#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mly s SER 2 N 0.00 1.98 0.08 1.08 1.04 -1.26 -4.95 113.70 111.66 3mly s SER 2 Ca 0.00 1.58 -0.22 0.00 0.48 0.00 0.00 55.95 57.80 3mly s SER 2 Cb 0.00 -2.26 -0.12 0.00 0.10 0.00 0.00 66.02 63.74 3mly s SER 2 CO 0.00 -3.59 1.62 0.58 0.98 0.00 0.00 173.24 172.83 3mly h VAL 3 N -2.20 1.14 -2.97 5.02 2.07 -1.95 -3.41 116.25 113.95 3mly h VAL 3 Ca -0.55 -0.43 -0.65 0.00 0.82 0.00 0.00 66.70 65.89 3mly h VAL 3 Cb 1.31 1.22 -0.11 0.00 -1.52 0.00 0.00 31.29 32.19 3mly h VAL 3 CO 0.51 0.13 -0.52 -0.76 0.02 0.00 0.00 177.57 176.95 3mly s LEU 4 N -9.86 4.14 -0.08 2.57 1.43 -1.26 -4.66 118.68 110.95 3mly s LEU 4 Ca -0.14 0.31 0.05 0.00 -1.03 0.00 0.00 54.13 53.32 3mly s LEU 4 Cb 0.06 -2.02 -0.01 0.00 0.03 0.00 0.00 46.19 44.26 3mly s LEU 4 CO 0.69 0.32 -0.24 -0.89 0.23 0.00 0.00 176.35 176.47 3mly s THR 5 N -0.51 2.15 0.11 5.49 2.01 -0.09 -3.87 115.64 120.93 3mly s THR 5 Ca 0.11 -1.01 0.07 0.00 0.31 0.00 0.00 61.69 61.17 3mly s THR 5 Cb -0.12 -1.80 -0.04 0.00 0.01 0.00 0.00 72.50 70.55 3mly s THR 5 CO 0.02 0.56 -0.17 -1.10 -0.69 0.00 0.00 174.62 173.24 3mly s GLN 6 N 0.09 1.07 0.35 4.92 -0.21 -1.26 -0.02 119.66 124.59 3mly s GLN 6 Ca -0.11 -1.19 -0.28 0.00 0.02 0.00 0.00 55.36 53.80 3mly s GLN 6 Cb -0.16 -1.14 -0.11 0.00 1.00 0.00 0.00 33.01 32.61 3mly s GLN 6 CO 0.06 0.24 1.38 -1.25 -2.12 0.00 0.00 175.29 173.61 3mly s PRO 7 N -2.26 4.24 0.49 2.91 0.04 -1.26 -4.84 135.00 134.32 3mly s PRO 7 Ca 0.07 2.36 0.21 0.00 0.04 0.00 0.00 61.00 63.69 3mly s PRO 7 Cb -0.08 -3.02 1.28 0.00 0.04 0.00 0.00 34.50 32.72 3mly s PRO 7 CO 0.04 -0.34 2.06 -1.00 0.04 0.00 0.00 177.00 177.80 3mly h PRO 8 N 3.20 0.00 -2.45 0.56 0.13 -1.97 -3.37 132.00 128.10 3mly h PRO 8 Ca -0.50 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.56 3mly h PRO 8 Cb 1.23 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.18 3mly h PRO 8 CO 0.65 0.13 0.03 -1.54 -0.23 0.00 0.00 178.00 177.04 3mly s SER 9 N -6.58 -0.48 0.02 1.44 1.04 -1.26 -0.91 113.70 106.96 3mly s SER 9 Ca -0.04 0.42 -0.02 0.00 0.48 0.00 0.00 55.95 56.80 3mly s SER 9 Cb 0.15 0.47 -0.02 0.00 0.10 0.00 0.00 66.02 66.72 3mly s SER 9 CO 0.64 -0.59 0.00 -0.69 0.98 0.00 0.00 173.24 173.58 3mly s VAL 11 N -1.52 0.11 0.03 5.02 1.01 -0.58 -4.91 120.40 119.56 3mly s VAL 11 Ca -0.10 -0.91 -0.16 0.00 0.00 0.00 0.00 61.98 60.81 3mly s VAL 11 Cb -0.02 -0.35 0.03 0.00 0.00 0.00 0.00 36.38 36.04 3mly s VAL 11 CO 0.06 -0.50 0.36 -0.94 0.00 0.00 0.00 175.10 174.08 3mly s SER 12 N -1.51 -0.21 0.16 3.32 1.04 -1.26 -1.62 113.70 113.61 3mly s SER 12 Ca -0.15 -0.05 -0.24 0.00 0.48 0.00 0.00 55.95 55.99 3mly s SER 12 Cb -0.09 0.38 0.06 0.00 0.10 0.00 0.00 66.02 66.48 3mly s SER 12 CO -0.01 -0.61 0.77 0.00 0.98 0.00 0.00 173.24 174.37 3mly s ALA 13 N -2.31 -1.55 0.62 5.32 0.00 -1.00 -4.99 121.76 117.86 3mly s ALA 13 Ca -0.06 0.28 -0.13 0.00 0.00 0.00 0.00 51.96 52.05 3mly s ALA 13 Cb -0.01 0.73 -0.03 0.00 0.00 0.00 0.00 23.12 23.81 3mly s ALA 13 CO -0.02 -0.89 1.04 0.00 0.00 0.00 0.00 175.76 175.89 3mly s ALA 14 N -3.57 2.88 0.42 0.00 0.00 -1.26 -0.67 121.76 119.56 3mly s ALA 14 Ca 0.07 0.11 -0.26 0.00 0.00 0.00 0.00 51.96 51.88 3mly s ALA 14 Cb -0.03 -3.15 -0.10 0.00 0.00 0.00 0.00 23.12 19.85 3mly s ALA 14 CO -0.03 -0.83 1.33 -0.35 0.00 0.00 0.00 175.76 175.88 3mly n PRO 15 N -2.56 2.07 0.00 0.00 -0.04 -1.26 -1.56 135.00 131.65 3mly n PRO 15 Ca 0.07 0.73 0.00 0.00 -0.04 0.00 0.00 63.50 64.27 3mly n PRO 15 Cb 0.54 -2.46 0.00 0.00 -0.04 0.00 0.00 33.50 31.53 3mly n PRO 15 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3mly n GLY 16 N 0.73 2.15 3.97 0.55 0.00 0.19 -4.88 105.19 107.89 3mly n GLY 16 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 3mly n GLY 16 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3mly s GLN 17 N -0.40 1.71 0.19 1.61 -1.52 -0.60 -4.23 119.66 116.42 3mly s GLN 17 Ca 0.00 -0.81 0.11 0.00 -1.95 0.00 0.00 55.36 52.71 3mly s GLN 17 Cb 0.00 -2.25 -0.04 0.00 -0.22 0.00 0.00 33.01 30.50 3mly s GLN 17 CO 0.00 -1.47 -0.20 -1.59 -0.25 0.00 0.00 175.29 171.78 3mly s LYS 18 N -5.23 1.68 0.11 2.91 -2.85 -1.26 -1.56 119.74 113.53 3mly s LYS 18 Ca 0.65 -1.44 -0.00 0.00 -1.00 0.00 0.00 55.97 54.18 3mly s LYS 18 Cb -0.07 -1.94 -0.04 0.00 -2.06 0.00 0.00 37.83 33.72 3mly s LYS 18 CO 0.45 0.41 0.00 0.14 0.10 0.00 0.00 175.35 176.45 3mly s VAL 19 N -1.66 0.33 0.11 1.79 -7.23 0.19 -4.97 120.40 108.97 3mly s VAL 19 Ca 0.22 -1.90 0.07 0.00 -1.81 0.00 0.00 61.98 58.57 3mly s VAL 19 Cb -0.08 -1.84 -0.04 0.00 0.56 0.00 0.00 36.38 34.99 3mly s VAL 19 CO 0.11 -0.70 -0.18 0.42 -0.31 0.00 0.00 175.10 174.44 3mly s THR 20 N -3.87 1.56 -0.10 5.32 -4.23 -1.26 -1.36 115.64 111.69 3mly s THR 20 Ca 0.17 -1.61 0.01 0.00 -1.18 0.00 0.00 61.69 59.08 3mly s THR 20 Cb 0.07 -1.52 0.02 0.00 1.34 0.00 0.00 72.50 72.41 3mly s THR 20 CO -0.03 -0.20 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.11 3mly s ILE 21 N -1.53 1.17 0.34 2.99 1.01 0.32 -4.98 121.20 120.51 3mly s ILE 21 Ca 0.07 -0.42 -0.16 0.00 0.00 0.00 0.00 60.65 60.14 3mly s ILE 21 Cb -0.08 -1.12 -0.09 0.00 0.01 0.00 0.00 42.46 41.17 3mly s ILE 21 CO 0.04 0.38 0.77 -0.44 0.00 0.00 0.00 174.94 175.70 3mly s SER 22 N 1.27 6.81 -0.22 3.58 0.01 -1.26 -1.17 113.70 122.72 3mly s SER 22 Ca -0.03 1.36 -0.02 0.00 1.31 0.00 0.00 55.95 58.57 3mly s SER 22 Cb -0.14 -2.40 0.07 0.00 0.21 0.00 0.00 66.02 63.75 3mly s SER 22 CO -0.04 -0.23 0.03 0.00 0.41 0.00 0.00 173.24 173.41 3mly s SER 24 N 1.74 6.08 0.00 0.00 0.15 0.97 -1.05 113.70 121.59 3mly s SER 24 Ca -0.01 0.07 0.00 0.00 0.70 0.00 0.00 55.95 56.72 3mly s SER 24 Cb -0.17 -2.13 0.00 0.00 -1.71 0.00 0.00 66.02 62.01 3mly s SER 24 CO -0.10 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 174.92 3mly n GLY 25 N 4.75 5.20 0.00 9.45 0.00 -0.33 -0.92 105.19 123.34 3mly n GLY 25 Ca -0.14 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.30 3mly n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3mly n SER 26 N 0.00 0.00 0.00 1.61 3.41 -1.24 -4.86 113.62 112.54 3mly n SER 26 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3mly n SER 26 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3mly n SER 26 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3mly n SER 27 N 0.00 0.00 0.00 4.04 3.41 -1.26 -1.88 113.62 117.93 3mly n SER 27 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3mly n SER 27 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3mly n SER 27 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3mly n ASN 27 N 0.00 0.00 -0.05 4.04 0.23 -1.26 -0.58 115.26 117.64 3mly n ASN 27 Ca 0.00 0.00 0.10 0.00 -0.53 0.00 0.00 54.58 54.15 3mly n ASN 27 Cb 0.00 0.00 0.49 0.00 -2.08 0.00 0.00 39.78 38.19 3mly n ASN 27 CO 0.00 0.00 0.00 0.40 -0.93 0.00 0.00 177.26 176.73 3mly h ILE 28 N 0.00 0.96 -0.26 1.53 2.04 -1.72 0.13 117.51 120.19 3mly h ILE 28 Ca 0.00 -0.15 0.07 0.00 1.00 0.00 0.00 64.86 65.79 3mly h ILE 28 Cb 0.00 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 3mly h ILE 28 CO 0.00 0.08 0.24 1.23 0.00 0.00 0.00 178.15 179.70 3mly h GLY 29 N 0.43 0.00 0.00 5.37 0.00 -1.53 -3.25 103.07 104.08 3mly h GLY 29 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 3mly h GLY 29 CO -0.06 0.00 -0.73 0.70 0.00 0.00 0.00 176.54 176.45 3mly n ASN 30 N -3.99 3.67 -4.16 0.19 3.02 0.19 -5.03 115.26 109.14 3mly n ASN 30 Ca 0.03 -0.11 -0.12 0.00 -0.03 0.00 0.00 54.58 54.35 3mly n ASN 30 Cb 0.38 0.94 -0.10 0.00 -0.61 0.00 0.00 39.78 40.39 3mly n ASN 30 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3mly s ASN 31 N -1.68 1.26 0.23 6.41 -0.87 0.20 -5.08 114.94 115.41 3mly s ASN 31 Ca 0.00 -0.88 -0.15 0.00 -1.57 0.00 0.00 52.86 50.26 3mly s ASN 31 Cb 0.00 0.05 -0.08 0.00 -0.02 0.00 0.00 41.25 41.20 3mly s ASN 31 CO 0.00 -0.35 0.64 -0.04 -2.57 0.00 0.00 177.10 174.78 3mly s MET 32 N -3.16 4.02 -0.05 -0.60 -1.94 -1.26 -4.35 119.30 111.96 3mly s MET 32 Ca 0.07 0.59 -0.14 0.00 -1.71 0.00 0.00 55.69 54.50 3mly s MET 32 Cb 0.00 -2.73 -0.05 0.00 2.01 0.00 0.00 34.83 34.06 3mly s MET 32 CO -0.02 0.34 0.37 0.08 -0.01 0.00 0.00 175.02 175.79 3mly s VAL 33 N -1.69 5.13 0.20 -6.03 1.01 -1.26 -4.65 120.40 113.12 3mly s VAL 33 Ca 0.45 0.75 0.09 0.00 0.00 0.00 0.00 61.98 63.28 3mly s VAL 33 Cb -0.13 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 3mly s VAL 33 CO 0.20 0.53 -0.08 -0.94 0.00 0.00 0.00 175.10 174.80 3mly s SER 34 N -0.67 4.27 0.08 3.32 1.04 -0.02 -1.01 113.70 120.70 3mly s SER 34 Ca 0.22 -0.62 0.05 0.00 0.48 0.00 0.00 55.95 56.08 3mly s SER 34 Cb -0.16 -0.72 -0.03 0.00 0.10 0.00 0.00 66.02 65.22 3mly s SER 34 CO 0.11 0.08 -0.14 0.26 0.98 0.00 0.00 173.24 174.53 3mly s TRP 35 N -1.88 1.23 0.04 5.02 0.52 0.29 -1.12 118.94 123.04 3mly s TRP 35 Ca 0.26 -0.49 0.03 0.00 0.02 0.00 0.00 56.10 55.93 3mly s TRP 35 Cb -0.08 -0.68 -0.02 0.00 -1.15 0.00 0.00 33.47 31.54 3mly s TRP 35 CO 0.16 0.06 -0.10 0.71 0.02 0.00 0.00 176.95 177.80 3mly s TYR 36 N -1.47 0.90 -0.13 -1.98 1.51 0.61 -0.58 117.35 116.21 3mly s TYR 36 Ca -0.00 -0.37 -0.01 0.00 -1.01 0.00 0.00 57.07 55.68 3mly s TYR 36 Cb -0.09 -0.54 -0.02 0.00 -0.11 0.00 0.00 41.96 41.20 3mly s TYR 36 CO 0.02 -0.01 -0.10 -1.14 -1.11 0.00 0.00 175.55 173.21 3mly s GLN 37 N -1.18 3.43 -0.14 -0.62 0.74 -0.30 -1.28 119.66 120.30 3mly s GLN 37 Ca -0.03 -0.63 -0.01 0.00 0.05 0.00 0.00 55.36 54.74 3mly s GLN 37 Cb -0.08 -2.71 0.04 0.00 1.10 0.00 0.00 33.01 31.36 3mly s GLN 37 CO 0.01 0.25 -0.04 -1.14 -0.55 0.00 0.00 175.29 173.82 3mly s GLN 38 N 0.29 1.24 -0.04 1.67 0.74 0.46 -0.40 119.66 123.62 3mly s GLN 38 Ca -0.08 -0.35 -0.23 0.00 0.05 0.00 0.00 55.36 54.75 3mly s GLN 38 Cb -0.15 -1.76 -0.04 0.00 1.10 0.00 0.00 33.01 32.15 3mly s GLN 38 CO 0.05 -0.40 0.70 -1.01 -0.55 0.00 0.00 175.29 174.08 3mly s HIS 39 N 1.73 3.62 0.30 1.67 3.76 -1.26 -1.16 115.29 123.95 3mly s HIS 39 Ca 0.02 1.29 -0.28 0.00 -0.15 0.00 0.00 55.06 55.94 3mly s HIS 39 Cb -0.14 -2.78 -0.13 0.00 1.11 0.00 0.00 32.58 30.63 3mly s HIS 39 CO -0.07 0.16 1.17 -0.35 -0.85 0.00 0.00 174.74 174.79 3mly n PRO 40 N 3.46 1.73 -0.01 8.40 -0.04 -1.26 -1.67 135.00 145.61 3mly n PRO 40 Ca -0.02 0.61 0.00 0.00 -0.04 0.00 0.00 63.50 64.05 3mly n PRO 40 Cb 0.51 -2.10 0.00 0.00 -0.04 0.00 0.00 33.50 31.87 3mly n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3mly n GLY 41 N 1.13 1.22 3.35 0.55 0.00 -1.26 -5.04 105.19 105.14 3mly n GLY 41 Ca 0.08 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.92 3mly n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3mly s THR 42 N -2.42 1.10 0.54 2.61 -4.23 -0.67 -5.14 115.64 107.43 3mly s THR 42 Ca 0.00 -2.04 -0.20 0.00 -1.18 0.00 0.00 61.69 58.28 3mly s THR 42 Cb 0.00 -2.42 -0.06 0.00 1.34 0.00 0.00 72.50 71.36 3mly s THR 42 CO 0.00 -0.27 1.13 0.00 -0.54 0.00 0.00 174.62 174.94 3mly s ALA 43 N -3.38 2.70 0.57 3.99 0.00 -1.26 -4.57 121.76 119.81 3mly s ALA 43 Ca 0.30 0.84 -0.20 0.00 0.00 0.00 0.00 51.96 52.90 3mly s ALA 43 Cb 0.06 -3.36 -0.05 0.00 0.00 0.00 0.00 23.12 19.76 3mly s ALA 43 CO 0.10 -0.78 1.08 -2.30 0.00 0.00 0.00 175.76 173.86 3mly n PRO 44 N -1.29 1.14 -5.04 0.00 -0.02 -1.26 -4.67 135.00 123.86 3mly n PRO 44 Ca 0.12 0.43 -0.32 0.00 -2.02 0.00 0.00 63.50 61.71 3mly n PRO 44 Cb 0.51 -2.27 -0.16 0.00 -0.02 0.00 0.00 33.50 31.57 3mly n PRO 44 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3mly s LYS 45 N -2.74 2.98 0.04 -0.52 2.20 0.46 -4.93 119.74 117.23 3mly s LYS 45 Ca 0.74 -0.80 -0.30 0.00 -0.36 0.00 0.00 55.97 55.25 3mly s LYS 45 Cb -0.43 -2.39 -0.08 0.00 -1.51 0.00 0.00 37.83 33.42 3mly s LYS 45 CO 0.48 0.29 1.69 -1.17 -0.36 0.00 0.00 175.35 176.29 3mly s LEU 46 N 0.09 4.36 -0.21 5.43 2.96 -1.26 -1.15 118.68 128.91 3mly s LEU 46 Ca -0.09 2.46 -0.02 0.00 -0.22 0.00 0.00 54.13 56.26 3mly s LEU 46 Cb -0.15 -3.55 -0.12 0.00 0.50 0.00 0.00 46.19 42.86 3mly s LEU 46 CO 0.06 -0.92 -0.21 0.18 -1.32 0.00 0.00 176.35 174.15 3mly n LEU 47 N 6.13 2.61 -3.85 -0.68 4.77 0.26 -4.80 117.00 121.44 3mly n LEU 47 Ca 0.17 -0.01 -0.12 0.00 -0.03 0.00 0.00 56.01 56.01 3mly n LEU 47 Cb 0.41 -0.69 -0.13 0.00 -2.33 0.00 0.00 43.42 40.68 3mly n LEU 47 CO 0.63 0.74 -0.28 -0.63 -1.33 0.00 0.00 177.39 176.53 3mly s ILE 48 N -2.40 0.00 0.14 -0.08 -1.09 -1.14 -4.16 121.20 112.47 3mly s ILE 48 Ca -0.28 -0.04 0.01 0.00 -2.23 0.00 0.00 60.65 58.11 3mly s ILE 48 Cb 0.08 -0.12 -0.04 0.00 -1.58 0.00 0.00 42.46 40.80 3mly s ILE 48 CO 0.45 -0.02 0.00 -0.72 -1.23 0.00 0.00 174.94 173.42 3mly s TYR 49 N -0.03 1.02 -1.49 3.97 -0.85 0.16 -0.55 117.35 119.58 3mly s TYR 49 Ca -0.01 -1.06 -0.03 0.00 -0.52 0.00 0.00 57.07 55.45 3mly s TYR 49 Cb -0.01 -0.59 0.03 0.00 0.38 0.00 0.00 41.96 41.77 3mly s TYR 49 CO 0.00 -0.30 0.38 0.39 -1.52 0.00 0.00 175.55 174.50 3mly n GLU 50 N -0.15 -2.68 0.00 -3.49 1.02 -1.18 -0.97 120.64 113.19 3mly n GLU 50 Ca -0.08 0.32 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 3mly n GLU 50 Cb 0.63 -4.40 0.00 0.00 -0.02 0.00 0.00 31.44 27.65 3mly n GLU 50 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3mly n ASN 51 N -2.91 0.00 0.00 1.62 3.02 -0.18 -4.07 115.26 112.74 3mly n ASN 51 Ca -0.25 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.30 3mly n ASN 51 Cb 0.66 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.83 3mly n ASN 51 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3mly n SER 52 N 1.80 0.04 -4.85 6.41 3.41 -1.10 -2.88 113.62 116.44 3mly n SER 52 Ca 0.00 -0.74 -0.36 0.00 -0.26 0.00 0.00 58.87 57.51 3mly n SER 52 Cb 0.00 0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 63.91 3mly n SER 52 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3mly s LYS 53 N -0.01 3.86 -0.16 4.33 1.02 -0.14 -4.47 119.74 124.17 3mly s LYS 53 Ca 0.00 0.32 -0.05 0.00 0.02 0.00 0.00 55.97 56.26 3mly s LYS 53 Cb 0.00 -3.09 -0.04 0.00 -0.52 0.00 0.00 37.83 34.18 3mly s LYS 53 CO 0.00 0.61 0.02 1.03 -0.92 0.00 0.00 175.35 176.10 3mly s ARG 54 N -1.53 3.72 0.89 1.68 0.52 -1.26 -0.67 118.95 122.30 3mly s ARG 54 Ca 0.29 -0.40 -0.11 0.00 -0.52 0.00 0.00 55.73 55.00 3mly s ARG 54 Cb -0.15 -3.06 0.13 0.00 0.52 0.00 0.00 34.95 32.39 3mly s ARG 54 CO 0.16 0.35 1.11 -2.14 0.02 0.00 0.00 175.30 174.80 3mly s PRO 55 N 0.12 1.22 0.36 3.54 0.02 -1.26 -4.96 135.00 134.05 3mly s PRO 55 Ca 0.03 1.27 -0.28 0.00 0.02 0.00 0.00 61.00 62.03 3mly s PRO 55 Cb -0.13 -1.77 -0.11 0.00 0.02 0.00 0.00 34.50 32.51 3mly s PRO 55 CO 0.01 -2.40 1.51 -1.12 -0.33 0.00 0.00 177.00 174.67 3mly s SER 56 N -2.97 6.34 0.00 2.53 0.01 -1.26 -2.74 113.70 115.61 3mly s SER 56 Ca 0.65 3.05 0.00 0.00 1.31 0.00 0.00 55.95 60.95 3mly s SER 56 Cb -0.21 -2.66 0.00 0.00 0.21 0.00 0.00 66.02 63.36 3mly s SER 56 CO 0.58 -0.89 0.00 0.61 0.41 0.00 0.00 173.24 173.95 3mly n GLY 57 N 0.71 3.25 3.64 3.44 0.00 -1.26 -5.04 105.19 109.93 3mly n GLY 57 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 3mly n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mly s ILE 58 N -2.85 4.98 0.70 -0.61 -1.09 -1.11 -5.04 121.20 116.18 3mly s ILE 58 Ca 0.00 1.20 -0.14 0.00 -2.23 0.00 0.00 60.65 59.48 3mly s ILE 58 Cb 0.00 -3.96 0.02 0.00 -1.58 0.00 0.00 42.46 36.94 3mly s ILE 58 CO 0.00 0.05 1.12 -2.16 -1.23 0.00 0.00 174.94 172.73 3mly s PRO 59 N 2.28 2.52 0.00 2.79 0.04 -1.26 -4.88 135.00 136.49 3mly s PRO 59 Ca 0.28 1.42 0.14 0.00 0.04 0.00 0.00 61.00 62.88 3mly s PRO 59 Cb -0.16 -1.91 0.70 0.00 0.04 0.00 0.00 34.50 33.17 3mly s PRO 59 CO 0.09 -1.47 1.37 -0.40 0.04 0.00 0.00 177.00 176.63 3mly n ASP 60 N -2.73 0.00 -0.01 6.66 5.68 -1.26 -2.17 116.55 122.72 3mly n ASP 60 Ca 0.11 0.10 0.15 0.00 -0.50 0.00 0.00 54.79 54.65 3mly n ASP 60 Cb 0.52 -0.29 0.76 0.00 -1.14 0.00 0.00 41.12 40.96 3mly n ASP 60 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 3mly n ARG 61 N -1.29 0.47 -3.52 0.11 1.85 -1.26 -4.60 116.66 108.43 3mly n ARG 61 Ca 0.06 -0.02 -0.37 0.00 -1.00 0.00 0.00 57.85 56.53 3mly n ARG 61 Cb 0.11 -1.50 -0.07 0.00 -1.05 0.00 0.00 32.46 29.96 3mly n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3mly s PHE 62 N -2.54 3.55 0.07 2.89 0.40 -0.92 -1.16 117.98 120.27 3mly s PHE 62 Ca 0.29 0.74 -0.03 0.00 -0.60 0.00 0.00 56.93 57.33 3mly s PHE 62 Cb 0.20 -2.33 -0.03 0.00 0.51 0.00 0.00 43.02 41.37 3mly s PHE 62 CO 0.46 0.36 0.05 -1.54 0.70 0.00 0.00 175.22 175.26 3mly s SER 63 N -0.00 0.35 0.03 1.36 1.04 -0.07 -4.98 113.70 111.44 3mly s SER 63 Ca 0.20 -0.93 0.01 0.00 0.48 0.00 0.00 55.95 55.71 3mly s SER 63 Cb -0.14 0.26 -0.02 0.00 0.10 0.00 0.00 66.02 66.21 3mly s SER 63 CO 0.07 -0.66 -0.05 -0.83 0.98 0.00 0.00 173.24 172.75 3mly s GLY 64 N -2.92 0.38 0.16 7.32 0.00 -1.26 -0.45 107.32 110.54 3mly s GLY 64 Ca 0.09 -0.69 -0.07 0.00 0.00 0.00 0.00 44.72 44.05 3mly s GLY 64 CO -0.08 -0.76 0.22 -1.35 0.00 0.00 0.00 173.10 171.13 3mly s SER 65 N -1.56 0.11 -0.01 1.64 1.04 -0.37 -4.13 113.70 110.42 3mly s SER 65 Ca -0.12 -0.97 -0.01 0.00 0.48 0.00 0.00 55.95 55.33 3mly s SER 65 Cb -0.10 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.43 3mly s SER 65 CO -0.01 -0.85 0.02 -0.60 0.98 0.00 0.00 173.24 172.78 3mly s ARG 66 N -3.99 0.03 -0.15 4.02 3.00 -1.26 -0.83 118.95 119.77 3mly s ARG 66 Ca 0.19 0.03 -0.07 0.00 -1.00 0.00 0.00 55.73 54.88 3mly s ARG 66 Cb 0.04 0.01 0.06 0.00 0.00 0.00 0.00 34.95 35.07 3mly s ARG 66 CO 0.01 -0.00 0.35 0.45 0.00 0.00 0.00 175.30 176.10 3mly s SER 67 N 0.01 -0.30 1.68 -2.12 0.15 -0.37 -5.00 113.70 107.75 3mly s SER 67 Ca -0.00 0.76 0.00 0.00 0.70 0.00 0.00 55.95 57.41 3mly s SER 67 Cb -0.00 0.73 0.00 0.00 -1.71 0.00 0.00 66.02 65.04 3mly s SER 67 CO 0.00 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 174.85 3mly n GLY 68 N 4.54 3.16 0.85 9.45 0.00 -1.26 -1.23 105.19 120.71 3mly n GLY 68 Ca -0.20 0.01 0.01 0.00 0.00 0.00 0.00 46.02 45.84 3mly n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3mly n THR 69 N 0.00 2.32 -4.25 2.61 -2.24 -1.26 -4.16 114.28 107.30 3mly n THR 69 Ca 0.00 -3.24 -0.14 0.00 -2.27 0.00 0.00 64.05 58.40 3mly n THR 69 Cb 0.00 -0.34 -0.10 0.00 -2.10 0.00 0.00 70.33 67.79 3mly n THR 69 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3mly s SER 70 N -3.12 1.41 0.10 3.42 1.04 -0.36 -1.19 113.70 114.99 3mly s SER 70 Ca 0.41 -1.13 -0.03 0.00 0.48 0.00 0.00 55.95 55.68 3mly s SER 70 Cb 0.38 0.07 -0.03 0.00 0.10 0.00 0.00 66.02 66.54 3mly s SER 70 CO -0.05 -0.50 0.06 0.00 0.98 0.00 0.00 173.24 173.73 3mly s ALA 71 N -3.56 0.52 -0.03 5.32 0.00 -0.22 -1.24 121.76 122.57 3mly s ALA 71 Ca 0.22 -1.22 -0.01 0.00 0.00 0.00 0.00 51.96 50.95 3mly s ALA 71 Cb 0.05 0.59 0.03 0.00 0.00 0.00 0.00 23.12 23.79 3mly s ALA 71 CO 0.03 -0.46 0.05 0.99 0.00 0.00 0.00 175.76 176.37 3mly s THR 72 N -3.97 -0.04 -0.20 0.00 2.01 -0.01 -1.02 115.64 112.41 3mly s THR 72 Ca 0.15 0.16 -0.10 0.00 0.31 0.00 0.00 61.69 62.21 3mly s THR 72 Cb 0.07 -0.10 -0.05 0.00 0.01 0.00 0.00 72.50 72.43 3mly s THR 72 CO -0.04 0.07 0.12 -0.22 -0.69 0.00 0.00 174.62 173.85 3mly s LEU 73 N 0.84 4.13 -0.07 4.42 2.96 -0.32 -1.24 118.68 129.40 3mly s LEU 73 Ca -0.07 0.19 0.01 0.00 -0.22 0.00 0.00 54.13 54.05 3mly s LEU 73 Cb -0.10 -2.07 -0.03 0.00 0.50 0.00 0.00 46.19 44.50 3mly s LEU 73 CO -0.03 0.17 -0.10 -0.83 -1.32 0.00 0.00 176.35 174.24 3mly s GLY 74 N 0.43 1.63 -0.09 7.98 0.00 0.41 -0.52 107.32 117.15 3mly s GLY 74 Ca 0.07 -0.92 -0.00 0.00 0.00 0.00 0.00 44.72 43.87 3mly s GLY 74 CO -0.01 -0.63 -0.06 -0.42 0.00 0.00 0.00 173.10 171.98 3mly s ILE 75 N -0.63 0.85 0.20 0.90 1.01 -0.47 -0.89 121.20 122.16 3mly s ILE 75 Ca 0.09 -0.20 0.07 0.00 0.00 0.00 0.00 60.65 60.61 3mly s ILE 75 Cb -0.11 -0.88 -0.04 0.00 0.01 0.00 0.00 42.46 41.43 3mly s ILE 75 CO 0.01 0.33 0.05 -0.63 0.00 0.00 0.00 174.94 174.71 3mly s ILE 76 N 1.57 3.93 -1.04 2.92 1.01 -0.31 -0.64 121.20 128.64 3mly s ILE 76 Ca 0.01 -1.42 -0.00 0.00 0.00 0.00 0.00 60.65 59.24 3mly s ILE 76 Cb -0.13 -3.02 -0.00 0.00 0.01 0.00 0.00 42.46 39.32 3mly s ILE 76 CO -0.05 -0.18 0.87 0.61 0.00 0.00 0.00 174.94 176.19 3mly n GLY 77 N -0.41 -0.28 3.63 6.18 0.00 -1.10 -4.83 105.19 108.39 3mly n GLY 77 Ca -0.09 0.04 -0.48 0.00 0.00 0.00 0.00 46.02 45.50 3mly n GLY 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mly n LEU 78 N -3.71 2.48 -4.41 0.99 4.77 -0.60 -4.56 117.00 111.96 3mly n LEU 78 Ca -0.25 1.12 -0.26 0.00 -0.03 0.00 0.00 56.01 56.59 3mly n LEU 78 Cb 0.65 -1.33 -0.12 0.00 -2.33 0.00 0.00 43.42 40.29 3mly n LEU 78 CO 0.53 -0.70 -0.52 -1.10 -1.33 0.00 0.00 177.39 174.27 3mly s GLN 79 N 0.25 1.48 0.37 3.23 -0.21 -1.26 -0.63 119.66 122.88 3mly s GLN 79 Ca 0.76 -1.51 0.11 0.00 0.02 0.00 0.00 55.36 54.74 3mly s GLN 79 Cb -0.77 -1.75 0.88 0.00 1.00 0.00 0.00 33.01 32.36 3mly s GLN 79 CO 0.45 0.37 1.86 1.15 -2.12 0.00 0.00 175.29 177.01 3mly h THR 80 N 3.18 0.79 0.00 -0.19 2.02 -1.94 -0.07 112.91 116.71 3mly h THR 80 Ca -0.45 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.51 3mly h THR 80 Cb 1.21 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 3mly h THR 80 CO 0.49 0.11 0.00 0.61 0.37 0.00 0.00 175.52 177.10 3mly n GLY 81 N -1.44 -0.91 0.07 2.16 0.00 -1.26 -1.66 105.19 102.15 3mly n GLY 81 Ca 0.18 0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.42 3mly n GLY 81 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3mly n ASP 82 N -1.98 0.56 -4.70 1.61 8.00 -0.04 -4.81 116.55 115.19 3mly n ASP 82 Ca 0.00 0.56 -0.42 0.00 0.71 0.00 0.00 54.79 55.64 3mly n ASP 82 Cb 0.09 -0.70 -0.03 0.00 -0.02 0.00 0.00 41.12 40.46 3mly n ASP 82 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3mly s GLU 83 N -3.08 4.13 0.00 -1.24 2.02 -0.66 -4.87 118.70 114.99 3mly s GLU 83 Ca 0.11 2.61 0.00 0.00 0.02 0.00 0.00 54.97 57.71 3mly s GLU 83 Cb 0.14 -3.39 0.00 0.00 0.10 0.00 0.00 34.13 30.98 3mly s GLU 83 CO 0.56 -0.81 0.00 0.00 0.02 0.00 0.00 175.26 175.03 3mly n ALA 84 N 5.02 0.00 -2.74 5.21 0.00 -1.20 -4.87 120.51 121.94 3mly n ALA 84 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.25 3mly n ALA 84 Cb 0.37 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.75 3mly n ALA 84 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3mly s GLU 85 N -2.00 4.06 -0.09 0.00 2.56 -0.31 -1.14 118.70 121.79 3mly s GLU 85 Ca 0.00 -0.04 0.02 0.00 0.00 0.00 0.00 54.97 54.95 3mly s GLU 85 Cb 0.00 -3.37 -0.02 0.00 2.00 0.00 0.00 34.13 32.74 3mly s GLU 85 CO 0.00 0.39 -0.14 0.71 -0.56 0.00 0.00 175.26 175.66 3mly s TYR 86 N 0.05 2.75 -0.01 5.30 1.51 0.29 -0.41 117.35 126.84 3mly s TYR 86 Ca 0.14 -0.39 0.06 0.00 -1.01 0.00 0.00 57.07 55.86 3mly s TYR 86 Cb -0.12 -1.73 -0.01 0.00 -0.11 0.00 0.00 41.96 39.98 3mly s TYR 86 CO 0.02 -0.00 -0.18 0.71 -1.11 0.00 0.00 175.55 174.99 3mly s TYR 87 N -0.22 1.61 0.20 2.71 1.51 -0.41 -0.82 117.35 121.94 3mly s TYR 87 Ca 0.01 -0.31 0.04 0.00 -1.01 0.00 0.00 57.07 55.80 3mly s TYR 87 Cb -0.13 -1.04 -0.03 0.00 -0.11 0.00 0.00 41.96 40.65 3mly s TYR 87 CO 0.03 -0.03 0.31 0.00 -1.11 0.00 0.00 175.55 174.75 3mly s ALA 89 N -1.88 -1.43 0.22 0.00 0.00 -0.27 -0.52 121.76 117.87 3mly s ALA 89 Ca 0.34 0.91 -0.13 0.00 0.00 0.00 0.00 51.96 53.08 3mly s ALA 89 Cb -0.10 0.12 0.05 0.00 0.00 0.00 0.00 23.12 23.19 3mly s ALA 89 CO 0.28 -0.38 0.66 -2.37 0.00 0.00 0.00 175.76 173.95 3mly n THR 90 N 0.86 0.00 -2.93 0.00 5.66 -0.84 -0.84 114.28 116.20 3mly n THR 90 Ca -0.19 -0.59 -0.39 0.00 -3.05 0.00 0.00 64.05 59.82 3mly n THR 90 Cb 0.58 0.65 -0.06 0.00 -1.55 0.00 0.00 70.33 69.95 3mly n THR 90 CO 0.00 0.00 0.00 0.86 -3.05 0.00 0.00 175.07 172.88 3mly s TRP 91 N -3.64 3.93 0.13 1.09 -0.11 -1.26 -0.64 118.94 118.44 3mly s TRP 91 Ca 0.14 1.70 0.09 0.00 1.22 0.00 0.00 56.10 59.25 3mly s TRP 91 Cb -0.03 -2.82 -0.04 0.00 -1.50 0.00 0.00 33.47 29.08 3mly s TRP 91 CO 0.07 0.50 -0.18 0.34 -4.62 0.00 0.00 176.95 173.05 3mly s ASP 92 N -1.16 3.86 0.00 5.86 -1.08 -0.11 -4.39 116.67 119.64 3mly s ASP 92 Ca 0.37 -0.59 0.11 0.00 -0.52 0.00 0.00 52.55 51.92 3mly s ASP 92 Cb -0.24 -0.52 0.53 0.00 -1.46 0.00 0.00 42.92 41.23 3mly s ASP 92 CO 0.28 0.17 1.29 0.61 0.52 0.00 0.00 175.17 178.04 3mly n GLY 93 N 0.72 -0.74 0.00 2.66 0.00 0.25 -0.63 105.19 107.45 3mly n GLY 93 Ca -0.15 -0.05 0.10 0.00 0.00 0.00 0.00 46.02 45.92 3mly n GLY 93 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3mly n SER 94 N -1.37 0.00 -1.45 1.61 3.41 -1.26 -4.88 113.62 109.68 3mly n SER 94 Ca 0.04 -0.82 -0.01 0.00 -0.26 0.00 0.00 58.87 57.82 3mly n SER 94 Cb 0.10 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.06 3mly n SER 94 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3mly n LEU 95 N -0.93 -2.25 -3.52 1.04 4.77 0.19 -5.08 117.00 111.23 3mly n LEU 95 Ca 0.15 -0.06 -0.09 0.00 -0.03 0.00 0.00 56.01 55.98 3mly n LEU 95 Cb 0.07 -0.72 -0.03 0.00 -2.33 0.00 0.00 43.42 40.41 3mly n LEU 95 CO 0.11 0.02 0.71 0.00 -1.33 0.00 0.00 177.39 176.90 3mly s ARG 95 N -3.57 0.77 0.18 3.23 1.70 -1.18 -5.02 118.95 115.06 3mly s ARG 95 Ca 0.02 -0.18 -0.30 0.00 -0.47 0.00 0.00 55.73 54.80 3mly s ARG 95 Cb -0.00 0.35 -0.08 0.00 -0.57 0.00 0.00 34.95 34.66 3mly s ARG 95 CO 0.06 -0.31 0.96 0.99 -1.08 0.00 0.00 175.30 175.91 3mly s THR 96 N -2.61 4.25 0.04 4.99 2.01 -1.26 -0.93 115.64 122.13 3mly s THR 96 Ca 0.03 2.06 0.09 0.00 0.31 0.00 0.00 61.69 64.18 3mly s THR 96 Cb -0.01 -4.32 -0.03 0.00 0.01 0.00 0.00 72.50 68.16 3mly s THR 96 CO -0.06 0.41 -0.26 0.68 -0.69 0.00 0.00 174.62 174.71 3mly s VAL 97 N -0.63 2.07 -0.00 3.82 -7.23 0.19 -4.92 120.40 113.70 3mly s VAL 97 Ca 0.44 -1.35 0.03 0.00 -1.81 0.00 0.00 61.98 59.29 3mly s VAL 97 Cb -0.25 -1.77 -0.03 0.00 0.56 0.00 0.00 36.38 34.89 3mly s VAL 97 CO 0.31 0.36 -0.05 -0.36 -0.31 0.00 0.00 175.10 175.04 3mly s PHE 98 N -0.79 2.92 1.01 2.82 0.08 -1.26 -1.98 117.98 120.79 3mly s PHE 98 Ca 0.11 -0.01 -0.11 0.00 0.12 0.00 0.00 56.93 57.04 3mly s PHE 98 Cb -0.10 -1.62 0.20 0.00 -0.57 0.00 0.00 43.02 40.93 3mly s PHE 98 CO 0.02 0.39 1.10 0.20 -0.10 0.00 0.00 175.22 176.83 3mly s GLY 99 N -1.41 1.63 0.00 4.36 0.00 0.32 -4.45 107.32 107.77 3mly s GLY 99 Ca 0.17 0.31 0.20 0.00 0.00 0.00 0.00 44.72 45.41 3mly s GLY 99 CO 0.08 0.85 1.65 0.61 0.00 0.00 0.00 173.10 176.29 3mly n GLY 100 N 0.45 -1.11 0.00 0.20 0.00 -1.25 -4.73 105.19 98.74 3mly n GLY 100 Ca 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3mly n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mly n GLY 101 N 0.54 1.27 3.11 -0.02 0.00 -1.26 -5.05 105.19 103.79 3mly n GLY 101 Ca 0.07 -1.56 -0.31 0.00 0.00 0.00 0.00 46.02 44.22 3mly n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mly s THR 102 N -1.56 1.82 -0.20 2.61 2.01 0.00 -4.41 115.64 115.91 3mly s THR 102 Ca 0.00 -0.83 -0.27 0.00 0.31 0.00 0.00 61.69 60.90 3mly s THR 102 Cb 0.00 -1.64 -0.00 0.00 0.01 0.00 0.00 72.50 70.87 3mly s THR 102 CO 0.00 0.50 0.92 -0.75 -0.69 0.00 0.00 174.62 174.61 3mly s LYS 103 N 0.97 4.27 -0.23 4.92 2.20 -0.09 -0.54 119.74 131.24 3mly s LYS 103 Ca -0.05 1.16 -0.13 0.00 -0.36 0.00 0.00 55.97 56.59 3mly s LYS 103 Cb -0.15 -3.61 -0.04 0.00 -1.51 0.00 0.00 37.83 32.52 3mly s LYS 103 CO -0.04 -0.48 0.28 -1.17 -0.36 0.00 0.00 175.35 173.59 3mly s LEU 104 N 2.66 4.12 -0.12 5.43 2.96 -0.29 -1.53 118.68 131.91 3mly s LEU 104 Ca 0.41 0.30 -0.01 0.00 -0.22 0.00 0.00 54.13 54.60 3mly s LEU 104 Cb -0.16 -2.31 -0.02 0.00 0.50 0.00 0.00 46.19 44.20 3mly s LEU 104 CO 0.10 -0.02 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.12 3mly s THR 105 N 1.28 3.41 -0.49 3.68 2.01 -0.64 -3.23 115.64 121.66 3mly s THR 105 Ca 0.13 -0.54 -0.17 0.00 0.31 0.00 0.00 61.69 61.42 3mly s THR 105 Cb -0.14 -2.44 0.07 0.00 0.01 0.00 0.00 72.50 69.99 3mly s THR 105 CO 0.07 0.53 0.48 -0.69 -0.69 0.00 0.00 174.62 174.32 3mly s VAL 106 N 0.13 5.10 -0.07 3.82 1.01 -1.26 -2.37 120.40 126.76 3mly s VAL 106 Ca -0.04 -0.86 -0.32 0.00 0.00 0.00 0.00 61.98 60.75 3mly s VAL 106 Cb -0.14 -4.19 -0.10 0.00 0.00 0.00 0.00 36.38 31.94 3mly s VAL 106 CO 0.04 -0.67 1.95 0.18 0.00 0.00 0.00 175.10 176.60 3mly n LEU 106 N 5.56 3.64 0.00 3.92 4.77 0.16 -4.85 117.00 130.19 3mly n LEU 106 Ca -0.10 0.88 0.00 0.00 -0.03 0.00 0.00 56.01 56.76 3mly n LEU 106 Cb 0.44 -1.43 0.00 0.00 -2.33 0.00 0.00 43.42 40.10 3mly n LEU 106 CO 0.50 -0.03 0.30 -1.54 -1.33 0.00 0.00 177.39 175.29 3mly n SER 107 N 7.40 1.12 -3.66 -1.43 3.41 -1.26 -4.36 113.62 114.84 3mly n SER 107 Ca 0.23 -1.33 -0.06 0.00 -0.26 0.00 0.00 58.87 57.44 3mly n SER 107 Cb 0.34 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.28 3mly n SER 107 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3mly s GLN 108 N -0.33 1.71 0.42 4.33 -2.07 -1.26 -5.14 119.66 117.32 3mly s GLN 108 Ca 0.00 -0.99 -0.25 0.00 -1.82 0.00 0.00 55.36 52.30 3mly s GLN 108 Cb 0.00 0.56 -0.08 0.00 -1.09 0.00 0.00 33.01 32.39 3mly s GLN 108 CO 0.00 -0.79 1.32 -2.14 -1.32 0.00 0.00 175.29 172.36 3mly s PRO 109 N -3.43 3.86 0.45 9.60 0.02 -1.26 -4.94 135.00 139.30 3mly s PRO 109 Ca 0.13 2.17 -0.25 0.00 0.02 0.00 0.00 61.00 63.07 3mly s PRO 109 Cb -0.05 -2.69 -0.08 0.00 0.02 0.00 0.00 34.50 31.70 3mly s PRO 109 CO 0.07 -0.59 1.42 1.63 -0.33 0.00 0.00 177.00 179.20 3mly n LYS 110 N -0.03 2.22 -3.77 5.54 5.02 -1.26 -4.82 118.16 121.06 3mly n LYS 110 Ca 0.05 0.79 -0.15 0.00 -2.02 0.00 0.00 58.31 56.98 3mly n LYS 110 Cb 0.44 -2.61 -0.16 0.00 -0.02 0.00 0.00 35.03 32.68 3mly n LYS 110 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3mly s ALA 111 N -1.19 0.02 0.49 7.82 0.00 0.62 -4.93 121.76 124.60 3mly s ALA 111 Ca 0.61 0.35 -0.19 0.00 0.00 0.00 0.00 51.96 52.74 3mly s ALA 111 Cb -0.45 -0.27 -0.08 0.00 0.00 0.00 0.00 23.12 22.31 3mly s ALA 111 CO 0.57 -0.11 1.01 0.00 0.00 0.00 0.00 175.76 177.23 3mly s ALA 112 N 1.04 2.93 0.42 0.00 0.00 -1.26 -1.40 121.76 123.50 3mly s ALA 112 Ca -0.09 0.43 -0.24 0.00 0.00 0.00 0.00 51.96 52.07 3mly s ALA 112 Cb -0.12 -3.20 -0.08 0.00 0.00 0.00 0.00 23.12 19.72 3mly s ALA 112 CO -0.03 -0.26 1.10 -1.25 0.00 0.00 0.00 175.76 175.32 3mly s PRO 113 N -3.53 3.99 -0.01 0.00 0.04 -1.26 -4.46 135.00 129.77 3mly s PRO 113 Ca 0.64 1.63 -0.20 0.00 0.04 0.00 0.00 61.00 63.11 3mly s PRO 113 Cb -0.13 -2.49 -0.05 0.00 0.04 0.00 0.00 34.50 31.87 3mly s PRO 113 CO 0.23 -0.32 0.57 -1.12 0.04 0.00 0.00 177.00 176.40 3mly s SER 114 N -1.46 6.93 -0.08 6.66 0.01 -0.11 -4.91 113.70 120.74 3mly s SER 114 Ca 0.60 1.11 0.04 0.00 1.31 0.00 0.00 55.95 59.02 3mly s SER 114 Cb -0.25 -2.35 -0.00 0.00 0.21 0.00 0.00 66.02 63.63 3mly s SER 114 CO 0.31 0.11 -0.22 -0.69 0.41 0.00 0.00 173.24 173.16 3mly s VAL 115 N -0.19 1.87 -0.08 3.43 1.01 -1.26 -1.23 120.40 123.95 3mly s VAL 115 Ca 0.30 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.38 3mly s VAL 115 Cb -0.18 -1.61 0.01 0.00 0.00 0.00 0.00 36.38 34.60 3mly s VAL 115 CO 0.16 0.52 -0.15 -0.89 0.00 0.00 0.00 175.10 174.74 3mly s THR 116 N 0.24 1.37 -0.13 3.92 2.01 -0.13 -4.95 115.64 117.97 3mly s THR 116 Ca -0.13 -0.60 0.03 0.00 0.31 0.00 0.00 61.69 61.29 3mly s THR 116 Cb -0.16 -1.24 0.00 0.00 0.01 0.00 0.00 72.50 71.12 3mly s THR 116 CO 0.06 0.41 -0.22 -0.22 -0.69 0.00 0.00 174.62 173.97 3mly s LEU 117 N 0.72 2.16 -0.09 4.42 2.96 -1.26 -0.40 118.68 127.19 3mly s LEU 117 Ca -0.13 -0.57 0.01 0.00 -0.22 0.00 0.00 54.13 53.23 3mly s LEU 117 Cb -0.16 -1.45 -0.02 0.00 0.50 0.00 0.00 46.19 45.06 3mly s LEU 117 CO 0.03 0.11 -0.11 -0.36 -1.32 0.00 0.00 176.35 174.70 3mly s PHE 118 N 0.64 2.81 0.94 5.38 0.08 -0.27 -4.93 117.98 122.64 3mly s PHE 118 Ca -0.11 -0.27 -0.13 0.00 0.12 0.00 0.00 56.93 56.54 3mly s PHE 118 Cb -0.16 -1.74 0.16 0.00 -0.57 0.00 0.00 43.02 40.70 3mly s PHE 118 CO 0.02 0.08 1.14 -1.25 -0.10 0.00 0.00 175.22 175.11 3mly s PRO 119 N -0.33 0.89 0.40 0.24 0.04 -1.26 -1.69 135.00 133.28 3mly s PRO 119 Ca 0.04 0.24 -0.27 0.00 0.04 0.00 0.00 61.00 61.05 3mly s PRO 119 Cb -0.13 -1.81 -0.09 0.00 0.04 0.00 0.00 34.50 32.51 3mly s PRO 119 CO 0.02 -2.36 1.38 -2.14 0.04 0.00 0.00 177.00 173.95 3mly s PRO 120 N -5.30 4.00 0.61 0.56 0.02 -1.22 -4.79 135.00 128.88 3mly s PRO 120 Ca 0.65 2.33 -0.15 0.00 0.02 0.00 0.00 61.00 63.86 3mly s PRO 120 Cb -0.14 -2.84 -0.03 0.00 0.02 0.00 0.00 34.50 31.51 3mly s PRO 120 CO 0.54 -0.53 1.05 -1.54 -0.33 0.00 0.00 177.00 176.19 3mly s SER 121 N -0.49 5.82 0.43 2.53 1.04 -1.26 -4.92 113.70 116.84 3mly s SER 121 Ca 0.55 1.73 0.12 0.00 0.48 0.00 0.00 55.95 58.82 3mly s SER 121 Cb -0.42 -2.52 0.93 0.00 0.10 0.00 0.00 66.02 64.12 3mly s SER 121 CO 0.55 -1.14 2.00 0.77 0.98 0.00 0.00 173.24 176.39 3mly h SER 122 N 0.22 0.16 -0.34 7.02 4.64 -1.99 -1.54 113.55 121.72 3mly h SER 122 Ca -0.46 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 60.82 3mly h SER 122 Cb 1.21 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.24 3mly h SER 122 CO 0.58 0.26 0.14 -0.33 -0.87 0.00 0.00 176.83 176.61 3mly h GLU 123 N 0.17 0.50 -0.57 4.77 3.07 -1.99 -1.46 114.58 119.08 3mly h GLU 123 Ca 0.04 -0.09 -0.05 0.00 -0.50 0.00 0.00 59.36 58.76 3mly h GLU 123 Cb 0.24 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.04 3mly h GLU 123 CO 0.01 0.49 0.14 1.49 -1.40 0.00 0.00 179.01 179.75 3mly h GLU 124 N 0.40 0.91 0.00 2.33 4.81 -1.77 -2.62 114.58 118.63 3mly h GLU 124 Ca 0.11 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 3mly h GLU 124 Cb 0.17 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.43 3mly h GLU 124 CO -0.01 0.84 -0.04 -0.07 -0.73 0.00 0.00 179.01 179.00 3mly h LEU 125 N 0.81 0.00 -0.84 1.64 3.38 -1.07 0.13 115.31 119.35 3mly h LEU 125 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 3mly h LEU 125 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3mly h LEU 125 CO 0.00 0.04 0.00 1.56 0.09 0.00 0.00 178.44 180.13 3mly h GLN 126 N 0.00 0.00 -0.60 1.13 1.08 -0.89 -1.87 115.11 113.96 3mly h GLN 126 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3mly h GLN 126 Cb 0.06 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 3mly h GLN 126 CO 0.00 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 177.88 3mly n ALA 127 N -1.98 2.90 -2.91 3.87 0.00 0.41 -4.93 120.51 117.87 3mly n ALA 127 Ca 0.02 -1.04 -0.22 0.00 0.00 0.00 0.00 53.44 52.20 3mly n ALA 127 Cb 0.34 -1.02 0.03 0.00 0.00 0.00 0.00 19.45 18.80 3mly n ALA 127 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3mly n ASN 128 N 0.67 -6.06 -4.30 0.00 5.03 -0.70 -5.00 115.26 104.90 3mly n ASN 128 Ca 0.17 -0.24 -0.16 0.00 0.87 0.00 0.00 54.58 55.23 3mly n ASN 128 Cb 0.63 -4.92 -0.10 0.00 -1.02 0.00 0.00 39.78 34.36 3mly n ASN 128 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 3mly s LYS 129 N -5.59 1.28 -0.23 3.52 -0.14 -1.03 -4.66 119.74 112.89 3mly s LYS 129 Ca 0.25 -1.65 -0.11 0.00 -1.36 0.00 0.00 55.97 53.10 3mly s LYS 129 Cb -0.11 -0.42 0.08 0.00 -1.68 0.00 0.00 37.83 35.70 3mly s LYS 129 CO 0.31 -0.15 0.53 0.00 -0.76 0.00 0.00 175.35 175.27 3mly s ALA 130 N -3.57 -1.48 -0.08 5.17 0.00 -1.13 -3.06 121.76 117.61 3mly s ALA 130 Ca 0.29 1.91 0.01 0.00 0.00 0.00 0.00 51.96 54.18 3mly s ALA 130 Cb 0.06 -1.31 0.02 0.00 0.00 0.00 0.00 23.12 21.89 3mly s ALA 130 CO 0.08 -0.53 -0.10 0.99 0.00 0.00 0.00 175.76 176.21 3mly s THR 131 N 2.01 1.03 -0.08 0.00 2.01 -1.26 -0.88 115.64 118.47 3mly s THR 131 Ca -0.07 -0.38 -0.15 0.00 0.31 0.00 0.00 61.69 61.40 3mly s THR 131 Cb -0.09 -0.99 -0.05 0.00 0.01 0.00 0.00 72.50 71.39 3mly s THR 131 CO -0.16 0.34 0.37 -0.76 -0.69 0.00 0.00 174.62 173.72 3mly s LEU 132 N 1.00 4.36 -0.22 4.42 1.02 0.08 -3.38 118.68 125.97 3mly s LEU 132 Ca -0.08 0.76 0.00 0.00 0.02 0.00 0.00 54.13 54.83 3mly s LEU 132 Cb -0.15 -2.50 0.03 0.00 0.02 0.00 0.00 46.19 43.59 3mly s LEU 132 CO -0.00 0.20 -0.14 -0.69 0.02 0.00 0.00 176.35 175.74 3mly s VAL 133 N -0.27 2.37 -0.29 -1.59 1.01 -0.69 -1.45 120.40 119.50 3mly s VAL 133 Ca 0.21 -1.08 -0.04 0.00 0.00 0.00 0.00 61.98 61.08 3mly s VAL 133 Cb -0.15 -2.14 0.03 0.00 0.00 0.00 0.00 36.38 34.12 3mly s VAL 133 CO 0.09 0.33 0.01 0.00 0.00 0.00 0.00 175.10 175.53 3mly s LEU 135 N 1.36 3.44 -0.13 0.00 1.43 0.47 -0.80 118.68 124.44 3mly s LEU 135 Ca -0.01 -0.11 0.01 0.00 -1.03 0.00 0.00 54.13 52.99 3mly s LEU 135 Cb -0.18 -1.87 0.02 0.00 0.03 0.00 0.00 46.19 44.19 3mly s LEU 135 CO -0.01 0.10 -0.15 -0.63 0.23 0.00 0.00 176.35 175.89 3mly s ILE 136 N 0.81 1.54 0.21 -0.59 1.01 0.12 -0.96 121.20 123.34 3mly s ILE 136 Ca 0.01 -0.63 -0.03 0.00 0.00 0.00 0.00 60.65 60.00 3mly s ILE 136 Cb -0.14 -1.43 -0.03 0.00 0.01 0.00 0.00 42.46 40.87 3mly s ILE 136 CO 0.02 0.45 0.19 -0.94 0.00 0.00 0.00 174.94 174.67 3mly s SER 137 N 1.28 0.11 -1.52 3.58 1.04 -0.36 -0.36 113.70 117.46 3mly s SER 137 Ca 0.00 -1.30 -0.13 0.00 0.48 0.00 0.00 55.95 54.99 3mly s SER 137 Cb -0.14 0.42 0.08 0.00 0.10 0.00 0.00 66.02 66.48 3mly s SER 137 CO -0.07 -0.89 0.97 0.47 0.98 0.00 0.00 173.24 174.70 3mly n ASP 138 N -0.29 -4.96 -4.68 7.02 8.00 -0.56 -0.93 116.55 120.15 3mly n ASP 138 Ca 0.01 -0.73 -0.28 0.00 0.71 0.00 0.00 54.79 54.50 3mly n ASP 138 Cb 0.65 -3.96 -0.08 0.00 -0.02 0.00 0.00 41.12 37.72 3mly n ASP 138 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 3mly s PHE 139 N -3.28 2.91 -0.25 1.24 -0.71 -0.96 -4.50 117.98 112.42 3mly s PHE 139 Ca 0.65 -0.09 -0.17 0.00 -1.04 0.00 0.00 56.93 56.28 3mly s PHE 139 Cb -0.32 -1.45 0.07 0.00 -1.21 0.00 0.00 43.02 40.11 3mly s PHE 139 CO 0.80 0.50 0.64 -0.47 -1.34 0.00 0.00 175.22 175.34 3mly s TYR 140 N -1.54 -0.90 1.07 3.49 5.04 -0.49 -0.40 117.35 123.62 3mly s TYR 140 Ca 0.27 1.90 -0.12 0.00 -2.44 0.00 0.00 57.07 56.68 3mly s TYR 140 Cb -0.10 0.47 0.23 0.00 0.35 0.00 0.00 41.96 42.91 3mly s TYR 140 CO 0.19 -0.45 1.08 -2.14 -1.34 0.00 0.00 175.55 172.88 3mly s PRO 141 N 1.22 -0.20 -1.44 4.97 0.02 -1.26 -0.27 135.00 138.03 3mly s PRO 141 Ca -0.07 1.18 -0.09 0.00 0.02 0.00 0.00 61.00 62.05 3mly s PRO 141 Cb -0.05 -1.61 0.05 0.00 0.02 0.00 0.00 34.50 32.90 3mly s PRO 141 CO -0.13 -3.34 2.48 0.41 -0.33 0.00 0.00 177.00 176.09 3mly n GLY 142 N 0.68 4.73 3.09 0.52 0.00 -1.26 -4.81 105.19 108.14 3mly n GLY 142 Ca 0.07 -1.82 -0.12 0.00 0.00 0.00 0.00 46.02 44.15 3mly n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mly s ALA 143 N 0.72 -0.65 0.05 4.61 0.00 -1.26 -4.75 121.76 120.48 3mly s ALA 143 Ca 0.56 1.10 -0.01 0.00 0.00 0.00 0.00 51.96 53.61 3mly s ALA 143 Cb 0.16 -0.69 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 3mly s ALA 143 CO -0.07 -0.21 -0.03 0.14 0.00 0.00 0.00 175.76 175.59 3mly s VAL 144 N 1.30 0.23 -0.08 0.00 -7.23 -1.26 -4.71 120.40 108.65 3mly s VAL 144 Ca -0.09 -1.75 0.04 0.00 -1.81 0.00 0.00 61.98 58.37 3mly s VAL 144 Cb -0.10 -1.43 -0.01 0.00 0.56 0.00 0.00 36.38 35.40 3mly s VAL 144 CO -0.09 -0.96 -0.21 -0.89 -0.31 0.00 0.00 175.10 172.64 3mly s THR 145 N -3.72 2.36 -0.11 5.32 2.01 -0.62 -4.98 115.64 115.89 3mly s THR 145 Ca 0.06 -0.94 0.00 0.00 0.31 0.00 0.00 61.69 61.12 3mly s THR 145 Cb 0.07 -1.90 -0.02 0.00 0.01 0.00 0.00 72.50 70.65 3mly s THR 145 CO -0.09 0.56 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.60 3mly s VAL 146 N -0.01 3.25 -0.02 3.82 1.01 -1.26 -0.72 120.40 126.47 3mly s VAL 146 Ca -0.07 -0.61 0.05 0.00 0.00 0.00 0.00 61.98 61.35 3mly s VAL 146 Cb -0.15 -2.35 -0.01 0.00 0.00 0.00 0.00 36.38 33.87 3mly s VAL 146 CO 0.05 0.54 -0.17 0.00 0.00 0.00 0.00 175.10 175.52 3mly s ALA 147 N 0.03 1.40 0.01 5.51 0.00 0.18 -4.99 121.76 123.90 3mly s ALA 147 Ca -0.03 -0.71 0.04 0.00 0.00 0.00 0.00 51.96 51.25 3mly s ALA 147 Cb -0.14 -0.38 -0.03 0.00 0.00 0.00 0.00 23.12 22.57 3mly s ALA 147 CO 0.04 0.33 -0.08 -1.58 0.00 0.00 0.00 175.76 174.47 3mly s TRP 148 N -0.32 2.85 -0.02 0.00 0.52 -1.26 -0.39 118.94 120.32 3mly s TRP 148 Ca 0.05 -0.06 0.06 0.00 0.02 0.00 0.00 56.10 56.17 3mly s TRP 148 Cb -0.07 -1.59 -0.02 0.00 -1.15 0.00 0.00 33.47 30.64 3mly s TRP 148 CO -0.00 0.36 -0.22 0.15 0.02 0.00 0.00 176.95 177.27 3mly s LYS 149 N -1.45 1.80 -0.25 4.98 -0.14 -0.14 -1.46 119.74 123.08 3mly s LYS 149 Ca 0.17 -0.77 -0.06 0.00 -1.36 0.00 0.00 55.97 53.95 3mly s LYS 149 Cb -0.11 -1.71 -0.01 0.00 -1.68 0.00 0.00 37.83 34.31 3mly s LYS 149 CO 0.08 0.45 0.03 0.00 -0.76 0.00 0.00 175.35 175.14 3mly s ALA 150 N -0.45 3.02 0.00 5.17 0.00 0.92 -0.84 121.76 129.58 3mly s ALA 150 Ca 0.07 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 50.81 3mly s ALA 150 Cb -0.09 -1.97 0.00 0.00 0.00 0.00 0.00 23.12 21.07 3mly s ALA 150 CO -0.00 -0.57 0.00 -0.25 0.00 0.00 0.00 175.76 174.93 3mly n ASP 151 N 4.87 0.00 -0.81 0.00 8.00 0.50 -0.87 116.55 128.24 3mly n ASP 151 Ca -0.16 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.40 3mly n ASP 151 Cb 0.50 0.00 0.20 0.00 -0.02 0.00 0.00 41.12 41.80 3mly n ASP 151 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 3mly n SER 152 N 7.49 3.30 -4.67 -2.24 2.88 -1.26 -4.78 113.62 114.34 3mly n SER 152 Ca 0.00 -2.20 -0.34 0.00 -1.33 0.00 0.00 58.87 55.00 3mly n SER 152 Cb 0.00 -0.33 -0.09 0.00 -0.75 0.00 0.00 64.21 63.04 3mly n SER 152 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 3mly s SER 153 N -1.15 5.08 0.37 -3.46 0.01 -0.05 -5.06 113.70 109.44 3mly s SER 153 Ca 0.30 0.04 -0.28 0.00 1.31 0.00 0.00 55.95 57.33 3mly s SER 153 Cb 0.18 -1.36 -0.11 0.00 0.21 0.00 0.00 66.02 64.95 3mly s SER 153 CO 0.17 0.33 1.43 -2.16 0.41 0.00 0.00 173.24 173.42 3mly s PRO 154 N -1.19 4.14 -0.04 12.44 0.04 -1.26 -0.06 135.00 149.07 3mly s PRO 154 Ca 0.16 2.46 0.03 0.00 0.04 0.00 0.00 61.00 63.68 3mly s PRO 154 Cb -0.11 -2.96 -0.03 0.00 0.04 0.00 0.00 34.50 31.43 3mly s PRO 154 CO 0.06 -0.46 -0.10 0.54 0.04 0.00 0.00 177.00 177.08 3mly s VAL 155 N -1.14 3.44 -0.02 -0.36 0.11 -0.54 -4.75 120.40 117.15 3mly s VAL 155 Ca 0.52 -0.68 -0.00 0.00 -2.93 0.00 0.00 61.98 58.89 3mly s VAL 155 Cb -0.44 -2.42 -0.01 0.00 -1.53 0.00 0.00 36.38 31.98 3mly s VAL 155 CO 0.60 0.53 -0.02 -2.11 -3.33 0.00 0.00 175.10 170.76 3mly n ARG 156 N 2.03 0.04 -2.24 1.54 0.00 -1.26 -4.41 116.66 112.35 3mly n ARG 156 Ca -0.17 0.01 -0.40 0.00 -0.00 0.00 0.00 57.85 57.29 3mly n ARG 156 Cb 0.53 -0.85 -0.03 0.00 -0.00 0.00 0.00 32.46 32.11 3mly n ARG 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3mly s ALA 157 N -2.04 3.39 0.00 2.89 0.00 -1.26 -3.50 121.76 121.24 3mly s ALA 157 Ca -0.03 1.11 0.00 0.00 0.00 0.00 0.00 51.96 53.04 3mly s ALA 157 Cb 0.01 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.71 3mly s ALA 157 CO 0.04 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.70 3mly n GLY 158 N 0.86 0.73 3.72 0.00 0.00 -1.26 -4.88 105.19 104.35 3mly n GLY 158 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 3mly n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mly s VAL 159 N -2.76 5.28 -0.08 1.61 1.01 -1.23 -1.26 120.40 122.97 3mly s VAL 159 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.60 3mly s VAL 159 Cb 0.00 -3.67 0.02 0.00 0.00 0.00 0.00 36.38 32.73 3mly s VAL 159 CO 0.00 0.36 -0.07 -1.61 0.00 0.00 0.00 175.10 173.78 3mly s GLU 160 N 0.62 1.31 -0.05 2.72 0.41 -0.23 -4.99 118.70 118.49 3mly s GLU 160 Ca 0.18 -0.21 0.04 0.00 -0.41 0.00 0.00 54.97 54.57 3mly s GLU 160 Cb -0.13 -1.32 -0.00 0.00 -1.78 0.00 0.00 34.13 30.89 3mly s GLU 160 CO 0.05 -0.17 -0.18 0.99 -0.49 0.00 0.00 175.26 175.46 3mly s THR 161 N 1.36 1.50 0.70 3.63 2.01 -1.26 -0.55 115.64 123.04 3mly s THR 161 Ca -0.02 -0.75 -0.11 0.00 0.31 0.00 0.00 61.69 61.12 3mly s THR 161 Cb -0.14 -1.30 0.01 0.00 0.01 0.00 0.00 72.50 71.09 3mly s THR 161 CO -0.03 0.43 1.08 0.42 -0.69 0.00 0.00 174.62 175.83 3mly s THR 162 N 0.10 3.75 0.48 -0.82 -4.23 0.14 -5.01 115.64 110.06 3mly s THR 162 Ca -0.06 0.57 -0.21 0.00 -1.18 0.00 0.00 61.69 60.81 3mly s THR 162 Cb -0.13 -3.49 -0.07 0.00 1.34 0.00 0.00 72.50 70.15 3mly s THR 162 CO 0.03 -0.74 1.11 0.42 -0.54 0.00 0.00 174.62 174.90 3mly s THR 163 N -3.25 3.35 0.41 3.99 -4.23 -1.26 -4.63 115.64 110.02 3mly s THR 163 Ca 0.58 0.92 -0.25 0.00 -1.18 0.00 0.00 61.69 61.76 3mly s THR 163 Cb -0.12 -3.42 -0.08 0.00 1.34 0.00 0.00 72.50 70.22 3mly s THR 163 CO 0.53 -0.10 1.26 -2.16 -0.54 0.00 0.00 174.62 173.61 3mly s PRO 164 N -2.96 3.94 0.06 3.99 0.04 -1.26 -4.72 135.00 134.09 3mly s PRO 164 Ca 0.66 2.05 0.07 0.00 0.04 0.00 0.00 61.00 63.83 3mly s PRO 164 Cb -0.24 -2.69 -0.03 0.00 0.04 0.00 0.00 34.50 31.58 3mly s PRO 164 CO 0.28 -0.48 -0.20 -1.54 0.04 0.00 0.00 177.00 175.10 3mly s SER 165 N -0.89 2.43 0.03 6.66 1.04 0.27 -4.92 113.70 118.32 3mly s SER 165 Ca 0.58 -0.56 -0.30 0.00 0.48 0.00 0.00 55.95 56.15 3mly s SER 165 Cb -0.36 -0.18 -0.05 0.00 0.10 0.00 0.00 66.02 65.54 3mly s SER 165 CO 0.45 0.12 1.15 -0.75 0.98 0.00 0.00 173.24 175.20 3mly s LYS 166 N -1.37 4.44 0.75 4.02 2.20 -1.26 -0.84 119.74 127.69 3mly s LYS 166 Ca 0.07 1.68 -0.10 0.00 -0.36 0.00 0.00 55.97 57.26 3mly s LYS 166 Cb -0.09 -3.41 0.06 0.00 -1.51 0.00 0.00 37.83 32.88 3mly s LYS 166 CO 0.02 -0.25 1.10 -0.65 -0.36 0.00 0.00 175.35 175.21 3mly s GLN 167 N 1.26 2.19 0.53 4.03 -0.21 0.97 -4.92 119.66 123.52 3mly s GLN 167 Ca 0.57 0.02 0.19 0.00 0.02 0.00 0.00 55.36 56.15 3mly s GLN 167 Cb -0.27 -2.05 1.36 0.00 1.00 0.00 0.00 33.01 33.06 3mly s GLN 167 CO 0.28 -1.37 2.15 0.66 -2.12 0.00 0.00 175.29 174.89 3mly h SER 168 N -0.81 0.00 -0.33 5.90 4.64 -1.96 -1.16 113.55 119.83 3mly h SER 168 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3mly h SER 168 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 3mly h SER 168 CO 0.64 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.14 3mly n ASN 169 N -4.42 1.81 0.00 4.97 0.23 -1.26 -4.91 115.26 111.68 3mly n ASN 169 Ca -0.02 -2.01 0.00 0.00 -0.53 0.00 0.00 54.58 52.02 3mly n ASN 169 Cb 0.13 -0.23 0.00 0.00 -2.08 0.00 0.00 39.78 37.60 3mly n ASN 169 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 3mly n ASN 170 N 0.47 0.00 -3.06 0.53 5.03 -0.44 -5.00 115.26 112.79 3mly n ASN 170 Ca 0.11 0.00 -0.13 0.00 0.87 0.00 0.00 54.58 55.43 3mly n ASN 170 Cb 0.29 -0.38 0.08 0.00 -1.02 0.00 0.00 39.78 38.74 3mly n ASN 170 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3mly n LYS 171 N -2.00 -0.22 -4.37 3.52 5.02 -1.26 -4.76 118.16 114.09 3mly n LYS 171 Ca 0.00 -1.14 -0.22 0.00 -2.02 0.00 0.00 58.31 54.93 3mly n LYS 171 Cb 0.00 -0.50 -0.11 0.00 -0.02 0.00 0.00 35.03 34.40 3mly n LYS 171 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3mly s TYR 172 N -1.93 1.94 0.09 2.13 1.51 0.47 -0.02 117.35 121.54 3mly s TYR 172 Ca 0.34 -0.45 0.05 0.00 -1.01 0.00 0.00 57.07 56.00 3mly s TYR 172 Cb -0.01 -0.92 -0.03 0.00 -0.11 0.00 0.00 41.96 40.88 3mly s TYR 172 CO 0.24 0.43 -0.14 0.00 -1.11 0.00 0.00 175.55 174.97 3mly s ALA 173 N -2.32 1.26 0.20 3.71 0.00 -0.02 -1.49 121.76 123.09 3mly s ALA 173 Ca 0.21 -1.11 -0.16 0.00 0.00 0.00 0.00 51.96 50.90 3mly s ALA 173 Cb -0.05 -0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.02 3mly s ALA 173 CO 0.09 0.12 0.49 0.00 0.00 0.00 0.00 175.76 176.45 3mly s ALA 174 N -1.68 -0.73 0.06 0.00 0.00 0.51 -0.57 121.76 119.34 3mly s ALA 174 Ca 0.02 -0.39 0.01 0.00 0.00 0.00 0.00 51.96 51.60 3mly s ALA 174 Cb -0.08 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 23.88 3mly s ALA 174 CO 0.02 -0.79 -0.05 -1.54 0.00 0.00 0.00 175.76 173.40 3mly s SER 175 N -2.90 0.73 -0.03 0.00 1.04 -1.26 -0.71 113.70 110.56 3mly s SER 175 Ca 0.12 -0.77 0.01 0.00 0.48 0.00 0.00 55.95 55.79 3mly s SER 175 Cb -0.00 0.10 0.02 0.00 0.10 0.00 0.00 66.02 66.23 3mly s SER 175 CO -0.01 -0.39 -0.05 -0.55 0.98 0.00 0.00 173.24 173.22 3mly s SER 176 N -2.28 0.89 -0.11 7.02 0.15 0.02 -0.68 113.70 118.71 3mly s SER 176 Ca -0.01 -0.13 0.02 0.00 0.70 0.00 0.00 55.95 56.54 3mly s SER 176 Cb -0.02 -0.37 -0.01 0.00 -1.71 0.00 0.00 66.02 63.92 3mly s SER 176 CO -0.04 -0.02 -0.19 -0.31 1.20 0.00 0.00 173.24 173.88 3mly s TYR 177 N 0.66 2.67 -0.26 3.44 1.51 0.29 -0.53 117.35 125.12 3mly s TYR 177 Ca -0.09 -0.78 -0.01 0.00 -1.01 0.00 0.00 57.07 55.18 3mly s TYR 177 Cb -0.12 -1.75 0.04 0.00 -0.11 0.00 0.00 41.96 40.02 3mly s TYR 177 CO 0.00 -0.27 -0.06 -1.17 -1.11 0.00 0.00 175.55 172.94 3mly s LEU 178 N 0.23 3.38 -0.12 -1.29 2.96 -0.53 -1.07 118.68 122.25 3mly s LEU 178 Ca -0.12 -1.06 -0.22 0.00 -0.22 0.00 0.00 54.13 52.51 3mly s LEU 178 Cb -0.16 -1.65 -0.03 0.00 0.50 0.00 0.00 46.19 44.85 3mly s LEU 178 CO 0.06 -0.17 0.64 -0.44 -1.32 0.00 0.00 176.35 175.13 3mly s SER 179 N 1.27 6.84 0.16 3.68 0.01 -0.39 -0.74 113.70 124.53 3mly s SER 179 Ca -0.03 1.01 0.03 0.00 1.31 0.00 0.00 55.95 58.28 3mly s SER 179 Cb -0.18 -2.37 -0.05 0.00 0.21 0.00 0.00 66.02 63.63 3mly s SER 179 CO -0.04 -0.15 -0.05 -0.76 0.41 0.00 0.00 173.24 172.65 3mly s LEU 180 N 1.12 2.35 0.54 2.44 1.43 -0.06 -4.67 118.68 121.84 3mly s LEU 180 Ca 0.33 -1.09 -0.13 0.00 -1.03 0.00 0.00 54.13 52.20 3mly s LEU 180 Cb -0.17 -0.21 -0.06 0.00 0.03 0.00 0.00 46.19 45.78 3mly s LEU 180 CO 0.14 -0.45 0.98 0.42 0.23 0.00 0.00 176.35 177.67 3mly s THR 181 N -3.48 4.64 0.40 5.49 -4.23 -1.26 -2.82 115.64 114.38 3mly s THR 181 Ca 0.20 1.00 0.11 0.00 -1.18 0.00 0.00 61.69 61.82 3mly s THR 181 Cb 0.04 -3.78 0.32 0.00 1.34 0.00 0.00 72.50 70.42 3mly s THR 181 CO 0.02 -0.85 1.96 -0.65 -0.54 0.00 0.00 174.62 174.56 3mly h PRO 182 N 0.46 0.52 -0.58 3.99 0.11 -1.83 -1.81 132.00 132.86 3mly h PRO 182 Ca -0.46 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.59 3mly h PRO 182 Cb 1.19 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.15 3mly h PRO 182 CO 0.62 0.35 0.23 1.05 -0.21 0.00 0.00 178.00 180.03 3mly h GLU 183 N 0.54 0.87 -0.38 1.05 9.09 -1.98 -0.31 114.58 123.46 3mly h GLU 183 Ca 0.31 -0.16 -0.01 0.00 0.05 0.00 0.00 59.36 59.55 3mly h GLU 183 Cb 0.49 -0.14 -0.02 0.00 -1.65 0.00 0.00 28.75 27.44 3mly h GLU 183 CO -0.10 0.75 0.19 1.96 0.05 0.00 0.00 179.01 181.86 3mly h GLN 184 N 0.80 0.55 -0.53 1.06 4.20 -1.75 -0.27 115.11 119.16 3mly h GLN 184 Ca 0.19 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.85 3mly h GLN 184 Cb 0.21 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.85 3mly h GLN 184 CO -0.02 0.47 0.33 2.35 -0.67 0.00 0.00 178.83 181.29 3mly h TRP 185 N 0.49 0.62 0.00 2.96 2.91 -1.08 -2.66 115.95 119.18 3mly h TRP 185 Ca 0.13 0.02 -0.03 0.00 1.13 0.00 0.00 58.89 60.14 3mly h TRP 185 Cb 0.10 -0.20 -0.00 0.00 -0.51 0.00 0.00 29.16 28.54 3mly h TRP 185 CO -0.02 0.36 -0.15 0.87 -1.03 0.00 0.00 178.44 178.48 3mly h LYS 186 N 0.66 0.00 -0.07 2.65 1.57 -0.80 -3.29 116.57 117.28 3mly h LYS 186 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3mly h LYS 186 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 3mly h LYS 186 CO -0.08 0.15 0.00 0.43 -0.57 0.00 0.00 179.45 179.38 3mly n SER 187 N -3.19 2.97 -4.74 0.86 7.64 -0.13 -4.84 113.62 112.19 3mly n SER 187 Ca 0.02 -1.97 -0.26 0.00 1.01 0.00 0.00 58.87 57.66 3mly n SER 187 Cb 0.49 -0.03 -0.06 0.00 -1.01 0.00 0.00 64.21 63.60 3mly n SER 187 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 3mly s HIS 188 N -1.94 3.02 -0.01 1.43 3.76 -1.09 -5.02 115.29 115.44 3mly s HIS 188 Ca 0.30 -0.07 0.12 0.00 -0.15 0.00 0.00 55.06 55.26 3mly s HIS 188 Cb 0.20 -1.46 -0.01 0.00 1.11 0.00 0.00 32.58 32.43 3mly s HIS 188 CO 0.30 0.52 1.40 0.00 -0.85 0.00 0.00 174.74 176.11 3mly h ARG 189 N 2.57 0.00 -2.70 1.40 3.08 -1.88 -3.44 114.38 113.41 3mly h ARG 189 Ca -0.47 0.00 0.08 0.00 0.07 0.00 0.00 59.98 59.65 3mly h ARG 189 Cb 1.20 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 31.15 3mly h ARG 189 CO 0.61 0.71 0.34 -1.54 -1.07 0.00 0.00 179.97 179.01 3mly s SER 190 N -6.57 -0.35 0.09 7.04 1.04 -1.26 -4.42 113.70 109.26 3mly s SER 190 Ca 0.02 -0.27 0.06 0.00 0.48 0.00 0.00 55.95 56.25 3mly s SER 190 Cb 0.09 0.57 -0.03 0.00 0.10 0.00 0.00 66.02 66.74 3mly s SER 190 CO 0.77 -0.99 -0.16 -0.31 0.98 0.00 0.00 173.24 173.53 3mly s TYR 191 N -3.56 1.38 0.00 5.02 1.51 -0.59 -0.37 117.35 120.74 3mly s TYR 191 Ca 0.07 -0.46 0.04 0.00 -1.01 0.00 0.00 57.07 55.71 3mly s TYR 191 Cb -0.02 -0.76 -0.01 0.00 -0.11 0.00 0.00 41.96 41.05 3mly s TYR 191 CO -0.03 0.10 -0.13 -1.12 -1.11 0.00 0.00 175.55 173.27 3mly s SER 192 N -1.87 1.50 -0.26 2.29 0.01 -0.02 -1.64 113.70 113.72 3mly s SER 192 Ca 0.01 -0.28 -0.07 0.00 1.31 0.00 0.00 55.95 56.93 3mly s SER 192 Cb -0.09 -0.15 -0.01 0.00 0.21 0.00 0.00 66.02 65.97 3mly s SER 192 CO 0.03 0.13 0.05 0.00 0.41 0.00 0.00 173.24 173.86 3mly s GLN 194 N 1.56 3.07 -0.25 0.00 -0.21 0.48 -1.36 119.66 122.95 3mly s GLN 194 Ca 0.05 -0.82 -0.05 0.00 0.02 0.00 0.00 55.36 54.57 3mly s GLN 194 Cb -0.15 -2.98 0.00 0.00 1.00 0.00 0.00 33.01 30.88 3mly s GLN 194 CO 0.02 -0.31 -0.00 0.08 -2.12 0.00 0.00 175.29 172.96 3mly s VAL 195 N 1.39 3.52 -0.18 1.09 1.01 0.90 -0.65 120.40 127.49 3mly s VAL 195 Ca 0.03 -0.63 -0.08 0.00 0.00 0.00 0.00 61.98 61.30 3mly s VAL 195 Cb -0.15 -2.70 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 3mly s VAL 195 CO -0.04 0.27 0.09 -0.89 0.00 0.00 0.00 175.10 174.52 3mly s THR 196 N 1.47 5.01 -0.10 3.92 2.01 0.10 -0.60 115.64 127.45 3mly s THR 196 Ca 0.04 0.04 -0.04 0.00 0.31 0.00 0.00 61.69 62.04 3mly s THR 196 Cb -0.16 -3.25 0.05 0.00 0.01 0.00 0.00 72.50 69.15 3mly s THR 196 CO -0.01 0.48 0.20 -2.28 -0.69 0.00 0.00 174.62 172.31 3mly s HIS 197 N 0.19 -0.27 -1.51 4.92 5.04 -0.37 -1.60 115.29 121.69 3mly s HIS 197 Ca 0.06 0.71 -0.12 0.00 -1.54 0.00 0.00 55.06 54.17 3mly s HIS 197 Cb -0.12 -0.10 0.07 0.00 0.04 0.00 0.00 32.58 32.47 3mly s HIS 197 CO -0.00 -0.26 0.93 0.39 -2.34 0.00 0.00 174.74 173.46 3mly n GLU 198 N 4.87 -5.37 -1.01 2.88 -0.58 -1.26 -1.50 120.64 118.67 3mly n GLU 198 Ca -0.14 0.59 -0.01 0.00 -0.42 0.00 0.00 57.16 57.19 3mly n GLU 198 Cb 0.51 -5.42 -0.00 0.00 -0.57 0.00 0.00 31.44 25.95 3mly n GLU 198 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3mly n GLY 199 N -1.68 0.29 3.19 0.62 0.00 -1.26 -4.99 105.19 101.36 3mly n GLY 199 Ca -0.01 -0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 3mly n GLY 199 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3mly s SER 200 N -2.04 2.66 -0.20 1.61 0.01 -0.56 -5.12 113.70 110.06 3mly s SER 200 Ca 0.00 -0.45 -0.06 0.00 1.31 0.00 0.00 55.95 56.75 3mly s SER 200 Cb 0.00 -0.91 -0.03 0.00 0.21 0.00 0.00 66.02 65.29 3mly s SER 200 CO 0.00 0.17 0.03 -0.89 0.41 0.00 0.00 173.24 172.96 3mly s THR 201 N 0.11 4.27 -0.18 1.44 2.01 -1.26 -1.24 115.64 120.80 3mly s THR 201 Ca -0.09 -0.21 -0.06 0.00 0.31 0.00 0.00 61.69 61.64 3mly s THR 201 Cb -0.14 -2.94 -0.04 0.00 0.01 0.00 0.00 72.50 69.39 3mly s THR 201 CO 0.05 0.42 0.03 -0.69 -0.69 0.00 0.00 174.62 173.74 3mly s VAL 202 N 0.89 4.52 0.06 3.82 1.01 0.23 -4.93 120.40 126.00 3mly s VAL 202 Ca 0.02 -0.13 0.05 0.00 0.00 0.00 0.00 61.98 61.92 3mly s VAL 202 Cb -0.14 -3.03 -0.03 0.00 0.00 0.00 0.00 36.38 33.19 3mly s VAL 202 CO 0.02 0.47 -0.14 -1.83 0.00 0.00 0.00 175.10 173.62 3mly s GLU 203 N 0.41 0.82 0.13 2.72 -1.05 -1.26 -0.07 118.70 120.40 3mly s GLU 203 Ca 0.01 -0.89 0.08 0.00 -0.15 0.00 0.00 54.97 54.02 3mly s GLU 203 Cb -0.13 -0.82 -0.04 0.00 -0.44 0.00 0.00 34.13 32.71 3mly s GLU 203 CO 0.01 0.19 -0.19 0.15 0.95 0.00 0.00 175.26 176.36 3mly s LYS 204 N -1.58 1.17 0.00 -4.83 -0.14 -0.46 -4.99 119.74 108.90 3mly s LYS 204 Ca -0.02 -1.26 0.03 0.00 -1.36 0.00 0.00 55.97 53.36 3mly s LYS 204 Cb -0.09 -1.31 -0.01 0.00 -1.68 0.00 0.00 37.83 34.73 3mly s LYS 204 CO 0.02 0.29 -0.09 0.99 -0.76 0.00 0.00 175.35 175.80 3mly s THR 205 N -1.59 0.70 0.17 2.17 2.01 -1.26 -1.14 115.64 116.70 3mly s THR 205 Ca 0.10 -0.50 0.04 0.00 0.31 0.00 0.00 61.69 61.64 3mly s THR 205 Cb -0.08 -0.61 -0.05 0.00 0.01 0.00 0.00 72.50 71.77 3mly s THR 205 CO 0.05 0.11 -0.08 0.68 -0.69 0.00 0.00 174.62 174.69 3mly s VAL 206 N -0.38 1.16 0.03 3.82 -7.23 -0.65 -5.00 120.40 112.14 3mly s VAL 206 Ca 0.02 -2.06 -0.08 0.00 -1.81 0.00 0.00 61.98 58.05 3mly s VAL 206 Cb -0.04 -1.99 -0.00 0.00 0.56 0.00 0.00 36.38 34.90 3mly s VAL 206 CO -0.00 -0.63 0.16 0.00 -0.31 0.00 0.00 175.10 174.32 3mly s ALA 207 N -3.33 -0.29 0.27 1.32 0.00 -1.26 -1.54 121.76 116.92 3mly s ALA 207 Ca 0.20 -0.29 -0.30 0.00 0.00 0.00 0.00 51.96 51.57 3mly s ALA 207 Cb 0.03 0.22 -0.10 0.00 0.00 0.00 0.00 23.12 23.26 3mly s ALA 207 CO 0.03 -0.30 1.45 -2.14 0.00 0.00 0.00 175.76 174.80 3mly s PRO 208 N -2.19 4.25 -0.23 0.00 0.02 -1.26 -5.01 135.00 130.59 3mly s PRO 208 Ca -0.08 2.34 -0.11 0.00 0.02 0.00 0.00 61.00 63.17 3mly s PRO 208 Cb -0.03 -3.09 0.08 0.00 0.02 0.00 0.00 34.50 31.48 3mly s PRO 208 CO -0.02 -0.43 0.53 0.99 -0.33 0.00 0.00 177.00 177.74 3mly s THR 209 N -0.16 -0.24 0.00 0.99 2.01 -1.26 -5.11 115.64 111.87 3mly s THR 209 Ca 0.59 0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.65 3mly s THR 209 Cb -0.43 -0.80 0.00 0.00 0.01 0.00 0.00 72.50 71.29 3mly s THR 209 CO 0.46 0.03 0.00 -1.84 -0.69 0.00 0.00 174.62 172.57 3mly n GLU 210 N 4.61 0.76 0.00 4.92 0.28 -1.26 -5.10 120.64 124.85 3mly n GLU 210 Ca -0.18 0.00 0.03 0.00 -0.16 0.00 0.00 57.16 56.85 3mly n GLU 210 Cb 0.55 0.00 0.03 0.00 1.43 0.00 0.00 31.44 33.44 3mly n GLU 210 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97