 Ca 0.21 2.34 -0.19 0.00 -1.03 0.00 0.00 54.13 55.46 2ews s LEU 171 Cb 0.09 -4.39 -0.01 0.00 0.03 0.00 0.00 46.19 41.91 2ews s LEU 171 CO 0.16 -1.19 0.59 -0.89 0.23 0.00 0.00 176.35 175.25 2ews s THR 172 N -1.58 4.98 0.09 5.49 2.01 -1.26 -1.32 115.64 124.05 2ews s THR 172 Ca 0.69 0.85 0.05 0.00 0.31 0.00 0.00 61.69 63.59 2ews s THR 172 Cb -0.29 -3.95 -0.23 0.00 0.01 0.00 0.00 72.50 68.05 2ews s THR 172 CO 0.34 -0.07 1.17 0.00 -0.69 0.00 0.00 174.62 175.37 2ews h ALA 173 N 8.14 0.35 -0.96 7.40 0.00 -1.09 -3.45 119.26 129.65 2ews h ALA 173 Ca -0.27 -0.98 0.08 0.00 0.00 0.00 0.00 54.91 53.74 2ews h ALA 173 Cb 1.12 -0.04 -0.21 0.00 0.00 0.00 0.00 17.79 18.66 2ews h ALA 173 CO 0.77 1.24 -0.29 0.00 0.00 0.00 0.00 179.25 180.98 2ews s ALA 174 N -2.69 -2.39 0.27 0.00 0.00 -0.59 -5.02 121.76 111.36 2ews s ALA 174 Ca -0.01 1.56 -0.30 0.00 0.00 0.00 0.00 51.96 53.21 2ews s ALA 174 Cb 0.09 -2.32 -0.12 0.00 0.00 0.00 0.00 23.12 20.78 2ews s ALA 174 CO 0.83 -1.52 1.63 0.09 0.00 0.00 0.00 175.76 176.80 2ews n ASN 175 N 5.42 3.93 0.00 0.00 4.13 -1.26 -0.24 115.26 127.23 2ews n ASN 175 Ca 0.01 1.13 0.00 0.00 1.68 0.00 0.00 54.58 57.40 2ews n ASN 175 Cb 0.52 -1.59 0.00 0.00 -1.54 0.00 0.00 39.78 37.17 2ews n ASN 175 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2ews n PHE 176 N 2.60 0.00 0.77 3.10 3.01 -1.21 -4.86 117.46 120.88 2ews n PHE 176 Ca 0.10 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.65 2ews n PHE 176 Cb 0.36 -1.31 0.43 0.00 -0.01 0.00 0.00 39.48 38.95 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 -0.85 -0.93 0.00 1.37 0.00 0.66 -2.86 105.19 102.58 2ews n GLY 177 Ca 0.00 -0.08 0.09 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.34 0.00 -0.22 1.61 -0.00 0.51 -4.61 115.22 111.17 2ews n HIS 178 Ca 0.07 0.00 0.01 0.00 0.46 0.00 0.00 57.72 58.27 2ews n HIS 178 Cb 0.16 -0.02 0.10 0.00 -0.12 0.00 0.00 29.99 30.10 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 0.38 0.00 3.57 2.07 -1.35 -0.52 116.25 120.40 2ews h VAL 179 Ca 0.00 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2ews h VAL 179 Cb 0.48 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 2ews h VAL 179 CO 0.00 0.01 0.00 0.18 0.02 0.00 0.00 177.57 177.78 2ews n LEU 180 N -5.38 0.54 -0.79 2.57 4.77 -1.26 -1.96 117.00 115.49 2ews n LEU 180 Ca 0.10 0.64 0.13 0.00 -0.03 0.00 0.00 56.01 56.84 2ews n LEU 180 Cb 0.38 -0.57 0.25 0.00 -2.33 0.00 0.00 43.42 41.14 2ews n LEU 180 CO 0.06 -0.51 0.71 1.41 -1.33 0.00 0.00 177.39 177.73 2ews n HIS 181 N -2.10 0.00 -2.02 -1.77 8.25 -0.22 -4.18 115.22 113.18 2ews n HIS 181 Ca 0.02 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.52 2ews n HIS 181 Cb 0.21 -0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.38 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 0.93 0.00 0.00 4.41 8.25 -0.83 -4.89 115.22 123.10 2ews n HIS 182 Ca 0.16 -0.58 0.00 0.00 -0.26 0.00 0.00 57.72 57.03 2ews n HIS 182 Cb 0.51 -0.14 0.00 0.00 1.12 0.00 0.00 29.99 31.49 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 -0.17 0.00 0.28 2.41 4.77 -1.07 -2.19 117.00 121.03 2ews n LEU 183 Ca 0.08 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.22 2ews n LEU 183 Cb 0.87 0.00 0.94 0.00 -2.33 0.00 0.00 43.42 42.90 2ews n LEU 183 CO -0.02 0.00 1.14 0.44 -1.33 0.00 0.00 177.39 177.62 2ews h ASP 184 N 0.00 0.00 -0.95 -1.43 3.32 -1.90 -3.46 116.42 112.00 2ews h ASP 184 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2ews h ASP 184 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2ews h ASP 184 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 2ews n ALA 185 N -2.27 0.00 -1.02 3.45 0.00 -0.93 -4.96 120.51 114.78 2ews n ALA 185 Ca -0.02 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.22 2ews n ALA 185 Cb 0.16 -0.36 0.04 0.00 0.00 0.00 0.00 19.45 19.28 2ews n ALA 185 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2ews n ASP 186 N 0.50 6.67 -3.87 0.00 8.00 -1.26 -4.64 116.55 121.95 2ews n ASP 186 Ca 0.00 -3.20 -0.42 0.00 0.71 0.00 0.00 54.79 51.88 2ews n ASP 186 Cb 0.36 -1.06 0.01 0.00 -0.02 0.00 0.00 41.12 40.40 2ews n ASP 186 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2ews n PHE 187 N 0.20 2.52 -1.20 1.24 0.99 -1.26 -4.90 117.46 115.05 2ews n PHE 187 Ca 0.37 -2.65 -0.32 0.00 -0.00 0.00 0.00 57.45 54.85 2ews n PHE 187 Cb 0.58 -1.50 0.11 0.00 -1.00 0.00 0.00 39.48 37.67 2ews n PHE 187 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 2ews s THR 188 N -1.90 2.62 0.42 4.37 -4.23 -1.26 -4.76 115.64 110.91 2ews s THR 188 Ca 0.37 0.24 0.14 0.00 -1.18 0.00 0.00 61.69 61.26 2ews s THR 188 Cb 0.09 -2.61 0.34 0.00 1.34 0.00 0.00 72.50 71.67 2ews s THR 188 CO 0.03 -0.22 1.94 -0.65 -0.54 0.00 0.00 174.62 175.18 2ews h PRO 189 N -0.97 0.42 -0.29 3.99 0.11 -1.95 -1.46 132.00 131.85 2ews h PRO 189 Ca -0.45 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.53 2ews h PRO 189 Cb 1.26 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 2ews h PRO 189 CO 0.48 0.28 -0.22 1.03 -0.21 0.00 0.00 178.00 179.36 2ews h SER 190 N 0.44 0.70 -0.49 -2.05 0.87 -1.90 -1.62 113.55 109.50 2ews h SER 190 Ca 0.34 -0.44 -0.11 0.00 -1.23 0.00 0.00 61.79 60.35 2ews h SER 190 Cb 0.72 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 2ews h SER 190 CO -0.11 0.99 -0.12 0.78 -0.53 0.00 0.00 176.83 177.85 2ews h ASN 191 N 0.41 0.94 -0.05 6.23 2.35 -1.63 -1.49 115.58 122.34 2ews h ASN 191 Ca 0.06 -0.36 -0.00 0.00 -0.55 0.00 0.00 56.30 55.44 2ews h ASN 191 Cb 0.77 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.88 2ews h ASN 191 CO 0.06 1.09 0.03 0.11 -1.65 0.00 0.00 177.43 177.06 2ews h LYS 192 N 0.79 0.07 -0.43 0.81 1.57 -1.28 -1.57 116.57 116.52 2ews h LYS 192 Ca 0.12 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.87 2ews h LYS 192 Cb 0.67 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.95 2ews h LYS 192 CO 0.05 0.15 0.16 -0.07 -0.57 0.00 0.00 179.45 179.16 2ews h LEU 193 N -0.02 0.56 -0.95 2.94 3.38 -1.26 -0.98 115.31 118.98 2ews h LEU 193 Ca 0.02 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 2ews h LEU 193 Cb 0.10 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2ews h LEU 193 CO -0.00 0.52 -0.26 0.00 0.09 0.00 0.00 178.44 178.79 2ews h ALA 194 N 1.56 1.11 -0.07 1.53 0.00 -1.00 -1.28 119.26 121.11 2ews h ALA 194 Ca 0.15 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.58 2ews h ALA 194 Cb 0.15 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2ews h ALA 194 CO -0.01 0.56 -0.53 0.00 0.00 0.00 0.00 179.25 179.26 2ews h ALA 195 N 1.32 0.98 -0.41 0.00 0.00 -0.26 0.72 119.26 121.61 2ews h ALA 195 Ca 0.06 -0.49 -0.06 0.00 0.00 0.00 0.00 54.91 54.41 2ews h ALA 195 Cb 0.68 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2ews h ALA 195 CO 0.05 0.67 0.01 0.28 0.00 0.00 0.00 179.25 180.26 2ews h VAL 196 N 0.15 1.26 -0.37 0.00 2.07 -0.61 -2.00 116.25 116.75 2ews h VAL 196 Ca 0.00 -1.00 -0.11 0.00 0.82 0.00 0.00 66.70 66.42 2ews h VAL 196 Cb 0.98 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 2ews h VAL 196 CO 0.08 0.34 -0.20 0.40 0.02 0.00 0.00 177.57 178.20 2ews h ILE 197 N 0.55 1.27 -0.18 4.57 2.04 -0.98 -2.79 117.51 121.99 2ews h ILE 197 Ca 0.12 -1.28 -0.01 0.00 1.00 0.00 0.00 64.86 64.69 2ews h ILE 197 Cb 0.47 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 2ews h ILE 197 CO 0.02 0.43 0.09 1.23 0.00 0.00 0.00 178.15 179.91 2ews h GLY 198 N 0.98 0.28 1.24 5.37 0.00 -0.60 -1.53 103.07 108.82 2ews h GLY 198 Ca 0.09 -0.14 -0.08 0.00 0.00 0.00 0.00 47.33 47.20 2ews h GLY 198 CO 0.05 0.13 0.02 -0.24 0.00 0.00 0.00 176.54 176.51 2ews h VAL 199 N 0.17 1.25 -0.13 4.60 3.04 -1.35 -0.37 116.25 123.45 2ews h VAL 199 Ca 0.06 -1.05 -0.01 0.00 -1.01 0.00 0.00 66.70 64.70 2ews h VAL 199 Cb 0.12 0.81 -0.01 0.00 -2.01 0.00 0.00 31.29 30.20 2ews h VAL 199 CO -0.01 0.38 0.05 0.58 -1.01 0.00 0.00 177.57 177.56 2ews h VAL 200 N 0.85 1.15 -0.76 1.51 2.07 -1.41 0.09 116.25 119.76 2ews h VAL 200 Ca 0.16 -0.46 -0.03 0.00 0.82 0.00 0.00 66.70 67.19 2ews h VAL 200 Cb 0.48 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 2ews h VAL 200 CO 0.02 0.14 0.34 1.23 0.02 0.00 0.00 177.57 179.32 2ews h GLY 201 N 0.05 1.19 1.06 2.17 0.00 -1.16 -1.86 103.07 104.52 2ews h GLY 201 Ca 0.04 -0.62 -0.13 0.00 0.00 0.00 0.00 47.33 46.63 2ews h GLY 201 CO -0.00 0.58 -0.25 0.83 0.00 0.00 0.00 176.54 177.70 2ews h GLU 202 N 1.08 0.88 -0.36 4.80 5.08 -0.93 -1.42 114.58 123.72 2ews h GLU 202 Ca 0.26 -0.41 -0.02 0.00 -1.00 0.00 0.00 59.36 58.18 2ews h GLU 202 Cb 0.16 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 2ews h GLU 202 CO -0.03 1.06 0.12 0.28 -1.00 0.00 0.00 179.01 179.44 2ews h VAL 203 N 0.69 1.20 -0.45 3.13 2.07 -0.85 0.41 116.25 122.45 2ews h VAL 203 Ca 0.08 -0.64 0.03 0.00 0.82 0.00 0.00 66.70 66.99 2ews h VAL 203 Cb 0.83 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 2ews h VAL 203 CO 0.07 0.22 0.25 0.58 0.02 0.00 0.00 177.57 178.72 2ews h VAL 204 N 0.43 1.02 -0.57 2.57 2.07 -1.30 -1.20 116.25 119.27 2ews h VAL 204 Ca 0.12 -0.17 -0.05 0.00 0.82 0.00 0.00 66.70 67.41 2ews h VAL 204 Cb 0.22 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 2ews h VAL 204 CO -0.01 0.09 0.16 0.74 0.02 0.00 0.00 177.57 178.57 2ews h THR 205 N 0.51 1.24 -0.54 2.57 2.02 -1.03 -0.40 112.91 117.28 2ews h THR 205 Ca 0.19 -0.85 0.00 0.00 0.77 0.00 0.00 66.41 66.52 2ews h THR 205 Cb 0.05 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 2ews h THR 205 CO -0.10 0.32 0.35 0.74 0.37 0.00 0.00 175.52 177.19 2ews h THR 206 N 0.81 1.15 -0.12 3.16 2.02 -0.51 0.44 112.91 119.86 2ews h THR 206 Ca 0.18 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 2ews h THR 206 Cb 0.32 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 2ews h THR 206 CO -0.00 0.15 0.03 0.24 0.37 0.00 0.00 175.52 176.31 2ews h MET 207 N 0.74 0.19 -0.10 6.66 2.86 -1.01 -0.88 114.93 123.38 2ews h MET 207 Ca 0.20 -0.04 0.03 0.00 -2.06 0.00 0.00 59.70 57.82 2ews h MET 207 Cb -0.06 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.55 2ews h MET 207 CO -0.04 0.35 -0.08 0.00 1.06 0.00 0.00 176.91 178.20 2ews h ALA 208 N 0.84 0.01 -0.74 6.32 0.00 -0.67 -1.11 119.26 123.91 2ews h ALA 208 Ca 0.04 0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.11 2ews h ALA 208 Cb 0.24 0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.11 2ews h ALA 208 CO -0.00 -0.54 0.35 0.82 0.00 0.00 0.00 179.25 179.88 2ews h ILE 209 N -0.08 0.77 -0.17 0.00 1.08 -0.03 0.11 117.51 119.19 2ews h ILE 209 Ca 0.07 -0.19 -0.05 0.00 -0.39 0.00 0.00 64.86 64.30 2ews h ILE 209 Cb 0.18 0.17 -0.00 0.00 -3.07 0.00 0.00 36.82 34.10 2ews h ILE 209 CO -0.15 0.10 -0.07 0.74 -0.69 0.00 0.00 178.15 178.08 2ews h THR 210 N 0.56 1.30 0.00 -0.27 2.02 -0.52 -2.45 112.91 113.55 2ews h THR 210 Ca 0.38 -1.10 -0.05 0.00 0.77 0.00 0.00 66.41 66.42 2ews h THR 210 Cb 0.48 1.67 -0.01 0.00 -1.74 0.00 0.00 68.15 68.55 2ews h THR 210 CO -0.32 0.33 -0.23 -0.37 0.37 0.00 0.00 175.52 175.30 2ews h VAL 211 N 0.04 0.53 -0.63 3.16 -1.51 -0.96 -1.59 116.25 115.30 2ews h VAL 211 Ca 0.04 -1.17 -0.08 0.00 -1.23 0.00 0.00 66.70 64.26 2ews h VAL 211 Cb 0.54 1.81 -0.02 0.00 -2.13 0.00 0.00 31.29 31.48 2ews h VAL 211 CO 0.02 0.22 0.08 0.00 -1.23 0.00 0.00 177.57 176.66 2ews h ALA 212 N 1.77 0.84 -0.44 5.19 0.00 -0.67 0.18 119.26 126.13 2ews h ALA 212 Ca -0.00 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 2ews h ALA 212 Cb 0.79 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2ews h ALA 212 CO 0.03 0.63 -0.10 -0.09 0.00 0.00 0.00 179.25 179.72 2ews h ARG 213 N 0.97 0.84 -0.67 0.00 2.43 -1.00 0.11 114.38 117.06 2ews h ARG 213 Ca 0.19 -0.32 -0.01 0.00 -0.81 0.00 0.00 59.98 59.03 2ews h ARG 213 Cb 0.47 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 2ews h ARG 213 CO 0.02 0.95 0.36 1.49 -1.51 0.00 0.00 179.97 181.28 2ews h GLU 214 N 0.67 0.92 -0.55 0.20 4.81 -0.98 -2.64 114.58 117.00 2ews h GLU 214 Ca 0.11 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2ews h GLU 214 Cb 0.63 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.83 2ews h GLU 214 CO 0.04 0.68 0.00 1.19 -0.73 0.00 0.00 179.01 180.19 2ews n PHE 215 N -4.37 1.33 -3.66 0.92 3.01 0.02 -5.00 117.46 109.71 2ews n PHE 215 Ca 0.06 -0.64 -0.28 0.00 1.01 0.00 0.00 57.45 57.60 2ews n PHE 215 Cb 0.10 -0.25 0.04 0.00 -0.01 0.00 0.00 39.48 39.36 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 0.79 -1.98 -3.84 -1.08 5.02 0.19 -5.02 118.16 112.25 2ews n LYS 216 Ca 0.24 0.52 -0.13 0.00 -2.02 0.00 0.00 58.31 56.92 2ews n LYS 216 Cb 0.86 -4.49 -0.14 0.00 -0.02 0.00 0.00 35.03 31.24 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 -3.53 -0.01 -1.50 -0.18 -1.32 -0.21 -5.02 115.64 103.87 2ews s THR 217 Ca 0.37 0.05 0.25 0.00 -1.21 0.00 0.00 61.69 61.16 2ews s THR 217 Cb -0.12 -0.07 0.14 0.00 -1.51 0.00 0.00 72.50 70.94 2ews s THR 217 CO 0.84 0.02 1.45 -0.62 -2.21 0.00 0.00 174.62 174.10 2ews n GLU 218 N 3.35 0.55 -3.56 7.08 1.02 -1.26 -4.43 120.64 123.40 2ews n GLU 218 Ca -0.16 -0.35 -0.37 0.00 -0.02 0.00 0.00 57.16 56.26 2ews n GLU 218 Cb 0.57 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.44 2ews n GLU 218 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2ews s ASN 219 N -2.68 6.61 -0.07 1.62 0.01 -1.26 -0.58 114.94 118.58 2ews s ASN 219 Ca 0.19 0.72 -0.03 0.00 -0.71 0.00 0.00 52.86 53.03 2ews s ASN 219 Cb 0.18 -2.20 0.04 0.00 0.41 0.00 0.00 41.25 39.68 2ews s ASN 219 CO 0.60 0.24 0.07 -0.63 -1.51 0.00 0.00 177.10 175.87 2ews s ILE 220 N -0.41 -0.11 -0.11 0.60 1.01 -0.94 -1.53 121.20 119.71 2ews s ILE 220 Ca 0.20 0.29 -0.05 0.00 0.00 0.00 0.00 60.65 61.10 2ews s ILE 220 Cb -0.15 -0.25 -0.04 0.00 0.01 0.00 0.00 42.46 42.04 2ews s ILE 220 CO 0.08 0.08 0.06 -0.69 0.00 0.00 0.00 174.94 174.47 2ews s VAL 221 N 2.17 4.85 -0.17 2.92 1.01 0.26 -0.81 120.40 130.63 2ews s VAL 221 Ca 0.04 -0.04 -0.01 0.00 0.00 0.00 0.00 61.98 61.98 2ews s VAL 221 Cb -0.13 -3.09 -0.00 0.00 0.00 0.00 0.00 36.38 33.16 2ews s VAL 221 CO -0.04 0.59 -0.12 -0.31 0.00 0.00 0.00 175.10 175.22 2ews s TYR 222 N -0.79 2.84 0.20 5.22 1.51 -0.00 -0.54 117.35 125.78 2ews s TYR 222 Ca 0.13 -1.00 0.01 0.00 -1.01 0.00 0.00 57.07 55.20 2ews s TYR 222 Cb -0.12 -1.94 -0.05 0.00 -0.11 0.00 0.00 41.96 39.74 2ews s TYR 222 CO 0.03 -0.48 0.04 0.96 -1.11 0.00 0.00 175.55 174.99 2ews s ILE 223 N 0.95 0.59 0.00 2.71 -4.36 -0.55 -4.16 121.20 116.38 2ews s ILE 223 Ca -0.02 -1.99 0.00 0.00 -0.26 0.00 0.00 60.65 58.38 2ews s ILE 223 Cb -0.15 -2.31 0.00 0.00 1.25 0.00 0.00 42.46 41.26 2ews s ILE 223 CO -0.01 -0.30 0.00 0.61 0.24 0.00 0.00 174.94 175.48 2ews n GLY 224 N -0.31 4.52 0.02 6.27 0.00 -1.26 -0.08 105.19 114.35 2ews n GLY 224 Ca -0.04 -1.24 0.08 0.00 0.00 0.00 0.00 46.02 44.82 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 0.11 0.28 1.61 7.64 -1.24 -2.37 113.62 119.65 2ews n SER 225 Ca 0.00 0.53 0.14 0.00 1.01 0.00 0.00 58.87 60.55 2ews n SER 225 Cb 0.00 -0.55 0.82 0.00 -1.01 0.00 0.00 64.21 63.47 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 0.67 6.43 0.02 -1.80 -0.50 113.55 118.37 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 0.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.80 2ews h SER 226 CO 0.00 0.07 -0.04 0.49 -1.14 0.00 0.00 176.83 176.21 2ews n PHE 227 N -3.62 0.00 -2.20 3.45 3.01 -1.00 -4.73 117.46 112.38 2ews n PHE 227 Ca -0.02 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.01 2ews n PHE 227 Cb 0.19 -0.34 -0.03 0.00 -0.01 0.00 0.00 39.48 39.29 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 -2.71 2.45 -1.37 1.38 3.76 -0.20 -2.76 115.29 115.83 2ews s HIS 228 Ca 0.23 0.60 -0.02 0.00 -0.15 0.00 0.00 55.06 55.73 2ews s HIS 228 Cb 0.20 -3.72 0.00 0.00 1.11 0.00 0.00 32.58 30.17 2ews s HIS 228 CO 0.50 -2.81 0.21 -1.71 -0.85 0.00 0.00 174.74 170.08 2ews n ASN 229 N 6.64 -5.13 -3.14 1.40 5.15 -1.26 -4.95 115.26 113.97 2ews n ASN 229 Ca 0.15 -0.11 -0.19 0.00 -0.60 0.00 0.00 54.58 53.83 2ews n ASN 229 Cb 0.44 -4.11 -0.05 0.00 -0.53 0.00 0.00 39.78 35.52 2ews n ASN 229 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2ews n ASN 230 N -1.44 -1.39 0.23 1.20 2.85 -1.11 -4.49 115.26 111.10 2ews n ASN 230 Ca -0.15 -2.65 0.09 0.00 -0.11 0.00 0.00 54.58 51.76 2ews n ASN 230 Cb 0.63 0.25 0.55 0.00 1.24 0.00 0.00 39.78 42.45 2ews n ASN 230 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2ews h ALA 231 N 5.06 1.23 0.01 5.20 0.00 -1.93 -2.98 119.26 125.84 2ews h ALA 231 Ca 0.15 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2ews h ALA 231 Cb 0.97 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2ews h ALA 231 CO 0.29 0.28 -0.00 1.25 0.00 0.00 0.00 179.25 181.06 2ews h LEU 232 N 0.00 -0.01 -0.71 0.00 5.85 -1.93 -1.17 115.31 117.34 2ews h LEU 232 Ca -0.00 -0.07 0.07 0.00 0.84 0.00 0.00 57.88 58.72 2ews h LEU 232 Cb 0.55 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.52 2ews h LEU 232 CO 0.03 0.07 0.39 0.25 -0.34 0.00 0.00 178.44 178.84 2ews h LEU 233 N -0.08 0.56 -0.67 2.25 5.85 -1.87 0.21 115.31 121.56 2ews h LEU 233 Ca -0.00 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 2ews h LEU 233 Cb 0.08 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 2ews h LEU 233 CO 0.00 0.35 0.26 -0.09 -0.34 0.00 0.00 178.44 178.61 2ews h ARG 234 N 0.70 1.01 -0.47 1.25 2.43 -1.50 -2.05 114.38 115.74 2ews h ARG 234 Ca 0.33 -0.19 -0.04 0.00 -0.81 0.00 0.00 59.98 59.27 2ews h ARG 234 Cb 0.26 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 2ews h ARG 234 CO -0.21 0.85 0.13 -0.22 -1.51 0.00 0.00 179.97 179.00 2ews h LYS 235 N 0.95 0.74 -0.07 0.20 3.64 -0.30 -1.58 116.57 120.16 2ews h LYS 235 Ca 0.22 -0.17 0.03 0.00 -1.27 0.00 0.00 60.65 59.46 2ews h LYS 235 Cb 0.22 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 2ews h LYS 235 CO -0.02 0.72 -0.12 0.28 -2.27 0.00 0.00 179.45 178.05 2ews h VAL 236 N 0.63 0.68 -0.57 2.00 2.07 -0.34 -0.77 116.25 119.96 2ews h VAL 236 Ca 0.15 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.59 2ews h VAL 236 Cb 0.30 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 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 -0.17 1.26 -0.35 2.57 -1.51 -1.30 -1.76 116.25 114.98 2ews h VAL 237 Ca 0.07 -1.07 -0.03 0.00 -1.23 0.00 0.00 66.70 64.44 2ews h VAL 237 Cb 0.26 0.84 -0.02 0.00 -2.13 0.00 0.00 31.29 30.25 2ews h VAL 237 CO -0.17 0.39 0.12 -0.33 -1.23 0.00 0.00 177.57 176.35 2ews h GLU 238 N 0.87 0.54 -0.19 5.19 5.08 -1.07 -1.37 114.58 123.63 2ews h GLU 238 Ca 0.16 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.37 2ews h GLU 238 Cb 0.50 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 2ews h GLU 238 CO 0.02 0.56 -0.07 -0.44 -1.00 0.00 0.00 179.01 178.08 2ews h ASP 239 N 0.42 0.38 -0.45 1.42 3.32 -1.11 -3.03 116.42 117.37 2ews h ASP 239 Ca 0.12 -0.39 -0.03 0.00 0.02 0.00 0.00 57.03 56.75 2ews h ASP 239 Cb 0.23 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 2ews h ASP 239 CO -0.01 0.68 0.19 0.22 -1.72 0.00 0.00 179.24 178.60 2ews h TYR 240 N 0.07 0.73 -0.48 4.55 3.20 -1.32 -1.99 116.97 121.73 2ews h TYR 240 Ca 0.04 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 2ews h TYR 240 Cb 0.53 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.55 2ews h TYR 240 CO 0.06 0.58 0.26 1.15 -1.64 0.00 0.00 178.16 178.57 2ews h THR 241 N 0.72 1.15 -0.08 1.81 2.02 -1.20 -1.64 112.91 115.69 2ews h THR 241 Ca 0.17 -0.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.95 2ews h THR 241 Cb 0.17 0.51 -0.00 0.00 -1.74 0.00 0.00 68.15 67.08 2ews h THR 241 CO -0.01 0.17 0.00 0.58 0.37 0.00 0.00 175.52 176.63 2ews h VAL 242 N 0.67 1.24 -1.01 3.16 2.07 -1.25 -2.19 116.25 118.94 2ews h VAL 242 Ca 0.17 -0.76 0.11 0.00 0.82 0.00 0.00 66.70 67.04 2ews h VAL 242 Cb 0.03 1.61 -0.08 0.00 -1.52 0.00 0.00 31.29 31.32 2ews h VAL 242 CO -0.03 0.21 0.64 -0.07 0.02 0.00 0.00 177.57 178.34 2ews h LEU 243 N -0.14 0.96 0.00 2.57 3.38 -1.12 -0.72 115.31 120.24 2ews h LEU 243 Ca 0.02 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2ews h LEU 243 Cb 0.33 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2ews h LEU 243 CO 0.00 0.53 0.00 0.54 0.09 0.00 0.00 178.44 179.60 2ews n ARG 244 N -4.59 0.98 -0.80 1.13 5.12 -0.67 -4.91 116.66 112.91 2ews n ARG 244 Ca 0.18 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.10 2ews n ARG 244 Cb 0.32 -1.39 0.00 0.00 -1.16 0.00 0.00 32.46 30.23 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 0.86 0.86 3.33 -0.13 0.00 -0.28 -5.07 105.19 104.76 2ews n GLY 245 Ca 0.19 -0.56 -0.17 0.00 0.00 0.00 0.00 46.02 45.48 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 -3.96 3.73 0.61 0.00 0.00 0.25 -3.82 119.74 116.56 2ews s LYS 247 Ca 0.34 -0.46 -0.11 0.00 0.00 0.00 0.00 55.97 55.74 2ews s LYS 247 Cb 0.07 -3.22 -0.04 0.00 0.00 0.00 0.00 37.83 34.64 2ews s LYS 247 CO 0.11 -0.00 1.03 -1.25 0.00 0.00 0.00 175.35 175.24 2ews s PRO 248 N 1.09 3.61 -0.12 1.78 0.04 -1.26 -2.21 135.00 137.94 2ews s PRO 248 Ca 0.04 0.78 -0.05 0.00 0.04 0.00 0.00 61.00 61.80 2ews s PRO 248 Cb -0.14 -2.08 0.05 0.00 0.04 0.00 0.00 34.50 32.37 2ews s PRO 248 CO 0.03 -0.56 0.26 0.71 0.04 0.00 0.00 177.00 177.48 2ews s TYR 249 N -3.12 -0.39 -0.03 0.56 1.51 0.01 -4.88 117.35 111.01 2ews s TYR 249 Ca 0.55 0.90 0.07 0.00 -1.01 0.00 0.00 57.07 57.58 2ews s TYR 249 Cb -0.11 0.03 -0.02 0.00 -0.11 0.00 0.00 41.96 41.75 2ews s TYR 249 CO 0.52 -0.29 -0.25 -0.47 -1.11 0.00 0.00 175.55 173.95 2ews s TYR 250 N 1.75 2.29 -0.12 2.71 5.04 -1.26 -0.82 117.35 126.93 2ews s TYR 250 Ca -0.05 -0.49 0.00 0.00 -2.44 0.00 0.00 57.07 54.09 2ews s TYR 250 Cb -0.11 -1.48 -0.01 0.00 0.35 0.00 0.00 41.96 40.70 2ews s TYR 250 CO -0.09 -0.08 -0.14 0.08 -1.34 0.00 0.00 175.55 173.98 2ews s VAL 251 N -0.50 2.98 0.38 3.14 1.01 -1.26 -5.01 120.40 121.14 2ews s VAL 251 Ca 0.07 -0.69 -0.26 0.00 0.00 0.00 0.00 61.98 61.09 2ews s VAL 251 Cb -0.11 -2.24 -0.09 0.00 0.00 0.00 0.00 36.38 33.95 2ews s VAL 251 CO 0.00 0.53 1.24 -1.61 0.00 0.00 0.00 175.10 175.26 2ews s GLU 252 N 0.27 4.11 -1.63 2.72 0.41 -1.26 -1.57 118.70 121.74 2ews s GLU 252 Ca -0.10 2.03 0.00 0.00 -0.41 0.00 0.00 54.97 56.49 2ews s GLU 252 Cb -0.16 -2.81 0.00 0.00 -1.78 0.00 0.00 34.13 29.38 2ews s GLU 252 CO 0.06 -0.33 0.00 0.09 -0.49 0.00 0.00 175.26 174.59 2ews n ASN 253 N 0.30 -5.36 0.32 -0.19 3.02 -1.26 -4.84 115.26 107.25 2ews n ASN 253 Ca 0.03 0.38 0.20 0.00 -0.03 0.00 0.00 54.58 55.16 2ews n ASN 253 Cb 0.44 -4.22 1.10 0.00 -0.61 0.00 0.00 39.78 36.50 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 -1.66 0.54 103.07 111.36 2ews h GLY 254 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.02 2ews h GLY 254 CO 0.46 0.00 0.00 0.00 0.00 0.00 0.00 176.54 177.00 2ews n ALA 255 N -2.13 1.66 -0.23 3.60 0.00 -1.26 -1.81 120.51 120.34 2ews n ALA 255 Ca -0.03 0.03 0.11 0.00 0.00 0.00 0.00 53.44 53.56 2ews n ALA 255 Cb 0.12 -1.33 0.31 0.00 0.00 0.00 0.00 19.45 18.55 2ews n ALA 255 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2ews n PHE 256 N -1.96 0.93 -0.21 0.00 3.01 0.18 -4.56 117.46 114.85 2ews n PHE 256 Ca 0.03 -0.47 0.02 0.00 1.01 0.00 0.00 57.45 58.04 2ews n PHE 256 Cb 0.21 0.00 0.13 0.00 -0.01 0.00 0.00 39.48 39.80 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 4.15 -0.13 -0.26 4.37 0.02 -1.48 -0.41 113.55 119.82 2ews h SER 257 Ca 0.00 0.14 -0.03 0.00 -0.84 0.00 0.00 61.79 61.06 2ews h SER 257 Cb 0.95 0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.70 2ews h SER 257 CO 0.00 -0.06 0.04 1.23 -1.14 0.00 0.00 176.83 176.90 2ews h GLY 258 N 0.19 0.46 0.76 -3.77 0.00 -1.80 0.25 103.07 99.16 2ews h GLY 258 Ca 0.35 -0.31 0.03 0.00 0.00 0.00 0.00 47.33 47.40 2ews h GLY 258 CO -0.49 0.29 0.10 0.00 0.00 0.00 0.00 176.54 176.43 2ews h ALA 259 N 0.86 0.33 -0.20 3.60 0.00 -1.69 0.54 119.26 122.69 2ews h ALA 259 Ca 0.08 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2ews h ALA 259 Cb 0.33 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2ews h ALA 259 CO 0.01 -0.31 0.09 0.82 0.00 0.00 0.00 179.25 179.86 2ews h ILE 260 N 0.22 1.15 -0.86 0.00 2.04 -1.01 -3.04 117.51 116.01 2ews h ILE 260 Ca 0.13 -0.44 0.07 0.00 1.00 0.00 0.00 64.86 65.62 2ews h ILE 260 Cb 0.10 1.07 -0.07 0.00 -0.74 0.00 0.00 36.82 37.18 2ews h ILE 260 CO -0.13 0.14 0.53 1.23 0.00 0.00 0.00 178.15 179.92 2ews h GLY 261 N 0.19 1.32 1.63 5.37 0.00 0.09 -2.17 103.07 109.50 2ews h GLY 261 Ca 0.07 -0.37 0.03 0.00 0.00 0.00 0.00 47.33 47.06 2ews h GLY 261 CO -0.01 0.23 0.18 0.00 0.00 0.00 0.00 176.54 176.94 2ews h ALA 262 N 1.43 1.97 0.00 3.60 0.00 -0.79 -0.30 119.26 125.17 2ews h ALA 262 Ca 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2ews h ALA 262 Cb 0.24 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2ews h ALA 262 CO -0.20 -0.01 0.00 -0.07 0.00 0.00 0.00 179.25 178.97 2ews h LEU 263 N 0.22 0.00 -2.33 0.00 3.38 -1.40 -3.32 115.31 111.87 2ews h LEU 263 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2ews h LEU 263 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2ews h LEU 263 CO -0.02 0.00 0.00 -1.22 0.09 0.00 0.00 178.44 177.29 2ews n TYR 264 N -2.89 0.28 0.95 1.13 4.01 -0.21 -4.33 117.16 116.10 2ews n TYR 264 Ca 0.04 -0.31 0.05 0.00 -0.16 0.00 0.00 57.90 57.52 2ews n TYR 264 Cb 0.47 -0.02 0.14 0.00 -0.31 0.00 0.00 39.34 39.62 2ews n TYR 264 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2ews n LEU 265 N 0.54 1.77 0.00 7.72 4.77 -0.67 -5.06 117.00 126.07 2ews n LEU 265 Ca 0.09 -0.89 0.00 0.00 -0.03 0.00 0.00 56.01 55.19 2ews n LEU 265 Cb 0.37 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 2ews n LEU 265 CO 0.07 0.41 0.00 -0.62 -1.33 0.00 0.00 177.39 175.93