#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r6m s ASN 2 N 0.00 2.14 0.14 6.12 2.20 -1.26 -5.09 114.94 119.19 1r6m s ASN 2 Ca 0.00 -0.72 -0.31 0.00 -0.94 0.00 0.00 52.86 50.90 1r6m s ASN 2 Cb 0.00 0.17 -0.08 0.00 -2.00 0.00 0.00 41.25 39.34 1r6m s ASN 2 CO 0.00 -0.38 1.34 -0.13 -2.94 0.00 0.00 177.10 174.99 1r6m s ARG 3 N 2.26 4.36 0.32 3.55 0.52 -1.26 -4.92 118.95 123.78 1r6m s ARG 3 Ca 0.08 2.03 0.05 0.00 -0.52 0.00 0.00 55.73 57.37 1r6m s ARG 3 Cb -0.15 -3.24 0.86 0.00 0.52 0.00 0.00 34.95 32.93 1r6m s ARG 3 CO -0.25 -0.35 1.59 -1.35 0.02 0.00 0.00 175.30 174.96 1r6m h PRO 4 N 6.33 0.04 -0.01 3.54 0.11 -2.00 1.46 132.00 141.47 1r6m h PRO 4 Ca -0.43 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1r6m h PRO 4 Cb 1.21 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1r6m h PRO 4 CO 0.83 0.03 0.00 -1.13 -0.21 0.00 0.00 178.00 177.52 1r6m n SER 5 N -5.40 0.07 -0.57 -2.05 3.41 -1.26 -4.85 113.62 102.97 1r6m n SER 5 Ca 0.26 -1.56 -0.07 0.00 -0.26 0.00 0.00 58.87 57.23 1r6m n SER 5 Cb 0.84 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.76 1r6m n SER 5 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1r6m n GLY 6 N 0.74 0.81 3.82 5.00 0.00 0.50 -4.96 105.19 111.10 1r6m n GLY 6 Ca 0.11 -0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1r6m n GLY 6 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1r6m s ARG 7 N -2.39 3.32 0.27 1.61 3.52 -1.26 -4.93 118.95 119.09 1r6m s ARG 7 Ca 0.00 1.04 -0.27 0.00 -0.13 0.00 0.00 55.73 56.37 1r6m s ARG 7 Cb 0.00 -2.04 -0.09 0.00 -1.56 0.00 0.00 34.95 31.26 1r6m s ARG 7 CO 0.00 -0.80 0.92 0.00 -0.81 0.00 0.00 175.30 174.61 1r6m s ALA 8 N -2.75 3.29 0.55 6.12 0.00 -1.26 -4.44 121.76 123.27 1r6m s ALA 8 Ca 0.60 0.53 0.17 0.00 0.00 0.00 0.00 51.96 53.27 1r6m s ALA 8 Cb -0.14 -3.16 0.93 0.00 0.00 0.00 0.00 23.12 20.75 1r6m s ALA 8 CO 0.44 0.21 1.49 0.00 0.00 0.00 0.00 175.76 177.89 1r6m h ALA 9 N 3.68 1.51 -0.02 0.00 0.00 -1.95 0.50 119.26 122.98 1r6m h ALA 9 Ca -0.46 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1r6m h ALA 9 Cb 1.20 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1r6m h ALA 9 CO 0.66 -0.51 -0.22 -0.40 0.00 0.00 0.00 179.25 178.78 1r6m n ASP 10 N -2.58 2.12 -4.37 0.00 5.75 -1.26 -1.31 116.55 114.91 1r6m n ASP 10 Ca -0.01 -3.46 -0.33 0.00 -0.01 0.00 0.00 54.79 50.98 1r6m n ASP 10 Cb 0.57 -0.48 -0.14 0.00 -1.03 0.00 0.00 41.12 40.04 1r6m n ASP 10 CO 0.00 0.00 0.00 -1.58 -0.11 0.00 0.00 177.20 175.51 1r6m s GLN 11 N -3.04 3.41 0.76 0.11 0.74 0.17 -4.91 119.66 116.90 1r6m s GLN 11 Ca 0.35 -0.66 -0.11 0.00 0.05 0.00 0.00 55.36 55.00 1r6m s GLN 11 Cb 0.32 -2.73 0.05 0.00 1.10 0.00 0.00 33.01 31.75 1r6m s GLN 11 CO -0.01 0.14 1.08 -0.51 -0.55 0.00 0.00 175.29 175.44 1r6m s LEU 12 N 0.55 2.92 0.81 3.68 1.43 -1.26 -4.69 118.68 122.12 1r6m s LEU 12 Ca -0.07 1.63 -0.12 0.00 -1.03 0.00 0.00 54.13 54.54 1r6m s LEU 12 Cb -0.15 -4.35 0.08 0.00 0.03 0.00 0.00 46.19 41.79 1r6m s LEU 12 CO 0.03 -1.86 1.13 -0.13 0.23 0.00 0.00 176.35 175.76 1r6m s ARG 13 N -5.00 2.01 0.14 1.70 0.52 -1.26 -4.94 118.95 112.11 1r6m s ARG 13 Ca 0.60 0.36 -0.31 0.00 -0.52 0.00 0.00 55.73 55.86 1r6m s ARG 13 Cb -0.16 -1.93 -0.09 0.00 0.52 0.00 0.00 34.95 33.29 1r6m s ARG 13 CO 0.55 -1.61 1.53 -2.14 0.02 0.00 0.00 175.30 173.65 1r6m s PRO 14 N -5.36 4.24 -0.08 3.54 0.02 -1.26 -4.70 135.00 131.40 1r6m s PRO 14 Ca 0.61 2.29 0.03 0.00 0.02 0.00 0.00 61.00 63.95 1r6m s PRO 14 Cb -0.13 -3.21 -0.02 0.00 0.02 0.00 0.00 34.50 31.16 1r6m s PRO 14 CO 0.52 -0.58 -0.18 0.42 -0.33 0.00 0.00 177.00 176.85 1r6m s ILE 15 N 1.26 2.65 0.01 2.83 1.01 -1.26 -1.06 121.20 126.64 1r6m s ILE 15 Ca 0.69 -0.84 0.03 0.00 0.00 0.00 0.00 60.65 60.52 1r6m s ILE 15 Cb -0.42 -2.04 -0.01 0.00 0.01 0.00 0.00 42.46 40.01 1r6m s ILE 15 CO 0.31 0.56 -0.08 -0.60 0.00 0.00 0.00 174.94 175.13 1r6m s ARG 16 N -0.12 0.61 -0.11 2.79 3.52 -0.65 -4.99 118.95 120.01 1r6m s ARG 16 Ca -0.03 -0.40 -0.01 0.00 -0.13 0.00 0.00 55.73 55.16 1r6m s ARG 16 Cb -0.14 -0.56 0.03 0.00 -1.56 0.00 0.00 34.95 32.72 1r6m s ARG 16 CO 0.04 0.15 -0.02 0.42 -0.81 0.00 0.00 175.30 175.07 1r6m s ILE 17 N -0.46 0.66 -0.23 4.11 1.01 -1.26 -0.04 121.20 124.99 1r6m s ILE 17 Ca 0.00 -0.18 -0.03 0.00 0.00 0.00 0.00 60.65 60.45 1r6m s ILE 17 Cb -0.05 -0.83 0.01 0.00 0.01 0.00 0.00 42.46 41.60 1r6m s ILE 17 CO 0.00 0.21 -0.05 -0.89 0.00 0.00 0.00 174.94 174.20 1r6m s THR 18 N 1.84 3.09 0.62 2.92 2.01 -0.10 -4.91 115.64 121.12 1r6m s THR 18 Ca 0.04 -0.77 -0.07 0.00 0.31 0.00 0.00 61.69 61.20 1r6m s THR 18 Cb -0.13 -2.48 0.01 0.00 0.01 0.00 0.00 72.50 69.91 1r6m s THR 18 CO -0.07 0.31 0.94 -0.13 -0.69 0.00 0.00 174.62 174.99 1r6m s ARG 19 N 1.40 2.88 -1.62 4.92 0.52 -1.26 -0.47 118.95 125.32 1r6m s ARG 19 Ca 0.03 0.08 -0.16 0.00 -0.52 0.00 0.00 55.73 55.15 1r6m s ARG 19 Cb -0.15 -2.22 0.12 0.00 0.52 0.00 0.00 34.95 33.22 1r6m s ARG 19 CO -0.04 -0.78 0.89 0.72 0.02 0.00 0.00 175.30 176.10 1r6m n HIS 20 N -2.68 -2.03 -0.08 -0.53 8.25 0.90 -4.87 115.22 114.19 1r6m n HIS 20 Ca 0.05 0.85 -0.10 0.00 -0.26 0.00 0.00 57.72 58.26 1r6m n HIS 20 Cb 0.58 -3.47 -0.03 0.00 1.12 0.00 0.00 29.99 28.19 1r6m n HIS 20 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1r6m h TYR 21 N -1.80 0.39 -4.29 4.41 3.20 -1.35 -3.43 116.97 114.10 1r6m h TYR 21 Ca -0.59 -0.03 -0.64 0.00 3.14 0.00 0.00 58.73 60.62 1r6m h TYR 21 Cb 1.38 -0.12 -0.27 0.00 1.54 0.00 0.00 36.73 39.26 1r6m h TYR 21 CO 0.60 0.39 -0.86 0.95 -1.64 0.00 0.00 178.16 177.60 1r6m s THR 22 N -5.61 1.89 -1.34 1.81 -4.23 -1.26 -5.04 115.64 101.85 1r6m s THR 22 Ca -0.13 -1.23 0.22 0.00 -1.18 0.00 0.00 61.69 59.36 1r6m s THR 22 Cb 0.08 -1.62 0.34 0.00 1.34 0.00 0.00 72.50 72.65 1r6m s THR 22 CO 0.72 0.34 1.71 2.29 -0.54 0.00 0.00 174.62 179.13 1r6m n LYS 23 N 1.96 0.25 -0.05 3.99 2.85 -1.26 -4.32 118.16 121.57 1r6m n LYS 23 Ca -0.17 0.09 -0.22 0.00 -1.05 0.00 0.00 58.31 56.96 1r6m n LYS 23 Cb 0.52 -1.50 -0.13 0.00 -0.65 0.00 0.00 35.03 33.28 1r6m n LYS 23 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1r6m n HIS 24 N -1.33 1.00 -1.55 5.58 8.25 -1.26 -4.97 115.22 120.94 1r6m n HIS 24 Ca 0.09 0.28 -0.35 0.00 -0.26 0.00 0.00 57.72 57.49 1r6m n HIS 24 Cb 0.19 -1.12 0.08 0.00 1.12 0.00 0.00 29.99 30.26 1r6m n HIS 24 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1r6m s ALA 25 N -2.49 2.22 -0.18 -1.41 0.00 -1.26 -4.90 121.76 113.74 1r6m s ALA 25 Ca -0.26 0.89 0.29 0.00 0.00 0.00 0.00 51.96 52.87 1r6m s ALA 25 Cb 0.07 -3.46 1.20 0.00 0.00 0.00 0.00 23.12 20.93 1r6m s ALA 25 CO 0.68 -1.72 1.85 0.93 0.00 0.00 0.00 175.76 177.51 1r6m h GLU 26 N -0.07 0.00 -2.50 0.00 3.07 -1.84 -3.41 114.58 109.84 1r6m h GLU 26 Ca -0.48 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.30 1r6m h GLU 26 Cb 1.29 0.00 -0.26 0.00 -0.84 0.00 0.00 28.75 28.95 1r6m h GLU 26 CO 0.51 0.00 -0.25 0.20 -1.40 0.00 0.00 179.01 178.07 1r6m s GLY 27 N -3.85 -0.40 -0.08 -3.84 0.00 -1.17 -3.39 107.32 94.59 1r6m s GLY 27 Ca 0.02 1.70 -0.03 0.00 0.00 0.00 0.00 44.72 46.41 1r6m s GLY 27 CO 0.45 1.97 0.17 -0.45 0.00 0.00 0.00 173.10 175.25 1r6m s SER 28 N 1.70 0.40 -0.02 1.64 0.15 -1.26 -0.10 113.70 116.21 1r6m s SER 28 Ca -0.08 0.36 0.03 0.00 0.70 0.00 0.00 55.95 56.96 1r6m s SER 28 Cb -0.09 0.30 -0.00 0.00 -1.71 0.00 0.00 66.02 64.53 1r6m s SER 28 CO -0.14 -0.21 -0.10 -0.69 1.20 0.00 0.00 173.24 173.30 1r6m s VAL 29 N 1.93 0.79 -0.36 4.45 1.01 0.73 -0.07 120.40 128.89 1r6m s VAL 29 Ca -0.01 -0.40 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 1r6m s VAL 29 Cb -0.12 -0.68 0.00 0.00 0.00 0.00 0.00 36.38 35.58 1r6m s VAL 29 CO -0.06 0.24 0.22 -0.22 0.00 0.00 0.00 175.10 175.28 1r6m s LEU 30 N -0.03 4.59 -0.12 3.92 2.96 0.37 0.04 118.68 130.41 1r6m s LEU 30 Ca 0.01 -0.68 -0.03 0.00 -0.22 0.00 0.00 54.13 53.21 1r6m s LEU 30 Cb -0.06 -2.08 -0.03 0.00 0.50 0.00 0.00 46.19 44.52 1r6m s LEU 30 CO 0.00 -0.30 -0.02 0.54 -1.32 0.00 0.00 176.35 175.24 1r6m s VAL 31 N 1.65 4.08 -0.16 1.68 0.11 -0.32 -0.92 120.40 126.52 1r6m s VAL 31 Ca 0.05 -0.31 -0.00 0.00 -2.93 0.00 0.00 61.98 58.78 1r6m s VAL 31 Cb -0.18 -2.75 0.03 0.00 -1.53 0.00 0.00 36.38 31.96 1r6m s VAL 31 CO 0.08 0.55 -0.08 -1.61 -3.33 0.00 0.00 175.10 170.71 1r6m s GLU 32 N -0.26 1.74 -0.67 1.54 2.02 0.94 -1.29 118.70 122.72 1r6m s GLU 32 Ca 0.05 -0.53 -0.07 0.00 0.02 0.00 0.00 54.97 54.45 1r6m s GLU 32 Cb -0.13 -2.01 0.17 0.00 0.10 0.00 0.00 34.13 32.27 1r6m s GLU 32 CO 0.02 -0.35 0.53 -0.06 0.02 0.00 0.00 175.26 175.42 1r6m s PHE 33 N 1.58 3.52 0.00 1.61 0.40 0.68 -1.63 117.98 124.14 1r6m s PHE 33 Ca 0.02 -2.39 0.00 0.00 -0.60 0.00 0.00 56.93 53.96 1r6m s PHE 33 Cb -0.14 -3.43 0.00 0.00 0.51 0.00 0.00 43.02 39.96 1r6m s PHE 33 CO -0.09 -0.91 0.00 0.41 0.70 0.00 0.00 175.22 175.34 1r6m n GLY 34 N 3.81 3.26 0.04 4.36 0.00 -0.22 -1.00 105.19 115.43 1r6m n GLY 34 Ca 0.08 -0.15 0.15 0.00 0.00 0.00 0.00 46.02 46.10 1r6m n GLY 34 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1r6m n ASP 35 N 5.93 0.14 -4.62 1.61 8.00 -1.26 -4.70 116.55 121.65 1r6m n ASP 35 Ca 0.00 -0.48 -0.42 0.00 0.71 0.00 0.00 54.79 54.60 1r6m n ASP 35 Cb 0.00 -0.16 -0.04 0.00 -0.02 0.00 0.00 41.12 40.90 1r6m n ASP 35 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1r6m s THR 36 N -2.39 4.72 -0.11 -3.53 2.01 -0.17 -4.39 115.64 111.77 1r6m s THR 36 Ca 0.34 1.28 0.02 0.00 0.31 0.00 0.00 61.69 63.63 1r6m s THR 36 Cb 0.21 -4.21 0.02 0.00 0.01 0.00 0.00 72.50 68.52 1r6m s THR 36 CO 0.44 -0.32 -0.15 -0.54 -0.69 0.00 0.00 174.62 173.36 1r6m s LYS 37 N 3.12 2.26 -0.02 4.92 1.02 0.45 -0.23 119.74 131.26 1r6m s LYS 37 Ca 0.35 -0.57 0.03 0.00 0.02 0.00 0.00 55.97 55.79 1r6m s LYS 37 Cb -0.14 -1.93 -0.00 0.00 -0.52 0.00 0.00 37.83 35.24 1r6m s LYS 37 CO 0.13 -0.08 -0.09 0.08 -0.92 0.00 0.00 175.35 174.48 1r6m s VAL 38 N 1.02 0.75 -0.31 3.17 1.01 -0.42 -1.70 120.40 123.93 1r6m s VAL 38 Ca -0.06 -0.37 -0.18 0.00 0.00 0.00 0.00 61.98 61.38 1r6m s VAL 38 Cb -0.15 -0.65 -0.02 0.00 0.00 0.00 0.00 36.38 35.56 1r6m s VAL 38 CO -0.02 0.23 0.50 -0.51 0.00 0.00 0.00 175.10 175.29 1r6m s ILE 39 N 0.03 5.06 -0.27 2.22 1.10 -0.09 -1.17 121.20 128.09 1r6m s ILE 39 Ca -0.00 0.57 -0.03 0.00 -0.51 0.00 0.00 60.65 60.68 1r6m s ILE 39 Cb -0.06 -3.88 0.03 0.00 0.15 0.00 0.00 42.46 38.69 1r6m s ILE 39 CO 0.00 -0.05 -0.02 0.00 -2.11 0.00 0.00 174.94 172.75 1r6m s THR 41 N 1.35 2.40 -0.13 0.00 -4.23 -0.10 -0.19 115.64 114.74 1r6m s THR 41 Ca -0.00 -1.84 0.02 0.00 -1.18 0.00 0.00 61.69 58.69 1r6m s THR 41 Cb -0.17 -2.11 0.01 0.00 1.34 0.00 0.00 72.50 71.57 1r6m s THR 41 CO -0.03 0.00 -0.18 -0.69 -0.54 0.00 0.00 174.62 173.18 1r6m s VAL 42 N -1.34 1.76 -0.22 2.29 1.01 0.85 -0.24 120.40 124.52 1r6m s VAL 42 Ca 0.18 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.32 1r6m s VAL 42 Cb -0.09 -1.58 -0.00 0.00 0.00 0.00 0.00 36.38 34.70 1r6m s VAL 42 CO 0.08 0.49 -0.05 -0.44 0.00 0.00 0.00 175.10 175.19 1r6m s SER 43 N 0.94 4.26 -0.29 3.32 0.01 0.86 -2.30 113.70 120.50 1r6m s SER 43 Ca -0.06 -0.47 -0.24 0.00 1.31 0.00 0.00 55.95 56.50 1r6m s SER 43 Cb -0.15 -1.72 -0.00 0.00 0.21 0.00 0.00 66.02 64.36 1r6m s SER 43 CO -0.02 -0.04 0.80 0.00 0.41 0.00 0.00 173.24 174.39 1r6m s ALA 44 N 1.45 3.56 -0.06 1.44 0.00 -1.26 -0.83 121.76 126.07 1r6m s ALA 44 Ca 0.05 -0.34 0.06 0.00 0.00 0.00 0.00 51.96 51.73 1r6m s ALA 44 Cb -0.14 -3.30 -0.01 0.00 0.00 0.00 0.00 23.12 19.66 1r6m s ALA 44 CO -0.04 -1.13 -0.24 -2.00 0.00 0.00 0.00 175.76 172.35 1r6m s GLU 45 N 2.94 2.54 0.30 0.00 2.56 0.62 -4.99 118.70 122.68 1r6m s GLU 45 Ca 0.33 -0.89 -0.29 0.00 0.00 0.00 0.00 54.97 54.13 1r6m s GLU 45 Cb -0.14 -2.18 -0.09 0.00 2.00 0.00 0.00 34.13 33.71 1r6m s GLU 45 CO 0.11 0.41 1.11 0.45 -0.56 0.00 0.00 175.26 176.78 1r6m s SER 46 N -0.22 7.17 0.00 -1.70 0.15 -1.26 0.35 113.70 118.19 1r6m s SER 46 Ca -0.02 2.27 0.00 0.00 0.70 0.00 0.00 55.95 58.91 1r6m s SER 46 Cb -0.13 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.55 1r6m s SER 46 CO 0.03 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.87 1r6m n GLY 47 N 1.08 -3.69 3.25 9.45 0.00 0.43 -4.77 105.19 110.93 1r6m n GLY 47 Ca -0.00 -2.09 -0.10 0.00 0.00 0.00 0.00 46.02 43.82 1r6m n GLY 47 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1r6m s VAL 48 N -0.75 0.10 0.00 1.61 -7.23 -1.25 -2.18 120.40 110.70 1r6m s VAL 48 Ca 0.00 -0.84 0.00 0.00 -1.81 0.00 0.00 61.98 59.33 1r6m s VAL 48 Cb 0.00 -1.12 0.00 0.00 0.56 0.00 0.00 36.38 35.82 1r6m s VAL 48 CO 0.00 -0.46 0.00 -2.65 -0.31 0.00 0.00 175.10 171.68 1r6m n PRO 49 N 0.18 0.00 -3.07 4.82 -0.02 -1.26 -4.61 135.00 131.04 1r6m n PRO 49 Ca -0.17 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 60.96 1r6m n PRO 49 Cb 0.61 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 34.07 1r6m n PRO 49 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1r6m n ARG 50 N 0.00 3.87 -2.90 -0.52 0.00 -1.26 -5.01 116.66 110.83 1r6m n ARG 50 Ca 0.00 -4.65 -0.10 0.00 -0.00 0.00 0.00 57.85 53.10 1r6m n ARG 50 Cb 0.00 -2.39 -0.03 0.00 -0.00 0.00 0.00 32.46 30.04 1r6m n ARG 50 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 1r6m n PHE 51 N 0.75 0.08 0.00 2.89 3.72 -1.26 -4.99 117.46 118.65 1r6m n PHE 51 Ca 0.31 -0.97 0.00 0.00 -0.05 0.00 0.00 57.45 56.74 1r6m n PHE 51 Cb 0.35 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.88 1r6m n PHE 51 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 176.76 178.18 1r6m n LEU 52 N 0.00 0.00 -0.10 4.37 -0.00 -1.26 -5.06 117.00 114.96 1r6m n LEU 52 Ca -0.03 0.00 -0.11 0.00 -0.00 0.00 0.00 56.01 55.88 1r6m n LEU 52 Cb 0.23 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.57 1r6m n LEU 52 CO 0.12 0.00 0.50 0.11 -0.00 0.00 0.00 177.39 178.12 1r6m h LYS 53 N 0.00 -0.31 0.00 1.47 1.57 -2.03 -3.52 116.57 113.74 1r6m h LYS 53 Ca 0.00 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1r6m h LYS 53 Cb 0.00 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1r6m h LYS 53 CO 0.00 -0.21 0.00 0.00 -0.57 0.00 0.00 179.45 178.67 1r6m n GLN 57 N -4.76 0.00 -0.17 3.15 10.64 -1.26 -4.99 117.38 119.98 1r6m n GLN 57 Ca -0.03 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.14 1r6m n GLN 57 Cb 0.27 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.65 1r6m n GLN 57 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1r6m n GLY 58 N -0.27 0.45 3.33 2.61 0.00 0.17 -4.65 105.19 106.83 1r6m n GLY 58 Ca 0.00 -1.85 -0.13 0.00 0.00 0.00 0.00 46.02 44.04 1r6m n GLY 58 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1r6m s TRP 59 N 0.59 -0.29 -0.08 1.61 -0.00 -0.79 -4.89 118.94 115.09 1r6m s TRP 59 Ca 0.00 0.28 -0.05 0.00 -0.00 0.00 0.00 56.10 56.33 1r6m s TRP 59 Cb 0.00 0.23 0.03 0.00 -0.00 0.00 0.00 33.47 33.73 1r6m s TRP 59 CO 0.00 -0.57 0.19 -1.17 -0.00 0.00 0.00 176.95 175.40 1r6m s LEU 60 N -1.95 0.88 0.05 5.86 0.20 -1.26 0.17 118.68 122.63 1r6m s LEU 60 Ca -0.06 0.40 0.01 0.00 0.69 0.00 0.00 54.13 55.17 1r6m s LEU 60 Cb -0.01 0.59 -0.03 0.00 -0.43 0.00 0.00 46.19 46.31 1r6m s LEU 60 CO -0.02 -0.12 -0.05 0.28 -0.29 0.00 0.00 176.35 176.16 1r6m s THR 61 N 0.73 0.40 0.05 3.68 -1.32 -0.31 -4.92 115.64 113.94 1r6m s THR 61 Ca -0.05 -1.48 0.02 0.00 -1.21 0.00 0.00 61.69 58.97 1r6m s THR 61 Cb -0.07 -1.08 -0.02 0.00 -1.51 0.00 0.00 72.50 69.82 1r6m s THR 61 CO -0.04 -0.72 -0.08 0.00 -2.21 0.00 0.00 174.62 171.57 1r6m s ALA 62 N -2.73 0.61 0.15 11.08 0.00 -1.26 -0.68 121.76 128.93 1r6m s ALA 62 Ca -0.01 -0.79 0.07 0.00 0.00 0.00 0.00 51.96 51.23 1r6m s ALA 62 Cb -0.01 0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.11 1r6m s ALA 62 CO -0.04 -0.02 -0.15 -1.21 0.00 0.00 0.00 175.76 174.34 1r6m s GLU 63 N -1.66 1.14 0.01 0.00 2.02 0.48 -4.73 118.70 115.96 1r6m s GLU 63 Ca -0.09 -1.37 0.03 0.00 0.02 0.00 0.00 54.97 53.56 1r6m s GLU 63 Cb -0.10 -1.01 -0.01 0.00 0.10 0.00 0.00 34.13 33.11 1r6m s GLU 63 CO 0.00 0.19 -0.10 -0.47 0.02 0.00 0.00 175.26 174.90 1r6m s TYR 64 N -2.41 0.87 0.11 1.61 5.04 -1.26 -1.32 117.35 119.99 1r6m s TYR 64 Ca 0.14 -0.22 -0.09 0.00 -2.44 0.00 0.00 57.07 54.46 1r6m s TYR 64 Cb -0.03 -0.55 -0.00 0.00 0.35 0.00 0.00 41.96 41.73 1r6m s TYR 64 CO 0.04 -0.01 0.23 0.20 -1.34 0.00 0.00 175.55 174.67 1r6m s GLY 65 N -0.49 0.16 -0.02 8.97 0.00 -0.28 -4.98 107.32 110.68 1r6m s GLY 65 Ca 0.02 -0.64 0.01 0.00 0.00 0.00 0.00 44.72 44.12 1r6m s GLY 65 CO -0.00 -0.77 -0.05 1.06 0.00 0.00 0.00 173.10 173.34 1r6m s MET 66 N -3.88 0.54 0.42 2.90 -1.94 -1.26 -0.75 119.30 115.33 1r6m s MET 66 Ca 0.08 -0.15 -0.24 0.00 -1.71 0.00 0.00 55.69 53.67 1r6m s MET 66 Cb 0.04 -0.55 -0.08 0.00 2.01 0.00 0.00 34.83 36.25 1r6m s MET 66 CO -0.08 0.04 1.18 -0.51 -0.01 0.00 0.00 175.02 175.64 1r6m s LEU 67 N 0.27 4.12 0.44 -0.03 1.43 -0.37 -4.91 118.68 119.63 1r6m s LEU 67 Ca -0.03 2.36 0.21 0.00 -1.03 0.00 0.00 54.13 55.64 1r6m s LEU 67 Cb -0.07 -4.10 1.18 0.00 0.03 0.00 0.00 46.19 43.23 1r6m s LEU 67 CO -0.00 -0.79 1.83 -0.65 0.23 0.00 0.00 176.35 176.97 1r6m h PRO 68 N 2.41 0.31 -0.78 1.29 0.11 -1.92 -1.21 132.00 132.20 1r6m h PRO 68 Ca -0.49 -0.02 -0.56 0.00 0.11 0.00 0.00 66.00 65.05 1r6m h PRO 68 Cb 1.24 -0.07 -0.37 0.00 0.11 0.00 0.00 31.00 31.91 1r6m h PRO 68 CO 0.62 0.20 -0.33 -2.13 -0.21 0.00 0.00 178.00 176.15 1r6m n ARG 69 N -4.48 3.24 0.10 1.05 3.00 -1.26 -0.79 116.66 117.52 1r6m n ARG 69 Ca 0.21 -3.87 0.12 0.00 -0.00 0.00 0.00 57.85 54.31 1r6m n ARG 69 Cb 0.82 -2.25 0.22 0.00 0.00 0.00 0.00 32.46 31.25 1r6m n ARG 69 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1r6m h SER 70 N 2.05 0.00 -2.80 6.15 4.64 -1.41 -3.46 113.55 118.72 1r6m h SER 70 Ca 0.42 -0.11 -0.59 0.00 -0.47 0.00 0.00 61.79 61.05 1r6m h SER 70 Cb 1.35 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.35 1r6m h SER 70 CO 0.95 0.05 -0.60 0.42 -0.87 0.00 0.00 176.83 176.79 1r6m s THR 71 N -3.18 4.27 0.23 2.95 -4.23 -1.26 0.67 115.64 115.08 1r6m s THR 71 Ca 0.07 -1.15 -0.10 0.00 -1.18 0.00 0.00 61.69 59.33 1r6m s THR 71 Cb 0.12 -3.16 0.25 0.00 1.34 0.00 0.00 72.50 71.05 1r6m s THR 71 CO 0.69 -0.09 1.64 1.23 -0.54 0.00 0.00 174.62 177.55 1r6m h GLY 72 N 2.57 0.69 -5.69 3.99 0.00 -1.89 -3.36 103.07 99.39 1r6m h GLY 72 Ca -0.47 0.14 -0.65 0.00 0.00 0.00 0.00 47.33 46.34 1r6m h GLY 72 CO 0.62 -0.26 -0.63 -0.54 0.00 0.00 0.00 176.54 175.73 1r6m s GLU 73 N -6.16 3.47 0.10 4.80 8.01 -1.26 -5.05 118.70 122.61 1r6m s GLU 73 Ca -0.14 -0.45 -0.35 0.00 0.01 0.00 0.00 54.97 54.04 1r6m s GLU 73 Cb 0.21 -2.92 -0.15 0.00 -4.31 0.00 0.00 34.13 26.96 1r6m s GLU 73 CO 0.75 0.42 1.53 -2.13 0.01 0.00 0.00 175.26 175.84 1r6m n ARG 74 N 3.02 1.80 -4.04 1.61 0.63 -1.26 -4.93 116.66 113.49 1r6m n ARG 74 Ca -0.18 0.65 -0.36 0.00 -0.92 0.00 0.00 57.85 57.05 1r6m n ARG 74 Cb 0.53 -2.38 -0.08 0.00 0.45 0.00 0.00 32.46 30.97 1r6m n ARG 74 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1r6m s ASN 75 N 1.13 5.85 0.15 6.15 2.20 0.03 -5.02 114.94 125.44 1r6m s ASN 75 Ca 0.82 0.26 -0.34 0.00 -0.94 0.00 0.00 52.86 52.67 1r6m s ASN 75 Cb -0.78 -1.87 -0.14 0.00 -2.00 0.00 0.00 41.25 36.46 1r6m s ASN 75 CO 0.43 0.33 1.60 1.67 -2.94 0.00 0.00 177.10 178.18 1r6m n GLN 76 N 2.52 2.20 -1.96 3.55 7.27 -1.26 -4.43 117.38 125.27 1r6m n GLN 76 Ca -0.18 0.79 -0.42 0.00 0.07 0.00 0.00 57.00 57.26 1r6m n GLN 76 Cb 0.54 -2.57 -0.03 0.00 2.41 0.00 0.00 30.24 30.59 1r6m n GLN 76 CO 0.00 0.00 0.00 0.50 0.07 0.00 0.00 177.06 177.63 1r6m s ARG 77 N 1.06 4.21 0.40 3.69 3.52 -1.26 -4.89 118.95 125.68 1r6m s ARG 77 Ca 0.79 2.29 0.12 0.00 -0.13 0.00 0.00 55.73 58.80 1r6m s ARG 77 Cb -0.67 -3.61 0.83 0.00 -1.56 0.00 0.00 34.95 29.95 1r6m s ARG 77 CO 0.38 -0.72 1.91 0.93 -0.81 0.00 0.00 175.30 176.99 1r6m h GLU 78 N 8.31 0.09 -0.93 5.12 5.08 -1.91 -1.99 114.58 128.35 1r6m h GLU 78 Ca -0.42 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 57.94 1r6m h GLU 78 Cb 1.20 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.39 1r6m h GLU 78 CO 0.93 0.32 0.61 0.00 -1.00 0.00 0.00 179.01 179.86 1r6m h ALA 79 N 1.69 1.20 0.00 3.43 0.00 -1.90 0.41 119.26 124.09 1r6m h ALA 79 Ca 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1r6m h ALA 79 Cb 0.45 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1r6m h ALA 79 CO 0.03 0.52 -0.58 0.66 0.00 0.00 0.00 179.25 179.88 1r6m h SER 80 N 1.21 0.00 1.01 0.00 4.64 -1.88 -3.18 113.55 115.35 1r6m h SER 80 Ca 0.36 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 1r6m h SER 80 Cb -0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 1r6m h SER 80 CO -0.10 0.01 -0.32 -2.11 -0.87 0.00 0.00 176.83 173.44 1r6m n ARG 81 N -2.76 0.19 -3.30 4.77 -4.01 -0.78 -4.95 116.66 105.81 1r6m n ARG 81 Ca 0.02 0.10 -0.17 0.00 -1.04 0.00 0.00 57.85 56.75 1r6m n ARG 81 Cb 0.53 -1.66 0.07 0.00 -3.04 0.00 0.00 32.46 28.36 1r6m n ARG 81 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1r6m n GLY 82 N 1.38 -0.24 0.00 2.89 0.00 0.09 -5.00 105.19 104.32 1r6m n GLY 82 Ca 0.05 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1r6m n GLY 82 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1r6m n LYS 83 N -3.92 0.00 -3.67 1.61 4.81 -1.07 -5.07 118.16 110.85 1r6m n LYS 83 Ca -0.07 0.00 -0.36 0.00 -0.87 0.00 0.00 58.31 57.00 1r6m n LYS 83 Cb 0.58 0.00 -0.09 0.00 0.02 0.00 0.00 35.03 35.53 1r6m n LYS 83 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 1r6m s GLN 84 N -1.50 4.07 1.15 1.64 -0.21 -1.26 -4.67 119.66 118.88 1r6m s GLN 84 Ca 0.00 -0.27 -0.14 0.00 0.02 0.00 0.00 55.36 54.97 1r6m s GLN 84 Cb 0.00 -3.53 0.27 0.00 1.00 0.00 0.00 33.01 30.75 1r6m s GLN 84 CO 0.00 0.07 1.04 0.20 -2.12 0.00 0.00 175.29 174.48 1r6m s GLY 85 N 1.03 1.54 0.21 3.09 0.00 -1.26 -4.78 107.32 107.14 1r6m s GLY 85 Ca 0.07 -0.30 -0.10 0.00 0.00 0.00 0.00 44.72 44.40 1r6m s GLY 85 CO 0.04 0.43 1.87 -1.33 0.00 0.00 0.00 173.10 174.11 1r6m h GLY 86 N -2.53 1.09 0.43 0.20 0.00 -2.00 -2.74 103.07 97.52 1r6m h GLY 86 Ca -0.59 -0.43 0.05 0.00 0.00 0.00 0.00 47.33 46.36 1r6m h GLY 86 CO 0.51 0.42 -0.11 -0.09 0.00 0.00 0.00 176.54 177.27 1r6m h ARG 87 N 1.03 -0.09 -0.08 4.80 2.43 -1.99 -0.36 114.38 120.13 1r6m h ARG 87 Ca 0.28 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.49 1r6m h ARG 87 Cb -0.08 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.46 1r6m h ARG 87 CO -0.06 -0.06 -0.15 1.15 -1.51 0.00 0.00 179.97 179.35 1r6m h THR 88 N -0.09 0.62 -0.56 0.20 2.02 -1.86 0.51 112.91 113.75 1r6m h THR 88 Ca 0.12 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.29 1r6m h THR 88 Cb 0.27 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 67.28 1r6m h THR 88 CO -0.27 0.00 0.32 -0.07 0.37 0.00 0.00 175.52 175.86 1r6m h LEU 89 N -0.20 0.69 0.19 2.58 3.38 -1.28 0.10 115.31 120.77 1r6m h LEU 89 Ca 0.08 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1r6m h LEU 89 Cb 0.31 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1r6m h LEU 89 CO -0.20 0.57 -0.33 -0.08 0.09 0.00 0.00 178.44 178.49 1r6m h GLU 90 N 0.75 -0.58 -0.67 1.13 4.81 -0.61 0.18 114.58 119.59 1r6m h GLU 90 Ca 0.20 0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.49 1r6m h GLU 90 Cb 0.03 0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 1r6m h GLU 90 CO -0.03 -0.39 0.43 0.82 -0.73 0.00 0.00 179.01 179.11 1r6m h ILE 91 N -0.60 1.13 -0.00 2.32 2.04 -0.74 -1.51 117.51 120.15 1r6m h ILE 91 Ca 0.01 -0.30 0.02 0.00 1.00 0.00 0.00 64.86 65.60 1r6m h ILE 91 Cb 0.60 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 1r6m h ILE 91 CO -0.15 0.16 -0.14 1.56 0.00 0.00 0.00 178.15 179.57 1r6m h GLN 92 N 0.86 -0.23 -0.53 2.37 4.20 -0.19 -0.75 115.11 120.84 1r6m h GLN 92 Ca 0.26 0.02 0.02 0.00 0.06 0.00 0.00 58.65 59.00 1r6m h GLN 92 Cb -0.04 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 1r6m h GLN 92 CO -0.08 -0.15 0.33 0.00 -0.67 0.00 0.00 178.83 178.26 1r6m h ARG 93 N -0.24 0.65 -0.11 1.46 3.08 -0.44 -1.76 114.38 117.01 1r6m h ARG 93 Ca 0.05 -0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.10 1r6m h ARG 93 Cb 0.30 -0.15 -0.05 0.00 0.08 0.00 0.00 29.97 30.16 1r6m h ARG 93 CO -0.14 0.43 -0.16 1.25 -1.07 0.00 0.00 179.97 180.28 1r6m h LEU 94 N 0.67 -0.49 -0.29 3.04 5.85 -0.86 -1.27 115.31 121.95 1r6m h LEU 94 Ca 0.21 0.09 0.06 0.00 0.84 0.00 0.00 57.88 59.07 1r6m h LEU 94 Cb -0.02 0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 1r6m h LEU 94 CO -0.07 -0.21 -0.08 0.40 -0.34 0.00 0.00 178.44 178.14 1r6m h ILE 95 N -0.21 0.70 -0.32 4.05 1.08 -0.74 -0.42 117.51 121.65 1r6m h ILE 95 Ca 0.09 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.59 1r6m h ILE 95 Cb 0.34 0.70 -0.03 0.00 -3.07 0.00 0.00 36.82 34.75 1r6m h ILE 95 CO -0.24 0.00 0.14 1.23 -0.69 0.00 0.00 178.15 178.59 1r6m h GLY 96 N -0.01 0.42 0.98 5.37 0.00 -0.93 -0.94 103.07 107.97 1r6m h GLY 96 Ca 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1r6m h GLY 96 CO -0.31 0.07 0.11 3.21 0.00 0.00 0.00 176.54 179.61 1r6m h ARG 97 N 0.30 0.22 -0.31 4.80 3.08 -0.91 -0.61 114.38 120.96 1r6m h ARG 97 Ca 0.14 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.21 1r6m h ARG 97 Cb 0.07 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.03 1r6m h ARG 97 CO -0.11 0.17 0.05 0.77 -1.07 0.00 0.00 179.97 179.78 1r6m h SER 98 N 0.21 -0.01 1.19 7.04 0.02 -0.78 -1.10 113.55 120.12 1r6m h SER 98 Ca 0.06 0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 60.99 1r6m h SER 98 Cb 0.00 0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1r6m h SER 98 CO -0.01 0.03 -0.33 -0.07 -1.14 0.00 0.00 176.83 175.31 1r6m h LEU 99 N 0.15 0.00 -0.66 5.07 4.07 -1.08 -2.89 115.31 119.97 1r6m h LEU 99 Ca 0.14 0.00 -0.14 0.00 0.08 0.00 0.00 57.88 57.96 1r6m h LEU 99 Cb 0.16 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.89 1r6m h LEU 99 CO -0.20 0.33 -0.55 0.03 -1.08 0.00 0.00 178.44 176.97 1r6m h ARG 100 N 0.00 0.34 0.00 1.13 3.08 -0.63 -2.79 114.38 115.51 1r6m h ARG 100 Ca -0.00 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 59.83 1r6m h ARG 100 Cb 1.01 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.09 1r6m h ARG 100 CO 0.04 0.80 0.00 0.00 -1.07 0.00 0.00 179.97 179.74 1r6m h ALA 101 N 1.16 1.00 -0.01 0.04 0.00 -1.00 -1.45 119.26 119.01 1r6m h ALA 101 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1r6m h ALA 101 Cb 1.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1r6m h ALA 101 CO 0.09 0.00 -0.18 0.00 0.00 0.00 0.00 179.25 179.17 1r6m n ALA 102 N -2.07 2.90 -2.41 0.00 0.00 -1.05 -4.76 120.51 113.10 1r6m n ALA 102 Ca -0.01 -0.32 -0.28 0.00 0.00 0.00 0.00 53.44 52.83 1r6m n ALA 102 Cb 0.22 -1.25 -0.12 0.00 0.00 0.00 0.00 19.45 18.30 1r6m n ALA 102 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1r6m s LEU 103 N -2.50 2.37 -0.81 0.00 1.43 -0.55 -0.25 118.68 118.37 1r6m s LEU 103 Ca 0.26 -0.80 -0.13 0.00 -1.03 0.00 0.00 54.13 52.43 1r6m s LEU 103 Cb 0.20 -1.18 0.22 0.00 0.03 0.00 0.00 46.19 45.45 1r6m s LEU 103 CO 0.50 0.15 0.74 -0.62 0.23 0.00 0.00 176.35 177.35 1r6m s ASP 104 N -2.34 6.62 0.50 2.29 -1.08 0.29 -4.77 116.67 118.18 1r6m s ASP 104 Ca 0.17 -2.73 0.29 0.00 -0.52 0.00 0.00 52.55 49.76 1r6m s ASP 104 Cb -0.09 -2.17 1.39 0.00 -1.46 0.00 0.00 42.92 40.59 1r6m s ASP 104 CO 0.08 -0.55 1.84 -0.07 0.52 0.00 0.00 175.17 176.99 1r6m h LEU 105 N 7.68 0.12 -1.06 -1.34 3.38 -1.87 -0.97 115.31 121.24 1r6m h LEU 105 Ca 0.10 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1r6m h LEU 105 Cb 1.03 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.73 1r6m h LEU 105 CO 0.75 0.03 0.57 0.77 0.09 0.00 0.00 178.44 180.65 1r6m h SER 106 N 0.11 1.06 0.86 -0.43 4.64 -1.90 0.51 113.55 118.39 1r6m h SER 106 Ca 0.50 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 1r6m h SER 106 Cb 1.77 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 63.60 1r6m h SER 106 CO -0.07 0.79 0.00 0.29 -0.87 0.00 0.00 176.83 176.97 1r6m n LYS 107 N -4.38 0.10 0.19 4.77 5.02 -0.37 -3.51 118.16 119.98 1r6m n LYS 107 Ca 0.10 0.02 0.05 0.00 -2.02 0.00 0.00 58.31 56.46 1r6m n LYS 107 Cb 0.04 -1.50 0.37 0.00 -0.02 0.00 0.00 35.03 33.92 1r6m n LYS 107 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1r6m h LEU 108 N 0.00 0.00 0.00 -0.35 5.85 -1.33 -0.06 115.31 119.42 1r6m h LEU 108 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1r6m h LEU 108 Cb 0.43 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.46 1r6m h LEU 108 CO 0.00 0.38 0.00 0.61 -0.34 0.00 0.00 178.44 179.09 1r6m n GLY 109 N -0.10 -1.83 2.35 3.75 0.00 -1.23 -4.38 105.19 103.75 1r6m n GLY 109 Ca -0.01 -1.93 -0.27 0.00 0.00 0.00 0.00 46.02 43.81 1r6m n GLY 109 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1r6m n GLU 110 N -0.01 2.32 -4.21 1.61 0.28 -1.26 -1.48 120.64 117.89 1r6m n GLU 110 Ca 0.00 -2.42 -0.24 0.00 -0.16 0.00 0.00 57.16 54.34 1r6m n GLU 110 Cb 0.00 -2.02 -0.06 0.00 1.43 0.00 0.00 31.44 30.78 1r6m n GLU 110 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 1r6m s ASN 111 N -0.25 4.93 -0.07 -1.84 -0.87 -1.23 -0.43 114.94 115.18 1r6m s ASN 111 Ca 0.50 -0.45 0.05 0.00 -1.57 0.00 0.00 52.86 51.39 1r6m s ASN 111 Cb 0.37 -1.07 -0.00 0.00 -0.02 0.00 0.00 41.25 40.52 1r6m s ASN 111 CO -0.15 0.01 -0.22 -0.89 -2.57 0.00 0.00 177.10 173.28 1r6m s THR 112 N -2.11 1.84 -0.19 1.60 2.01 0.15 -1.89 115.64 117.06 1r6m s THR 112 Ca 0.31 -0.92 -0.06 0.00 0.31 0.00 0.00 61.69 61.33 1r6m s THR 112 Cb -0.08 -1.59 -0.03 0.00 0.01 0.00 0.00 72.50 70.81 1r6m s THR 112 CO 0.21 0.51 0.03 -0.76 -0.69 0.00 0.00 174.62 173.93 1r6m s LEU 113 N 0.17 3.56 -0.29 4.42 1.43 0.13 -0.27 118.68 127.82 1r6m s LEU 113 Ca -0.11 -0.04 -0.07 0.00 -1.03 0.00 0.00 54.13 52.88 1r6m s LEU 113 Cb -0.15 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.17 1r6m s LEU 113 CO 0.06 0.13 0.07 -0.31 0.23 0.00 0.00 176.35 176.53 1r6m s TYR 114 N 0.61 3.13 -0.23 0.29 1.51 -0.01 -1.17 117.35 121.48 1r6m s TYR 114 Ca 0.01 -0.90 -0.14 0.00 -1.01 0.00 0.00 57.07 55.03 1r6m s TYR 114 Cb -0.13 -2.25 -0.04 0.00 -0.11 0.00 0.00 41.96 39.43 1r6m s TYR 114 CO 0.02 -0.55 0.33 0.42 -1.11 0.00 0.00 175.55 174.66 1r6m s ILE 115 N 1.51 5.23 -0.21 2.71 -1.09 0.14 -0.10 121.20 129.39 1r6m s ILE 115 Ca 0.03 0.53 0.02 0.00 -2.23 0.00 0.00 60.65 59.00 1r6m s ILE 115 Cb -0.17 -3.66 0.04 0.00 -1.58 0.00 0.00 42.46 37.09 1r6m s ILE 115 CO 0.02 0.24 -0.16 -1.81 -1.23 0.00 0.00 174.94 172.01 1r6m s ASP 116 N 1.25 3.65 -0.30 3.58 1.01 0.67 -0.39 116.67 126.15 1r6m s ASP 116 Ca 0.15 -0.95 -0.03 0.00 0.71 0.00 0.00 52.55 52.43 1r6m s ASP 116 Cb -0.15 -1.49 0.04 0.00 1.01 0.00 0.00 42.92 42.34 1r6m s ASP 116 CO 0.08 -0.08 0.01 0.00 0.21 0.00 0.00 175.17 175.38 1r6m s ASP 118 N 1.29 3.20 -0.25 0.00 1.11 -0.20 -1.13 116.67 120.69 1r6m s ASP 118 Ca -0.04 -0.61 -0.29 0.00 0.18 0.00 0.00 52.55 51.79 1r6m s ASP 118 Cb -0.19 -1.48 0.01 0.00 1.07 0.00 0.00 42.92 42.33 1r6m s ASP 118 CO -0.01 0.04 1.06 -0.69 1.18 0.00 0.00 175.17 176.75 1r6m s VAL 119 N 1.08 4.61 -0.12 -1.27 1.01 0.07 -0.91 120.40 124.87 1r6m s VAL 119 Ca -0.00 1.92 0.21 0.00 0.00 0.00 0.00 61.98 64.10 1r6m s VAL 119 Cb -0.14 -4.32 -0.20 0.00 0.00 0.00 0.00 36.38 31.72 1r6m s VAL 119 CO -0.08 -0.27 0.64 -0.38 0.00 0.00 0.00 175.10 175.02 1r6m n ILE 120 N 5.49 0.59 -3.66 2.22 5.41 -0.69 -1.24 119.36 127.48 1r6m n ILE 120 Ca 0.12 -0.60 -0.07 0.00 1.00 0.00 0.00 62.75 63.20 1r6m n ILE 120 Cb 0.46 -0.30 -0.08 0.00 -0.71 0.00 0.00 39.64 39.01 1r6m n ILE 120 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 176.55 174.97 1r6m s GLN 121 N -3.22 0.40 -0.08 0.38 0.74 -1.11 -4.37 119.66 112.41 1r6m s GLN 121 Ca -0.05 1.14 -0.02 0.00 0.05 0.00 0.00 55.36 56.47 1r6m s GLN 121 Cb 0.11 0.45 -0.03 0.00 1.10 0.00 0.00 33.01 34.63 1r6m s GLN 121 CO 0.85 -0.23 0.02 0.00 -0.55 0.00 0.00 175.29 175.38 1r6m s ALA 122 N 2.59 3.37 -0.36 1.58 0.00 0.21 -0.41 121.76 128.75 1r6m s ALA 122 Ca -0.03 -0.80 0.11 0.00 0.00 0.00 0.00 51.96 51.23 1r6m s ALA 122 Cb -0.12 -1.53 0.38 0.00 0.00 0.00 0.00 23.12 21.85 1r6m s ALA 122 CO -0.15 0.60 1.42 -3.47 0.00 0.00 0.00 175.76 174.17 1r6m n ASP 123 N 1.99 -1.61 0.00 0.00 2.03 -1.26 -4.73 116.55 112.96 1r6m n ASP 123 Ca -0.18 -2.28 0.00 0.00 0.52 0.00 0.00 54.79 52.85 1r6m n ASP 123 Cb 0.54 0.82 0.00 0.00 -0.72 0.00 0.00 41.12 41.76 1r6m n ASP 123 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1r6m n GLY 124 N -1.07 -1.05 2.29 0.27 0.00 -1.26 -1.30 105.19 103.06 1r6m n GLY 124 Ca -0.11 -1.35 -0.12 0.00 0.00 0.00 0.00 46.02 44.43 1r6m n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r6m n GLY 125 N 0.05 -0.11 0.29 -0.02 0.00 -1.24 -4.73 105.19 99.42 1r6m n GLY 125 Ca 0.00 -0.34 -0.03 0.00 0.00 0.00 0.00 46.02 45.64 1r6m n GLY 125 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1r6m h THR 126 N -0.18 1.23 -0.50 2.61 1.35 -1.93 -0.38 112.91 115.10 1r6m h THR 126 Ca -0.30 -0.92 -0.11 0.00 -0.55 0.00 0.00 66.41 64.53 1r6m h THR 126 Cb 1.22 0.83 -0.02 0.00 -1.73 0.00 0.00 68.15 68.45 1r6m h THR 126 CO 0.34 0.33 -0.10 0.08 -0.25 0.00 0.00 175.52 175.92 1r6m h ARG 127 N 0.73 0.96 -0.25 4.72 0.11 -1.98 0.13 114.38 118.80 1r6m h ARG 127 Ca 0.15 -0.36 -0.15 0.00 0.10 0.00 0.00 59.98 59.72 1r6m h ARG 127 Cb 0.39 -0.06 -0.01 0.00 1.11 0.00 0.00 29.97 31.41 1r6m h ARG 127 CO 0.01 1.02 -0.46 1.79 0.10 0.00 0.00 179.97 182.43 1r6m h THR 128 N 0.82 1.30 -0.45 0.08 1.35 -1.82 -1.74 112.91 112.45 1r6m h THR 128 Ca 0.13 -1.66 -0.13 0.00 -0.55 0.00 0.00 66.41 64.20 1r6m h THR 128 Cb 0.66 1.60 -0.01 0.00 -1.73 0.00 0.00 68.15 68.67 1r6m h THR 128 CO 0.05 0.53 -0.21 0.00 -0.25 0.00 0.00 175.52 175.63 1r6m h ALA 129 N 0.96 0.64 0.10 6.62 0.00 -0.95 -2.50 119.26 124.14 1r6m h ALA 129 Ca 0.03 -0.39 0.02 0.00 0.00 0.00 0.00 54.91 54.57 1r6m h ALA 129 Cb 1.00 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 1r6m h ALA 129 CO 0.09 0.62 -0.29 0.77 0.00 0.00 0.00 179.25 180.44 1r6m h SER 130 N 0.78 -0.83 -0.08 0.00 0.02 -0.47 0.11 113.55 113.08 1r6m h SER 130 Ca 0.10 0.10 0.03 0.00 -0.84 0.00 0.00 61.79 61.19 1r6m h SER 130 Cb 0.79 0.32 -0.04 0.00 0.14 0.00 0.00 62.40 63.61 1r6m h SER 130 CO 0.07 -0.38 -0.16 0.40 -1.14 0.00 0.00 176.83 175.62 1r6m h ILE 131 N -0.50 0.60 -0.90 3.27 2.04 -1.31 0.31 117.51 121.02 1r6m h ILE 131 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.90 1r6m h ILE 131 Cb 0.53 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 37.17 1r6m h ILE 131 CO -0.18 0.00 0.57 0.74 0.00 0.00 0.00 178.15 179.28 1r6m h THR 132 N -0.22 1.24 -0.03 -0.27 2.02 -1.20 -2.35 112.91 112.10 1r6m h THR 132 Ca 0.08 -0.48 -0.21 0.00 0.77 0.00 0.00 66.41 66.57 1r6m h THR 132 Cb 0.33 -0.06 0.02 0.00 -1.74 0.00 0.00 68.15 66.69 1r6m h THR 132 CO -0.21 0.24 -0.79 1.23 0.37 0.00 0.00 175.52 176.36 1r6m h GLY 133 N 1.23 0.65 1.77 2.16 0.00 -0.44 -3.27 103.07 105.17 1r6m h GLY 133 Ca 0.33 -1.09 0.01 0.00 0.00 0.00 0.00 47.33 46.58 1r6m h GLY 133 CO -0.07 0.96 0.15 0.00 0.00 0.00 0.00 176.54 177.58 1r6m h ALA 134 N 0.39 1.86 -0.84 3.60 0.00 -0.26 -1.88 119.26 122.13 1r6m h ALA 134 Ca -0.09 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1r6m h ALA 134 Cb 1.46 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 19.13 1r6m h ALA 134 CO 0.16 0.13 0.43 1.15 0.00 0.00 0.00 179.25 181.12 1r6m h THR 135 N 0.29 1.25 -0.54 0.00 2.02 -1.47 0.16 112.91 114.62 1r6m h THR 135 Ca 0.08 -0.67 -0.12 0.00 0.77 0.00 0.00 66.41 66.47 1r6m h THR 135 Cb -0.02 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 66.53 1r6m h THR 135 CO -0.02 0.29 -0.12 0.58 0.37 0.00 0.00 175.52 176.62 1r6m h VAL 136 N 1.19 1.27 -0.60 3.16 2.07 -1.45 -2.00 116.25 119.89 1r6m h VAL 136 Ca 0.29 -1.29 -0.04 0.00 0.82 0.00 0.00 66.70 66.49 1r6m h VAL 136 Cb 0.07 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1r6m h VAL 136 CO -0.04 0.45 0.23 0.00 0.02 0.00 0.00 177.57 178.23 1r6m h ALA 137 N 0.92 1.28 -0.41 1.67 0.00 -1.00 -2.46 119.26 119.26 1r6m h ALA 137 Ca 0.14 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1r6m h ALA 137 Cb 0.70 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1r6m h ALA 137 CO 0.05 0.53 0.27 1.25 0.00 0.00 0.00 179.25 181.35 1r6m h LEU 138 N 0.86 0.45 0.11 0.00 5.85 -0.26 -0.94 115.31 121.39 1r6m h LEU 138 Ca 0.20 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 1r6m h LEU 138 Cb 0.18 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 1r6m h LEU 138 CO -0.02 0.33 -0.08 0.40 -0.34 0.00 0.00 178.44 178.73 1r6m h ILE 139 N 0.54 0.83 -0.87 4.05 1.08 -1.00 -0.55 117.51 121.60 1r6m h ILE 139 Ca 0.15 0.00 0.10 0.00 -0.39 0.00 0.00 64.86 64.73 1r6m h ILE 139 Cb -0.05 0.83 -0.08 0.00 -3.07 0.00 0.00 36.82 34.45 1r6m h ILE 139 CO -0.04 0.00 0.50 0.44 -0.69 0.00 0.00 178.15 178.36 1r6m h ASP 140 N -0.19 0.72 -0.28 1.72 3.32 -1.22 -2.00 116.42 118.48 1r6m h ASP 140 Ca -0.00 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 1r6m h ASP 140 Cb 0.17 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 1r6m h ASP 140 CO -0.00 0.40 0.15 0.00 -1.72 0.00 0.00 179.24 178.06 1r6m h ALA 141 N 1.48 0.37 -0.57 3.45 0.00 -0.52 -2.34 119.26 121.13 1r6m h ALA 141 Ca 0.42 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.30 1r6m h ALA 141 Cb 0.41 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1r6m h ALA 141 CO -0.26 -0.09 0.38 -0.07 0.00 0.00 0.00 179.25 179.20 1r6m h LEU 142 N 0.34 0.54 -0.57 0.00 3.38 -0.49 0.22 115.31 118.73 1r6m h LEU 142 Ca 0.10 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 1r6m h LEU 142 Cb 0.08 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1r6m h LEU 142 CO -0.01 0.37 0.14 0.00 0.09 0.00 0.00 178.44 179.02 1r6m h ALA 143 N 1.68 0.75 0.08 1.53 0.00 -0.96 0.41 119.26 122.75 1r6m h ALA 143 Ca 0.23 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1r6m h ALA 143 Cb 0.14 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1r6m h ALA 143 CO -0.06 0.46 -0.08 0.28 0.00 0.00 0.00 179.25 179.85 1r6m h VAL 144 N 0.82 0.82 -0.31 0.00 2.07 -0.49 -1.57 116.25 117.59 1r6m h VAL 144 Ca 0.18 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.66 1r6m h VAL 144 Cb 0.35 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 1r6m h VAL 144 CO 0.00 0.00 0.04 -0.07 0.02 0.00 0.00 177.57 177.56 1r6m h LEU 145 N -0.18 0.41 0.37 2.57 3.38 -1.05 -2.20 115.31 118.62 1r6m h LEU 145 Ca 0.00 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1r6m h LEU 145 Cb 0.17 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1r6m h LEU 145 CO -0.02 0.45 -0.18 0.50 0.09 0.00 0.00 178.44 179.28 1r6m h LYS 146 N 0.44 -0.48 -0.46 1.13 3.64 -0.41 -1.54 116.57 118.89 1r6m h LYS 146 Ca 0.10 0.03 0.13 0.00 -1.27 0.00 0.00 60.65 59.64 1r6m h LYS 146 Cb 0.23 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.14 1r6m h LYS 146 CO 0.00 -0.26 0.33 -0.22 -2.27 0.00 0.00 179.45 177.03 1r6m h LYS 147 N -0.59 0.02 -0.00 1.90 3.64 -1.06 0.65 116.57 121.13 1r6m h LYS 147 Ca -0.05 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1r6m h LYS 147 Cb 0.44 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1r6m h LYS 147 CO 0.08 0.02 -0.03 0.54 -2.27 0.00 0.00 179.45 177.79 1r6m n ARG 148 N -4.41 0.89 -3.62 1.90 1.74 -0.81 -4.92 116.66 107.43 1r6m n ARG 148 Ca 0.08 -0.20 -0.22 0.00 -0.77 0.00 0.00 57.85 56.74 1r6m n ARG 148 Cb 0.52 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.53 1r6m n ARG 148 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1r6m n GLY 149 N 1.16 -0.43 0.28 -0.13 0.00 0.23 -4.89 105.19 101.40 1r6m n GLY 149 Ca 0.19 0.17 0.06 0.00 0.00 0.00 0.00 46.02 46.43 1r6m n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r6m n ALA 150 N -4.53 2.88 -1.98 4.61 0.00 -0.67 -5.02 120.51 115.80 1r6m n ALA 150 Ca -0.14 -0.47 -0.21 0.00 0.00 0.00 0.00 53.44 52.61 1r6m n ALA 150 Cb 0.61 -0.40 0.05 0.00 0.00 0.00 0.00 19.45 19.72 1r6m n ALA 150 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1r6m s LEU 151 N -1.66 3.21 -0.46 0.00 1.43 -1.26 -4.57 118.68 115.38 1r6m s LEU 151 Ca 0.10 -0.14 0.09 0.00 -1.03 0.00 0.00 54.13 53.14 1r6m s LEU 151 Cb 0.09 -2.61 0.35 0.00 0.03 0.00 0.00 46.19 44.06 1r6m s LEU 151 CO 0.28 -1.30 0.85 0.29 0.23 0.00 0.00 176.35 176.69 1r6m n LYS 152 N -2.43 2.02 0.00 1.70 4.01 -0.03 -4.91 118.16 118.51 1r6m n LYS 152 Ca 0.10 -4.04 0.00 0.00 -0.51 0.00 0.00 58.31 53.86 1r6m n LYS 152 Cb 0.60 -1.93 0.00 0.00 -0.51 0.00 0.00 35.03 33.19 1r6m n LYS 152 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1r6m n GLY 153 N 0.01 -0.95 3.27 0.72 0.00 -1.25 -4.39 105.19 102.60 1r6m n GLY 153 Ca 0.27 -2.15 -0.44 0.00 0.00 0.00 0.00 46.02 43.70 1r6m n GLY 153 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1r6m s ASN 154 N -4.00 6.05 0.00 1.61 0.02 -1.26 -4.86 114.94 112.51 1r6m s ASN 154 Ca 0.00 -1.95 0.10 0.00 -1.02 0.00 0.00 52.86 49.99 1r6m s ASN 154 Cb 0.00 -2.13 0.56 0.00 0.02 0.00 0.00 41.25 39.70 1r6m s ASN 154 CO 0.00 -0.76 1.14 -0.81 0.02 0.00 0.00 177.10 176.69 1r6m n PRO 155 N 4.96 0.23 -2.43 -0.60 -0.04 -1.26 -4.69 135.00 131.16 1r6m n PRO 155 Ca -0.09 0.10 -0.41 0.00 -0.04 0.00 0.00 63.50 63.07 1r6m n PRO 155 Cb 0.41 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.34 1r6m n PRO 155 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1r6m s LEU 156 N -2.31 3.30 0.01 1.53 0.20 -1.26 0.11 118.68 120.26 1r6m s LEU 156 Ca 0.12 -0.02 -0.20 0.00 0.69 0.00 0.00 54.13 54.73 1r6m s LEU 156 Cb 0.07 -2.81 -0.22 0.00 -0.43 0.00 0.00 46.19 42.80 1r6m s LEU 156 CO 0.14 -1.81 1.13 0.11 -0.29 0.00 0.00 176.35 175.63 1r6m h LYS 157 N 10.94 0.42 -1.36 1.98 1.57 -0.89 -3.47 116.57 125.75 1r6m h LYS 157 Ca -0.27 -0.41 0.21 0.00 -1.87 0.00 0.00 60.65 58.31 1r6m h LYS 157 Cb 1.08 0.11 -0.23 0.00 0.08 0.00 0.00 32.23 33.27 1r6m h LYS 157 CO 1.22 1.07 0.80 1.14 -0.57 0.00 0.00 179.45 183.11 1r6m s GLN 158 N -3.35 0.29 0.73 3.15 -2.07 -1.10 -5.03 119.66 112.28 1r6m s GLN 158 Ca -0.13 -0.01 -0.13 0.00 -1.82 0.00 0.00 55.36 53.26 1r6m s GLN 158 Cb 0.04 0.14 0.04 0.00 -1.09 0.00 0.00 33.01 32.13 1r6m s GLN 158 CO 0.82 -0.11 1.12 -1.64 -1.32 0.00 0.00 175.29 174.16 1r6m s MET 159 N -1.65 2.36 -0.04 9.60 -1.94 -1.26 -4.52 119.30 121.84 1r6m s MET 159 Ca 0.07 1.38 -0.01 0.00 -1.71 0.00 0.00 55.69 55.42 1r6m s MET 159 Cb -0.01 -1.90 0.03 0.00 2.01 0.00 0.00 34.83 34.97 1r6m s MET 159 CO -0.04 -1.59 0.08 0.08 -0.01 0.00 0.00 175.02 173.53 1r6m s VAL 160 N -2.51 -0.05 0.19 -6.03 1.01 -1.26 -3.16 120.40 108.60 1r6m s VAL 160 Ca 0.66 0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.84 1r6m s VAL 160 Cb -0.21 -0.15 -0.05 0.00 0.00 0.00 0.00 36.38 35.98 1r6m s VAL 160 CO 0.48 0.07 -0.01 0.00 0.00 0.00 0.00 175.10 175.64 1r6m s ALA 161 N 0.98 1.51 0.05 5.51 0.00 -0.70 -4.55 121.76 124.56 1r6m s ALA 161 Ca -0.08 -1.64 -0.03 0.00 0.00 0.00 0.00 51.96 50.22 1r6m s ALA 161 Cb -0.11 0.47 -0.03 0.00 0.00 0.00 0.00 23.12 23.46 1r6m s ALA 161 CO -0.04 -0.27 0.02 0.00 0.00 0.00 0.00 175.76 175.47 1r6m s ALA 162 N -3.54 0.24 0.04 0.00 0.00 -1.26 -1.29 121.76 115.96 1r6m s ALA 162 Ca 0.25 -0.90 -0.27 0.00 0.00 0.00 0.00 51.96 51.04 1r6m s ALA 162 Cb 0.05 0.26 0.09 0.00 0.00 0.00 0.00 23.12 23.53 1r6m s ALA 162 CO 0.05 -0.33 0.74 0.54 0.00 0.00 0.00 175.76 176.76 1r6m s VAL 163 N -3.19 0.00 0.34 0.00 0.11 -0.42 -4.70 120.40 112.55 1r6m s VAL 163 Ca 0.00 0.00 0.08 0.00 -2.93 0.00 0.00 61.98 59.13 1r6m s VAL 163 Cb 0.03 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.84 1r6m s VAL 163 CO -0.07 0.00 0.19 -0.94 -3.33 0.00 0.00 175.10 170.94 1r6m s SER 164 N -2.24 4.86 -0.04 3.54 1.04 -1.26 -0.79 113.70 118.80 1r6m s SER 164 Ca -0.00 -0.69 -0.11 0.00 0.48 0.00 0.00 55.95 55.63 1r6m s SER 164 Cb -0.01 -0.80 0.02 0.00 0.10 0.00 0.00 66.02 65.33 1r6m s SER 164 CO -0.06 -0.32 0.25 -0.69 0.98 0.00 0.00 173.24 173.40 1r6m s VAL 165 N -2.39 0.05 0.04 5.02 1.01 0.67 -0.46 120.40 124.33 1r6m s VAL 165 Ca 0.39 -0.37 -0.17 0.00 0.00 0.00 0.00 61.98 61.82 1r6m s VAL 165 Cb -0.03 -0.49 0.03 0.00 0.00 0.00 0.00 36.38 35.88 1r6m s VAL 165 CO 0.24 -0.21 0.39 -0.83 0.00 0.00 0.00 175.10 174.69 1r6m s GLY 166 N -0.86 -0.24 -0.60 4.51 0.00 -0.68 0.20 107.32 109.66 1r6m s GLY 166 Ca -0.09 0.27 -0.23 0.00 0.00 0.00 0.00 44.72 44.67 1r6m s GLY 166 CO 0.02 0.02 0.93 -0.42 0.00 0.00 0.00 173.10 173.66 1r6m s ILE 167 N -2.36 4.39 -0.19 0.90 -1.09 -0.26 -0.75 121.20 121.85 1r6m s ILE 167 Ca -0.06 -0.08 -0.05 0.00 -2.23 0.00 0.00 60.65 58.23 1r6m s ILE 167 Cb -0.01 -4.59 -0.03 0.00 -1.58 0.00 0.00 42.46 36.25 1r6m s ILE 167 CO -0.02 -1.25 -0.00 -0.47 -1.23 0.00 0.00 174.94 171.97 1r6m s TYR 168 N 3.91 3.06 -1.22 3.97 5.04 -0.05 -4.37 117.35 127.69 1r6m s TYR 168 Ca 0.25 -0.34 -0.05 0.00 -2.44 0.00 0.00 57.07 54.49 1r6m s TYR 168 Cb -0.15 -2.05 0.04 0.00 0.35 0.00 0.00 41.96 40.15 1r6m s TYR 168 CO 0.14 -0.13 0.33 1.04 -1.34 0.00 0.00 175.55 175.59 1r6m n GLN 169 N 3.96 -3.16 -0.96 4.97 6.02 -1.26 -0.59 117.38 126.37 1r6m n GLN 169 Ca -0.17 0.57 0.00 0.00 -0.01 0.00 0.00 57.00 57.39 1r6m n GLN 169 Cb 0.52 -5.25 0.00 0.00 1.02 0.00 0.00 30.24 26.53 1r6m n GLN 169 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1r6m n GLY 170 N -1.08 0.49 3.05 1.08 0.00 -1.26 -4.29 105.19 103.18 1r6m n GLY 170 Ca -0.07 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.49 1r6m n GLY 170 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r6m s VAL 171 N -2.00 0.94 0.06 1.61 1.01 0.25 -5.06 120.40 117.21 1r6m s VAL 171 Ca 0.00 -0.47 -0.31 0.00 0.00 0.00 0.00 61.98 61.20 1r6m s VAL 171 Cb 0.00 -0.81 -0.08 0.00 0.00 0.00 0.00 36.38 35.49 1r6m s VAL 171 CO 0.00 0.28 1.56 -2.84 0.00 0.00 0.00 175.10 174.10 1r6m s PRO 172 N -0.01 4.23 0.04 2.72 0.02 -1.26 -0.87 135.00 139.87 1r6m s PRO 172 Ca -0.00 2.22 0.07 0.00 0.02 0.00 0.00 61.00 63.31 1r6m s PRO 172 Cb -0.07 -3.53 -0.02 0.00 0.02 0.00 0.00 34.50 30.89 1r6m s PRO 172 CO 0.00 -0.66 -0.19 0.14 -0.33 0.00 0.00 177.00 175.96 1r6m s VAL 173 N 2.34 1.52 -0.11 3.83 -7.23 0.07 -4.82 120.40 116.00 1r6m s VAL 173 Ca 0.70 -1.12 -0.16 0.00 -1.81 0.00 0.00 61.98 59.59 1r6m s VAL 173 Cb -0.38 -1.33 -0.05 0.00 0.56 0.00 0.00 36.38 35.19 1r6m s VAL 173 CO 0.31 0.17 0.39 -0.22 -0.31 0.00 0.00 175.10 175.44 1r6m s LEU 174 N -1.12 4.30 -0.34 1.32 2.96 -0.42 -1.68 118.68 123.70 1r6m s LEU 174 Ca 0.06 0.72 -0.10 0.00 -0.22 0.00 0.00 54.13 54.59 1r6m s LEU 174 Cb -0.08 -2.55 0.01 0.00 0.50 0.00 0.00 46.19 44.07 1r6m s LEU 174 CO 0.01 0.10 0.38 -0.67 -1.32 0.00 0.00 176.35 174.86 1r6m n ASP 175 N 3.31 -7.06 -4.74 3.68 2.03 0.39 -4.67 116.55 109.49 1r6m n ASP 175 Ca -0.10 0.64 -0.41 0.00 0.52 0.00 0.00 54.79 55.44 1r6m n ASP 175 Cb 0.52 -4.72 -0.03 0.00 -0.72 0.00 0.00 41.12 36.17 1r6m n ASP 175 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1r6m s LEU 176 N -2.13 4.44 0.00 -2.67 1.43 -1.26 -4.81 118.68 113.69 1r6m s LEU 176 Ca 0.16 2.34 -0.01 0.00 -1.03 0.00 0.00 54.13 55.59 1r6m s LEU 176 Cb -0.04 -3.61 0.13 0.00 0.03 0.00 0.00 46.19 42.69 1r6m s LEU 176 CO 0.65 -0.44 0.85 -0.90 0.23 0.00 0.00 176.35 176.75 1r6m n ASP 177 N 2.36 1.03 -0.13 2.29 5.68 -1.26 -3.66 116.55 122.85 1r6m n ASP 177 Ca 0.04 -1.90 -0.07 0.00 -0.50 0.00 0.00 54.79 52.36 1r6m n ASP 177 Cb 0.44 -0.56 0.01 0.00 -1.14 0.00 0.00 41.12 39.86 1r6m n ASP 177 CO 0.00 0.00 0.00 0.22 -1.33 0.00 0.00 177.20 176.09 1r6m h TYR 178 N -0.66 0.50 0.16 2.11 3.20 -1.50 -2.10 116.97 118.68 1r6m h TYR 178 Ca -0.28 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.62 1r6m h TYR 178 Cb 1.01 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 39.09 1r6m h TYR 178 CO 0.00 0.30 -0.28 -0.07 -1.64 0.00 0.00 178.16 176.47 1r6m h LEU 179 N 0.54 -0.79 -0.54 2.82 3.38 -1.94 -1.74 115.31 117.04 1r6m h LEU 179 Ca 0.16 0.09 0.01 0.00 0.09 0.00 0.00 57.88 58.23 1r6m h LEU 179 Cb -0.03 0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 1r6m h LEU 179 CO -0.05 -0.38 0.35 -0.33 0.09 0.00 0.00 178.44 178.12 1r6m h GLU 180 N -0.52 0.69 -0.73 1.13 5.08 -1.93 -1.52 114.58 116.77 1r6m h GLU 180 Ca 0.02 -0.04 0.08 0.00 -1.00 0.00 0.00 59.36 58.41 1r6m h GLU 180 Cb 0.53 -0.16 -0.06 0.00 0.50 0.00 0.00 28.75 29.56 1r6m h GLU 180 CO -0.14 0.46 0.41 0.22 -1.00 0.00 0.00 179.01 178.96 1r6m h ASP 181 N 0.71 0.59 -0.53 1.42 3.58 -1.16 0.49 116.42 121.51 1r6m h ASP 181 Ca 0.20 0.04 -0.09 0.00 0.42 0.00 0.00 57.03 57.60 1r6m h ASP 181 Cb -0.06 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 40.90 1r6m h ASP 181 CO -0.06 0.36 -0.02 0.28 -2.88 0.00 0.00 179.24 176.93 1r6m h SER 182 N 0.72 0.93 0.12 2.28 0.02 -0.89 -3.27 113.55 113.46 1r6m h SER 182 Ca 0.34 -0.31 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 1r6m h SER 182 Cb 0.27 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.56 1r6m h SER 182 CO -0.22 1.02 -0.06 0.00 -1.14 0.00 0.00 176.83 176.43 1r6m h ALA 183 N 0.94 -0.16 -2.62 3.77 0.00 -0.40 -3.45 119.26 117.34 1r6m h ALA 183 Ca 0.15 -0.22 -0.55 0.00 0.00 0.00 0.00 54.91 54.29 1r6m h ALA 183 Cb 0.55 0.06 0.09 0.00 0.00 0.00 0.00 17.79 18.49 1r6m h ALA 183 CO 0.03 -0.36 0.74 0.00 0.00 0.00 0.00 179.25 179.66 1r6m n ALA 184 N -2.42 1.92 0.60 0.00 0.00 0.16 -4.91 120.51 115.87 1r6m n ALA 184 Ca -0.09 0.38 0.10 0.00 0.00 0.00 0.00 53.44 53.83 1r6m n ALA 184 Cb 0.25 -2.37 -0.13 0.00 0.00 0.00 0.00 19.45 17.20 1r6m n ALA 184 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1r6m n GLU 185 N 1.70 0.55 -4.28 0.00 1.02 -1.26 -4.87 120.64 113.49 1r6m n GLU 185 Ca 0.08 -0.06 -0.28 0.00 -0.02 0.00 0.00 57.16 56.88 1r6m n GLU 185 Cb 0.35 -1.45 -0.17 0.00 -0.02 0.00 0.00 31.44 30.16 1r6m n GLU 185 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1r6m s THR 186 N -3.05 1.38 0.29 2.62 2.01 -1.26 0.31 115.64 117.95 1r6m s THR 186 Ca 0.02 -0.55 0.04 0.00 0.31 0.00 0.00 61.69 61.51 1r6m s THR 186 Cb 0.14 -1.29 -0.03 0.00 0.01 0.00 0.00 72.50 71.33 1r6m s THR 186 CO 0.82 0.42 0.26 1.51 -0.69 0.00 0.00 174.62 176.94 1r6m s ASP 187 N 1.19 1.17 -0.24 3.53 -4.77 -0.94 -1.10 116.67 115.51 1r6m s ASP 187 Ca -0.03 -1.62 -0.15 0.00 -3.30 0.00 0.00 52.55 47.45 1r6m s ASP 187 Cb -0.14 0.52 0.07 0.00 -1.09 0.00 0.00 42.92 42.28 1r6m s ASP 187 CO -0.04 -1.03 0.60 -0.22 0.70 0.00 0.00 175.17 175.18 1r6m s LEU 188 N -3.30 -0.61 -0.10 2.11 2.96 0.13 -2.53 118.68 117.35 1r6m s LEU 188 Ca 0.39 1.30 0.01 0.00 -0.22 0.00 0.00 54.13 55.61 1r6m s LEU 188 Cb 0.03 2.06 -0.02 0.00 0.50 0.00 0.00 46.19 48.76 1r6m s LEU 188 CO 0.23 -0.22 -0.12 0.20 -1.32 0.00 0.00 176.35 175.11 1r6m s ASN 189 N 1.33 4.16 -0.00 3.68 0.01 -0.12 -0.24 114.94 123.75 1r6m s ASN 189 Ca -0.08 -0.23 0.02 0.00 -0.71 0.00 0.00 52.86 51.86 1r6m s ASN 189 Cb -0.06 -1.33 -0.01 0.00 0.41 0.00 0.00 41.25 40.26 1r6m s ASN 189 CO -0.14 0.24 -0.07 0.54 -1.51 0.00 0.00 177.10 176.17 1r6m s VAL 190 N -0.12 0.53 -0.12 1.60 0.11 0.03 -1.46 120.40 120.96 1r6m s VAL 190 Ca -0.01 -0.32 0.03 0.00 -2.93 0.00 0.00 61.98 58.75 1r6m s VAL 190 Cb -0.14 -0.45 0.01 0.00 -1.53 0.00 0.00 36.38 34.27 1r6m s VAL 190 CO 0.03 0.13 -0.21 -0.69 -3.33 0.00 0.00 175.10 171.03 1r6m s VAL 191 N -0.21 1.94 0.20 2.04 1.01 0.18 -1.29 120.40 124.27 1r6m s VAL 191 Ca 0.02 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.09 1r6m s VAL 191 Cb -0.03 -1.70 -0.05 0.00 0.00 0.00 0.00 36.38 34.60 1r6m s VAL 191 CO -0.00 0.53 0.04 -0.04 0.00 0.00 0.00 175.10 175.63 1r6m s MET 192 N 0.64 1.19 0.48 2.72 -1.94 -0.41 -1.16 119.30 120.82 1r6m s MET 192 Ca -0.12 -1.60 0.07 0.00 -1.71 0.00 0.00 55.69 52.32 1r6m s MET 192 Cb -0.16 -0.18 0.01 0.00 2.01 0.00 0.00 34.83 36.50 1r6m s MET 192 CO 0.03 -0.21 0.37 0.95 -0.01 0.00 0.00 175.02 176.15 1r6m s THR 193 N -3.76 2.10 0.11 2.05 -4.23 -0.91 -1.72 115.64 109.28 1r6m s THR 193 Ca 0.29 -1.46 -0.24 0.00 -1.18 0.00 0.00 61.69 59.10 1r6m s THR 193 Cb 0.07 -2.57 -0.08 0.00 1.34 0.00 0.00 72.50 71.26 1r6m s THR 193 CO 0.07 0.00 1.69 0.44 -0.54 0.00 0.00 174.62 176.28 1r6m h ASP 194 N 0.94 -0.35 -0.84 3.99 3.32 -1.90 -2.28 116.42 119.31 1r6m h ASP 194 Ca -0.39 0.05 0.24 0.00 0.02 0.00 0.00 57.03 56.95 1r6m h ASP 194 Cb 1.28 0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.94 1r6m h ASP 194 CO 0.59 -0.17 0.72 0.00 -1.72 0.00 0.00 179.24 178.66 1r6m h ALA 195 N 0.74 2.70 0.00 3.45 0.00 -1.96 -3.44 119.26 120.75 1r6m h ALA 195 Ca 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1r6m h ALA 195 Cb 0.26 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1r6m h ALA 195 CO -0.11 -1.16 0.00 0.41 0.00 0.00 0.00 179.25 178.39 1r6m n GLY 196 N -1.65 1.31 3.92 0.00 0.00 -0.86 -5.11 105.19 102.81 1r6m n GLY 196 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 1r6m n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1r6m s GLY 197 N -2.00 1.47 -0.16 -0.02 0.00 -1.26 -4.89 107.32 100.46 1r6m s GLY 197 Ca 0.00 -0.71 -0.09 0.00 0.00 0.00 0.00 44.72 43.92 1r6m s GLY 197 CO 0.00 -0.61 0.14 -1.36 0.00 0.00 0.00 173.10 171.27 1r6m s PHE 198 N -2.44 3.51 -0.02 1.90 0.08 -1.26 -2.15 117.98 117.61 1r6m s PHE 198 Ca 0.43 0.45 0.06 0.00 0.12 0.00 0.00 56.93 57.99 1r6m s PHE 198 Cb -0.10 -2.06 -0.09 0.00 -0.57 0.00 0.00 43.02 40.20 1r6m s PHE 198 CO 0.38 0.52 0.12 1.51 -0.10 0.00 0.00 175.22 177.65 1r6m n ILE 199 N 2.73 0.07 -3.66 0.64 0.13 -0.31 -4.99 119.36 113.97 1r6m n ILE 199 Ca -0.18 -0.16 -0.07 0.00 -1.10 0.00 0.00 62.75 61.24 1r6m n ILE 199 Cb 0.53 0.15 -0.08 0.00 -0.84 0.00 0.00 39.64 39.41 1r6m n ILE 199 CO 0.00 0.00 0.00 -0.70 2.80 0.00 0.00 176.55 178.65 1r6m s GLU 200 N -2.38 0.56 -0.10 9.51 2.56 -1.04 -4.97 118.70 122.84 1r6m s GLU 200 Ca -0.02 1.12 -0.02 0.00 0.00 0.00 0.00 54.97 56.04 1r6m s GLU 200 Cb 0.04 0.23 0.04 0.00 2.00 0.00 0.00 34.13 36.43 1r6m s GLU 200 CO 0.25 -0.17 0.04 0.08 -0.56 0.00 0.00 175.26 174.90 1r6m s VAL 201 N 1.87 0.18 -0.11 3.70 1.01 -1.26 -0.64 120.40 125.14 1r6m s VAL 201 Ca -0.08 0.06 -0.01 0.00 0.00 0.00 0.00 61.98 61.94 1r6m s VAL 201 Cb -0.08 -0.51 0.03 0.00 0.00 0.00 0.00 36.38 35.83 1r6m s VAL 201 CO -0.17 0.07 -0.02 -1.58 0.00 0.00 0.00 175.10 173.40 1r6m s GLN 202 N 2.04 1.01 -0.04 2.72 0.74 -0.54 -5.01 119.66 120.59 1r6m s GLN 202 Ca 0.04 -0.16 0.03 0.00 0.05 0.00 0.00 55.36 55.31 1r6m s GLN 202 Cb -0.14 -1.46 0.00 0.00 1.10 0.00 0.00 33.01 32.51 1r6m s GLN 202 CO -0.06 -0.36 -0.13 0.20 -0.55 0.00 0.00 175.29 174.40 1r6m s GLY 203 N 1.83 0.73 0.00 2.59 0.00 -1.26 -0.95 107.32 110.26 1r6m s GLY 203 Ca 0.04 -0.49 0.04 0.00 0.00 0.00 0.00 44.72 44.31 1r6m s GLY 203 CO -0.07 -0.17 -0.13 -0.51 0.00 0.00 0.00 173.10 172.22 1r6m s THR 204 N 0.19 1.05 -0.19 0.90 -4.23 -1.05 -5.01 115.64 107.30 1r6m s THR 204 Ca -0.05 -0.66 0.01 0.00 -1.18 0.00 0.00 61.69 59.81 1r6m s THR 204 Cb -0.11 -0.90 0.04 0.00 1.34 0.00 0.00 72.50 72.87 1r6m s THR 204 CO 0.02 0.22 -0.13 0.00 -0.54 0.00 0.00 174.62 174.18 1r6m s ALA 205 N -0.44 2.14 -0.04 3.99 0.00 -1.26 -2.20 121.76 123.95 1r6m s ALA 205 Ca 0.04 -1.23 -0.03 0.00 0.00 0.00 0.00 51.96 50.73 1r6m s ALA 205 Cb -0.06 -1.26 -0.27 0.00 0.00 0.00 0.00 23.12 21.53 1r6m s ALA 205 CO -0.00 -0.68 0.67 0.93 0.00 0.00 0.00 175.76 176.68 1r6m h GLU 206 N 7.95 0.25 0.00 0.00 5.08 -0.53 -3.46 114.58 123.86 1r6m h GLU 206 Ca -0.33 -0.42 0.00 0.00 -1.00 0.00 0.00 59.36 57.61 1r6m h GLU 206 Cb 1.11 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.51 1r6m h GLU 206 CO 0.52 1.09 0.00 0.41 -1.00 0.00 0.00 179.01 180.04 1r6m n GLY 207 N 1.77 0.73 3.68 -3.84 0.00 -1.26 -4.98 105.19 101.30 1r6m n GLY 207 Ca -0.22 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.36 1r6m n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r6m n ALA 208 N -3.00 1.83 -1.81 4.61 0.00 -1.26 -4.90 120.51 115.98 1r6m n ALA 208 Ca 0.00 0.34 -0.41 0.00 0.00 0.00 0.00 53.44 53.37 1r6m n ALA 208 Cb 0.00 -2.53 -0.02 0.00 0.00 0.00 0.00 19.45 16.91 1r6m n ALA 208 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1r6m s PRO 209 N 2.57 4.22 0.15 0.00 0.02 -1.26 -4.91 135.00 135.78 1r6m s PRO 209 Ca 0.83 2.40 -0.30 0.00 0.02 0.00 0.00 61.00 63.95 1r6m s PRO 209 Cb -0.56 -3.05 -0.07 0.00 0.02 0.00 0.00 34.50 30.85 1r6m s PRO 209 CO 0.40 -0.43 0.96 -0.59 -0.33 0.00 0.00 177.00 177.01 1r6m s PHE 210 N -0.58 3.86 0.50 6.54 -0.71 -1.26 -5.04 117.98 121.28 1r6m s PHE 210 Ca 0.56 1.83 -0.04 0.00 -1.04 0.00 0.00 56.93 58.24 1r6m s PHE 210 Cb -0.44 -3.04 -0.01 0.00 -1.21 0.00 0.00 43.02 38.32 1r6m s PHE 210 CO 0.52 0.27 0.77 1.03 -1.34 0.00 0.00 175.22 176.47 1r6m s ARG 211 N -0.31 3.24 0.26 1.99 0.52 -1.26 -4.87 118.95 118.51 1r6m s ARG 211 Ca 0.45 -0.06 -0.10 0.00 -0.52 0.00 0.00 55.73 55.50 1r6m s ARG 211 Cb -0.24 -2.41 0.39 0.00 0.52 0.00 0.00 34.95 33.21 1r6m s ARG 211 CO 0.30 -0.34 1.57 -1.35 0.02 0.00 0.00 175.30 175.51 1r6m h PRO 212 N 0.19 -0.00 -0.75 3.54 0.11 -2.00 -0.41 132.00 132.68 1r6m h PRO 212 Ca -0.47 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.70 1r6m h PRO 212 Cb 1.23 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.29 1r6m h PRO 212 CO 0.60 -0.00 0.44 0.00 -0.21 0.00 0.00 178.00 178.84 1r6m h ALA 213 N 1.86 1.01 0.39 -0.75 0.00 -1.99 -0.73 119.26 119.06 1r6m h ALA 213 Ca 0.43 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.32 1r6m h ALA 213 Cb 0.66 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1r6m h ALA 213 CO -0.94 0.16 -0.19 0.93 0.00 0.00 0.00 179.25 179.21 1r6m h GLU 214 N 0.82 -0.51 -0.28 0.00 5.08 -1.47 -0.69 114.58 117.53 1r6m h GLU 214 Ca 0.33 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.79 1r6m h GLU 214 Cb 0.16 0.12 -0.08 0.00 0.50 0.00 0.00 28.75 29.45 1r6m h GLU 214 CO -0.17 -0.34 -0.29 1.25 -1.00 0.00 0.00 179.01 178.47 1r6m h LEU 215 N -0.53 -0.92 -1.61 1.33 5.85 -1.01 0.17 115.31 118.59 1r6m h LEU 215 Ca -0.05 0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.87 1r6m h LEU 215 Cb 0.41 0.43 -0.03 0.00 0.37 0.00 0.00 40.66 41.84 1r6m h LEU 215 CO 0.08 -0.31 0.32 0.78 -0.34 0.00 0.00 178.44 178.98 1r6m h ASN 216 N -0.28 0.44 -0.26 1.25 2.35 -0.98 0.22 115.58 118.31 1r6m h ASN 216 Ca 0.14 -0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.76 1r6m h ASN 216 Cb 0.51 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.77 1r6m h ASN 216 CO -0.44 0.30 -0.34 0.00 -1.65 0.00 0.00 177.43 175.30 1r6m h ALA 217 N 1.73 0.40 -0.65 -0.83 0.00 0.50 -1.02 119.26 119.39 1r6m h ALA 217 Ca 0.20 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 1r6m h ALA 217 Cb 0.16 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1r6m h ALA 217 CO -0.05 0.45 0.20 0.52 0.00 0.00 0.00 179.25 180.37 1r6m h MET 218 N 0.42 1.01 -0.75 0.00 2.86 0.25 -1.27 114.93 117.46 1r6m h MET 218 Ca 0.03 -0.22 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 1r6m h MET 218 Cb 0.92 -0.15 -0.04 0.00 0.06 0.00 0.00 31.60 32.40 1r6m h MET 218 CO 0.08 0.89 0.43 -0.07 1.06 0.00 0.00 176.91 179.29 1r6m h LEU 219 N 0.94 0.92 -0.63 1.22 3.38 -0.51 -0.22 115.31 120.40 1r6m h LEU 219 Ca 0.21 -0.08 -0.12 0.00 0.09 0.00 0.00 57.88 57.98 1r6m h LEU 219 Cb 0.30 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1r6m h LEU 219 CO -0.01 0.73 -0.20 -0.33 0.09 0.00 0.00 178.44 178.73 1r6m h GLU 220 N 1.03 0.87 -0.06 1.13 5.08 -0.86 -0.73 114.58 121.03 1r6m h GLU 220 Ca 0.27 -0.35 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1r6m h GLU 220 Cb 0.00 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 1r6m h GLU 220 CO -0.05 0.99 0.02 1.25 -1.00 0.00 0.00 179.01 180.22 1r6m h LEU 221 N 0.76 0.09 -0.40 1.33 5.85 -0.85 -2.03 115.31 120.05 1r6m h LEU 221 Ca 0.11 -0.20 0.08 0.00 0.84 0.00 0.00 57.88 58.70 1r6m h LEU 221 Cb 0.74 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.68 1r6m h LEU 221 CO 0.06 0.26 -0.01 0.00 -0.34 0.00 0.00 178.44 178.41 1r6m h ALA 222 N 0.83 0.36 -0.65 1.25 0.00 -0.89 -1.36 119.26 118.79 1r6m h ALA 222 Ca 0.02 0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.12 1r6m h ALA 222 Cb 0.21 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 1r6m h ALA 222 CO -0.00 -0.40 0.43 1.96 0.00 0.00 0.00 179.25 181.24 1r6m h GLN 223 N 0.09 0.62 0.08 0.00 4.20 -0.95 -1.48 115.11 117.68 1r6m h GLN 223 Ca 0.20 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.87 1r6m h GLN 223 Cb 0.29 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.93 1r6m h GLN 223 CO -0.34 0.41 -0.04 0.37 -0.67 0.00 0.00 178.83 178.55 1r6m h GLN 224 N 0.64 -0.11 -0.26 1.46 4.15 -0.51 -3.16 115.11 117.32 1r6m h GLN 224 Ca 0.28 0.01 -0.07 0.00 0.77 0.00 0.00 58.65 59.64 1r6m h GLN 224 Cb 0.29 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.99 1r6m h GLN 224 CO -0.09 0.25 -0.13 0.78 -1.93 0.00 0.00 178.83 177.71 1r6m h GLY 225 N -0.49 0.46 -0.36 2.39 0.00 -1.27 -2.90 103.07 100.90 1r6m h GLY 225 Ca -0.01 -0.32 0.28 0.00 0.00 0.00 0.00 47.33 47.28 1r6m h GLY 225 CO 0.02 0.29 0.52 1.98 0.00 0.00 0.00 176.54 179.35 1r6m h MET 226 N 0.40 0.39 -0.57 4.80 -1.53 -1.23 0.11 114.93 117.29 1r6m h MET 226 Ca 0.08 -0.02 -0.02 0.00 -3.44 0.00 0.00 59.70 56.29 1r6m h MET 226 Cb 0.48 -0.09 -0.03 0.00 -0.55 0.00 0.00 31.60 31.41 1r6m h MET 226 CO 0.03 0.26 0.28 1.96 0.14 0.00 0.00 176.91 179.58 1r6m h GLN 227 N 0.40 0.80 -0.34 0.39 1.08 -1.55 -1.73 115.11 114.17 1r6m h GLN 227 Ca 0.67 -0.10 -0.09 0.00 -1.45 0.00 0.00 58.65 57.68 1r6m h GLN 227 Cb 1.41 -0.16 -0.02 0.00 -0.05 0.00 0.00 27.48 28.66 1r6m h GLN 227 CO -0.56 0.62 -0.16 1.49 -0.95 0.00 0.00 178.83 179.26 1r6m h GLU 228 N 0.81 0.62 -0.09 1.46 4.81 -0.93 -2.65 114.58 118.60 1r6m h GLU 228 Ca 0.20 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1r6m h GLU 228 Cb 0.08 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 1r6m h GLU 228 CO -0.03 0.76 0.03 -0.07 -0.73 0.00 0.00 179.01 178.97 1r6m h LEU 229 N 0.56 0.13 -1.74 1.64 3.38 -1.13 -0.40 115.31 117.75 1r6m h LEU 229 Ca 0.09 -0.19 0.06 0.00 0.09 0.00 0.00 57.88 57.93 1r6m h LEU 229 Cb 0.60 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1r6m h LEU 229 CO 0.04 0.29 0.29 -0.26 0.09 0.00 0.00 178.44 178.88 1r6m h PHE 230 N -0.03 0.32 -0.11 1.13 0.04 -1.33 -0.46 116.94 116.50 1r6m h PHE 230 Ca 0.03 0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.78 1r6m h PHE 230 Cb 0.20 -0.11 -0.00 0.00 2.20 0.00 0.00 35.95 38.24 1r6m h PHE 230 CO -0.01 0.18 -0.03 1.49 -0.60 0.00 0.00 178.31 179.33 1r6m h GLU 231 N 0.32 0.22 -0.78 1.51 4.81 -1.09 -2.31 114.58 117.26 1r6m h GLU 231 Ca 0.18 -0.09 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 1r6m h GLU 231 Cb 0.32 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.65 1r6m h GLU 231 CO -0.04 0.54 0.42 -0.07 -0.73 0.00 0.00 179.01 179.13 1r6m h LEU 232 N -0.11 0.97 -0.31 1.64 3.38 0.00 -1.24 115.31 119.64 1r6m h LEU 232 Ca 0.03 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1r6m h LEU 232 Cb 0.46 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1r6m h LEU 232 CO 0.01 0.78 0.05 1.56 0.09 0.00 0.00 178.44 180.94 1r6m h GLN 233 N 1.09 0.51 -0.79 1.13 4.20 -1.07 -1.38 115.11 118.80 1r6m h GLN 233 Ca 0.27 -0.14 -0.04 0.00 0.06 0.00 0.00 58.65 58.81 1r6m h GLN 233 Cb 0.03 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.72 1r6m h GLN 233 CO -0.04 0.61 0.35 0.00 -0.67 0.00 0.00 178.83 179.07 1r6m h ARG 234 N 0.34 1.16 0.15 1.46 3.08 -1.13 -0.92 114.38 118.52 1r6m h ARG 234 Ca 0.09 -0.19 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 1r6m h ARG 234 Cb 0.34 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 1r6m h ARG 234 CO 0.01 0.92 -0.10 0.00 -1.07 0.00 0.00 179.97 179.73 1r6m h ALA 235 N 1.18 -0.23 -0.53 0.04 0.00 -1.08 -2.06 119.26 116.58 1r6m h ALA 235 Ca 0.27 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.21 1r6m h ALA 235 Cb 0.17 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 1r6m h ALA 235 CO -0.03 -0.64 0.20 0.00 0.00 0.00 0.00 179.25 178.78 1r6m h ALA 236 N 0.59 0.66 0.00 0.00 0.00 -0.96 -0.70 119.26 118.85 1r6m h ALA 236 Ca -0.01 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1r6m h ALA 236 Cb 0.22 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1r6m h ALA 236 CO 0.00 -0.19 0.00 1.28 0.00 0.00 0.00 179.25 180.34 1r6m n LEU 237 N -4.99 0.32 -1.47 0.00 4.77 -0.38 -1.96 117.00 113.29 1r6m n LEU 237 Ca 0.06 0.60 0.05 0.00 -0.03 0.00 0.00 56.01 56.69 1r6m n LEU 237 Cb 0.21 -0.58 0.29 0.00 -2.33 0.00 0.00 43.42 41.01 1r6m n LEU 237 CO 0.24 -0.51 0.70 0.00 -1.33 0.00 0.00 177.39 176.50 1r6m n ALA 238 N -1.64 3.43 -0.77 -1.18 0.00 -0.27 -5.08 120.51 115.01 1r6m n ALA 238 Ca 0.02 -1.35 0.00 0.00 0.00 0.00 0.00 53.44 52.11 1r6m n ALA 238 Cb 0.14 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.51 1r6m n ALA 238 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89