#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tye s PRO 2 N 0.00 4.48 0.19 1.61 0.04 -1.26 -4.97 135.00 135.09 1tye s PRO 2 Ca 0.00 2.02 0.01 0.00 0.04 0.00 0.00 61.00 63.07 1tye s PRO 2 Cb 0.00 -3.14 -0.05 0.00 0.04 0.00 0.00 34.50 31.36 1tye s PRO 2 CO 0.00 -0.02 0.03 1.21 0.04 0.00 0.00 177.00 178.26 1tye s ASN 3 N -0.56 1.09 0.45 6.66 2.47 -1.26 -5.02 114.94 118.76 1tye s ASN 3 Ca 0.48 -1.23 0.30 0.00 0.42 0.00 0.00 52.86 52.83 1tye s ASN 3 Cb -0.36 0.15 1.63 0.00 -1.45 0.00 0.00 41.25 41.22 1tye s ASN 3 CO 0.46 -0.63 1.93 -0.29 -3.72 0.00 0.00 177.10 174.86 1tye h ILE 4 N 2.64 0.00 0.00 -5.21 2.10 -1.99 -2.01 117.51 113.03 1tye h ILE 4 Ca -0.37 -0.03 -0.17 0.00 1.08 0.00 0.00 64.86 65.38 1tye h ILE 4 Cb 1.21 0.73 -0.02 0.00 -1.09 0.00 0.00 36.82 37.65 1tye h ILE 4 CO 0.62 0.00 -0.79 0.00 -1.08 0.00 0.00 178.15 176.89 1tye h THR 6 N 0.00 0.89 -0.00 0.00 2.02 -1.44 -3.20 112.91 111.18 1tye h THR 6 Ca -0.01 -2.64 0.00 0.00 0.77 0.00 0.00 66.41 64.53 1tye h THR 6 Cb 1.58 2.56 -0.00 0.00 -1.74 0.00 0.00 68.15 70.55 1tye h THR 6 CO 0.10 0.73 0.01 0.71 0.37 0.00 0.00 175.52 177.44 1tye h THR 7 N 0.04 0.11 0.00 3.16 1.35 -1.56 -2.90 112.91 113.11 1tye h THR 7 Ca -0.31 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.55 1tye h THR 7 Cb 2.01 0.99 0.00 0.00 -1.73 0.00 0.00 68.15 69.42 1tye h THR 7 CO 0.11 0.00 0.00 -2.11 -0.25 0.00 0.00 175.52 173.27 1tye n ARG 8 N -3.24 0.43 -1.64 4.72 1.85 -1.26 -5.04 116.66 112.49 1tye n ARG 8 Ca -0.03 -0.71 -0.48 0.00 -1.00 0.00 0.00 57.85 55.63 1tye n ARG 8 Cb 0.08 -0.87 -0.05 0.00 -1.05 0.00 0.00 32.46 30.58 1tye n ARG 8 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1tye n GLY 9 N -0.15 0.88 0.62 2.89 0.00 -1.10 -4.93 105.19 103.40 1tye n GLY 9 Ca 0.00 0.67 -0.00 0.00 0.00 0.00 0.00 46.02 46.69 1tye n GLY 9 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1tye n VAL 10 N 3.08 0.08 -0.19 1.61 0.31 -1.26 -5.06 118.33 116.89 1tye n VAL 10 Ca 0.17 0.20 0.00 0.00 -0.01 0.00 0.00 64.34 64.70 1tye n VAL 10 Cb 0.25 -1.23 0.00 0.00 -0.91 0.00 0.00 33.84 31.95 1tye n VAL 10 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1tye n SER 11 N -2.58 0.00 -4.47 4.52 3.41 -1.26 -5.16 113.62 108.09 1tye n SER 11 Ca -0.00 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.33 1tye n SER 11 Cb 0.01 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.85 1tye n SER 11 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1tye s SER 12 N 0.00 3.69 0.13 4.04 0.15 -1.26 -4.91 113.70 115.53 1tye s SER 12 Ca 0.00 -0.74 -0.14 0.00 0.70 0.00 0.00 55.95 55.77 1tye s SER 12 Cb 0.00 -0.41 -0.02 0.00 -1.71 0.00 0.00 66.02 63.89 1tye s SER 12 CO 0.00 0.13 1.57 0.00 1.20 0.00 0.00 173.24 176.14 1tye h GLN 14 N 0.57 -0.15 -0.14 0.00 4.15 -1.93 -1.24 115.11 116.37 1tye h GLN 14 Ca 0.12 0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.59 1tye h GLN 14 Cb 0.49 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.21 1tye h GLN 14 CO 0.02 -0.10 0.11 1.96 -1.93 0.00 0.00 178.83 178.89 1tye h GLN 15 N -0.16 0.00 -0.09 1.69 4.20 -1.93 -0.83 115.11 117.99 1tye h GLN 15 Ca 0.11 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.68 1tye h GLN 15 Cb 0.31 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 1tye h GLN 15 CO -0.27 0.00 -0.55 0.00 -0.67 0.00 0.00 178.83 177.34 1tye h LEU 17 N 0.20 0.12 0.00 0.00 3.38 -0.82 -3.17 115.31 115.02 1tye h LEU 17 Ca 0.00 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1tye h LEU 17 Cb 1.03 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1tye h LEU 17 CO 0.09 1.06 0.00 0.00 0.09 0.00 0.00 178.44 179.68 1tye n ALA 18 N -2.40 1.85 -0.05 1.53 0.00 -0.71 -3.10 120.51 117.63 1tye n ALA 18 Ca -0.02 -0.07 -0.16 0.00 0.00 0.00 0.00 53.44 53.18 1tye n ALA 18 Cb 0.93 -1.26 -0.13 0.00 0.00 0.00 0.00 19.45 18.99 1tye n ALA 18 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1tye h VAL 19 N 0.00 1.63 -1.80 0.00 2.07 -1.51 -3.49 116.25 113.14 1tye h VAL 19 Ca 0.00 -2.37 0.05 0.00 0.82 0.00 0.00 66.70 65.20 1tye h VAL 19 Cb 0.18 3.22 -0.21 0.00 -1.52 0.00 0.00 31.29 32.96 1tye h VAL 19 CO 0.00 0.60 0.46 -0.55 0.02 0.00 0.00 177.57 178.10 1tye s SER 20 N -6.46 -0.43 0.47 0.57 0.15 -1.18 -5.03 113.70 101.79 1tye s SER 20 Ca -0.19 0.40 0.16 0.00 0.70 0.00 0.00 55.95 57.02 1tye s SER 20 Cb -0.01 0.37 1.15 0.00 -1.71 0.00 0.00 66.02 65.82 1tye s SER 20 CO 0.71 -0.46 2.02 -0.65 1.20 0.00 0.00 173.24 176.06 1tye h PRO 21 N 2.55 0.24 -0.00 5.44 0.11 -1.78 -2.43 132.00 136.12 1tye h PRO 21 Ca -0.21 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1tye h PRO 21 Cb 1.17 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1tye h PRO 21 CO 0.33 0.16 -0.03 0.00 -0.21 0.00 0.00 178.00 178.25 1tye n MET 22 N -4.46 0.50 -3.03 1.05 0.00 -1.26 -4.88 117.12 105.03 1tye n MET 22 Ca 0.07 -0.05 -0.37 0.00 0.00 0.00 0.00 57.70 57.36 1tye n MET 22 Cb 0.35 -1.50 -0.06 0.00 0.00 0.00 0.00 33.22 32.01 1tye n MET 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1tye n ALA 24 N 0.78 0.25 -2.55 0.00 0.00 -0.15 -4.78 120.51 114.05 1tye n ALA 24 Ca -0.02 -1.31 -0.17 0.00 0.00 0.00 0.00 53.44 51.93 1tye n ALA 24 Cb 0.51 0.72 -0.06 0.00 0.00 0.00 0.00 19.45 20.61 1tye n ALA 24 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1tye s TRP 25 N -2.05 1.44 -0.30 0.00 -0.11 -1.23 -3.34 118.94 113.36 1tye s TRP 25 Ca 0.00 -1.50 -0.02 0.00 1.22 0.00 0.00 56.10 55.80 1tye s TRP 25 Cb -0.00 -0.43 0.19 0.00 -1.50 0.00 0.00 33.47 31.73 1tye s TRP 25 CO 0.00 -0.99 0.77 0.00 -4.62 0.00 0.00 176.95 172.11 1tye n SER 27 N 5.35 4.12 -4.61 0.00 2.88 -0.96 -4.88 113.62 115.53 1tye n SER 27 Ca 0.03 -2.93 -0.40 0.00 -1.33 0.00 0.00 58.87 54.24 1tye n SER 27 Cb 0.54 -0.76 -0.08 0.00 -0.75 0.00 0.00 64.21 63.16 1tye n SER 27 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1tye s ASP 28 N -0.20 6.40 0.54 -3.46 2.15 -1.26 -4.96 116.67 115.88 1tye s ASP 28 Ca 0.32 0.42 0.32 0.00 0.43 0.00 0.00 52.55 54.04 1tye s ASP 28 Cb 0.26 -2.27 1.40 0.00 -0.30 0.00 0.00 42.92 42.01 1tye s ASP 28 CO 0.04 -0.31 2.00 -0.33 -0.17 0.00 0.00 175.17 176.41 1tye h GLU 29 N 8.10 0.00 0.00 4.34 3.07 -1.99 -3.16 114.58 124.94 1tye h GLU 29 Ca -0.29 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.57 1tye h GLU 29 Cb 1.14 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.05 1tye h GLU 29 CO 0.72 0.06 0.00 0.00 -1.40 0.00 0.00 179.01 178.39 1tye n ALA 30 N -2.14 1.50 -2.86 3.43 0.00 -1.26 -4.63 120.51 114.55 1tye n ALA 30 Ca -0.00 -0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 1tye n ALA 30 Cb 0.30 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.69 1tye n ALA 30 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1tye s LEU 31 N -1.64 4.22 0.22 0.00 1.43 -1.20 -5.06 118.68 116.65 1tye s LEU 31 Ca 0.00 0.30 -0.32 0.00 -1.03 0.00 0.00 54.13 53.08 1tye s LEU 31 Cb 0.00 -2.45 -0.13 0.00 0.03 0.00 0.00 46.19 43.64 1tye s LEU 31 CO 0.00 0.28 1.50 -2.65 0.23 0.00 0.00 176.35 175.71 1tye n PRO 32 N 1.13 2.18 -0.46 1.29 -0.02 -1.26 -4.80 135.00 133.06 1tye n PRO 32 Ca -0.12 0.78 -0.05 0.00 -2.02 0.00 0.00 63.50 62.08 1tye n PRO 32 Cb 0.53 -2.50 -0.07 0.00 -0.02 0.00 0.00 33.50 31.44 1tye n PRO 32 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1tye n LEU 33 N 2.68 2.63 0.00 2.45 4.77 -1.26 -1.58 117.00 126.69 1tye n LEU 33 Ca 0.13 -1.74 0.00 0.00 -0.03 0.00 0.00 56.01 54.37 1tye n LEU 33 Cb 0.31 -0.69 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 1tye n LEU 33 CO 0.63 0.59 0.00 0.61 -1.33 0.00 0.00 177.39 177.89 1tye n GLY 34 N 2.59 0.75 3.90 -0.72 0.00 -1.26 -5.15 105.19 105.31 1tye n GLY 34 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 1tye n GLY 34 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1tye s SER 35 N 0.00 5.78 -0.04 1.61 0.01 -0.61 -5.00 113.70 115.45 1tye s SER 35 Ca 0.00 0.92 -0.30 0.00 1.31 0.00 0.00 55.95 57.88 1tye s SER 35 Cb 0.00 -1.95 -0.07 0.00 0.21 0.00 0.00 66.02 64.20 1tye s SER 35 CO 0.00 -0.99 1.95 -2.84 0.41 0.00 0.00 173.24 171.78 1tye s PRO 36 N -5.03 3.94 -0.02 12.44 0.02 -1.26 -4.87 135.00 140.22 1tye s PRO 36 Ca 0.53 2.39 0.03 0.00 0.02 0.00 0.00 61.00 63.98 1tye s PRO 36 Cb -0.11 -4.17 -0.25 0.00 0.02 0.00 0.00 34.50 29.99 1tye s PRO 36 CO 0.47 -1.18 0.75 -0.09 -0.33 0.00 0.00 177.00 176.63 1tye h ARG 37 N 11.30 0.13 -4.96 5.54 9.65 -1.94 -3.44 114.38 130.66 1tye h ARG 37 Ca -0.46 -0.23 -0.67 0.00 -1.10 0.00 0.00 59.98 57.53 1tye h ARG 37 Cb 1.23 0.09 -0.31 0.00 -1.39 0.00 0.00 29.97 29.59 1tye h ARG 37 CO 0.95 0.89 -0.75 0.00 2.80 0.00 0.00 179.97 183.86 1tye n ASP 39 N 4.72 -1.37 -4.13 0.00 -0.08 -1.21 -3.61 116.55 110.86 1tye n ASP 39 Ca -0.18 -1.79 -0.29 0.00 -1.51 0.00 0.00 54.79 51.02 1tye n ASP 39 Cb 0.49 2.24 0.24 0.00 2.34 0.00 0.00 41.12 46.43 1tye n ASP 39 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1tye s LEU 40 N 0.00 0.51 -0.02 -2.67 1.43 -1.26 -0.98 118.68 115.69 1tye s LEU 40 Ca 0.15 1.04 -0.23 0.00 -1.03 0.00 0.00 54.13 54.06 1tye s LEU 40 Cb -0.02 -2.85 -0.21 0.00 0.03 0.00 0.00 46.19 43.14 1tye s LEU 40 CO 0.05 -4.20 1.14 0.50 0.23 0.00 0.00 176.35 174.07 1tye h LYS 41 N -2.63 0.22 -0.54 1.70 3.64 -1.96 -2.73 116.57 114.27 1tye h LYS 41 Ca -0.52 -0.18 -0.07 0.00 -1.27 0.00 0.00 60.65 58.61 1tye h LYS 41 Cb 1.33 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.16 1tye h LYS 41 CO 0.43 0.84 0.07 0.93 -2.27 0.00 0.00 179.45 179.46 1tye h GLU 42 N -0.34 0.87 -0.30 1.90 3.07 -1.98 -2.20 114.58 115.60 1tye h GLU 42 Ca -0.02 -0.21 -0.08 0.00 -0.50 0.00 0.00 59.36 58.55 1tye h GLU 42 Cb 0.89 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.67 1tye h GLU 42 CO 0.05 0.83 -0.15 -0.91 -1.40 0.00 0.00 179.01 177.42 1tye h ASN 43 N 0.82 0.52 1.05 1.42 2.35 -1.94 -2.31 115.58 117.49 1tye h ASN 43 Ca 0.17 -0.15 -0.08 0.00 -0.55 0.00 0.00 56.30 55.69 1tye h ASN 43 Cb 0.39 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 1tye h ASN 43 CO 0.01 0.70 -0.39 -0.07 -1.65 0.00 0.00 177.43 176.03 1tye h LEU 44 N 0.49 0.00 -0.09 1.61 3.38 -1.12 -2.56 115.31 117.02 1tye h LEU 44 Ca 0.09 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.82 1tye h LEU 44 Cb 0.55 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.31 1tye h LEU 44 CO 0.03 0.39 -0.87 -0.07 0.09 0.00 0.00 178.44 178.01 1tye h LEU 45 N 0.00 0.92 -1.18 1.67 3.38 -1.03 -2.15 115.31 116.92 1tye h LEU 45 Ca -0.00 -0.67 -0.08 0.00 0.09 0.00 0.00 57.88 57.22 1tye h LEU 45 Cb 1.01 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1tye h LEU 45 CO 0.05 1.46 -0.36 0.50 0.09 0.00 0.00 178.44 180.17 1tye h LYS 46 N 0.46 0.00 -0.24 1.13 3.64 -1.40 -2.02 116.57 118.14 1tye h LYS 46 Ca -0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1tye h LYS 46 Cb 1.51 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.33 1tye h LYS 46 CO 0.18 0.36 0.00 -3.47 -2.27 0.00 0.00 179.45 174.25 1tye n ASP 47 N -3.78 1.05 -3.23 4.20 -0.08 -0.97 -4.93 116.55 108.80 1tye n ASP 47 Ca -0.01 -2.02 -0.11 0.00 -1.51 0.00 0.00 54.79 51.14 1tye n ASP 47 Cb 0.44 -0.16 0.04 0.00 2.34 0.00 0.00 41.12 43.79 1tye n ASP 47 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1tye n ASN 48 N 0.03 -6.92 -4.79 1.67 4.13 -0.76 -4.96 115.26 103.66 1tye n ASN 48 Ca 0.06 -0.52 -0.36 0.00 1.68 0.00 0.00 54.58 55.44 1tye n ASN 48 Cb 0.18 -5.03 -0.08 0.00 -1.54 0.00 0.00 39.78 33.31 1tye n ASN 48 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1tye s ALA 50 N -0.96 3.37 -1.79 0.00 0.00 -1.26 -4.85 121.76 116.28 1tye s ALA 50 Ca 0.14 0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.37 1tye s ALA 50 Cb -0.12 -3.78 0.00 0.00 0.00 0.00 0.00 23.12 19.22 1tye s ALA 50 CO 0.03 -1.76 0.00 -2.30 0.00 0.00 0.00 175.76 171.73 1tye n PRO 51 N 7.35 0.00 -0.11 0.00 -0.02 -1.26 -1.62 135.00 139.33 1tye n PRO 51 Ca 0.16 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.49 1tye n PRO 51 Cb 0.46 -1.00 -0.13 0.00 -0.02 0.00 0.00 33.50 32.81 1tye n PRO 51 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1tye n GLU 52 N -0.45 0.70 -0.06 -0.52 -0.58 -1.26 -4.43 120.64 114.04 1tye n GLU 52 Ca 0.00 0.09 0.12 0.00 -0.42 0.00 0.00 57.16 56.95 1tye n GLU 52 Cb 0.00 -1.49 0.35 0.00 -0.57 0.00 0.00 31.44 29.74 1tye n GLU 52 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1tye n SER 53 N -3.05 2.10 -4.74 1.62 3.41 -0.64 -4.92 113.62 107.40 1tye n SER 53 Ca -0.39 -1.73 -0.41 0.00 -0.26 0.00 0.00 58.87 56.08 1tye n SER 53 Cb 1.01 -0.08 -0.05 0.00 -0.26 0.00 0.00 64.21 64.84 1tye n SER 53 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1tye s ILE 54 N -1.84 4.04 -0.46 -1.33 1.01 -1.22 -2.25 121.20 119.15 1tye s ILE 54 Ca 0.34 1.82 0.03 0.00 0.00 0.00 0.00 60.65 62.85 1tye s ILE 54 Cb 0.20 -4.16 0.13 0.00 0.01 0.00 0.00 42.46 38.63 1tye s ILE 54 CO 0.30 0.34 0.21 -1.61 0.00 0.00 0.00 174.94 174.18 1tye s GLU 55 N -0.54 1.62 -0.62 2.79 0.41 -1.23 -4.99 118.70 116.13 1tye s GLU 55 Ca 0.47 -2.24 0.05 0.00 -0.41 0.00 0.00 54.97 52.84 1tye s GLU 55 Cb -0.27 -2.93 0.18 0.00 -1.78 0.00 0.00 34.13 29.32 1tye s GLU 55 CO 0.34 -1.09 0.47 0.34 -0.49 0.00 0.00 175.26 174.83 1tye n PHE 56 N 3.51 2.14 -1.31 1.61 7.35 -1.26 -3.49 117.46 126.02 1tye n PHE 56 Ca 0.05 -4.03 -0.34 0.00 -0.76 0.00 0.00 57.45 52.37 1tye n PHE 56 Cb 0.35 -0.39 0.11 0.00 0.35 0.00 0.00 39.48 39.89 1tye n PHE 56 CO 0.00 0.00 0.00 -2.14 -0.76 0.00 0.00 176.76 173.86 1tye s PRO 57 N -1.14 1.94 0.01 -7.13 0.02 -1.26 -5.06 135.00 122.38 1tye s PRO 57 Ca 0.28 1.77 0.01 0.00 0.02 0.00 0.00 61.00 63.08 1tye s PRO 57 Cb -0.00 -1.81 -0.01 0.00 0.02 0.00 0.00 34.50 32.70 1tye s PRO 57 CO -0.17 -1.99 -0.03 0.14 -0.33 0.00 0.00 177.00 174.62 1tye s VAL 58 N -2.03 0.17 0.12 3.83 -7.23 -1.26 -4.98 120.40 109.03 1tye s VAL 58 Ca 0.74 -0.54 -0.29 0.00 -1.81 0.00 0.00 61.98 60.09 1tye s VAL 58 Cb -0.29 -0.24 -0.06 0.00 0.56 0.00 0.00 36.38 36.34 1tye s VAL 58 CO 0.47 -0.23 0.90 -0.44 -0.31 0.00 0.00 175.10 175.50 1tye s SER 59 N -0.81 7.46 0.02 4.85 0.01 -1.26 -4.85 113.70 119.13 1tye s SER 59 Ca -0.07 1.74 0.00 0.00 1.31 0.00 0.00 55.95 58.93 1tye s SER 59 Cb -0.06 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.61 1tye s SER 59 CO -0.00 0.01 0.00 -1.84 0.41 0.00 0.00 173.24 171.82 1tye n GLU 60 N 2.47 0.00 -2.65 12.44 0.28 -1.15 -4.98 120.64 127.06 1tye n GLU 60 Ca -0.00 0.00 -0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1tye n GLU 60 Cb 0.49 -0.30 -0.00 0.00 1.43 0.00 0.00 31.44 33.06 1tye n GLU 60 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1tye n ALA 61 N -2.88 -3.48 -2.54 -1.84 0.00 -1.24 -4.93 120.51 103.60 1tye n ALA 61 Ca 0.00 0.51 -0.32 0.00 0.00 0.00 0.00 53.44 53.62 1tye n ALA 61 Cb 0.26 -1.02 -0.05 0.00 0.00 0.00 0.00 19.45 18.64 1tye n ALA 61 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1tye s ARG 62 N -1.53 3.73 -0.46 0.00 0.52 0.05 -4.87 118.95 116.40 1tye s ARG 62 Ca -0.01 0.13 -0.27 0.00 -0.52 0.00 0.00 55.73 55.07 1tye s ARG 62 Cb 0.00 -2.80 0.03 0.00 0.52 0.00 0.00 34.95 32.69 1tye s ARG 62 CO 0.74 0.43 1.00 0.08 0.02 0.00 0.00 175.30 177.57 1tye s VAL 63 N -1.66 4.39 0.00 3.52 1.01 -1.26 -1.22 120.40 125.18 1tye s VAL 63 Ca 0.42 0.94 0.00 0.00 0.00 0.00 0.00 61.98 63.34 1tye s VAL 63 Cb -0.12 -4.49 0.00 0.00 0.00 0.00 0.00 36.38 31.77 1tye s VAL 63 CO 0.22 -0.88 0.06 0.18 0.00 0.00 0.00 175.10 174.68 1tye n LEU 64 N 7.38 2.16 -4.56 3.92 4.32 -0.73 -4.92 117.00 124.57 1tye n LEU 64 Ca 0.08 0.15 -0.34 0.00 -0.02 0.00 0.00 56.01 55.88 1tye n LEU 64 Cb 0.49 -0.10 -0.11 0.00 -1.62 0.00 0.00 43.42 42.08 1tye n LEU 64 CO 0.66 -0.10 -0.34 -1.83 -1.22 0.00 0.00 177.39 174.57 1tye s GLU 65 N -0.32 3.39 -0.47 3.23 -1.05 -1.15 -5.04 118.70 117.28 1tye s GLU 65 Ca 0.00 -0.49 0.05 0.00 -0.15 0.00 0.00 54.97 54.38 1tye s GLU 65 Cb 0.00 -2.85 0.24 0.00 -0.44 0.00 0.00 34.13 31.08 1tye s GLU 65 CO 0.00 0.42 0.92 -0.40 0.95 0.00 0.00 175.26 177.14 1tye n ASP 66 N 3.01 -2.76 -4.73 0.83 5.75 -1.26 -2.25 116.55 115.14 1tye n ASP 66 Ca -0.18 -3.08 -0.41 0.00 -0.01 0.00 0.00 54.79 51.11 1tye n ASP 66 Cb 0.53 1.70 -0.04 0.00 -1.03 0.00 0.00 41.12 42.28 1tye n ASP 66 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1tye s ARG 67 N 0.65 4.55 1.05 0.11 3.03 -1.26 -4.81 118.95 122.27 1tye s ARG 67 Ca 0.31 1.75 -0.20 0.00 2.03 0.00 0.00 55.73 59.62 1tye s ARG 67 Cb 0.21 -3.29 -0.00 0.00 -1.03 0.00 0.00 34.95 30.84 1tye s ARG 67 CO -0.21 -0.01 -0.36 -2.30 -1.13 0.00 0.00 175.30 171.29 1tye n PRO 68 N 2.66 -0.85 -2.75 3.89 -0.02 -1.26 -4.85 135.00 131.81 1tye n PRO 68 Ca 0.04 -0.23 -0.42 0.00 -2.02 0.00 0.00 63.50 60.87 1tye n PRO 68 Cb 0.46 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.40 1tye n PRO 68 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1tye s LEU 69 N 1.73 4.40 1.26 2.45 1.43 -1.26 -4.76 118.68 123.93 1tye s LEU 69 Ca 0.50 1.64 -0.20 0.00 -1.03 0.00 0.00 54.13 55.04 1tye s LEU 69 Cb -0.09 -3.52 0.31 0.00 0.03 0.00 0.00 46.19 42.92 1tye s LEU 69 CO 0.68 -0.20 1.05 -0.44 0.23 0.00 0.00 176.35 177.67 1tye s SER 70 N 0.74 0.35 -0.02 2.29 0.01 -0.98 -5.03 113.70 111.04 1tye s SER 70 Ca 0.49 0.77 0.14 0.00 1.31 0.00 0.00 55.95 58.66 1tye s SER 70 Cb -0.21 -1.09 0.25 0.00 0.21 0.00 0.00 66.02 65.18 1tye s SER 70 CO 0.27 -4.49 1.11 0.47 0.41 0.00 0.00 173.24 171.01 1tye n ASP 71 N -5.03 0.75 -3.27 2.44 8.00 -1.26 -4.98 116.55 113.20 1tye n ASP 71 Ca 0.12 -2.21 -0.05 0.00 0.71 0.00 0.00 54.79 53.35 1tye n ASP 71 Cb 0.59 -0.29 0.02 0.00 -0.02 0.00 0.00 41.12 41.42 1tye n ASP 71 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 1tye s LYS 72 N -0.43 1.62 0.00 -1.24 -2.85 -1.26 -5.06 119.74 110.52 1tye s LYS 72 Ca 0.21 -1.03 0.00 0.00 -1.00 0.00 0.00 55.97 54.15 1tye s LYS 72 Cb 0.23 0.46 0.00 0.00 -2.06 0.00 0.00 37.83 36.46 1tye s LYS 72 CO -0.08 -0.76 0.00 0.41 0.10 0.00 0.00 175.35 175.02 1tye n GLY 73 N -0.62 0.11 3.69 0.59 0.00 -1.26 -4.96 105.19 102.74 1tye n GLY 73 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 1tye n GLY 73 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1tye s SER 74 N 0.00 7.09 0.00 1.61 0.01 -1.26 -3.93 113.70 117.21 1tye s SER 74 Ca 0.00 1.78 0.00 0.00 1.31 0.00 0.00 55.95 59.04 1tye s SER 74 Cb 0.00 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.67 1tye s SER 74 CO 0.00 -0.55 0.00 0.61 0.41 0.00 0.00 173.24 173.71 1tye n GLY 75 N 3.31 2.62 3.22 3.44 0.00 -1.26 -4.97 105.19 111.55 1tye n GLY 75 Ca 0.10 -0.63 0.04 0.00 0.00 0.00 0.00 46.02 45.53 1tye n GLY 75 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1tye s ASP 76 N 0.00 -0.65 -1.07 1.61 -1.08 -1.25 -5.08 116.67 109.15 1tye s ASP 76 Ca 0.00 0.54 -0.12 0.00 -0.52 0.00 0.00 52.55 52.45 1tye s ASP 76 Cb 0.00 1.60 0.23 0.00 -1.46 0.00 0.00 42.92 43.29 1tye s ASP 76 CO 0.00 -0.12 1.12 -0.94 0.52 0.00 0.00 175.17 175.75 1tye s SER 77 N 2.79 7.11 0.02 -0.34 1.04 -1.26 -4.90 113.70 118.16 1tye s SER 77 Ca 0.02 -3.17 -0.09 0.00 0.48 0.00 0.00 55.95 53.20 1tye s SER 77 Cb -0.10 -2.27 -0.05 0.00 0.10 0.00 0.00 66.02 63.71 1tye s SER 77 CO -0.15 -0.51 1.13 0.77 0.98 0.00 0.00 173.24 175.47 1tye h SER 78 N 7.16 -0.28 -0.99 7.02 4.64 -1.98 -3.45 113.55 125.67 1tye h SER 78 Ca 0.19 0.01 0.16 0.00 -0.47 0.00 0.00 61.79 61.69 1tye h SER 78 Cb 0.92 0.08 -0.22 0.00 -0.31 0.00 0.00 62.40 62.87 1tye h SER 78 CO 1.02 -0.18 0.06 0.00 -0.87 0.00 0.00 176.83 176.87 1tye s GLN 79 N -3.68 0.36 0.26 4.77 -2.07 -1.26 -5.18 119.66 112.86 1tye s GLN 79 Ca -0.04 0.79 0.08 0.00 -1.82 0.00 0.00 55.36 54.37 1tye s GLN 79 Cb 0.01 0.46 -0.04 0.00 -1.09 0.00 0.00 33.01 32.35 1tye s GLN 79 CO 0.14 -0.23 0.11 0.54 -1.32 0.00 0.00 175.29 174.52 1tye s VAL 80 N 2.70 3.97 -0.23 3.63 0.11 -1.26 -5.12 120.40 124.20 1tye s VAL 80 Ca 0.02 -1.64 -0.03 0.00 -2.93 0.00 0.00 61.98 57.40 1tye s VAL 80 Cb -0.09 -3.15 0.01 0.00 -1.53 0.00 0.00 36.38 31.62 1tye s VAL 80 CO -0.17 -0.36 -0.06 0.42 -3.33 0.00 0.00 175.10 171.60 1tye s THR 81 N -2.23 3.05 -0.09 5.04 -4.23 -1.26 -4.94 115.64 110.98 1tye s THR 81 Ca 0.32 -0.76 0.04 0.00 -1.18 0.00 0.00 61.69 60.11 1tye s THR 81 Cb -0.07 -2.45 0.07 0.00 1.34 0.00 0.00 72.50 71.39 1tye s THR 81 CO 0.23 0.33 1.05 0.00 -0.54 0.00 0.00 174.62 175.69 1tye n GLN 82 N 4.73 2.73 -4.33 3.99 10.64 -1.26 -2.32 117.38 131.56 1tye n GLN 82 Ca -0.18 -1.72 -0.21 0.00 -1.83 0.00 0.00 57.00 53.06 1tye n GLN 82 Cb 0.49 -1.11 -0.11 0.00 -0.86 0.00 0.00 30.24 28.65 1tye n GLN 82 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 1tye s VAL 83 N -1.32 1.76 0.12 -0.39 1.01 -1.26 -0.97 120.40 119.36 1tye s VAL 83 Ca 0.07 -1.95 0.05 0.00 0.00 0.00 0.00 61.98 60.15 1tye s VAL 83 Cb 0.06 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 1tye s VAL 83 CO 0.02 -0.38 0.05 -0.44 0.00 0.00 0.00 175.10 174.35 1tye s SER 84 N -2.76 5.21 -0.87 3.32 0.01 -0.36 -4.63 113.70 113.62 1tye s SER 84 Ca 0.16 -0.17 -0.04 0.00 1.31 0.00 0.00 55.95 57.22 1tye s SER 84 Cb -0.05 -1.29 0.00 0.00 0.21 0.00 0.00 66.02 64.90 1tye s SER 84 CO 0.06 0.13 0.61 -2.65 0.41 0.00 0.00 173.24 171.81 1tye n PRO 85 N 0.20 -1.41 0.31 12.44 -0.02 -1.26 -4.57 135.00 140.68 1tye n PRO 85 Ca -0.09 0.68 0.21 0.00 -2.02 0.00 0.00 63.50 62.27 1tye n PRO 85 Cb 0.53 -2.28 1.09 0.00 -0.02 0.00 0.00 33.50 32.82 1tye n PRO 85 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1tye h GLN 86 N -0.53 0.00 -2.37 -0.52 7.50 -1.71 -3.38 115.11 114.10 1tye h GLN 86 Ca -0.65 0.00 -0.05 0.00 0.50 0.00 0.00 58.65 58.45 1tye h GLN 86 Cb 1.41 0.00 -0.25 0.00 0.05 0.00 0.00 27.48 28.69 1tye h GLN 86 CO 0.38 0.00 -0.24 0.50 -1.50 0.00 0.00 178.83 177.98 1tye s ARG 87 N -4.02 0.46 0.01 1.46 3.52 -1.22 -0.48 118.95 118.67 1tye s ARG 87 Ca -0.04 1.08 0.03 0.00 -0.13 0.00 0.00 55.73 56.67 1tye s ARG 87 Cb 0.12 0.30 -0.01 0.00 -1.56 0.00 0.00 34.95 33.79 1tye s ARG 87 CO 0.39 -0.20 -0.09 0.96 -0.81 0.00 0.00 175.30 175.55 1tye s ILE 88 N 2.16 0.72 -0.36 4.11 -4.36 -0.82 -1.77 121.20 120.87 1tye s ILE 88 Ca -0.06 -0.62 -0.14 0.00 -0.26 0.00 0.00 60.65 59.58 1tye s ILE 88 Cb -0.10 -0.65 -0.01 0.00 1.25 0.00 0.00 42.46 42.96 1tye s ILE 88 CO -0.15 0.04 0.27 0.00 0.24 0.00 0.00 174.94 175.34 1tye s ALA 89 N -0.54 3.50 -0.37 2.27 0.00 -0.35 -1.00 121.76 125.25 1tye s ALA 89 Ca 0.00 -1.45 -0.13 0.00 0.00 0.00 0.00 51.96 50.39 1tye s ALA 89 Cb -0.05 -2.74 0.01 0.00 0.00 0.00 0.00 23.12 20.33 1tye s ALA 89 CO 0.00 -1.11 0.24 -1.17 0.00 0.00 0.00 175.76 173.72 1tye s LEU 90 N 1.75 4.73 -0.19 0.00 2.96 0.14 -0.77 118.68 127.29 1tye s LEU 90 Ca 0.06 -0.78 -0.00 0.00 -0.22 0.00 0.00 54.13 53.19 1tye s LEU 90 Cb -0.18 -2.09 0.01 0.00 0.50 0.00 0.00 46.19 44.43 1tye s LEU 90 CO 0.11 -0.35 -0.15 -0.60 -1.32 0.00 0.00 176.35 174.03 1tye s ARG 91 N 1.64 3.12 0.02 1.98 3.52 -1.26 -0.43 118.95 127.53 1tye s ARG 91 Ca 0.04 -0.77 0.00 0.00 -0.13 0.00 0.00 55.73 54.88 1tye s ARG 91 Cb -0.18 -2.70 -0.01 0.00 -1.56 0.00 0.00 34.95 30.49 1tye s ARG 91 CO 0.09 -0.19 -0.03 -0.48 -0.81 0.00 0.00 175.30 173.88 1tye s LEU 92 N 1.32 2.16 0.73 -0.88 0.05 -0.65 -2.92 118.68 118.49 1tye s LEU 92 Ca 0.05 -0.34 -0.11 0.00 0.05 0.00 0.00 54.13 53.77 1tye s LEU 92 Cb -0.14 0.03 0.03 0.00 -2.05 0.00 0.00 46.19 44.06 1tye s LEU 92 CO -0.09 -0.19 1.09 0.00 -0.55 0.00 0.00 176.35 176.61 1tye s ARG 93 N -0.99 2.64 0.13 1.48 1.70 -1.26 -2.31 118.95 120.33 1tye s ARG 93 Ca -0.10 0.58 -0.35 0.00 -0.47 0.00 0.00 55.73 55.39 1tye s ARG 93 Cb -0.07 -1.99 -0.16 0.00 -0.57 0.00 0.00 34.95 32.17 1tye s ARG 93 CO -0.01 -1.22 1.32 -0.35 -1.08 0.00 0.00 175.30 173.97 1tye n PRO 94 N -3.15 1.32 -0.79 3.89 -0.04 -1.26 -1.92 135.00 133.05 1tye n PRO 94 Ca 0.07 0.47 0.00 0.00 -0.04 0.00 0.00 63.50 64.00 1tye n PRO 94 Cb 0.56 -2.09 0.00 0.00 -0.04 0.00 0.00 33.50 31.93 1tye n PRO 94 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1tye n ASP 95 N 2.47 -2.86 -4.76 3.54 9.92 -1.20 -4.37 116.55 119.29 1tye n ASP 95 Ca 0.17 0.00 -0.27 0.00 -0.53 0.00 0.00 54.79 54.15 1tye n ASP 95 Cb 0.22 -2.67 0.10 0.00 -0.64 0.00 0.00 41.12 38.14 1tye n ASP 95 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1tye s ASP 96 N -2.06 4.36 -0.05 -2.24 2.15 -0.81 -4.72 116.67 113.31 1tye s ASP 96 Ca 0.00 0.48 -0.02 0.00 0.43 0.00 0.00 52.55 53.44 1tye s ASP 96 Cb 0.00 -0.95 0.04 0.00 -0.30 0.00 0.00 42.92 41.71 1tye s ASP 96 CO 0.00 -1.93 0.10 -0.44 -0.17 0.00 0.00 175.17 172.73 1tye s SER 97 N -4.62 0.48 -0.04 -0.34 0.01 -1.26 -3.08 113.70 104.85 1tye s SER 97 Ca 0.64 0.19 0.06 0.00 1.31 0.00 0.00 55.95 58.15 1tye s SER 97 Cb -0.09 0.06 -0.02 0.00 0.21 0.00 0.00 66.02 66.18 1tye s SER 97 CO 0.48 -0.19 -0.22 -0.75 0.41 0.00 0.00 173.24 172.96 1tye s LYS 98 N 1.69 2.32 -0.04 12.44 2.47 -1.01 -4.95 119.74 132.65 1tye s LYS 98 Ca -0.02 -0.86 0.03 0.00 -1.56 0.00 0.00 55.97 53.56 1tye s LYS 98 Cb -0.12 -2.17 -0.03 0.00 -1.46 0.00 0.00 37.83 34.05 1tye s LYS 98 CO -0.04 0.54 -0.13 0.54 0.16 0.00 0.00 175.35 176.42 1tye s ASN 99 N -0.55 4.17 0.41 1.43 4.22 -1.26 -1.55 114.94 121.81 1tye s ASN 99 Ca 0.08 -0.17 0.04 0.00 -2.14 0.00 0.00 52.86 50.67 1tye s ASN 99 Cb -0.11 -0.91 -0.02 0.00 1.28 0.00 0.00 41.25 41.49 1tye s ASN 99 CO 0.00 0.34 0.15 0.72 -2.04 0.00 0.00 177.10 176.27 1tye s PHE 100 N -0.77 1.78 0.23 1.54 -0.12 0.52 -4.99 117.98 116.16 1tye s PHE 100 Ca 0.12 -1.34 0.10 0.00 -0.05 0.00 0.00 56.93 55.76 1tye s PHE 100 Cb -0.11 -1.11 -0.05 0.00 -0.63 0.00 0.00 43.02 41.12 1tye s PHE 100 CO 0.01 -0.37 -0.18 -1.12 -0.05 0.00 0.00 175.22 173.52 1tye s SER 101 N -3.59 3.08 -0.22 1.98 0.01 -1.26 -1.33 113.70 112.36 1tye s SER 101 Ca 0.25 -1.00 -0.24 0.00 1.31 0.00 0.00 55.95 56.27 1tye s SER 101 Cb 0.02 -0.22 0.06 0.00 0.21 0.00 0.00 66.02 66.10 1tye s SER 101 CO 0.16 -0.05 0.66 -0.51 0.41 0.00 0.00 173.24 173.91 1tye s ILE 102 N -2.59 0.00 -0.07 1.44 2.07 -1.08 -4.82 121.20 116.15 1tye s ILE 102 Ca 0.25 -0.01 -0.07 0.00 -1.41 0.00 0.00 60.65 59.41 1tye s ILE 102 Cb -0.04 -0.92 0.02 0.00 0.13 0.00 0.00 42.46 41.65 1tye s ILE 102 CO 0.11 -0.01 0.20 0.00 -1.91 0.00 0.00 174.94 173.33 1tye s GLN 103 N 0.15 0.24 0.27 3.50 -2.07 -1.26 -0.62 119.66 119.86 1tye s GLN 103 Ca -0.01 0.26 0.11 0.00 -1.82 0.00 0.00 55.36 53.90 1tye s GLN 103 Cb -0.04 0.11 -0.05 0.00 -1.09 0.00 0.00 33.01 31.95 1tye s GLN 103 CO 0.02 -0.03 -0.17 0.14 -1.32 0.00 0.00 175.29 173.93 1tye s VAL 104 N 0.07 2.65 -0.01 3.63 -7.23 0.81 -1.23 120.40 119.09 1tye s VAL 104 Ca -0.00 -2.29 -0.01 0.00 -1.81 0.00 0.00 61.98 57.87 1tye s VAL 104 Cb -0.01 -2.39 0.01 0.00 0.56 0.00 0.00 36.38 34.55 1tye s VAL 104 CO 0.00 -0.37 0.02 -0.60 -0.31 0.00 0.00 175.10 173.84 1tye s ARG 105 N -3.47 0.01 -0.68 4.82 3.52 -0.14 -0.40 118.95 122.61 1tye s ARG 105 Ca 0.30 0.07 -0.26 0.00 -0.13 0.00 0.00 55.73 55.70 1tye s ARG 105 Cb -0.05 -0.04 0.04 0.00 -1.56 0.00 0.00 34.95 33.33 1tye s ARG 105 CO 0.16 -0.04 1.18 -1.14 -0.81 0.00 0.00 175.30 174.65 1tye s GLN 106 N 0.25 3.24 -0.17 5.12 2.00 -1.02 -4.70 119.66 124.38 1tye s GLN 106 Ca -0.02 -0.26 0.11 0.00 -2.00 0.00 0.00 55.36 53.18 1tye s GLN 106 Cb -0.03 -4.15 -0.18 0.00 0.80 0.00 0.00 33.01 29.45 1tye s GLN 106 CO -0.01 -1.96 -0.01 1.55 -0.50 0.00 0.00 175.29 174.36 1tye n VAL 107 N 6.34 1.12 -1.91 1.34 3.14 -1.26 0.14 118.33 127.23 1tye n VAL 107 Ca 0.03 -0.61 -0.34 0.00 -2.96 0.00 0.00 64.34 60.45 1tye n VAL 107 Cb 0.48 -0.76 0.04 0.00 -1.06 0.00 0.00 33.84 32.54 1tye n VAL 107 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 1tye s GLU 108 N -2.39 2.93 0.33 1.45 0.41 -1.26 -4.83 118.70 115.34 1tye s GLU 108 Ca -0.14 1.54 -0.26 0.00 -0.41 0.00 0.00 54.97 55.71 1tye s GLU 108 Cb 0.05 -1.95 -0.10 0.00 -1.78 0.00 0.00 34.13 30.35 1tye s GLU 108 CO 0.60 -1.18 0.98 -0.51 -0.49 0.00 0.00 175.26 174.66 1tye s ASP 109 N -2.16 7.23 0.21 -0.19 1.01 -1.26 -4.99 116.67 116.51 1tye s ASP 109 Ca 0.71 1.92 -0.30 0.00 0.71 0.00 0.00 52.55 55.58 1tye s ASP 109 Cb -0.23 -2.59 -0.10 0.00 1.01 0.00 0.00 42.92 41.01 1tye s ASP 109 CO 0.36 -0.15 1.44 -0.31 0.21 0.00 0.00 175.17 176.73 1tye s TYR 110 N -1.57 3.08 0.15 4.23 2.02 -1.26 -4.83 117.35 119.18 1tye s TYR 110 Ca 0.51 0.96 -0.31 0.00 -0.37 0.00 0.00 57.07 57.86 1tye s TYR 110 Cb -0.21 -3.80 -0.09 0.00 -0.40 0.00 0.00 41.96 37.47 1tye s TYR 110 CO 0.26 -2.69 1.42 -2.14 -1.57 0.00 0.00 175.55 170.83 1tye s PRO 111 N 0.15 4.30 -0.03 -1.71 0.02 -1.26 -4.74 135.00 131.74 1tye s PRO 111 Ca 0.62 2.15 0.03 0.00 0.02 0.00 0.00 61.00 63.82 1tye s PRO 111 Cb -0.41 -3.21 -0.00 0.00 0.02 0.00 0.00 34.50 30.90 1tye s PRO 111 CO 0.38 -0.44 -0.12 0.08 -0.33 0.00 0.00 177.00 176.58 1tye s VAL 112 N 0.88 0.97 -0.13 3.83 1.01 -1.07 -1.54 120.40 124.34 1tye s VAL 112 Ca 0.64 -0.47 0.02 0.00 0.00 0.00 0.00 61.98 62.17 1tye s VAL 112 Cb -0.39 -0.85 0.01 0.00 0.00 0.00 0.00 36.38 35.15 1tye s VAL 112 CO 0.33 0.29 -0.21 -1.81 0.00 0.00 0.00 175.10 173.70 1tye s ASP 113 N 0.09 3.02 -0.10 3.32 1.11 0.62 -2.50 116.67 122.23 1tye s ASP 113 Ca -0.02 -0.58 0.04 0.00 0.18 0.00 0.00 52.55 52.17 1tye s ASP 113 Cb -0.09 -1.40 -0.00 0.00 1.07 0.00 0.00 42.92 42.51 1tye s ASP 113 CO 0.01 0.07 -0.24 -0.63 1.18 0.00 0.00 175.17 175.56 1tye s ILE 114 N 0.83 2.09 -0.19 0.77 1.01 -1.07 0.46 121.20 125.09 1tye s ILE 114 Ca -0.07 -1.01 0.01 0.00 0.00 0.00 0.00 60.65 59.58 1tye s ILE 114 Cb -0.15 -1.79 0.03 0.00 0.01 0.00 0.00 42.46 40.56 1tye s ILE 114 CO -0.02 0.56 -0.15 -0.47 0.00 0.00 0.00 174.94 174.86 1tye s TYR 115 N 0.33 2.67 0.05 3.97 5.04 -0.53 -1.83 117.35 127.05 1tye s TYR 115 Ca -0.19 -1.68 -0.24 0.00 -2.44 0.00 0.00 57.07 52.52 1tye s TYR 115 Cb -0.18 -1.80 -0.06 0.00 0.35 0.00 0.00 41.96 40.28 1tye s TYR 115 CO 0.09 -0.78 0.72 -0.47 -1.34 0.00 0.00 175.55 173.77 1tye s TYR 116 N 1.32 3.74 -0.30 4.97 5.04 -0.17 -1.94 117.35 130.01 1tye s TYR 116 Ca 0.01 1.42 0.03 0.00 -2.44 0.00 0.00 57.07 56.09 1tye s TYR 116 Cb -0.15 -2.76 0.08 0.00 0.35 0.00 0.00 41.96 39.48 1tye s TYR 116 CO -0.10 0.32 -0.03 -1.17 -1.34 0.00 0.00 175.55 173.23 1tye s LEU 117 N -0.21 4.03 -0.21 6.97 2.96 -0.20 -0.49 118.68 131.52 1tye s LEU 117 Ca 0.36 -1.76 -0.19 0.00 -0.22 0.00 0.00 54.13 52.33 1tye s LEU 117 Cb -0.20 -1.57 -0.03 0.00 0.50 0.00 0.00 46.19 44.89 1tye s LEU 117 CO 0.22 -0.28 0.54 -0.04 -1.32 0.00 0.00 176.35 175.46 1tye s MET 118 N 1.02 4.17 -0.38 1.98 -1.94 0.50 -2.20 119.30 122.45 1tye s MET 118 Ca 0.01 0.43 -0.28 0.00 -1.71 0.00 0.00 55.69 54.14 1tye s MET 118 Cb -0.19 -3.59 0.02 0.00 2.01 0.00 0.00 34.83 33.08 1tye s MET 118 CO -0.07 -0.21 1.05 0.34 -0.01 0.00 0.00 175.02 176.12 1tye s ASP 119 N 1.25 6.78 -0.32 3.03 -1.08 -1.24 -0.95 116.67 124.14 1tye s ASP 119 Ca 0.24 0.76 0.08 0.00 -0.52 0.00 0.00 52.55 53.10 1tye s ASP 119 Cb -0.15 -2.52 0.50 0.00 -1.46 0.00 0.00 42.92 39.28 1tye s ASP 119 CO 0.09 -0.97 1.47 0.18 0.52 0.00 0.00 175.17 176.46 1tye n LEU 120 N 7.10 4.49 -4.90 -1.34 4.32 -0.38 -4.86 117.00 121.43 1tye n LEU 120 Ca 0.11 -3.97 -0.29 0.00 -0.02 0.00 0.00 56.01 51.84 1tye n LEU 120 Cb 0.48 -0.62 0.08 0.00 -1.62 0.00 0.00 43.42 41.73 1tye n LEU 120 CO 0.62 1.41 0.76 -0.94 -1.22 0.00 0.00 177.39 178.02 1tye s SER 121 N -2.65 4.72 0.33 -1.43 1.04 -1.26 -0.72 113.70 113.73 1tye s SER 121 Ca 0.47 0.81 0.03 0.00 0.48 0.00 0.00 55.95 57.73 1tye s SER 121 Cb 0.42 -1.38 0.63 0.00 0.10 0.00 0.00 66.02 65.79 1tye s SER 121 CO -0.00 -1.76 1.95 0.22 0.98 0.00 0.00 173.24 174.63 1tye h TYR 122 N -0.92 0.89 0.00 5.02 3.20 -1.48 -1.12 116.97 122.56 1tye h TYR 122 Ca -0.46 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.44 1tye h TYR 122 Cb 1.31 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 39.29 1tye h TYR 122 CO 0.35 0.49 0.00 -1.13 -1.64 0.00 0.00 178.16 176.23 1tye n SER 123 N -4.47 0.47 0.01 -2.11 3.41 -1.26 -1.09 113.62 108.58 1tye n SER 123 Ca 0.11 0.66 0.13 0.00 -0.26 0.00 0.00 58.87 59.52 1tye n SER 123 Cb 0.18 -0.75 0.48 0.00 -0.26 0.00 0.00 64.21 63.86 1tye n SER 123 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1tye n MET 124 N -2.07 0.03 -0.17 4.33 2.81 -0.42 -4.26 117.12 117.37 1tye n MET 124 Ca 0.01 0.02 -0.08 0.00 -1.81 0.00 0.00 57.70 55.83 1tye n MET 124 Cb 0.12 -1.53 -0.03 0.00 -0.71 0.00 0.00 33.22 31.07 1tye n MET 124 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 1tye h LYS 125 N 0.00 -0.24 0.00 0.03 3.64 -1.21 0.64 116.57 119.43 1tye h LYS 125 Ca 0.00 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1tye h LYS 125 Cb 0.53 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1tye h LYS 125 CO 0.00 -0.16 0.00 -0.40 -2.27 0.00 0.00 179.45 176.62 1tye n ASP 126 N -5.42 0.00 -0.00 4.20 5.75 -1.26 -2.44 116.55 117.39 1tye n ASP 126 Ca 0.01 -0.14 0.05 0.00 -0.01 0.00 0.00 54.79 54.70 1tye n ASP 126 Cb 0.35 -0.20 -0.06 0.00 -1.03 0.00 0.00 41.12 40.18 1tye n ASP 126 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1tye n ASP 127 N -1.20 0.95 -0.31 -1.12 9.92 0.18 -4.71 116.55 120.26 1tye n ASP 127 Ca 0.10 -0.57 0.15 0.00 -0.53 0.00 0.00 54.79 53.94 1tye n ASP 127 Cb 0.11 1.10 0.34 0.00 -0.64 0.00 0.00 41.12 42.03 1tye n ASP 127 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 1tye h LEU 128 N 0.00 0.29 -0.10 0.64 5.85 0.16 0.15 115.31 122.29 1tye h LEU 128 Ca 0.00 0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1tye h LEU 128 Cb 0.28 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1tye h LEU 128 CO 0.00 -0.07 0.06 -0.25 -0.34 0.00 0.00 178.44 177.84 1tye h TRP 129 N 0.34 0.14 -0.64 1.25 7.01 -1.84 -2.28 115.95 119.92 1tye h TRP 129 Ca 0.60 0.00 0.08 0.00 2.11 0.00 0.00 58.89 61.67 1tye h TRP 129 Cb 1.21 -0.04 -0.06 0.00 -2.10 0.00 0.00 29.16 28.16 1tye h TRP 129 CO -0.14 0.12 0.31 0.77 -2.79 0.00 0.00 178.44 176.71 1tye h SER 130 N 0.11 0.41 1.11 2.65 0.02 -1.29 0.26 113.55 116.82 1tye h SER 130 Ca 0.04 0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 60.97 1tye h SER 130 Cb 0.02 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1tye h SER 130 CO -0.01 0.25 -0.34 0.16 -1.14 0.00 0.00 176.83 175.76 1tye h ILE 131 N 0.56 0.71 0.01 3.27 3.07 -1.30 -1.28 117.51 122.55 1tye h ILE 131 Ca 0.31 -1.55 -0.18 0.00 1.55 0.00 0.00 64.86 64.99 1tye h ILE 131 Cb 0.29 2.01 0.02 0.00 -0.27 0.00 0.00 36.82 38.87 1tye h ILE 131 CO -0.24 0.33 -0.73 1.56 -1.05 0.00 0.00 178.15 178.03 1tye h GLN 132 N 0.00 0.47 -0.25 0.16 4.20 -0.78 -1.44 115.11 117.47 1tye h GLN 132 Ca -0.00 -0.52 -0.00 0.00 0.06 0.00 0.00 58.65 58.18 1tye h GLN 132 Cb 0.99 0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.91 1tye h GLN 132 CO 0.04 1.17 0.14 -0.97 -0.67 0.00 0.00 178.83 178.55 1tye h ASN 133 N -0.01 0.30 -0.13 1.46 -1.24 -0.93 -1.60 115.58 113.44 1tye h ASN 133 Ca -0.09 -0.06 0.00 0.00 0.71 0.00 0.00 56.30 56.86 1tye h ASN 133 Cb 1.43 -0.08 -0.01 0.00 0.73 0.00 0.00 38.32 40.40 1tye h ASN 133 CO 0.14 0.27 0.08 0.25 -1.29 0.00 0.00 177.43 176.88 1tye h LEU 134 N 0.30 0.12 -1.85 0.34 5.85 -1.27 0.44 115.31 119.24 1tye h LEU 134 Ca 0.09 -0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.86 1tye h LEU 134 Cb 0.03 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 1tye h LEU 134 CO -0.02 0.09 0.21 1.23 -0.34 0.00 0.00 178.44 179.62 1tye h GLY 135 N 0.16 0.23 0.73 3.75 0.00 -1.07 0.33 103.07 107.21 1tye h GLY 135 Ca 0.05 -0.08 -0.18 0.00 0.00 0.00 0.00 47.33 47.12 1tye h GLY 135 CO -0.02 0.06 -0.77 -0.84 0.00 0.00 0.00 176.54 174.97 1tye h THR 136 N 0.19 1.48 0.00 4.70 2.02 -0.36 -3.24 112.91 117.70 1tye h THR 136 Ca 0.14 -2.40 -0.02 0.00 0.77 0.00 0.00 66.41 64.89 1tye h THR 136 Cb 0.30 3.02 -0.00 0.00 -1.74 0.00 0.00 68.15 69.73 1tye h THR 136 CO -0.02 0.69 -0.10 0.11 0.37 0.00 0.00 175.52 176.57 1tye h LYS 137 N -0.28 0.00 0.43 6.66 6.56 0.41 -2.99 116.57 127.37 1tye h LYS 137 Ca -0.13 0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.44 1tye h LYS 137 Cb 1.56 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.22 1tye h LYS 137 CO 0.15 0.10 -0.21 1.25 -2.06 0.00 0.00 179.45 178.68 1tye h LEU 138 N 0.00 -0.49 -2.06 2.94 5.85 -0.39 -1.89 115.31 119.27 1tye h LEU 138 Ca -0.00 -0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.69 1tye h LEU 138 Cb 0.47 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 1tye h LEU 138 CO 0.01 -0.15 0.17 0.00 -0.34 0.00 0.00 178.44 178.14 1tye h ALA 139 N -0.46 2.14 0.16 1.25 0.00 -1.56 -2.51 119.26 118.28 1tye h ALA 139 Ca -0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1tye h ALA 139 Cb 0.56 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1tye h ALA 139 CO 0.10 -0.29 -0.08 1.15 0.00 0.00 0.00 179.25 180.13 1tye h THR 140 N 0.00 0.78 -0.43 0.00 2.02 -1.41 -2.71 112.91 111.16 1tye h THR 140 Ca 0.11 -1.14 0.08 0.00 0.77 0.00 0.00 66.41 66.23 1tye h THR 140 Cb 0.46 1.33 -0.07 0.00 -1.74 0.00 0.00 68.15 68.13 1tye h THR 140 CO -0.00 0.21 0.02 -0.61 0.37 0.00 0.00 175.52 175.50 1tye h GLN 141 N -0.90 0.12 -0.35 6.66 5.75 -1.06 -2.07 115.11 123.27 1tye h GLN 141 Ca -0.02 -0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.43 1tye h GLN 141 Cb 0.51 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.02 1tye h GLN 141 CO 0.04 0.08 0.06 0.52 -2.65 0.00 0.00 178.83 176.87 1tye h MET 142 N 0.13 0.59 -0.12 1.69 2.86 -1.59 -2.44 114.93 116.05 1tye h MET 142 Ca 0.21 -0.16 0.03 0.00 -2.06 0.00 0.00 59.70 57.73 1tye h MET 142 Cb 0.30 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.88 1tye h MET 142 CO -0.34 0.66 0.18 -0.09 1.06 0.00 0.00 176.91 178.38 1tye h ARG 143 N 0.42 0.00 0.00 1.72 9.65 -1.10 0.50 114.38 125.58 1tye h ARG 143 Ca 0.11 0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 58.96 1tye h ARG 143 Cb 0.36 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.94 1tye h ARG 143 CO 0.01 0.00 -0.69 0.87 2.80 0.00 0.00 179.97 182.95 1tye h LYS 144 N 0.00 0.00 0.00 0.20 1.57 -0.93 -3.33 116.57 114.08 1tye h LYS 144 Ca 0.06 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.66 1tye h LYS 144 Cb 0.41 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.69 1tye h LYS 144 CO -0.00 0.07 -1.81 1.28 -0.57 0.00 0.00 179.45 178.41 1tye n LEU 145 N -2.87 0.41 -3.66 2.94 4.32 0.96 -4.92 117.00 114.19 1tye n LEU 145 Ca 0.00 0.18 -0.07 0.00 -0.02 0.00 0.00 56.01 56.11 1tye n LEU 145 Cb 0.59 0.17 -0.08 0.00 -1.62 0.00 0.00 43.42 42.47 1tye n LEU 145 CO 0.38 0.20 0.09 0.28 -1.22 0.00 0.00 177.39 177.12 1tye s THR 146 N -2.96 -0.67 -2.00 -5.08 -1.32 0.14 -4.87 115.64 98.88 1tye s THR 146 Ca -0.06 0.12 0.07 0.00 -1.21 0.00 0.00 61.69 60.60 1tye s THR 146 Cb 0.09 -0.75 0.19 0.00 -1.51 0.00 0.00 72.50 70.52 1tye s THR 146 CO 0.84 0.05 0.89 -1.54 -2.21 0.00 0.00 174.62 172.65 1tye n SER 147 N 5.29 0.00 -3.89 8.08 3.41 -1.26 -4.25 113.62 121.00 1tye n SER 147 Ca -0.11 -0.90 -0.30 0.00 -0.26 0.00 0.00 58.87 57.30 1tye n SER 147 Cb 0.50 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.30 1tye n SER 147 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1tye s ASN 148 N -1.65 4.36 0.02 4.04 2.47 -1.26 -5.10 114.94 117.82 1tye s ASN 148 Ca 0.10 -2.20 0.01 0.00 0.42 0.00 0.00 52.86 51.19 1tye s ASN 148 Cb 0.05 -1.35 -0.02 0.00 -1.45 0.00 0.00 41.25 38.48 1tye s ASN 148 CO 0.08 -0.35 -0.04 -0.22 -3.72 0.00 0.00 177.10 172.84 1tye s LEU 149 N 0.86 2.24 -0.26 3.21 2.96 -1.26 -2.59 118.68 123.84 1tye s LEU 149 Ca 0.12 -0.50 -0.04 0.00 -0.22 0.00 0.00 54.13 53.50 1tye s LEU 149 Cb -0.20 0.04 0.09 0.00 0.50 0.00 0.00 46.19 46.61 1tye s LEU 149 CO -0.11 -0.27 0.11 -0.13 -1.32 0.00 0.00 176.35 174.64 1tye s ARG 150 N -1.45 0.23 0.27 1.98 1.81 -1.04 -4.27 118.95 116.48 1tye s ARG 150 Ca -0.14 -0.47 0.07 0.00 -1.72 0.00 0.00 55.73 53.47 1tye s ARG 150 Cb -0.10 -1.43 -0.03 0.00 -0.45 0.00 0.00 34.95 32.94 1tye s ARG 150 CO -0.01 -0.92 0.25 -1.50 -0.68 0.00 0.00 175.30 172.45 1tye s ILE 151 N 2.06 4.33 0.17 1.52 2.07 -0.50 -2.59 121.20 128.25 1tye s ILE 151 Ca 0.07 -1.33 -0.23 0.00 -1.41 0.00 0.00 60.65 57.76 1tye s ILE 151 Cb -0.16 -3.41 0.08 0.00 0.13 0.00 0.00 42.46 39.10 1tye s ILE 151 CO -0.28 -0.30 1.06 -0.83 -1.91 0.00 0.00 174.94 172.68 1tye s GLY 152 N -3.91 0.09 0.06 1.50 0.00 -0.76 -0.66 107.32 103.64 1tye s GLY 152 Ca 0.35 -0.30 -0.27 0.00 0.00 0.00 0.00 44.72 44.50 1tye s GLY 152 CO 0.26 2.77 0.83 -0.11 0.00 0.00 0.00 173.10 176.86 1tye s PHE 153 N -2.15 -0.35 0.25 1.90 -0.71 -0.86 -1.00 117.98 115.05 1tye s PHE 153 Ca 0.23 0.17 -0.06 0.00 -1.04 0.00 0.00 56.93 56.23 1tye s PHE 153 Cb -0.02 0.56 -0.02 0.00 -1.21 0.00 0.00 43.02 42.33 1tye s PHE 153 CO 0.05 -0.66 0.34 0.20 -1.34 0.00 0.00 175.22 173.81 1tye s GLY 154 N -2.61 1.06 0.11 1.99 0.00 0.35 -1.29 107.32 106.94 1tye s GLY 154 Ca 0.05 -1.31 0.03 0.00 0.00 0.00 0.00 44.72 43.50 1tye s GLY 154 CO -0.08 -0.99 -0.09 0.00 0.00 0.00 0.00 173.10 171.95 1tye s ALA 155 N -3.91 1.13 0.15 3.20 0.00 -0.08 -0.37 121.76 121.88 1tye s ALA 155 Ca 0.30 -1.31 -0.07 0.00 0.00 0.00 0.00 51.96 50.88 1tye s ALA 155 Cb 0.02 0.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.21 1tye s ALA 155 CO 0.12 -0.13 0.22 -0.59 0.00 0.00 0.00 175.76 175.39 1tye s PHE 156 N -3.08 0.48 0.05 0.00 -0.12 -0.12 -0.43 117.98 114.76 1tye s PHE 156 Ca 0.10 -0.86 0.00 0.00 -0.05 0.00 0.00 56.93 56.13 1tye s PHE 156 Cb 0.01 -0.16 0.00 0.00 -0.63 0.00 0.00 43.02 42.25 1tye s PHE 156 CO -0.02 -0.65 0.00 0.28 -0.05 0.00 0.00 175.22 174.78 1tye n VAL 157 N -0.17 0.00 -0.34 -2.49 0.31 -0.80 -1.25 118.33 113.59 1tye n VAL 157 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 1tye n VAL 157 Cb 0.63 -0.07 0.00 0.00 -0.91 0.00 0.00 33.84 33.49 1tye n VAL 157 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1tye n ASP 158 N -2.65 0.00 -4.66 4.52 -0.08 -1.13 -2.41 116.55 110.14 1tye n ASP 158 Ca 0.00 0.00 -0.43 0.00 -1.51 0.00 0.00 54.79 52.85 1tye n ASP 158 Cb 0.00 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 43.44 1tye n ASP 158 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1tye s LYS 159 N -1.80 4.24 -0.61 -0.67 1.02 -1.26 -2.44 119.74 118.21 1tye s LYS 159 Ca 0.00 1.71 -0.10 0.00 0.02 0.00 0.00 55.97 57.60 1tye s LYS 159 Cb 0.00 -3.76 -0.09 0.00 -0.52 0.00 0.00 37.83 33.46 1tye s LYS 159 CO 0.00 -0.69 1.79 -2.30 -0.92 0.00 0.00 175.35 173.23 1tye n PRO 160 N 6.51 1.34 -3.85 -1.68 -0.02 -1.26 -4.28 135.00 131.76 1tye n PRO 160 Ca 0.14 -1.31 -0.12 0.00 -2.02 0.00 0.00 63.50 60.20 1tye n PRO 160 Cb 0.45 -2.47 -0.11 0.00 -0.02 0.00 0.00 33.50 31.35 1tye n PRO 160 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1tye s VAL 161 N 4.41 0.06 0.47 -1.45 1.01 -1.26 -4.90 120.40 118.73 1tye s VAL 161 Ca 0.38 -0.48 -0.24 0.00 0.00 0.00 0.00 61.98 61.63 1tye s VAL 161 Cb 0.09 -0.39 -0.07 0.00 0.00 0.00 0.00 36.38 36.01 1tye s VAL 161 CO 0.04 -0.27 1.37 -0.55 0.00 0.00 0.00 175.10 175.70 1tye s SER 162 N -0.95 5.83 0.00 3.32 0.15 -1.26 -0.46 113.70 120.33 1tye s SER 162 Ca -0.10 2.80 0.21 0.00 0.70 0.00 0.00 55.95 59.56 1tye s SER 162 Cb -0.06 -2.64 0.75 0.00 -1.71 0.00 0.00 66.02 62.36 1tye s SER 162 CO 0.01 -1.20 1.55 -0.81 1.20 0.00 0.00 173.24 174.00 1tye n PRO 163 N -0.35 1.76 -0.01 5.44 -0.04 -1.26 -4.53 135.00 136.01 1tye n PRO 163 Ca 0.06 -1.15 -0.13 0.00 -0.04 0.00 0.00 63.50 62.25 1tye n PRO 163 Cb 0.43 -1.41 -0.09 0.00 -0.04 0.00 0.00 33.50 32.39 1tye n PRO 163 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1tye h TYR 164 N 2.35 0.04 -3.30 0.54 0.05 -1.04 -3.42 116.97 112.18 1tye h TYR 164 Ca 0.00 -0.01 -0.56 0.00 0.05 0.00 0.00 58.73 58.21 1tye h TYR 164 Cb 0.51 -0.01 -0.04 0.00 1.01 0.00 0.00 36.73 38.20 1tye h TYR 164 CO 0.10 0.43 0.01 1.41 -1.05 0.00 0.00 178.16 179.07 1tye s MET 165 N -4.59 4.29 -0.07 4.88 1.75 -0.44 0.19 119.30 125.30 1tye s MET 165 Ca -0.15 0.83 -0.30 0.00 -1.25 0.00 0.00 55.69 54.82 1tye s MET 165 Cb 0.03 -3.25 -0.03 0.00 2.84 0.00 0.00 34.83 34.42 1tye s MET 165 CO 0.68 0.61 1.17 0.71 -0.65 0.00 0.00 175.02 177.54 1tye s TYR 166 N -1.07 3.22 -0.43 4.11 1.51 -1.26 -4.21 117.35 119.21 1tye s TYR 166 Ca 0.31 1.26 0.13 0.00 -1.01 0.00 0.00 57.07 57.75 1tye s TYR 166 Cb -0.20 -3.39 0.37 0.00 -0.11 0.00 0.00 41.96 38.63 1tye s TYR 166 CO 0.21 -1.17 1.29 0.44 -1.11 0.00 0.00 175.55 175.21 1tye n ILE 167 N 4.67 1.64 -3.61 2.71 -5.35 -1.26 -4.49 119.36 113.68 1tye n ILE 167 Ca 0.11 -1.51 -0.15 0.00 -0.27 0.00 0.00 62.75 60.93 1tye n ILE 167 Cb 0.46 0.10 -0.07 0.00 -1.74 0.00 0.00 39.64 38.40 1tye n ILE 167 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1tye s SER 168 N -1.59 -0.66 1.13 7.28 1.04 -1.26 -4.71 113.70 114.93 1tye s SER 168 Ca 0.30 1.05 -0.16 0.00 0.48 0.00 0.00 55.95 57.62 1tye s SER 168 Cb 0.22 1.01 0.23 0.00 0.10 0.00 0.00 66.02 67.58 1tye s SER 168 CO 0.10 -0.38 0.98 -2.65 0.98 0.00 0.00 173.24 172.27 1tye n PRO 169 N 1.98 -2.15 0.18 4.02 -0.02 -1.26 -4.79 135.00 132.96 1tye n PRO 169 Ca -0.16 -1.54 0.18 0.00 -2.02 0.00 0.00 63.50 59.95 1tye n PRO 169 Cb 0.56 -1.28 0.81 0.00 -0.02 0.00 0.00 33.50 33.57 1tye n PRO 169 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1tye h PRO 170 N 0.00 0.00 0.00 0.52 0.11 -2.01 -0.90 132.00 129.72 1tye h PRO 170 Ca -0.35 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.66 1tye h PRO 170 Cb 1.02 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 1tye h PRO 170 CO 0.23 0.00 -0.51 0.93 -0.21 0.00 0.00 178.00 178.45 1tye h GLU 171 N 0.00 0.00 0.00 1.05 3.07 -1.95 -3.18 114.58 113.57 1tye h GLU 171 Ca 0.11 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.95 1tye h GLU 171 Cb 0.58 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.49 1tye h GLU 171 CO -0.00 0.51 -0.06 0.00 -1.40 0.00 0.00 179.01 178.06 1tye h ALA 172 N 1.49 1.67 -0.83 3.43 0.00 -1.27 0.27 119.26 124.02 1tye h ALA 172 Ca -0.01 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1tye h ALA 172 Cb 0.97 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 1tye h ALA 172 CO 0.07 0.07 0.39 -0.07 0.00 0.00 0.00 179.25 179.70 1tye h LEU 173 N 0.00 1.10 0.00 0.00 -0.00 -1.68 -2.20 115.31 112.53 1tye h LEU 173 Ca -0.00 -0.14 -0.12 0.00 -0.00 0.00 0.00 57.88 57.62 1tye h LEU 173 Cb 0.12 -0.28 -0.02 0.00 -0.00 0.00 0.00 40.66 40.47 1tye h LEU 173 CO 0.01 0.93 -1.39 -0.62 -0.00 0.00 0.00 178.44 177.37 1tye n GLU 174 N -4.31 0.62 -3.45 1.13 4.71 -0.96 -4.54 120.64 113.84 1tye n GLU 174 Ca 0.08 0.15 -0.27 0.00 -0.01 0.00 0.00 57.16 57.12 1tye n GLU 174 Cb 0.15 -1.78 -0.11 0.00 -1.01 0.00 0.00 31.44 28.69 1tye n GLU 174 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 1tye s ASN 175 N -5.55 2.65 0.56 1.62 2.47 0.05 -3.63 114.94 113.10 1tye s ASN 175 Ca -0.03 -2.00 0.26 0.00 0.42 0.00 0.00 52.86 51.51 1tye s ASN 175 Cb 0.09 -0.20 1.62 0.00 -1.45 0.00 0.00 41.25 41.30 1tye s ASN 175 CO 0.81 -0.31 2.19 -0.65 -3.72 0.00 0.00 177.10 175.42 1tye h PRO 176 N 7.13 0.00 -0.00 0.43 0.11 -1.62 -0.74 132.00 137.31 1tye h PRO 176 Ca 0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1tye h PRO 176 Cb 0.99 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1tye h PRO 176 CO 0.26 0.03 -0.03 0.00 -0.21 0.00 0.00 178.00 178.05 1tye h TYR 178 N 0.16 -0.20 0.00 0.00 3.20 -1.20 0.33 116.97 119.26 1tye h TYR 178 Ca 0.00 0.07 -0.00 0.00 3.14 0.00 0.00 58.73 61.94 1tye h TYR 178 Cb 0.27 0.24 -0.00 0.00 1.54 0.00 0.00 36.73 38.78 1tye h TYR 178 CO 0.00 -0.39 -0.00 0.22 -1.64 0.00 0.00 178.16 176.35 1tye h ASP 179 N 0.02 0.00 -0.57 -2.11 -0.00 -1.82 -1.94 116.42 110.00 1tye h ASP 179 Ca 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.55 1tye h ASP 179 Cb 0.96 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.29 1tye h ASP 179 CO -0.90 0.00 0.00 0.23 -0.00 0.00 0.00 179.24 178.58 1tye n MET 180 N -3.98 2.39 -0.99 0.28 2.81 0.11 -4.91 117.12 112.83 1tye n MET 180 Ca -0.03 -2.07 0.00 0.00 -1.81 0.00 0.00 57.70 53.79 1tye n MET 180 Cb 0.08 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.12 1tye n MET 180 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1tye n LYS 181 N 1.14 -1.38 -2.38 0.03 4.76 -0.73 -4.97 118.16 114.64 1tye n LYS 181 Ca 0.19 0.34 -0.08 0.00 -2.87 0.00 0.00 58.31 55.90 1tye n LYS 181 Cb 0.50 -4.39 -0.01 0.00 -1.84 0.00 0.00 35.03 29.29 1tye n LYS 181 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1tye n THR 182 N -2.30 0.00 -3.78 -0.18 -2.24 -1.21 -5.04 114.28 99.54 1tye n THR 182 Ca 0.00 -0.62 -0.14 0.00 -2.27 0.00 0.00 64.05 61.02 1tye n THR 182 Cb 0.34 -0.17 -0.15 0.00 -2.10 0.00 0.00 70.33 68.26 1tye n THR 182 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1tye s THR 183 N -1.05 -0.04 0.20 4.28 -1.32 -1.26 -3.69 115.64 112.76 1tye s THR 183 Ca 0.05 0.14 -0.01 0.00 -1.21 0.00 0.00 61.69 60.66 1tye s THR 183 Cb -0.00 -0.15 -0.04 0.00 -1.51 0.00 0.00 72.50 70.80 1tye s THR 183 CO 0.03 0.06 0.12 0.00 -2.21 0.00 0.00 174.62 172.62 1tye s LEU 185 N -3.16 3.11 0.60 0.00 1.43 -1.18 -4.46 118.68 115.02 1tye s LEU 185 Ca 0.37 1.85 -0.16 0.00 -1.03 0.00 0.00 54.13 55.16 1tye s LEU 185 Cb 0.07 -4.53 -0.03 0.00 0.03 0.00 0.00 46.19 41.73 1tye s LEU 185 CO 0.11 -1.94 1.07 -2.16 0.23 0.00 0.00 176.35 173.65 1tye s PRO 186 N -4.74 3.24 0.68 1.29 0.04 -1.24 -4.36 135.00 129.90 1tye s PRO 186 Ca 0.62 1.25 -0.16 0.00 0.04 0.00 0.00 61.00 62.75 1tye s PRO 186 Cb -0.18 -2.02 0.01 0.00 0.04 0.00 0.00 34.50 32.36 1tye s PRO 186 CO 0.53 -0.88 1.19 1.41 0.04 0.00 0.00 177.00 179.29 1tye s MET 187 N -4.05 2.47 -0.09 4.56 1.75 -1.26 -4.91 119.30 117.77 1tye s MET 187 Ca 0.64 1.71 -0.30 0.00 -1.25 0.00 0.00 55.69 56.49 1tye s MET 187 Cb -0.17 -1.88 0.07 0.00 2.84 0.00 0.00 34.83 35.69 1tye s MET 187 CO 0.37 -1.57 0.70 -0.59 -0.65 0.00 0.00 175.02 173.28 1tye s PHE 188 N -1.95 -0.67 0.00 4.11 -0.71 -1.26 -4.95 117.98 112.55 1tye s PHE 188 Ca 0.74 1.23 0.00 0.00 -1.04 0.00 0.00 56.93 57.85 1tye s PHE 188 Cb -0.28 0.39 0.00 0.00 -1.21 0.00 0.00 43.02 41.92 1tye s PHE 188 CO 0.41 -0.57 0.48 0.41 -1.34 0.00 0.00 175.22 174.62 1tye n GLY 189 N 1.16 -1.43 3.00 1.99 0.00 -1.02 -2.85 105.19 106.04 1tye n GLY 189 Ca -0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 1tye n GLY 189 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1tye s TYR 190 N -1.59 -0.18 -0.06 1.61 5.04 -1.26 -1.90 117.35 119.02 1tye s TYR 190 Ca 0.00 0.45 0.01 0.00 -2.44 0.00 0.00 57.07 55.09 1tye s TYR 190 Cb 0.00 0.02 0.02 0.00 0.35 0.00 0.00 41.96 42.35 1tye s TYR 190 CO 0.00 -0.11 -0.06 0.21 -1.34 0.00 0.00 175.55 174.25 1tye s LYS 191 N 0.45 1.03 -0.44 4.97 2.20 0.43 -1.87 119.74 126.52 1tye s LYS 191 Ca -0.03 -0.16 -0.21 0.00 -0.36 0.00 0.00 55.97 55.21 1tye s LYS 191 Cb -0.04 -1.02 0.02 0.00 -1.51 0.00 0.00 37.83 35.27 1tye s LYS 191 CO -0.02 -0.10 0.68 -1.58 -0.36 0.00 0.00 175.35 173.97 1tye s HIS 192 N 1.04 3.05 -0.21 4.03 5.65 -0.07 -0.90 115.29 127.88 1tye s HIS 192 Ca -0.09 0.02 -0.14 0.00 0.25 0.00 0.00 55.06 55.10 1tye s HIS 192 Cb -0.14 -3.41 -0.18 0.00 -1.18 0.00 0.00 32.58 27.66 1tye s HIS 192 CO -0.00 -0.88 0.05 1.55 -0.65 0.00 0.00 174.74 174.80 1tye n VAL 193 N 5.91 1.58 -3.91 0.89 3.14 -1.18 -4.82 118.33 119.93 1tye n VAL 193 Ca -0.01 -0.31 -0.29 0.00 -2.96 0.00 0.00 64.34 60.77 1tye n VAL 193 Cb 0.48 -1.87 -0.16 0.00 -1.06 0.00 0.00 33.84 31.23 1tye n VAL 193 CO 0.00 0.00 0.00 -0.22 -6.46 0.00 0.00 176.83 170.15 1tye s LEU 194 N -7.46 1.89 0.67 6.55 2.96 -0.41 -5.01 118.68 117.87 1tye s LEU 194 Ca -0.31 -0.81 -0.17 0.00 -0.22 0.00 0.00 54.13 52.63 1tye s LEU 194 Cb 0.09 -1.01 0.00 0.00 0.50 0.00 0.00 46.19 45.77 1tye s LEU 194 CO 0.60 -0.19 1.21 -0.89 -1.32 0.00 0.00 176.35 175.76 1tye s THR 195 N 1.56 2.48 0.07 3.68 2.01 -1.26 -2.03 115.64 122.15 1tye s THR 195 Ca -0.01 0.26 -0.34 0.00 0.31 0.00 0.00 61.69 61.92 1tye s THR 195 Cb -0.16 -2.94 -0.13 0.00 0.01 0.00 0.00 72.50 69.28 1tye s THR 195 CO -0.08 -0.10 1.72 0.18 -0.69 0.00 0.00 174.62 175.65 1tye n LEU 196 N -2.22 3.37 -3.82 4.42 4.77 -0.63 -4.64 117.00 118.25 1tye n LEU 196 Ca 0.13 1.03 -0.10 0.00 -0.03 0.00 0.00 56.01 57.05 1tye n LEU 196 Cb 0.50 -1.43 -0.06 0.00 -2.33 0.00 0.00 43.42 40.10 1tye n LEU 196 CO 0.46 -0.13 0.07 0.28 -1.33 0.00 0.00 177.39 176.74 1tye s THR 197 N 2.24 0.07 -1.33 -5.08 -1.32 0.16 -4.88 115.64 105.52 1tye s THR 197 Ca 0.84 -1.05 0.27 0.00 -1.21 0.00 0.00 61.69 60.54 1tye s THR 197 Cb -0.65 -1.54 0.21 0.00 -1.51 0.00 0.00 72.50 69.01 1tye s THR 197 CO 0.42 -0.33 1.64 -0.90 -2.21 0.00 0.00 174.62 173.24 1tye n ASP 198 N -0.21 0.52 -4.58 8.08 5.75 -1.26 -1.41 116.55 123.44 1tye n ASP 198 Ca -0.11 -0.35 -0.36 0.00 -0.01 0.00 0.00 54.79 53.96 1tye n ASP 198 Cb 0.63 0.02 -0.03 0.00 -1.03 0.00 0.00 41.12 40.71 1tye n ASP 198 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1tye s GLN 199 N -2.76 3.27 0.13 0.11 -0.21 -1.26 -4.82 119.66 114.12 1tye s GLN 199 Ca 0.19 -1.56 -0.19 0.00 0.02 0.00 0.00 55.36 53.82 1tye s GLN 199 Cb 0.19 -5.39 -0.05 0.00 1.00 0.00 0.00 33.01 28.76 1tye s GLN 199 CO 0.58 -3.06 1.76 0.28 -2.12 0.00 0.00 175.29 172.73 1tye h VAL 200 N 5.93 1.00 -0.00 1.09 2.07 -1.97 -2.38 116.25 121.99 1tye h VAL 200 Ca 0.33 -0.08 -0.02 0.00 0.82 0.00 0.00 66.70 67.75 1tye h VAL 200 Cb 0.91 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1tye h VAL 200 CO 1.35 0.04 -0.07 0.71 0.02 0.00 0.00 177.57 179.62 1tye h THR 201 N 0.23 1.06 0.00 2.57 1.35 -2.00 -1.28 112.91 114.84 1tye h THR 201 Ca 0.09 -0.26 -0.09 0.00 -0.55 0.00 0.00 66.41 65.60 1tye h THR 201 Cb 0.01 1.14 -0.01 0.00 -1.73 0.00 0.00 68.15 67.56 1tye h THR 201 CO -0.06 0.07 -0.43 -0.09 -0.25 0.00 0.00 175.52 174.77 1tye h ARG 202 N 0.01 0.00 -0.21 4.72 1.12 -1.91 -2.88 114.38 115.22 1tye h ARG 202 Ca 0.00 0.00 -0.15 0.00 -1.11 0.00 0.00 59.98 58.72 1tye h ARG 202 Cb 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.09 1tye h ARG 202 CO 0.01 0.43 -0.46 0.35 -3.11 0.00 0.00 179.97 177.19 1tye h PHE 203 N 0.00 0.87 -0.67 2.20 3.57 -0.74 -2.84 116.94 119.33 1tye h PHE 203 Ca -0.00 -0.32 -0.08 0.00 3.53 0.00 0.00 57.97 61.09 1tye h PHE 203 Cb 1.29 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.84 1tye h PHE 203 CO 0.00 1.10 0.09 -0.91 -2.23 0.00 0.00 178.31 176.36 1tye h ASN 204 N 0.39 1.08 -0.23 0.41 -0.26 -1.34 -1.13 115.58 114.50 1tye h ASN 204 Ca 0.00 -0.27 -0.02 0.00 -0.56 0.00 0.00 56.30 55.45 1tye h ASN 204 Cb 1.07 -0.29 -0.01 0.00 -1.06 0.00 0.00 38.32 38.03 1tye h ASN 204 CO 0.10 1.07 0.06 -0.33 -1.06 0.00 0.00 177.43 177.27 1tye h GLU 205 N 1.04 0.36 -0.81 0.81 5.08 -1.55 -2.67 114.58 116.84 1tye h GLU 205 Ca 0.20 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1tye h GLU 205 Cb 0.47 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.63 1tye h GLU 205 CO 0.02 0.47 0.52 1.49 -1.00 0.00 0.00 179.01 180.50 1tye h GLU 206 N 0.19 1.08 -0.26 2.33 4.57 -1.34 -2.63 114.58 118.52 1tye h GLU 206 Ca 0.07 -0.08 -0.09 0.00 -1.18 0.00 0.00 59.36 58.09 1tye h GLU 206 Cb 0.27 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 1tye h GLU 206 CO 0.00 0.73 -0.21 0.28 -1.18 0.00 0.00 179.01 178.64 1tye h VAL 207 N 1.10 1.25 0.00 0.32 2.07 -1.14 -2.87 116.25 116.98 1tye h VAL 207 Ca 0.29 -1.17 0.00 0.00 0.82 0.00 0.00 66.70 66.64 1tye h VAL 207 Cb -0.09 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1tye h VAL 207 CO -0.06 0.37 0.00 0.29 0.02 0.00 0.00 177.57 178.19 1tye n LYS 208 N -4.15 0.28 -0.18 1.57 5.02 -1.00 -2.89 118.16 116.80 1tye n LYS 208 Ca -0.00 0.04 0.10 0.00 -2.02 0.00 0.00 58.31 56.43 1tye n LYS 208 Cb 0.37 -1.50 0.27 0.00 -0.02 0.00 0.00 35.03 34.15 1tye n LYS 208 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1tye n LYS 209 N -1.34 2.12 -3.06 1.97 5.02 -1.08 -4.94 118.16 116.85 1tye n LYS 209 Ca 0.11 -1.71 -0.39 0.00 -2.02 0.00 0.00 58.31 54.29 1tye n LYS 209 Cb 0.24 -1.43 -0.05 0.00 -0.02 0.00 0.00 35.03 33.77 1tye n LYS 209 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1tye s GLN 210 N -1.53 4.43 0.18 1.97 -1.52 -1.14 -5.08 119.66 116.98 1tye s GLN 210 Ca 0.35 0.95 0.04 0.00 -1.95 0.00 0.00 55.36 54.74 1tye s GLN 210 Cb 0.19 -3.35 -0.05 0.00 -0.22 0.00 0.00 33.01 29.58 1tye s GLN 210 CO 0.27 0.32 -0.05 -1.54 -0.25 0.00 0.00 175.29 174.04 1tye s SER 211 N -0.12 1.70 0.78 5.90 1.04 -1.26 -5.09 113.70 116.64 1tye s SER 211 Ca 0.36 -1.12 -0.12 0.00 0.48 0.00 0.00 55.95 55.55 1tye s SER 211 Cb -0.20 0.02 0.06 0.00 0.10 0.00 0.00 66.02 66.00 1tye s SER 211 CO 0.21 -0.44 1.15 0.68 0.98 0.00 0.00 173.24 175.82 1tye s VAL 212 N -3.42 2.52 0.00 5.02 -7.23 -1.26 -4.90 120.40 111.12 1tye s VAL 212 Ca 0.22 0.17 0.00 0.00 -1.81 0.00 0.00 61.98 60.56 1tye s VAL 212 Cb 0.04 -3.16 0.00 0.00 0.56 0.00 0.00 36.38 33.82 1tye s VAL 212 CO 0.04 -0.22 0.00 -0.24 -0.31 0.00 0.00 175.10 174.37 1tye n SER 213 N -3.22 1.43 -4.02 4.85 2.88 0.10 -3.11 113.62 112.53 1tye n SER 213 Ca 0.08 -0.41 -0.09 0.00 -1.33 0.00 0.00 58.87 57.12 1tye n SER 213 Cb 0.60 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.95 1tye n SER 213 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 1tye s ARG 214 N -0.22 0.43 0.10 -1.46 3.00 -1.26 -1.13 118.95 118.41 1tye s ARG 214 Ca 0.00 -0.80 -0.14 0.00 -1.00 0.00 0.00 55.73 53.79 1tye s ARG 214 Cb 0.00 0.06 0.03 0.00 0.00 0.00 0.00 34.95 35.04 1tye s ARG 214 CO 0.00 -0.05 0.34 1.21 0.00 0.00 0.00 175.30 176.81 1tye s ASN 215 N -1.87 -0.15 -0.07 -2.12 3.04 -1.26 -4.67 114.94 107.85 1tye s ASN 215 Ca -0.09 -0.34 -0.13 0.00 0.04 0.00 0.00 52.86 52.34 1tye s ASN 215 Cb -0.05 0.43 -0.29 0.00 -1.54 0.00 0.00 41.25 39.79 1tye s ASN 215 CO -0.03 -0.78 0.62 -0.09 -3.04 0.00 0.00 177.10 173.78 1tye h ARG 216 N 2.61 0.34 -5.77 0.43 2.43 -0.51 -3.48 114.38 110.43 1tye h ARG 216 Ca -0.33 -0.58 -0.67 0.00 -0.81 0.00 0.00 59.98 57.59 1tye h ARG 216 Cb 1.23 0.21 -0.12 0.00 -0.42 0.00 0.00 29.97 30.88 1tye h ARG 216 CO 0.48 1.28 -0.56 0.16 -1.51 0.00 0.00 179.97 179.82 1tye s ASP 217 N -7.19 5.75 0.20 -3.80 -4.77 -1.26 -5.02 116.67 100.57 1tye s ASP 217 Ca -0.18 0.27 -0.15 0.00 -3.30 0.00 0.00 52.55 49.20 1tye s ASP 217 Cb 0.05 -1.76 0.20 0.00 -1.09 0.00 0.00 42.92 40.31 1tye s ASP 217 CO 0.82 0.37 1.63 0.00 0.70 0.00 0.00 175.17 178.69 1tye h ALA 218 N 5.23 0.35 -2.95 2.11 0.00 -1.98 -3.40 119.26 118.62 1tye h ALA 218 Ca -0.51 0.22 -0.54 0.00 0.00 0.00 0.00 54.91 54.08 1tye h ALA 218 Cb 1.21 0.46 0.12 0.00 0.00 0.00 0.00 17.79 19.57 1tye h ALA 218 CO 0.57 -0.45 0.57 -2.14 0.00 0.00 0.00 179.25 177.80 1tye s PRO 219 N -6.22 3.22 0.48 0.00 0.02 -1.26 -4.49 135.00 126.75 1tye s PRO 219 Ca -0.14 2.10 0.02 0.00 0.02 0.00 0.00 61.00 63.00 1tye s PRO 219 Cb 0.18 -2.24 -0.01 0.00 0.02 0.00 0.00 34.50 32.45 1tye s PRO 219 CO 0.73 -1.09 0.07 0.39 -0.33 0.00 0.00 177.00 176.77 1tye n GLU 220 N -1.01 0.65 -1.67 5.54 -0.58 -1.20 -4.79 120.64 117.58 1tye n GLU 220 Ca 0.10 -3.74 -0.38 0.00 -0.42 0.00 0.00 57.16 52.73 1tye n GLU 220 Cb 0.46 1.44 0.06 0.00 -0.57 0.00 0.00 31.44 32.83 1tye n GLU 220 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1tye n GLY 221 N -1.14 5.67 0.23 0.62 0.00 -1.01 -1.07 105.19 108.49 1tye n GLY 221 Ca -0.15 -2.41 0.01 0.00 0.00 0.00 0.00 46.02 43.47 1tye n GLY 221 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1tye h GLY 222 N 2.57 0.25 2.00 -0.02 0.00 -1.89 -2.57 103.07 103.42 1tye h GLY 222 Ca 0.59 -0.18 -0.07 0.00 0.00 0.00 0.00 47.33 47.67 1tye h GLY 222 CO 1.51 0.17 -0.33 0.74 0.00 0.00 0.00 176.54 178.63 1tye h PHE 223 N 0.22 0.00 -0.54 5.60 0.04 -1.82 -0.05 116.94 120.39 1tye h PHE 223 Ca 0.04 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.72 1tye h PHE 223 Cb 0.52 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.64 1tye h PHE 223 CO 0.01 0.33 -0.02 -0.44 -0.60 0.00 0.00 178.31 177.58 1tye h ASP 224 N 0.00 0.91 0.09 2.17 3.32 -1.81 -1.34 116.42 119.76 1tye h ASP 224 Ca -0.00 -0.25 -0.18 0.00 0.02 0.00 0.00 57.03 56.62 1tye h ASP 224 Cb 0.72 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.02 1tye h ASP 224 CO 0.04 0.98 -0.65 0.00 -1.72 0.00 0.00 179.24 177.90 1tye h ALA 225 N 1.11 0.60 -0.49 3.45 0.00 -1.30 -1.93 119.26 120.70 1tye h ALA 225 Ca 0.15 -0.56 -0.11 0.00 0.00 0.00 0.00 54.91 54.39 1tye h ALA 225 Cb 0.54 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1tye h ALA 225 CO 0.03 0.72 -0.12 0.82 0.00 0.00 0.00 179.25 180.70 1tye h ILE 226 N 0.39 1.27 0.51 0.00 2.04 -0.83 -0.83 117.51 120.06 1tye h ILE 226 Ca -0.02 -1.25 -0.03 0.00 1.00 0.00 0.00 64.86 64.57 1tye h ILE 226 Cb 1.22 1.07 0.01 0.00 -0.74 0.00 0.00 36.82 38.37 1tye h ILE 226 CO 0.12 0.43 -0.25 -0.03 0.00 0.00 0.00 178.15 178.43 1tye h MET 227 N 0.79 -0.67 -0.78 2.37 4.05 -1.15 -2.31 114.93 117.24 1tye h MET 227 Ca 0.12 0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 59.58 1tye h MET 227 Cb 0.67 0.15 -0.04 0.00 -0.80 0.00 0.00 31.60 31.59 1tye h MET 227 CO 0.05 -0.44 0.44 1.96 0.23 0.00 0.00 176.91 179.15 1tye h GLN 228 N -0.70 1.08 0.00 0.39 1.08 -1.32 -1.05 115.11 114.59 1tye h GLN 228 Ca -0.07 -0.12 -0.00 0.00 -1.45 0.00 0.00 58.65 57.01 1tye h GLN 228 Cb 0.53 -0.22 -0.00 0.00 -0.05 0.00 0.00 27.48 27.75 1tye h GLN 228 CO 0.12 0.79 -0.00 0.00 -0.95 0.00 0.00 178.83 178.79 1tye h ALA 229 N 1.23 1.00 0.06 3.87 0.00 -1.10 -2.39 119.26 121.93 1tye h ALA 229 Ca 0.28 -0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.97 1tye h ALA 229 Cb 0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1tye h ALA 229 CO -0.05 0.00 -1.13 1.15 0.00 0.00 0.00 179.25 179.22 1tye h THR 230 N 0.00 1.11 -0.02 0.00 2.02 -0.68 -3.40 112.91 111.94 1tye h THR 230 Ca -0.00 -2.31 0.00 0.00 0.77 0.00 0.00 66.41 64.87 1tye h THR 230 Cb 0.33 2.66 0.00 0.00 -1.74 0.00 0.00 68.15 69.40 1tye h THR 230 CO 0.00 0.56 0.00 1.33 0.37 0.00 0.00 175.52 177.78 1tye n VAL 231 N -4.20 0.01 -3.15 3.16 0.24 -0.51 -4.60 118.33 109.28 1tye n VAL 231 Ca -0.25 -0.29 -0.43 0.00 -2.04 0.00 0.00 64.34 61.33 1tye n VAL 231 Cb 0.76 0.65 0.00 0.00 -1.47 0.00 0.00 33.84 33.78 1tye n VAL 231 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1tye n ASP 233 N 1.80 0.00 -0.29 0.00 9.92 -1.26 -1.77 116.55 124.95 1tye n ASP 233 Ca 0.25 0.81 0.01 0.00 -0.53 0.00 0.00 54.79 55.33 1tye n ASP 233 Cb 0.35 -0.31 0.15 0.00 -0.64 0.00 0.00 41.12 40.67 1tye n ASP 233 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 1tye h GLU 234 N 0.00 0.82 0.74 -1.24 4.39 -1.92 -1.83 114.58 115.54 1tye h GLU 234 Ca 0.00 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.61 1tye h GLU 234 Cb 0.00 -0.19 0.01 0.00 -0.10 0.00 0.00 28.75 28.47 1tye h GLU 234 CO 0.00 0.54 -0.36 0.87 -1.16 0.00 0.00 179.01 178.91 1tye h LYS 235 N 0.85 -0.96 -0.72 2.33 1.79 -1.90 -3.18 116.57 114.77 1tye h LYS 235 Ca 0.37 0.07 -0.03 0.00 -2.18 0.00 0.00 60.65 58.88 1tye h LYS 235 Cb 0.26 0.22 -0.03 0.00 -1.58 0.00 0.00 32.23 31.09 1tye h LYS 235 CO -0.21 -0.63 0.33 0.82 -1.08 0.00 0.00 179.45 178.68 1tye h ILE 236 N -1.05 1.24 0.00 1.86 1.08 -1.36 -3.44 117.51 115.85 1tye h ILE 236 Ca -0.10 -0.71 0.00 0.00 -0.39 0.00 0.00 64.86 63.66 1tye h ILE 236 Cb 0.78 0.37 0.00 0.00 -3.07 0.00 0.00 36.82 34.89 1tye h ILE 236 CO 0.17 0.29 0.00 0.61 -0.69 0.00 0.00 178.15 178.53 1tye n GLY 237 N -0.93 1.14 3.75 5.37 0.00 -0.69 -1.60 105.19 112.23 1tye n GLY 237 Ca 0.06 -0.31 -0.41 0.00 0.00 0.00 0.00 46.02 45.36 1tye n GLY 237 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1tye s TRP 238 N -2.00 2.76 -0.52 1.61 0.52 -1.24 -4.77 118.94 115.30 1tye s TRP 238 Ca 0.00 0.80 -0.14 0.00 0.02 0.00 0.00 56.10 56.79 1tye s TRP 238 Cb 0.00 -4.06 0.12 0.00 -1.15 0.00 0.00 33.47 28.39 1tye s TRP 238 CO 0.00 -3.53 0.45 -0.98 0.02 0.00 0.00 176.95 172.90 1tye s ARG 239 N -0.55 2.83 0.14 4.98 1.70 -1.26 -4.96 118.95 121.83 1tye s ARG 239 Ca 0.63 -1.71 0.08 0.00 -0.47 0.00 0.00 55.73 54.26 1tye s ARG 239 Cb -0.47 -4.17 0.52 0.00 -0.57 0.00 0.00 34.95 30.26 1tye s ARG 239 CO 0.48 -1.27 0.62 0.27 -1.08 0.00 0.00 175.30 174.32 1tye n ASN 240 N 5.14 0.13 0.10 -2.89 2.04 -1.26 -0.00 115.26 118.53 1tye n ASN 240 Ca -0.12 0.65 0.12 0.00 -0.44 0.00 0.00 54.58 54.79 1tye n ASN 240 Cb 0.40 -0.31 0.46 0.00 -2.53 0.00 0.00 39.78 37.79 1tye n ASN 240 CO 0.00 0.00 0.00 -0.90 -0.44 0.00 0.00 177.26 175.92 1tye n ASP 241 N -3.89 0.64 -4.94 0.53 5.75 -1.26 -4.88 116.55 108.50 1tye n ASP 241 Ca 0.15 0.61 -0.19 0.00 -0.01 0.00 0.00 54.79 55.35 1tye n ASP 241 Cb 0.50 -0.76 -0.01 0.00 -1.03 0.00 0.00 41.12 39.81 1tye n ASP 241 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1tye s ALA 242 N -3.20 4.21 0.04 2.12 0.00 1.00 -4.89 121.76 121.05 1tye s ALA 242 Ca 0.07 -1.67 -0.30 0.00 0.00 0.00 0.00 51.96 50.06 1tye s ALA 242 Cb 0.11 -1.40 -0.04 0.00 0.00 0.00 0.00 23.12 21.78 1tye s ALA 242 CO 0.47 -0.15 1.04 0.45 0.00 0.00 0.00 175.76 177.57 1tye s SER 243 N -4.18 7.31 -0.35 0.00 0.15 -0.59 -4.91 113.70 111.12 1tye s SER 243 Ca 0.48 1.80 -0.06 0.00 0.70 0.00 0.00 55.95 58.87 1tye s SER 243 Cb -0.07 -2.58 0.05 0.00 -1.71 0.00 0.00 66.02 61.71 1tye s SER 243 CO 0.30 -0.28 0.13 -1.00 1.20 0.00 0.00 173.24 173.59 1tye s HIS 244 N 0.78 3.30 -0.20 3.44 0.09 -1.26 -0.27 115.29 121.16 1tye s HIS 244 Ca 0.53 -1.55 -0.09 0.00 -0.00 0.00 0.00 55.06 53.95 1tye s HIS 244 Cb -0.24 -2.45 -0.04 0.00 -0.00 0.00 0.00 32.58 29.85 1tye s HIS 244 CO 0.29 -0.77 0.10 -0.51 -0.00 0.00 0.00 174.74 173.84 1tye s LEU 245 N 1.37 3.96 -0.42 0.89 1.43 0.17 -0.16 118.68 125.93 1tye s LEU 245 Ca -0.00 0.12 0.03 0.00 -1.03 0.00 0.00 54.13 53.25 1tye s LEU 245 Cb -0.20 -2.02 0.11 0.00 0.03 0.00 0.00 46.19 44.11 1tye s LEU 245 CO 0.02 0.15 0.15 -0.22 0.23 0.00 0.00 176.35 176.68 1tye s LEU 246 N 0.50 4.63 -0.10 1.79 0.20 -0.14 -1.46 118.68 124.11 1tye s LEU 246 Ca 0.05 -2.51 -0.24 0.00 0.69 0.00 0.00 54.13 52.13 1tye s LEU 246 Cb -0.12 -1.65 -0.03 0.00 -0.43 0.00 0.00 46.19 43.96 1tye s LEU 246 CO 0.00 -0.33 0.73 -0.69 -0.29 0.00 0.00 176.35 175.77 1tye s VAL 247 N 0.42 5.00 -0.04 1.68 1.01 -0.82 -1.15 120.40 126.50 1tye s VAL 247 Ca 0.13 1.47 0.06 0.00 0.00 0.00 0.00 61.98 63.65 1tye s VAL 247 Cb -0.22 -4.06 -0.02 0.00 0.00 0.00 0.00 36.38 32.08 1tye s VAL 247 CO -0.05 0.18 -0.23 0.12 0.00 0.00 0.00 175.10 175.12 1tye s PHE 248 N 1.25 2.45 0.11 5.22 5.36 0.04 -1.03 117.98 131.37 1tye s PHE 248 Ca 0.37 -0.46 0.07 0.00 -0.96 0.00 0.00 56.93 55.95 1tye s PHE 248 Cb -0.17 -1.56 -0.03 0.00 -0.34 0.00 0.00 43.02 40.91 1tye s PHE 248 CO 0.16 -0.05 -0.18 0.95 -1.46 0.00 0.00 175.22 174.64 1tye s THR 249 N -0.48 1.55 -0.25 0.12 -4.23 -0.94 0.51 115.64 111.92 1tye s THR 249 Ca 0.06 -1.57 -0.35 0.00 -1.18 0.00 0.00 61.69 58.66 1tye s THR 249 Cb -0.11 -1.49 0.16 0.00 1.34 0.00 0.00 72.50 72.40 1tye s THR 249 CO 0.01 -0.18 1.31 0.28 -0.54 0.00 0.00 174.62 175.50 1tye s THR 250 N -1.43 0.00 0.00 3.99 -1.32 -1.20 -3.71 115.64 111.97 1tye s THR 250 Ca 0.06 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.54 1tye s THR 250 Cb -0.09 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.90 1tye s THR 250 CO 0.04 0.00 0.92 -0.90 -2.21 0.00 0.00 174.62 172.46 1tye n ASP 251 N 0.13 1.76 -3.28 8.08 5.75 -1.26 -2.37 116.55 125.36 1tye n ASP 251 Ca 0.02 -1.84 -0.19 0.00 -0.01 0.00 0.00 54.79 52.78 1tye n ASP 251 Cb 0.58 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.60 1tye n ASP 251 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1tye s ALA 252 N -0.84 1.62 1.24 2.12 0.00 -1.26 -4.78 121.76 119.86 1tye s ALA 252 Ca 0.00 -1.96 -0.13 0.00 0.00 0.00 0.00 51.96 49.87 1tye s ALA 252 Cb 0.00 1.40 0.20 0.00 0.00 0.00 0.00 23.12 24.72 1tye s ALA 252 CO 0.00 -0.70 0.51 1.63 0.00 0.00 0.00 175.76 177.20 1tye n LYS 253 N -0.62 -3.26 -3.87 0.00 5.02 -1.26 -4.91 118.16 109.25 1tye n LYS 253 Ca 0.06 -0.84 -0.10 0.00 -2.02 0.00 0.00 58.31 55.40 1tye n LYS 253 Cb 0.62 -1.01 -0.09 0.00 -0.02 0.00 0.00 35.03 34.53 1tye n LYS 253 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1tye s THR 254 N -1.73 0.11 0.01 -0.18 -1.32 -1.26 -3.24 115.64 108.03 1tye s THR 254 Ca 0.37 -0.88 -0.26 0.00 -1.21 0.00 0.00 61.69 59.72 1tye s THR 254 Cb -0.06 -0.77 -0.04 0.00 -1.51 0.00 0.00 72.50 70.12 1tye s THR 254 CO 0.31 -0.48 0.79 -1.00 -2.21 0.00 0.00 174.62 172.02 1tye s HIS 255 N -2.21 3.68 0.39 9.09 3.76 -0.24 -4.75 115.29 125.01 1tye s HIS 255 Ca -0.08 1.46 0.08 0.00 -0.15 0.00 0.00 55.06 56.36 1tye s HIS 255 Cb -0.03 -2.88 -0.04 0.00 1.11 0.00 0.00 32.58 30.74 1tye s HIS 255 CO -0.02 0.16 0.19 0.96 -0.85 0.00 0.00 174.74 175.19 1tye s ILE 256 N 0.40 2.63 0.51 0.60 -4.36 -1.26 -4.66 121.20 115.05 1tye s ILE 256 Ca 0.41 -1.65 -0.22 0.00 -0.26 0.00 0.00 60.65 58.94 1tye s ILE 256 Cb -0.20 -2.99 -0.08 0.00 1.25 0.00 0.00 42.46 40.45 1tye s ILE 256 CO 0.23 -0.07 1.01 0.00 0.24 0.00 0.00 174.94 176.35 1tye n ALA 257 N -1.25 0.31 -0.30 2.27 0.00 -1.14 -2.58 120.51 117.82 1tye n ALA 257 Ca -0.01 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1tye n ALA 257 Cb 0.63 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.96 1tye n ALA 257 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1tye n LEU 258 N -0.12 0.00 0.08 0.00 4.77 -1.26 -4.88 117.00 115.59 1tye n LEU 258 Ca 0.11 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.99 1tye n LEU 258 Cb 0.43 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.49 1tye n LEU 258 CO 0.53 0.00 0.21 0.44 -1.33 0.00 0.00 177.39 177.24 1tye h ASP 259 N 0.00 0.34 0.00 -1.43 3.32 -1.87 -3.31 116.42 113.47 1tye h ASP 259 Ca 0.00 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 56.77 1tye h ASP 259 Cb 0.00 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.45 1tye h ASP 259 CO 0.00 1.09 0.32 1.23 -1.72 0.00 0.00 179.24 180.16 1tye h GLY 260 N 1.69 0.00 2.00 2.75 0.00 -1.80 -1.94 103.07 105.77 1tye h GLY 260 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.27 1tye h GLY 260 CO 0.15 0.00 0.00 -0.09 0.00 0.00 0.00 176.54 176.60 1tye h ARG 261 N 0.00 0.00 0.00 4.80 2.43 -1.57 0.71 114.38 120.75 1tye h ARG 261 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1tye h ARG 261 Cb 0.63 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 1tye h ARG 261 CO 0.00 0.00 0.00 -0.07 -1.51 0.00 0.00 179.97 178.39 1tye h LEU 262 N 0.00 0.00 -2.74 3.80 4.07 -1.65 -2.58 115.31 116.21 1tye h LEU 262 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1tye h LEU 262 Cb 0.26 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.00 1tye h LEU 262 CO 0.00 0.00 0.00 0.00 -1.08 0.00 0.00 178.44 177.36 1tye n ALA 263 N -1.92 2.30 -0.99 1.53 0.00 0.09 -4.47 120.51 117.07 1tye n ALA 263 Ca 0.03 -1.20 0.00 0.00 0.00 0.00 0.00 53.44 52.27 1tye n ALA 263 Cb 0.36 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 19.09 1tye n ALA 263 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tye n GLY 264 N 1.18 0.51 3.66 0.00 0.00 -0.97 -4.96 105.19 104.61 1tye n GLY 264 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 1tye n GLY 264 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tye s ILE 265 N -2.20 5.06 0.00 -0.61 1.01 -0.32 -4.93 121.20 119.21 1tye s ILE 265 Ca 0.00 1.05 0.00 0.00 0.00 0.00 0.00 60.65 61.70 1tye s ILE 265 Cb 0.00 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.58 1tye s ILE 265 CO 0.00 0.13 0.00 1.33 0.00 0.00 0.00 174.94 176.40 1tye n VAL 266 N 4.69 0.00 -1.63 2.92 0.24 -1.26 -2.48 118.33 120.81 1tye n VAL 266 Ca -0.03 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.84 1tye n VAL 266 Cb 0.50 0.29 -0.03 0.00 -1.47 0.00 0.00 33.84 33.13 1tye n VAL 266 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1tye n GLN 267 N -1.16 2.40 -1.79 7.34 7.27 -1.26 -4.85 117.38 125.33 1tye n GLN 267 Ca 0.00 0.80 -0.38 0.00 0.07 0.00 0.00 57.00 57.49 1tye n GLN 267 Cb 0.03 -3.06 0.04 0.00 2.41 0.00 0.00 30.24 29.66 1tye n GLN 267 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 1tye s PRO 268 N 5.26 3.13 -0.02 3.69 0.04 -1.26 -1.42 135.00 144.42 1tye s PRO 268 Ca 0.95 2.22 -0.34 0.00 0.04 0.00 0.00 61.00 63.86 1tye s PRO 268 Cb -0.43 -2.24 -0.12 0.00 0.04 0.00 0.00 34.50 31.75 1tye s PRO 268 CO 0.40 -1.19 1.80 -1.71 0.04 0.00 0.00 177.00 176.34 1tye n ASN 269 N -1.06 3.39 0.00 6.66 2.85 -1.26 -4.70 115.26 121.14 1tye n ASN 269 Ca 0.11 1.00 0.14 0.00 -0.11 0.00 0.00 54.58 55.72 1tye n ASN 269 Cb 0.45 -1.39 0.75 0.00 1.24 0.00 0.00 39.78 40.83 1tye n ASN 269 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 1tye n ASP 270 N 5.80 0.00 -0.99 1.20 5.75 -1.26 -4.91 116.55 122.14 1tye n ASP 270 Ca 0.21 -0.32 -0.13 0.00 -0.01 0.00 0.00 54.79 54.54 1tye n ASP 270 Cb 0.30 -0.21 -0.06 0.00 -1.03 0.00 0.00 41.12 40.12 1tye n ASP 270 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1tye n GLY 271 N 1.03 1.31 3.74 6.12 0.00 -1.26 -4.99 105.19 111.14 1tye n GLY 271 Ca 0.16 -0.17 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 1tye n GLY 271 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1tye s GLN 272 N -3.00 2.41 0.14 1.61 -0.21 -1.26 -4.92 119.66 114.44 1tye s GLN 272 Ca 0.00 -1.50 -0.30 0.00 0.02 0.00 0.00 55.36 53.57 1tye s GLN 272 Cb 0.00 -2.21 -0.07 0.00 1.00 0.00 0.00 33.01 31.73 1tye s GLN 272 CO 0.00 0.13 1.21 0.00 -2.12 0.00 0.00 175.29 174.51 1tye n HIS 274 N 3.05 0.00 -3.27 0.00 8.25 -1.26 -5.01 115.22 116.98 1tye n HIS 274 Ca 0.06 -0.48 -0.45 0.00 -0.26 0.00 0.00 57.72 56.59 1tye n HIS 274 Cb 0.45 -0.13 -0.06 0.00 1.12 0.00 0.00 29.99 31.37 1tye n HIS 274 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1tye s VAL 275 N -0.47 5.09 0.00 1.59 1.01 -1.26 -1.62 120.40 124.75 1tye s VAL 275 Ca 0.24 -1.18 0.00 0.00 0.00 0.00 0.00 61.98 61.04 1tye s VAL 275 Cb 0.27 -4.32 0.00 0.00 0.00 0.00 0.00 36.38 32.33 1tye s VAL 275 CO -0.10 -0.85 0.00 0.61 0.00 0.00 0.00 175.10 174.76 1tye n GLY 276 N 5.24 -0.03 0.17 4.51 0.00 -1.23 -4.82 105.19 109.02 1tye n GLY 276 Ca -0.12 -1.41 -0.10 0.00 0.00 0.00 0.00 46.02 44.39 1tye n GLY 276 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1tye h SER 277 N 0.00 0.46 0.05 1.61 0.02 -1.96 -2.95 113.55 110.77 1tye h SER 277 Ca 0.00 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 1tye h SER 277 Cb 0.00 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.42 1tye h SER 277 CO 0.00 0.56 0.00 -0.90 -1.14 0.00 0.00 176.83 175.35 1tye n ASP 278 N -4.67 0.00 -1.80 3.07 5.75 -1.26 -4.84 116.55 112.80 1tye n ASP 278 Ca -0.02 0.14 -0.16 0.00 -0.01 0.00 0.00 54.79 54.74 1tye n ASP 278 Cb 0.18 -0.21 -0.01 0.00 -1.03 0.00 0.00 41.12 40.06 1tye n ASP 278 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1tye n ASN 279 N -1.21 -4.70 -4.30 -1.12 3.02 -1.12 -4.93 115.26 100.90 1tye n ASN 279 Ca 0.02 -0.02 -0.26 0.00 -0.03 0.00 0.00 54.58 54.29 1tye n ASN 279 Cb 0.02 -3.82 -0.13 0.00 -0.61 0.00 0.00 39.78 35.24 1tye n ASN 279 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1tye s HIS 280 N -2.79 1.95 -0.61 3.10 3.76 -1.26 -0.89 115.29 118.56 1tye s HIS 280 Ca 0.01 -0.40 -0.27 0.00 -0.15 0.00 0.00 55.06 54.25 1tye s HIS 280 Cb -0.00 -1.11 0.01 0.00 1.11 0.00 0.00 32.58 32.59 1tye s HIS 280 CO 0.01 0.18 1.48 -0.47 -0.85 0.00 0.00 174.74 175.09 1tye s TYR 281 N -0.99 2.15 0.32 1.40 5.04 -0.78 -3.49 117.35 120.99 1tye s TYR 281 Ca 0.09 0.42 0.17 0.00 -2.44 0.00 0.00 57.07 55.30 1tye s TYR 281 Cb -0.10 -4.38 0.80 0.00 0.35 0.00 0.00 41.96 38.63 1tye s TYR 281 CO 0.04 -2.09 1.82 0.66 -1.34 0.00 0.00 175.55 174.64 1tye h SER 282 N 11.64 0.00 0.87 4.32 4.64 -1.66 -3.08 113.55 130.29 1tye h SER 282 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1tye h SER 282 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1tye h SER 282 CO 1.21 0.35 -0.01 0.00 -0.87 0.00 0.00 176.83 177.51 1tye n ALA 283 N -2.39 2.39 -0.31 5.18 0.00 -1.26 -4.27 120.51 119.85 1tye n ALA 283 Ca -0.01 -0.12 0.25 0.00 0.00 0.00 0.00 53.44 53.56 1tye n ALA 283 Cb 0.42 -1.47 0.47 0.00 0.00 0.00 0.00 19.45 18.87 1tye n ALA 283 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1tye n SER 284 N -1.44 0.18 -0.20 0.00 2.88 -1.16 -0.04 113.62 113.84 1tye n SER 284 Ca 0.09 1.59 0.12 0.00 -1.33 0.00 0.00 58.87 59.34 1tye n SER 284 Cb 0.31 -0.71 0.23 0.00 -0.75 0.00 0.00 64.21 63.30 1tye n SER 284 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1tye n THR 285 N -5.24 0.00 -0.00 2.46 -2.24 -1.26 -4.43 114.28 103.56 1tye n THR 285 Ca 0.31 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.99 1tye n THR 285 Cb 1.06 0.56 -0.01 0.00 -2.10 0.00 0.00 70.33 69.84 1tye n THR 285 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1tye n THR 286 N -0.84 0.02 -4.37 4.28 -2.24 0.95 -4.88 114.28 107.19 1tye n THR 286 Ca 0.09 -0.04 -0.32 0.00 -2.27 0.00 0.00 64.05 61.52 1tye n THR 286 Cb 0.36 0.15 -0.10 0.00 -2.10 0.00 0.00 70.33 68.64 1tye n THR 286 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1tye s MET 287 N -2.09 2.53 0.86 -0.78 0.00 0.62 -4.43 119.30 116.02 1tye s MET 287 Ca -0.01 -0.76 -0.12 0.00 0.00 0.00 0.00 55.69 54.81 1tye s MET 287 Cb 0.01 -2.51 0.10 0.00 0.00 0.00 0.00 34.83 32.44 1tye s MET 287 CO 0.06 0.59 1.11 0.34 0.00 0.00 0.00 175.02 177.12 1tye s ASP 288 N -1.63 3.97 0.64 1.11 -1.08 -0.51 -4.74 116.67 114.43 1tye s ASP 288 Ca 0.19 1.19 -0.16 0.00 -0.52 0.00 0.00 52.55 53.24 1tye s ASP 288 Cb -0.11 -1.85 -0.01 0.00 -1.46 0.00 0.00 42.92 39.49 1tye s ASP 288 CO 0.10 -2.29 1.14 -0.31 0.52 0.00 0.00 175.17 174.33 1tye s TYR 289 N -3.18 2.51 0.45 -5.34 1.51 -1.26 -4.21 117.35 107.84 1tye s TYR 289 Ca 0.62 1.56 -0.20 0.00 -1.01 0.00 0.00 57.07 58.04 1tye s TYR 289 Cb -0.15 -3.27 -0.10 0.00 -0.11 0.00 0.00 41.96 38.33 1tye s TYR 289 CO 0.54 -1.86 0.97 -1.25 -1.11 0.00 0.00 175.55 172.84 1tye s PRO 290 N -3.84 4.09 0.57 -1.71 0.04 -1.26 -3.99 135.00 128.89 1tye s PRO 290 Ca 0.70 1.16 -0.07 0.00 0.04 0.00 0.00 61.00 62.83 1tye s PRO 290 Cb -0.23 -2.15 -0.01 0.00 0.04 0.00 0.00 34.50 32.14 1tye s PRO 290 CO 0.39 -0.16 0.90 -1.54 0.04 0.00 0.00 177.00 176.63 1tye s SER 291 N -2.24 5.88 0.23 6.66 1.04 -1.26 -2.89 113.70 121.11 1tye s SER 291 Ca 0.63 0.92 -0.07 0.00 0.48 0.00 0.00 55.95 57.91 1tye s SER 291 Cb -0.11 -2.01 0.36 0.00 0.10 0.00 0.00 66.02 64.37 1tye s SER 291 CO 0.17 -0.91 1.74 -0.07 0.98 0.00 0.00 173.24 175.15 1tye h LEU 292 N -0.12 0.28 -0.21 2.42 3.38 -1.97 -2.60 115.31 116.49 1tye h LEU 292 Ca -0.46 0.09 0.04 0.00 0.09 0.00 0.00 57.88 57.65 1tye h LEU 292 Cb 1.23 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 42.00 1tye h LEU 292 CO 0.61 0.14 -0.06 1.23 0.09 0.00 0.00 178.44 180.45 1tye h GLY 293 N 0.45 0.13 1.08 0.83 0.00 -1.93 -1.61 103.07 102.02 1tye h GLY 293 Ca 0.36 0.08 0.03 0.00 0.00 0.00 0.00 47.33 47.80 1tye h GLY 293 CO -0.34 -0.09 0.56 -2.00 0.00 0.00 0.00 176.54 174.67 1tye h LEU 294 N -0.02 0.93 0.51 3.11 6.46 -1.88 -1.41 115.31 123.01 1tye h LEU 294 Ca 0.10 -0.01 -0.03 0.00 -0.12 0.00 0.00 57.88 57.82 1tye h LEU 294 Cb 0.17 -0.22 0.01 0.00 -0.73 0.00 0.00 40.66 39.89 1tye h LEU 294 CO -0.22 0.65 -0.25 0.24 -0.62 0.00 0.00 178.44 178.24 1tye h MET 295 N 1.08 -0.66 -0.49 1.25 2.86 -1.05 -2.24 114.93 115.69 1tye h MET 295 Ca 0.33 0.05 0.09 0.00 -2.06 0.00 0.00 59.70 58.11 1tye h MET 295 Cb -0.02 0.15 -0.08 0.00 0.06 0.00 0.00 31.60 31.71 1tye h MET 295 CO -0.09 -0.41 -0.01 1.15 1.06 0.00 0.00 176.91 178.61 1tye h THR 296 N -0.75 0.62 -0.06 2.22 2.02 -0.95 0.14 112.91 116.15 1tye h THR 296 Ca -0.07 -0.04 0.04 0.00 0.77 0.00 0.00 66.41 67.11 1tye h THR 296 Cb 0.56 0.50 -0.05 0.00 -1.74 0.00 0.00 68.15 67.42 1tye h THR 296 CO 0.12 0.02 -0.22 -0.08 0.37 0.00 0.00 175.52 175.73 1tye h GLU 297 N 0.11 -0.30 -0.61 6.66 4.81 -1.22 -1.48 114.58 122.55 1tye h GLU 297 Ca 0.24 0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.42 1tye h GLU 297 Cb 0.36 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 1tye h GLU 297 CO -0.41 -0.20 0.07 0.87 -0.73 0.00 0.00 179.01 178.61 1tye h LYS 298 N -0.32 1.00 -0.81 1.92 1.79 -0.76 0.61 116.57 120.00 1tye h LYS 298 Ca 0.08 -0.27 -0.02 0.00 -2.18 0.00 0.00 60.65 58.26 1tye h LYS 298 Cb 0.42 -0.12 -0.04 0.00 -1.58 0.00 0.00 32.23 30.92 1tye h LYS 298 CO -0.24 0.94 0.43 -0.07 -1.08 0.00 0.00 179.45 179.44 1tye h LEU 299 N 0.94 1.02 -0.05 2.94 3.38 -0.43 -1.63 115.31 121.48 1tye h LEU 299 Ca 0.18 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 1tye h LEU 299 Cb 0.45 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1tye h LEU 299 CO 0.02 0.83 -0.28 -1.28 0.09 0.00 0.00 178.44 177.81 1tye h SER 300 N 1.14 0.33 -0.66 -0.43 0.87 -1.01 0.10 113.55 113.88 1tye h SER 300 Ca 0.28 -0.67 0.15 0.00 -1.23 0.00 0.00 61.79 60.32 1tye h SER 300 Cb 0.05 -0.10 -0.04 0.00 -0.44 0.00 0.00 62.40 61.87 1tye h SER 300 CO -0.04 0.95 0.45 -0.61 -0.53 0.00 0.00 176.83 177.05 1tye h GLN 301 N -0.27 0.24 -0.12 2.24 4.15 -0.62 -1.29 115.11 119.44 1tye h GLN 301 Ca -0.02 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.38 1tye h GLN 301 Cb 0.95 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.59 1tye h GLN 301 CO 0.06 0.16 0.00 1.63 -1.93 0.00 0.00 178.83 178.75 1tye n LYS 302 N -4.43 1.70 -3.53 1.69 4.76 -0.63 -5.01 118.16 112.69 1tye n LYS 302 Ca 0.12 -1.70 -0.23 0.00 -2.87 0.00 0.00 58.31 53.63 1tye n LYS 302 Cb 0.56 -1.36 0.04 0.00 -1.84 0.00 0.00 35.03 32.43 1tye n LYS 302 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1tye n ASN 303 N 1.02 -5.89 -4.19 4.39 4.13 -0.49 -4.99 115.26 109.25 1tye n ASN 303 Ca 0.12 -0.81 -0.32 0.00 1.68 0.00 0.00 54.58 55.24 1tye n ASN 303 Cb 0.46 -3.76 -0.17 0.00 -1.54 0.00 0.00 39.78 34.77 1tye n ASN 303 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1tye s ILE 304 N -3.32 2.02 -0.42 2.41 1.01 -0.07 -4.14 121.20 118.69 1tye s ILE 304 Ca 0.34 -0.98 -0.19 0.00 0.00 0.00 0.00 60.65 59.82 1tye s ILE 304 Cb -0.11 -1.77 0.02 0.00 0.01 0.00 0.00 42.46 40.61 1tye s ILE 304 CO 0.83 0.55 0.53 0.20 0.00 0.00 0.00 174.94 177.05 1tye s ASN 305 N 0.57 6.26 -0.09 3.58 0.01 0.78 -4.70 114.94 121.35 1tye s ASN 305 Ca -0.13 -0.47 -0.28 0.00 -0.71 0.00 0.00 52.86 51.27 1tye s ASN 305 Cb -0.17 -2.27 -0.02 0.00 0.41 0.00 0.00 41.25 39.20 1tye s ASN 305 CO 0.04 -0.65 0.91 -0.22 -1.51 0.00 0.00 177.10 175.67 1tye s LEU 306 N 2.44 4.27 -0.08 0.60 2.96 -1.26 -0.96 118.68 126.65 1tye s LEU 306 Ca 0.17 1.43 0.04 0.00 -0.22 0.00 0.00 54.13 55.55 1tye s LEU 306 Cb -0.16 -3.41 0.00 0.00 0.50 0.00 0.00 46.19 43.12 1tye s LEU 306 CO 0.16 -0.34 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.01 1tye s ILE 307 N 1.59 1.82 -0.40 6.68 1.01 -0.30 -2.79 121.20 128.82 1tye s ILE 307 Ca 0.45 -0.89 -0.14 0.00 0.00 0.00 0.00 60.65 60.06 1tye s ILE 307 Cb -0.18 -1.58 0.01 0.00 0.01 0.00 0.00 42.46 40.72 1tye s ILE 307 CO 0.19 0.51 0.29 -0.36 0.00 0.00 0.00 174.94 175.57 1tye s PHE 308 N 0.30 3.24 -0.58 3.97 0.08 -0.42 -0.78 117.98 123.79 1tye s PHE 308 Ca -0.15 -0.55 -0.11 0.00 0.12 0.00 0.00 56.93 56.24 1tye s PHE 308 Cb -0.16 -2.57 0.15 0.00 -0.57 0.00 0.00 43.02 39.87 1tye s PHE 308 CO 0.07 -0.56 0.48 0.00 -0.10 0.00 0.00 175.22 175.11 1tye s ALA 309 N 1.68 3.62 0.16 5.36 0.00 0.18 0.99 121.76 133.75 1tye s ALA 309 Ca 0.05 -2.78 0.08 0.00 0.00 0.00 0.00 51.96 49.31 1tye s ALA 309 Cb -0.19 -3.07 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 1tye s ALA 309 CO 0.10 -2.03 -0.17 0.14 0.00 0.00 0.00 175.76 173.80 1tye s VAL 310 N 1.03 1.68 0.61 0.00 -7.23 -0.53 -3.21 120.40 112.75 1tye s VAL 310 Ca 0.09 -1.91 -0.18 0.00 -1.81 0.00 0.00 61.98 58.17 1tye s VAL 310 Cb -0.23 -1.80 -0.03 0.00 0.56 0.00 0.00 36.38 34.88 1tye s VAL 310 CO -0.02 -0.38 1.16 0.42 -0.31 0.00 0.00 175.10 175.97 1tye s THR 311 N -2.21 2.87 0.57 5.32 -4.23 -1.00 -0.58 115.64 116.37 1tye s THR 311 Ca 0.15 0.50 0.28 0.00 -1.18 0.00 0.00 61.69 61.44 1tye s THR 311 Cb -0.05 -3.13 0.39 0.00 1.34 0.00 0.00 72.50 71.06 1tye s THR 311 CO 0.06 -0.16 1.96 1.05 -0.54 0.00 0.00 174.62 176.99 1tye h GLU 312 N 0.65 0.00 0.00 3.99 -0.00 -1.94 -1.09 114.58 116.20 1tye h GLU 312 Ca -0.49 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.87 1tye h GLU 312 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.03 1tye h GLU 312 CO 0.55 0.00 0.00 0.27 -0.00 0.00 0.00 179.01 179.83 1tye n ASN 313 N -3.98 0.62 -0.09 3.06 6.94 -1.26 -3.05 115.26 117.50 1tye n ASN 313 Ca 0.09 0.64 0.02 0.00 -0.02 0.00 0.00 54.58 55.31 1tye n ASN 313 Cb 0.62 -0.78 0.03 0.00 -2.36 0.00 0.00 39.78 37.29 1tye n ASN 313 CO 0.00 0.00 0.00 0.55 -1.03 0.00 0.00 177.26 176.78 1tye n VAL 314 N -2.17 0.71 0.05 3.53 3.14 -0.44 -4.85 118.33 118.30 1tye n VAL 314 Ca 0.02 -0.78 -0.12 0.00 -2.96 0.00 0.00 64.34 60.51 1tye n VAL 314 Cb 0.24 0.52 -0.08 0.00 -1.06 0.00 0.00 33.84 33.46 1tye n VAL 314 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 1tye h VAL 315 N 1.96 1.01 -0.47 1.55 2.07 -1.40 -2.61 116.25 118.36 1tye h VAL 315 Ca 0.00 -0.17 0.07 0.00 0.82 0.00 0.00 66.70 67.41 1tye h VAL 315 Cb 0.88 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 31.72 1tye h VAL 315 CO 0.00 0.04 0.14 0.78 0.02 0.00 0.00 177.57 178.55 1tye h ASN 316 N -0.13 0.10 -0.68 0.57 2.35 -1.89 -0.47 115.58 115.44 1tye h ASN 316 Ca -0.01 0.07 0.10 0.00 -0.55 0.00 0.00 56.30 55.91 1tye h ASN 316 Cb 0.12 0.07 -0.07 0.00 0.05 0.00 0.00 38.32 38.48 1tye h ASN 316 CO 0.01 0.09 0.31 0.25 -1.65 0.00 0.00 177.43 176.43 1tye h LEU 317 N 0.29 0.36 -0.18 1.61 6.46 -1.89 0.13 115.31 122.09 1tye h LEU 317 Ca 0.23 0.07 0.00 0.00 -0.12 0.00 0.00 57.88 58.06 1tye h LEU 317 Cb 0.26 0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.21 1tye h LEU 317 CO -0.26 0.20 0.00 1.88 -0.62 0.00 0.00 178.44 179.64 1tye h TYR 318 N 0.52 0.00 -0.07 1.25 -1.99 -0.97 -2.20 116.97 113.51 1tye h TYR 318 Ca 0.34 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.97 1tye h TYR 318 Cb 0.39 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.13 1tye h TYR 318 CO -0.13 0.00 -0.34 1.96 -0.00 0.00 0.00 178.16 179.65 1tye h GLN 319 N 0.00 0.35 -0.90 4.88 4.20 0.23 -0.76 115.11 123.10 1tye h GLN 319 Ca 0.00 -0.28 0.03 0.00 0.06 0.00 0.00 58.65 58.46 1tye h GLN 319 Cb 0.83 0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.61 1tye h GLN 319 CO 0.00 0.93 0.59 -0.91 -0.67 0.00 0.00 178.83 178.77 1tye h ASN 320 N -0.14 0.99 0.91 1.46 2.35 -0.88 0.10 115.58 120.37 1tye h ASN 320 Ca -0.02 -0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.62 1tye h ASN 320 Cb 0.99 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 39.11 1tye h ASN 320 CO 0.07 0.69 -0.43 1.88 -1.65 0.00 0.00 177.43 177.98 1tye h TYR 321 N 1.15 0.00 -0.29 1.19 0.05 -1.37 -2.95 116.97 114.75 1tye h TYR 321 Ca 0.35 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 59.07 1tye h TYR 321 Cb -0.02 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.71 1tye h TYR 321 CO -0.00 0.43 -0.07 1.03 -1.05 0.00 0.00 178.16 178.50 1tye h SER 322 N 0.00 0.45 0.65 3.88 0.87 0.74 -2.45 113.55 117.67 1tye h SER 322 Ca -0.00 -0.10 -0.13 0.00 -1.23 0.00 0.00 61.79 60.33 1tye h SER 322 Cb 1.00 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.83 1tye h SER 322 CO 0.06 0.57 -0.63 -0.33 -0.53 0.00 0.00 176.83 175.96 1tye h GLU 323 N 0.45 0.00 -0.00 2.24 5.08 -1.17 -2.90 114.58 118.27 1tye h GLU 323 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1tye h GLU 323 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1tye h GLU 323 CO 0.02 0.63 -0.03 1.28 -1.00 0.00 0.00 179.01 179.91 1tye n LEU 324 N -3.77 0.25 -3.49 1.33 4.77 -0.95 -4.28 117.00 110.86 1tye n LEU 324 Ca -0.01 0.04 -0.29 0.00 -0.03 0.00 0.00 56.01 55.72 1tye n LEU 324 Cb 0.63 -0.13 -0.13 0.00 -2.33 0.00 0.00 43.42 41.47 1tye n LEU 324 CO 0.42 0.04 -0.32 -0.63 -1.33 0.00 0.00 177.39 175.58 1tye s ILE 325 N -2.28 0.16 0.63 -0.08 1.01 -1.05 -4.90 121.20 114.68 1tye s ILE 325 Ca 0.37 -1.58 -0.19 0.00 0.00 0.00 0.00 60.65 59.26 1tye s ILE 325 Cb 0.21 -1.13 -0.02 0.00 0.01 0.00 0.00 42.46 41.53 1tye s ILE 325 CO 0.42 -0.94 1.28 -2.65 0.00 0.00 0.00 174.94 173.05 1tye n PRO 326 N 4.24 1.21 -0.90 2.79 -0.02 -1.25 -3.43 135.00 137.64 1tye n PRO 326 Ca 0.09 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1tye n PRO 326 Cb 0.38 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 1tye n PRO 326 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1tye n GLY 327 N 0.92 0.63 3.50 -1.23 0.00 -1.26 -5.04 105.19 102.71 1tye n GLY 327 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 1tye n GLY 327 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tye s THR 328 N -2.36 3.76 0.24 2.61 -4.23 -1.22 -4.57 115.64 109.87 1tye s THR 328 Ca 0.00 -0.41 0.05 0.00 -1.18 0.00 0.00 61.69 60.15 1tye s THR 328 Cb 0.00 -2.62 -0.03 0.00 1.34 0.00 0.00 72.50 71.19 1tye s THR 328 CO 0.00 0.51 0.32 0.42 -0.54 0.00 0.00 174.62 175.33 1tye s THR 329 N 0.18 5.08 -0.07 3.99 -4.23 -1.12 -4.89 115.64 114.58 1tye s THR 329 Ca -0.03 -1.07 0.01 0.00 -1.18 0.00 0.00 61.69 59.42 1tye s THR 329 Cb -0.14 -3.75 0.02 0.00 1.34 0.00 0.00 72.50 69.97 1tye s THR 329 CO 0.03 -0.32 -0.07 -0.69 -0.54 0.00 0.00 174.62 173.03 1tye s VAL 330 N -2.00 0.80 0.20 2.29 1.01 -1.26 -1.30 120.40 120.15 1tye s VAL 330 Ca 0.34 -0.23 0.11 0.00 0.00 0.00 0.00 61.98 62.19 1tye s VAL 330 Cb -0.09 -0.81 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 1tye s VAL 330 CO 0.28 0.30 -0.22 -0.83 0.00 0.00 0.00 175.10 174.63 1tye s GLY 331 N 1.15 1.69 -0.43 4.51 0.00 0.28 -4.95 107.32 109.57 1tye s GLY 331 Ca -0.07 -1.66 -0.19 0.00 0.00 0.00 0.00 44.72 42.81 1tye s GLY 331 CO -0.01 -1.70 0.53 0.54 0.00 0.00 0.00 173.10 172.45 1tye s VAL 332 N -1.88 4.98 0.17 1.40 0.11 -1.26 -1.45 120.40 122.46 1tye s VAL 332 Ca 0.22 -0.17 -0.30 0.00 -2.93 0.00 0.00 61.98 58.79 1tye s VAL 332 Cb -0.07 -4.12 -0.08 0.00 -1.53 0.00 0.00 36.38 30.58 1tye s VAL 332 CO 0.10 -0.51 1.24 -0.22 -3.33 0.00 0.00 175.10 172.38 1tye s LEU 333 N 2.42 4.43 0.00 2.54 2.96 0.25 -4.43 118.68 126.84 1tye s LEU 333 Ca 0.16 2.27 0.00 0.00 -0.22 0.00 0.00 54.13 56.34 1tye s LEU 333 Cb -0.16 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.93 1tye s LEU 333 CO 0.16 -0.44 0.00 -1.54 -1.32 0.00 0.00 176.35 173.20 1tye n SER 334 N 2.76 0.00 -0.09 3.68 3.41 -1.26 -4.21 113.62 117.92 1tye n SER 334 Ca 0.06 -0.87 -0.04 0.00 -0.26 0.00 0.00 58.87 57.76 1tye n SER 334 Cb 0.44 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.57 1tye n SER 334 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 1tye h MET 335 N 0.00 0.73 -6.08 4.33 2.86 -1.94 -3.41 114.93 111.43 1tye h MET 335 Ca 0.00 -0.20 -0.57 0.00 -2.06 0.00 0.00 59.70 56.87 1tye h MET 335 Cb 0.00 -0.08 -0.05 0.00 0.06 0.00 0.00 31.60 31.52 1tye h MET 335 CO 0.00 0.76 0.36 0.34 1.06 0.00 0.00 176.91 179.43 1tye s ASP 336 N -6.67 7.06 0.00 1.22 -1.08 -1.26 -4.97 116.67 110.97 1tye s ASP 336 Ca -0.09 1.30 0.21 0.00 -0.52 0.00 0.00 52.55 53.46 1tye s ASP 336 Cb 0.15 -2.48 0.50 0.00 -1.46 0.00 0.00 42.92 39.63 1tye s ASP 336 CO 0.80 -0.33 1.43 -1.54 0.52 0.00 0.00 175.17 176.05 1tye n SER 337 N 4.73 3.59 0.10 -0.34 3.41 -1.26 -4.64 113.62 119.21 1tye n SER 337 Ca 0.04 -1.98 -0.16 0.00 -0.26 0.00 0.00 58.87 56.51 1tye n SER 337 Cb 0.50 -0.34 -0.10 0.00 -0.26 0.00 0.00 64.21 64.00 1tye n SER 337 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1tye h SER 338 N 4.11 -1.60 -0.13 4.04 0.02 -1.95 -2.54 113.55 115.51 1tye h SER 338 Ca 0.00 0.17 0.02 0.00 -0.84 0.00 0.00 61.79 61.13 1tye h SER 338 Cb 0.95 0.59 -0.03 0.00 0.14 0.00 0.00 62.40 64.06 1tye h SER 338 CO 0.00 -0.55 -0.18 -1.13 -1.14 0.00 0.00 176.83 173.83 1tye h ASN 339 N -0.74 -0.60 0.15 3.07 -0.73 -1.88 -2.00 115.58 112.85 1tye h ASN 339 Ca -0.00 0.08 -0.01 0.00 1.87 0.00 0.00 56.30 58.23 1tye h ASN 339 Cb 0.75 0.25 -0.00 0.00 0.27 0.00 0.00 38.32 39.58 1tye h ASN 339 CO -0.30 -0.13 -0.05 0.58 -0.37 0.00 0.00 177.43 177.17 1tye h VAL 340 N -0.13 0.51 -0.12 2.57 2.07 -1.77 -2.04 116.25 117.33 1tye h VAL 340 Ca 0.02 -0.22 -0.16 0.00 0.82 0.00 0.00 66.70 67.17 1tye h VAL 340 Cb 0.19 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 1tye h VAL 340 CO -0.19 0.05 -0.59 -0.07 0.02 0.00 0.00 177.57 176.78 1tye h LEU 341 N 0.00 0.46 -0.71 2.57 -0.00 -0.97 -3.09 115.31 113.57 1tye h LEU 341 Ca -0.00 -0.26 0.09 0.00 -0.00 0.00 0.00 57.88 57.71 1tye h LEU 341 Cb 0.14 -0.13 -0.07 0.00 -0.00 0.00 0.00 40.66 40.60 1tye h LEU 341 CO 0.01 0.95 0.36 1.56 -0.00 0.00 0.00 178.44 181.32 1tye h GLN 342 N 0.30 0.61 -0.39 1.13 1.08 -0.66 0.01 115.11 117.18 1tye h GLN 342 Ca -0.00 -0.04 0.08 0.00 -1.45 0.00 0.00 58.65 57.24 1tye h GLN 342 Cb 1.12 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 28.40 1tye h GLN 342 CO 0.10 0.40 0.27 -0.07 -0.95 0.00 0.00 178.83 178.59 1tye h LEU 343 N 0.63 0.16 -0.11 1.46 3.38 -1.58 0.17 115.31 119.42 1tye h LEU 343 Ca 0.34 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 58.08 1tye h LEU 343 Cb 0.33 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.05 1tye h LEU 343 CO -0.25 0.10 -1.00 0.40 0.09 0.00 0.00 178.44 177.78 1tye h ILE 344 N 0.18 1.40 0.43 1.22 1.08 -1.08 -2.21 117.51 118.54 1tye h ILE 344 Ca 0.18 -2.52 -0.02 0.00 -0.39 0.00 0.00 64.86 62.11 1tye h ILE 344 Cb 0.48 2.50 0.00 0.00 -3.07 0.00 0.00 36.82 36.74 1tye h ILE 344 CO -0.03 0.75 -0.21 0.58 -0.69 0.00 0.00 178.15 178.55 1tye h VAL 345 N 0.22 0.55 -0.22 1.67 2.07 -0.21 -2.86 116.25 117.47 1tye h VAL 345 Ca -0.10 -0.32 0.06 0.00 0.82 0.00 0.00 66.70 67.17 1tye h VAL 345 Cb 1.66 0.69 -0.07 0.00 -1.52 0.00 0.00 31.29 32.05 1tye h VAL 345 CO 0.18 0.06 -0.28 0.44 0.02 0.00 0.00 177.57 177.98 1tye h ASP 346 N -0.78 -0.88 -1.00 0.57 3.32 -0.81 -0.80 116.42 116.04 1tye h ASP 346 Ca -0.06 0.15 0.26 0.00 0.02 0.00 0.00 57.03 57.39 1tye h ASP 346 Cb 0.54 0.40 -0.13 0.00 0.22 0.00 0.00 39.33 40.36 1tye h ASP 346 CO 0.10 -0.31 0.59 0.00 -1.72 0.00 0.00 179.24 177.90 1tye h ALA 347 N 0.67 1.81 -0.04 3.45 0.00 -1.40 -0.33 119.26 123.42 1tye h ALA 347 Ca 0.13 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1tye h ALA 347 Cb 0.50 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1tye h ALA 347 CO -0.39 -0.31 -0.01 -0.92 0.00 0.00 0.00 179.25 177.62 1tye h TYR 348 N 0.55 0.10 -0.02 0.00 3.20 -0.93 -3.04 116.97 116.83 1tye h TYR 348 Ca 0.66 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.51 1tye h TYR 348 Cb 1.28 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 39.53 1tye h TYR 348 CO -0.01 0.44 0.06 0.78 -1.64 0.00 0.00 178.16 177.79 1tye h GLY 349 N -0.27 0.00 0.58 1.82 0.00 -0.36 -0.58 103.07 104.26 1tye h GLY 349 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1tye h GLY 349 CO 0.00 0.00 -0.19 0.28 0.00 0.00 0.00 176.54 176.63 1tye n LYS 350 N -3.33 0.74 -2.33 4.80 5.02 -0.72 -4.90 118.16 117.43 1tye n LYS 350 Ca -0.02 -0.36 -0.41 0.00 -2.02 0.00 0.00 58.31 55.50 1tye n LYS 350 Cb 0.14 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.62 1tye n LYS 350 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1tye s ILE 351 N -2.51 3.47 -0.02 -0.18 1.01 -0.23 -5.04 121.20 117.70 1tye s ILE 351 Ca 0.26 1.23 0.05 0.00 0.00 0.00 0.00 60.65 62.19 1tye s ILE 351 Cb 0.20 -3.79 -0.01 0.00 0.01 0.00 0.00 42.46 38.87 1tye s ILE 351 CO 0.50 0.19 -0.16 -0.13 0.00 0.00 0.00 174.94 175.35 1tye s ARG 352 N -0.23 1.44 0.54 2.79 3.00 -1.26 -4.75 118.95 120.47 1tye s ARG 352 Ca 0.54 -0.57 0.03 0.00 0.00 0.00 0.00 55.73 55.72 1tye s ARG 352 Cb -0.34 -1.34 0.02 0.00 0.00 0.00 0.00 34.95 33.29 1tye s ARG 352 CO 0.37 0.31 0.19 -1.54 0.00 0.00 0.00 175.30 174.63 1tye s SER 353 N -0.22 4.37 -0.08 0.23 1.04 -0.93 -4.93 113.70 113.18 1tye s SER 353 Ca 0.03 -1.51 -0.09 0.00 0.48 0.00 0.00 55.95 54.85 1tye s SER 353 Cb -0.08 0.60 0.02 0.00 0.10 0.00 0.00 66.02 66.67 1tye s SER 353 CO 0.00 -1.03 0.24 -1.59 0.98 0.00 0.00 173.24 171.85 1tye s LYS 354 N -4.09 0.34 -0.44 4.02 0.00 -1.26 -3.12 119.74 115.19 1tye s LYS 354 Ca 0.16 0.23 -0.15 0.00 0.00 0.00 0.00 55.97 56.21 1tye s LYS 354 Cb -0.01 0.16 0.05 0.00 0.00 0.00 0.00 37.83 38.03 1tye s LYS 354 CO 0.10 -0.05 0.35 0.08 0.00 0.00 0.00 175.35 175.82 1tye s VAL 355 N -0.13 5.24 -0.27 1.79 1.01 -0.59 -4.88 120.40 122.58 1tye s VAL 355 Ca -0.02 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.13 1tye s VAL 355 Cb -0.03 -4.03 0.07 0.00 0.00 0.00 0.00 36.38 32.39 1tye s VAL 355 CO 0.01 -0.45 -0.06 -0.70 0.00 0.00 0.00 175.10 173.90 1tye s GLU 356 N 1.68 1.90 0.40 2.72 2.12 -1.26 -1.44 118.70 124.81 1tye s GLU 356 Ca 0.05 -1.36 -0.25 0.00 0.36 0.00 0.00 54.97 53.76 1tye s GLU 356 Cb -0.22 -2.86 -0.08 0.00 0.26 0.00 0.00 34.13 31.23 1tye s GLU 356 CO 0.08 -0.66 1.19 -0.51 -0.54 0.00 0.00 175.26 174.83 1tye s LEU 357 N 1.14 4.20 0.03 2.70 1.43 -1.03 -1.98 118.68 125.18 1tye s LEU 357 Ca -0.04 2.41 0.03 0.00 -1.03 0.00 0.00 54.13 55.50 1tye s LEU 357 Cb -0.19 -3.99 -0.02 0.00 0.03 0.00 0.00 46.19 42.01 1tye s LEU 357 CO -0.07 -0.70 -0.09 -1.83 0.23 0.00 0.00 176.35 173.89 1tye s GLU 358 N -2.27 0.62 -0.28 1.70 -1.05 -0.92 -4.93 118.70 111.57 1tye s GLU 358 Ca 0.57 -0.64 -0.03 0.00 -0.15 0.00 0.00 54.97 54.72 1tye s GLU 358 Cb -0.32 -0.51 0.03 0.00 -0.44 0.00 0.00 34.13 32.89 1tye s GLU 358 CO 0.41 0.12 -0.00 0.08 0.95 0.00 0.00 175.26 176.81 1tye s VAL 359 N -0.95 3.24 -0.07 1.83 1.01 -1.26 -2.31 120.40 121.89 1tye s VAL 359 Ca -0.04 -1.02 -0.04 0.00 0.00 0.00 0.00 61.98 60.89 1tye s VAL 359 Cb -0.08 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 1tye s VAL 359 CO 0.01 0.08 0.09 -0.13 0.00 0.00 0.00 175.10 175.15 1tye s ARG 360 N 1.36 3.22 -0.63 2.72 0.52 -0.16 -4.79 118.95 121.19 1tye s ARG 360 Ca -0.00 -0.31 -0.18 0.00 -0.52 0.00 0.00 55.73 54.72 1tye s ARG 360 Cb -0.18 -2.99 0.03 0.00 0.52 0.00 0.00 34.95 32.33 1tye s ARG 360 CO -0.01 0.72 0.64 -0.40 0.02 0.00 0.00 175.30 176.26 1tye n ASP 361 N 1.76 -5.58 -4.23 0.23 5.75 -1.26 -1.98 116.55 111.24 1tye n ASP 361 Ca -0.17 -0.45 -0.32 0.00 -0.01 0.00 0.00 54.79 53.84 1tye n ASP 361 Cb 0.54 -2.22 -0.17 0.00 -1.03 0.00 0.00 41.12 38.24 1tye n ASP 361 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1tye s LEU 362 N -3.66 2.08 0.44 -2.12 0.20 -1.26 -3.91 118.68 110.45 1tye s LEU 362 Ca 0.18 -0.54 -0.21 0.00 0.69 0.00 0.00 54.13 54.25 1tye s LEU 362 Cb -0.02 -1.38 -0.13 0.00 -0.43 0.00 0.00 46.19 44.23 1tye s LEU 362 CO 0.87 0.19 0.42 -2.65 -0.29 0.00 0.00 176.35 174.89 1tye n PRO 363 N 3.32 0.43 0.19 0.98 -0.02 -1.26 -4.85 135.00 133.79 1tye n PRO 363 Ca -0.18 0.16 0.03 0.00 -2.02 0.00 0.00 63.50 61.49 1tye n PRO 363 Cb 0.53 -1.42 0.41 0.00 -0.02 0.00 0.00 33.50 33.00 1tye n PRO 363 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1tye h GLU 364 N 0.59 0.03 -1.09 -0.52 4.22 -2.03 -2.66 114.58 113.12 1tye h GLU 364 Ca -0.41 -0.01 -0.18 0.00 0.08 0.00 0.00 59.36 58.84 1tye h GLU 364 Cb 1.41 -0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.55 1tye h GLU 364 CO 0.49 0.31 0.24 -0.85 -2.18 0.00 0.00 179.01 177.02 1tye n GLU 365 N -4.19 1.45 -3.78 1.92 0.00 -1.26 -4.78 120.64 109.99 1tye n GLU 365 Ca -0.02 -1.04 -0.13 0.00 0.00 0.00 0.00 57.16 55.97 1tye n GLU 365 Cb 0.34 -1.41 -0.12 0.00 0.00 0.00 0.00 31.44 30.25 1tye n GLU 365 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 1tye s LEU 366 N -1.15 0.97 0.01 -1.84 0.20 -1.00 -2.87 118.68 112.99 1tye s LEU 366 Ca 0.20 0.49 0.00 0.00 0.69 0.00 0.00 54.13 55.51 1tye s LEU 366 Cb 0.17 0.81 -0.01 0.00 -0.43 0.00 0.00 46.19 46.73 1tye s LEU 366 CO 0.03 -0.10 -0.02 -0.94 -0.29 0.00 0.00 176.35 175.03 1tye s SER 367 N 0.31 0.21 0.37 3.68 1.04 -0.22 -4.78 113.70 114.32 1tye s SER 367 Ca -0.02 -0.16 0.08 0.00 0.48 0.00 0.00 55.95 56.33 1tye s SER 367 Cb -0.03 0.01 -0.04 0.00 0.10 0.00 0.00 66.02 66.06 1tye s SER 367 CO -0.01 -0.07 0.19 -0.76 0.98 0.00 0.00 173.24 173.56 1tye s LEU 368 N -0.45 3.23 -0.13 2.42 1.43 -1.26 -1.09 118.68 122.83 1tye s LEU 368 Ca -0.04 -0.87 -0.16 0.00 -1.03 0.00 0.00 54.13 52.03 1tye s LEU 368 Cb -0.03 -1.68 0.04 0.00 0.03 0.00 0.00 46.19 44.55 1tye s LEU 368 CO -0.00 -0.43 0.42 -0.94 0.23 0.00 0.00 176.35 175.63 1tye s SER 369 N -3.90 -0.41 0.10 2.29 1.04 -1.00 -4.99 113.70 106.82 1tye s SER 369 Ca 0.40 0.71 0.09 0.00 0.48 0.00 0.00 55.95 57.63 1tye s SER 369 Cb -0.00 0.75 -0.03 0.00 0.10 0.00 0.00 66.02 66.83 1tye s SER 369 CO 0.23 -0.24 -0.22 -0.36 0.98 0.00 0.00 173.24 173.64 1tye s PHE 370 N -0.16 1.88 -0.43 5.02 0.40 -1.26 -1.92 117.98 121.52 1tye s PHE 370 Ca -0.03 -0.41 0.02 0.00 -0.60 0.00 0.00 56.93 55.91 1tye s PHE 370 Cb -0.03 -1.04 0.13 0.00 0.51 0.00 0.00 43.02 42.59 1tye s PHE 370 CO 0.02 0.21 0.22 -0.80 0.70 0.00 0.00 175.22 175.57 1tye s ASN 371 N -1.83 3.73 0.48 1.36 0.01 -0.31 0.59 114.94 118.97 1tye s ASN 371 Ca 0.08 -2.52 -0.20 0.00 -0.71 0.00 0.00 52.86 49.51 1tye s ASN 371 Cb -0.10 -1.05 -0.09 0.00 0.41 0.00 0.00 41.25 40.43 1tye s ASN 371 CO 0.04 -0.28 1.02 0.00 -1.51 0.00 0.00 177.10 176.37 1tye s ALA 372 N 0.48 2.90 -0.31 0.60 0.00 -1.11 -1.87 121.76 122.46 1tye s ALA 372 Ca 0.17 0.55 -0.03 0.00 0.00 0.00 0.00 51.96 52.65 1tye s ALA 372 Cb -0.24 -3.23 0.11 0.00 0.00 0.00 0.00 23.12 19.77 1tye s ALA 372 CO -0.02 -0.24 0.16 0.95 0.00 0.00 0.00 175.76 176.61 1tye s THR 373 N -2.06 0.02 0.00 0.00 -4.23 -0.89 -1.55 115.64 106.93 1tye s THR 373 Ca 0.66 -1.11 0.00 0.00 -1.18 0.00 0.00 61.69 60.06 1tye s THR 373 Cb -0.15 -1.04 0.00 0.00 1.34 0.00 0.00 72.50 72.65 1tye s THR 373 CO 0.19 -0.82 0.00 0.00 -0.54 0.00 0.00 174.62 173.45 1tye h LEU 375 N 0.00 -0.36 0.00 0.00 4.07 -1.89 -2.76 115.31 114.38 1tye h LEU 375 Ca 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1tye h LEU 375 Cb 0.00 0.09 0.00 0.00 1.08 0.00 0.00 40.66 41.83 1tye h LEU 375 CO 0.00 -0.22 0.00 -0.46 -1.08 0.00 0.00 178.44 176.68 1tye n ASN 376 N -5.25 0.00 -1.10 -0.43 2.04 -1.26 -4.81 115.26 104.45 1tye n ASN 376 Ca -0.10 -0.37 -0.13 0.00 -0.44 0.00 0.00 54.58 53.54 1tye n ASN 376 Cb 0.20 0.00 -0.06 0.00 -2.53 0.00 0.00 39.78 37.39 1tye n ASN 376 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1tye n ASN 377 N -0.84 -5.05 -4.57 0.53 5.03 -1.04 -4.94 115.26 104.37 1tye n ASN 377 Ca 0.05 0.33 -0.43 0.00 0.87 0.00 0.00 54.58 55.40 1tye n ASN 377 Cb 0.02 -4.05 -0.04 0.00 -1.02 0.00 0.00 39.78 34.69 1tye n ASN 377 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1tye s GLU 378 N -3.06 3.60 0.03 3.52 2.12 -1.26 -4.88 118.70 118.76 1tye s GLU 378 Ca 0.00 0.24 -0.30 0.00 0.36 0.00 0.00 54.97 55.27 1tye s GLU 378 Cb 0.00 -3.90 -0.06 0.00 0.26 0.00 0.00 34.13 30.44 1tye s GLU 378 CO 0.00 -1.15 1.31 0.08 -0.54 0.00 0.00 175.26 174.96 1tye s VAL 379 N 3.66 3.82 -0.21 3.70 1.01 -1.26 -4.25 120.40 126.87 1tye s VAL 379 Ca 0.37 1.25 -0.02 0.00 0.00 0.00 0.00 61.98 63.58 1tye s VAL 379 Cb -0.11 -3.80 0.06 0.00 0.00 0.00 0.00 36.38 32.53 1tye s VAL 379 CO 0.24 0.04 0.02 -0.63 0.00 0.00 0.00 175.10 174.77 1tye s ILE 380 N 1.79 0.77 0.61 2.22 1.01 -0.60 -5.02 121.20 121.99 1tye s ILE 380 Ca 0.61 -0.75 -0.18 0.00 0.00 0.00 0.00 60.65 60.33 1tye s ILE 380 Cb -0.31 -1.24 -0.03 0.00 0.01 0.00 0.00 42.46 40.90 1tye s ILE 380 CO 0.27 -0.21 1.22 -2.84 0.00 0.00 0.00 174.94 173.38 1tye s PRO 381 N 1.74 2.88 0.00 2.79 0.02 -1.26 -2.75 135.00 138.42 1tye s PRO 381 Ca -0.02 1.85 0.00 0.00 0.02 0.00 0.00 61.00 62.85 1tye s PRO 381 Cb -0.18 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.43 1tye s PRO 381 CO -0.08 -1.28 0.00 0.41 -0.33 0.00 0.00 177.00 175.71 1tye n GLY 382 N 0.54 2.06 3.78 0.52 0.00 0.20 -4.94 105.19 107.35 1tye n GLY 382 Ca 0.14 -0.44 -0.37 0.00 0.00 0.00 0.00 46.02 45.34 1tye n GLY 382 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1tye s LEU 383 N 0.00 4.19 -0.28 0.99 2.96 -1.23 -4.56 118.68 120.74 1tye s LEU 383 Ca 0.00 2.16 0.21 0.00 -0.22 0.00 0.00 54.13 56.28 1tye s LEU 383 Cb 0.00 -4.09 0.49 0.00 0.50 0.00 0.00 46.19 43.09 1tye s LEU 383 CO 0.00 -0.54 1.14 2.29 -1.32 0.00 0.00 176.35 177.93 1tye n LYS 384 N 0.06 1.63 -3.70 1.98 2.85 -1.26 -2.93 118.16 116.79 1tye n LYS 384 Ca 0.04 -3.22 -0.11 0.00 -1.05 0.00 0.00 58.31 53.97 1tye n LYS 384 Cb 0.48 -1.34 -0.10 0.00 -0.65 0.00 0.00 35.03 33.42 1tye n LYS 384 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 1tye s SER 385 N -3.43 -0.52 0.03 -5.58 0.01 -1.26 -2.45 113.70 100.50 1tye s SER 385 Ca 0.25 0.92 0.07 0.00 1.31 0.00 0.00 55.95 58.50 1tye s SER 385 Cb 0.35 0.84 -0.02 0.00 0.21 0.00 0.00 66.02 67.40 1tye s SER 385 CO -0.04 -0.18 -0.19 0.00 0.41 0.00 0.00 173.24 173.23 1tye s MET 387 N -0.98 1.81 -0.91 0.00 -1.94 -1.26 -1.54 119.30 114.47 1tye s MET 387 Ca 0.07 -2.04 0.00 0.00 -1.71 0.00 0.00 55.69 52.01 1tye s MET 387 Cb -0.08 -1.05 0.00 0.00 2.01 0.00 0.00 34.83 35.71 1tye s MET 387 CO 0.01 -0.22 0.00 0.41 -0.01 0.00 0.00 175.02 175.21 1tye n GLY 388 N -0.83 -0.06 3.76 -0.03 0.00 -1.19 -4.87 105.19 101.96 1tye n GLY 388 Ca -0.05 -0.44 -0.36 0.00 0.00 0.00 0.00 46.02 45.17 1tye n GLY 388 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1tye s LEU 389 N -3.05 4.11 0.00 0.99 2.34 -1.18 -4.92 118.68 116.96 1tye s LEU 389 Ca 0.00 0.28 0.00 0.00 0.06 0.00 0.00 54.13 54.47 1tye s LEU 389 Cb 0.00 -2.01 0.00 0.00 -0.56 0.00 0.00 46.19 43.62 1tye s LEU 389 CO 0.00 0.30 0.00 0.29 -1.06 0.00 0.00 176.35 175.88 1tye n LYS 390 N 2.68 1.79 -2.81 1.48 4.01 -1.26 -2.18 118.16 121.86 1tye n LYS 390 Ca -0.18 0.00 -0.37 0.00 -0.51 0.00 0.00 58.31 57.25 1tye n LYS 390 Cb 0.54 0.00 -0.06 0.00 -0.51 0.00 0.00 35.03 34.99 1tye n LYS 390 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1tye s ILE 391 N 0.74 4.23 0.00 -0.18 -1.09 -1.26 -3.85 121.20 119.79 1tye s ILE 391 Ca 0.00 1.81 0.00 0.00 -2.23 0.00 0.00 60.65 60.23 1tye s ILE 391 Cb 0.00 -4.03 0.00 0.00 -1.58 0.00 0.00 42.46 36.85 1tye s ILE 391 CO 0.00 0.19 0.00 0.61 -1.23 0.00 0.00 174.94 174.51 1tye n GLY 392 N 0.69 2.68 3.64 6.18 0.00 0.12 -4.98 105.19 113.53 1tye n GLY 392 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 1tye n GLY 392 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1tye n ASP 393 N 0.65 1.24 -4.26 1.61 8.00 -1.25 -4.64 116.55 117.91 1tye n ASP 393 Ca 0.00 0.87 -0.29 0.00 0.71 0.00 0.00 54.79 56.09 1tye n ASP 393 Cb 0.00 -1.42 -0.16 0.00 -0.02 0.00 0.00 41.12 39.52 1tye n ASP 393 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1tye s THR 394 N -1.43 1.81 -0.00 -3.53 2.01 -1.26 -2.42 115.64 110.81 1tye s THR 394 Ca 0.73 -0.98 0.02 0.00 0.31 0.00 0.00 61.69 61.77 1tye s THR 394 Cb -0.44 -1.50 -0.01 0.00 0.01 0.00 0.00 72.50 70.57 1tye s THR 394 CO 0.49 0.51 -0.06 -0.69 -0.69 0.00 0.00 174.62 174.18 1tye s VAL 395 N -0.52 0.48 0.20 3.82 1.01 0.47 -4.81 120.40 121.05 1tye s VAL 395 Ca 0.08 -0.27 0.10 0.00 0.00 0.00 0.00 61.98 61.89 1tye s VAL 395 Cb -0.09 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 1tye s VAL 395 CO -0.01 0.13 -0.20 -0.94 0.00 0.00 0.00 175.10 174.08 1tye s SER 396 N -0.17 3.02 0.04 3.32 1.04 -1.22 -0.13 113.70 119.60 1tye s SER 396 Ca 0.02 -0.91 0.03 0.00 0.48 0.00 0.00 55.95 55.57 1tye s SER 396 Cb -0.02 -0.21 -0.02 0.00 0.10 0.00 0.00 66.02 65.87 1tye s SER 396 CO -0.00 0.01 -0.09 -0.36 0.98 0.00 0.00 173.24 173.78 1tye s PHE 397 N -2.12 0.76 -0.23 5.02 0.08 0.21 -2.10 117.98 119.60 1tye s PHE 397 Ca 0.20 -0.44 -0.05 0.00 0.12 0.00 0.00 56.93 56.76 1tye s PHE 397 Cb -0.06 -0.45 -0.01 0.00 -0.57 0.00 0.00 43.02 41.93 1tye s PHE 397 CO 0.09 -0.05 0.00 0.45 -0.10 0.00 0.00 175.22 175.61 1tye s SER 398 N -1.42 4.63 -0.05 1.36 0.15 -0.78 -2.64 113.70 114.95 1tye s SER 398 Ca -0.07 -0.36 0.03 0.00 0.70 0.00 0.00 55.95 56.25 1tye s SER 398 Cb -0.09 -1.81 -0.03 0.00 -1.71 0.00 0.00 66.02 62.38 1tye s SER 398 CO 0.01 -0.04 -0.10 -0.63 1.20 0.00 0.00 173.24 173.68 1tye s ILE 399 N 1.52 3.40 -0.11 6.45 1.01 -0.44 -1.16 121.20 131.87 1tye s ILE 399 Ca 0.06 -0.65 -0.00 0.00 0.00 0.00 0.00 60.65 60.06 1tye s ILE 399 Cb -0.15 -2.38 0.02 0.00 0.01 0.00 0.00 42.46 39.96 1tye s ILE 399 CO -0.01 0.56 -0.09 -0.70 0.00 0.00 0.00 174.94 174.70 1tye s GLU 400 N -0.89 1.67 -0.13 2.79 2.12 -0.81 -0.36 118.70 123.10 1tye s GLU 400 Ca 0.13 -0.32 -0.08 0.00 0.36 0.00 0.00 54.97 55.05 1tye s GLU 400 Cb -0.11 -1.65 -0.04 0.00 0.26 0.00 0.00 34.13 32.59 1tye s GLU 400 CO 0.02 -0.23 0.16 0.00 -0.54 0.00 0.00 175.26 174.67 1tye s ALA 401 N 1.56 3.83 -0.02 6.30 0.00 -0.60 -2.38 121.76 130.45 1tye s ALA 401 Ca 0.03 -0.62 0.02 0.00 0.00 0.00 0.00 51.96 51.39 1tye s ALA 401 Cb -0.13 -2.04 0.00 0.00 0.00 0.00 0.00 23.12 20.95 1tye s ALA 401 CO -0.07 0.52 -0.07 0.21 0.00 0.00 0.00 175.76 176.34 1tye s LYS 402 N -0.75 0.76 0.29 0.00 2.20 -0.25 -2.41 119.74 119.58 1tye s LYS 402 Ca 0.14 -0.24 0.09 0.00 -0.36 0.00 0.00 55.97 55.61 1tye s LYS 402 Cb -0.12 -0.73 -0.04 0.00 -1.51 0.00 0.00 37.83 35.42 1tye s LYS 402 CO 0.04 0.09 0.04 0.14 -0.36 0.00 0.00 175.35 175.29 1tye s VAL 403 N 0.19 3.34 -0.46 4.02 -7.23 -1.18 -1.05 120.40 118.03 1tye s VAL 403 Ca -0.03 -1.85 0.04 0.00 -1.81 0.00 0.00 61.98 58.34 1tye s VAL 403 Cb -0.07 -2.89 0.12 0.00 0.56 0.00 0.00 36.38 34.09 1tye s VAL 403 CO 0.00 -0.32 0.19 -0.60 -0.31 0.00 0.00 175.10 174.07 1tye s ARG 404 N -3.72 1.77 2.21 4.82 3.52 -1.14 -4.19 118.95 122.22 1tye s ARG 404 Ca 0.33 -2.35 0.00 0.00 -0.13 0.00 0.00 55.73 53.58 1tye s ARG 404 Cb -0.05 -3.21 0.00 0.00 -1.56 0.00 0.00 34.95 30.13 1tye s ARG 404 CO 0.21 -1.06 0.00 0.41 -0.81 0.00 0.00 175.30 174.05 1tye n GLY 405 N 3.49 -0.36 2.66 8.12 0.00 -1.26 -4.73 105.19 113.11 1tye n GLY 405 Ca 0.05 -1.31 -0.29 0.00 0.00 0.00 0.00 46.02 44.47 1tye n GLY 405 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tye n PRO 407 N 4.16 1.03 0.14 0.00 -0.02 -1.26 -4.94 135.00 134.11 1tye n PRO 407 Ca 0.05 0.39 0.13 0.00 -2.02 0.00 0.00 63.50 62.05 1tye n PRO 407 Cb 0.38 -2.17 0.37 0.00 -0.02 0.00 0.00 33.50 32.06 1tye n PRO 407 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1tye h GLN 408 N 0.73 0.00 -6.45 -0.52 4.20 -2.00 -3.40 115.11 107.66 1tye h GLN 408 Ca -0.48 0.00 -0.54 0.00 0.06 0.00 0.00 58.65 57.69 1tye h GLN 408 Cb 1.36 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.14 1tye h GLN 408 CO 0.52 0.00 0.62 -1.21 -0.67 0.00 0.00 178.83 178.09 1tye s GLU 409 N -3.17 4.40 -0.00 1.46 0.41 -1.26 -4.81 118.70 115.72 1tye s GLU 409 Ca 0.09 1.79 0.08 0.00 -0.41 0.00 0.00 54.97 56.52 1tye s GLU 409 Cb 0.10 -3.39 -0.09 0.00 -1.78 0.00 0.00 34.13 28.97 1tye s GLU 409 CO 0.59 -0.33 0.30 1.17 -0.49 0.00 0.00 175.26 176.50 1tye n LYS 410 N 4.26 3.82 -3.59 1.61 4.81 -1.26 -4.80 118.16 123.02 1tye n LYS 410 Ca 0.10 -0.01 -0.16 0.00 -0.87 0.00 0.00 58.31 57.37 1tye n LYS 410 Cb 0.46 -0.91 -0.13 0.00 0.02 0.00 0.00 35.03 34.46 1tye n LYS 410 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 1tye s GLU 411 N -1.85 0.15 0.28 1.64 2.56 -1.26 -3.53 118.70 116.69 1tye s GLU 411 Ca 0.02 0.52 -0.07 0.00 0.00 0.00 0.00 54.97 55.43 1tye s GLU 411 Cb 0.06 -0.51 -0.01 0.00 2.00 0.00 0.00 34.13 35.67 1tye s GLU 411 CO 0.32 -0.44 0.43 0.15 -0.56 0.00 0.00 175.26 175.17 1tye s LYS 412 N 2.37 1.65 -0.07 4.30 -0.14 -0.90 -5.04 119.74 121.91 1tye s LYS 412 Ca 0.04 -1.50 -0.31 0.00 -1.36 0.00 0.00 55.97 52.85 1tye s LYS 412 Cb -0.13 0.44 0.07 0.00 -1.68 0.00 0.00 37.83 36.52 1tye s LYS 412 CO -0.10 -0.67 0.70 -1.54 -0.76 0.00 0.00 175.35 172.98 1tye s SER 413 N -3.12 -0.65 0.19 2.83 1.04 -1.26 0.17 113.70 112.90 1tye s SER 413 Ca 0.28 0.74 -0.00 0.00 0.48 0.00 0.00 55.95 57.44 1tye s SER 413 Cb 0.00 0.57 -0.04 0.00 0.10 0.00 0.00 66.02 66.65 1tye s SER 413 CO 0.14 -0.58 0.08 0.72 0.98 0.00 0.00 173.24 174.58 1tye s PHE 414 N -1.11 1.17 0.00 5.02 -0.71 -0.58 -4.78 117.98 116.99 1tye s PHE 414 Ca -0.10 -1.24 0.06 0.00 -1.04 0.00 0.00 56.93 54.61 1tye s PHE 414 Cb -0.00 -0.64 -0.02 0.00 -1.21 0.00 0.00 43.02 41.16 1tye s PHE 414 CO 0.09 -0.47 -0.17 0.95 -1.34 0.00 0.00 175.22 174.28 1tye s THR 415 N -3.96 1.37 -0.24 -4.49 -4.23 -0.84 -0.66 115.64 102.60 1tye s THR 415 Ca 0.32 -0.83 0.01 0.00 -1.18 0.00 0.00 61.69 60.01 1tye s THR 415 Cb 0.07 -1.16 0.06 0.00 1.34 0.00 0.00 72.50 72.82 1tye s THR 415 CO 0.08 0.31 -0.03 -0.63 -0.54 0.00 0.00 174.62 173.81 1tye s ILE 416 N -0.51 1.47 0.00 2.99 1.01 -0.38 -0.99 121.20 124.79 1tye s ILE 416 Ca 0.06 -1.25 -0.00 0.00 0.00 0.00 0.00 60.65 59.46 1tye s ILE 416 Cb -0.07 -1.79 -0.00 0.00 0.01 0.00 0.00 42.46 40.61 1tye s ILE 416 CO -0.00 -0.17 0.01 -1.59 0.00 0.00 0.00 174.94 173.19 1tye s LYS 417 N 1.41 0.09 0.45 2.79 -2.85 -0.98 -1.60 119.74 119.05 1tye s LYS 417 Ca -0.04 -0.13 -0.23 0.00 -1.00 0.00 0.00 55.97 54.57 1tye s LYS 417 Cb -0.19 0.03 -0.08 0.00 -2.06 0.00 0.00 37.83 35.54 1tye s LYS 417 CO -0.07 -0.01 1.10 -1.25 0.10 0.00 0.00 175.35 175.21 1tye s PRO 418 N -0.35 3.86 0.41 1.78 0.04 -1.26 -2.17 135.00 137.31 1tye s PRO 418 Ca -0.04 1.61 -0.24 0.00 0.04 0.00 0.00 61.00 62.37 1tye s PRO 418 Cb -0.02 -2.36 -0.08 0.00 0.04 0.00 0.00 34.50 32.07 1tye s PRO 418 CO -0.00 -0.43 1.14 0.14 0.04 0.00 0.00 177.00 177.89 1tye s VAL 419 N -1.67 3.28 0.00 -0.36 -7.23 -0.84 -2.93 120.40 110.65 1tye s VAL 419 Ca 0.63 1.02 0.00 0.00 -1.81 0.00 0.00 61.98 61.82 1tye s VAL 419 Cb -0.24 -3.55 0.00 0.00 0.56 0.00 0.00 36.38 33.15 1tye s VAL 419 CO 0.29 0.05 0.00 0.61 -0.31 0.00 0.00 175.10 175.74 1tye n GLY 420 N 0.53 0.70 3.44 2.32 0.00 -1.26 -4.70 105.19 106.21 1tye n GLY 420 Ca 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.86 1tye n GLY 420 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1tye s PHE 421 N -2.33 1.96 -0.08 1.61 0.40 -1.15 -5.05 117.98 113.34 1tye s PHE 421 Ca 0.00 -0.75 0.05 0.00 -0.60 0.00 0.00 56.93 55.63 1tye s PHE 421 Cb 0.00 -1.16 -0.09 0.00 0.51 0.00 0.00 43.02 42.28 1tye s PHE 421 CO 0.00 0.23 0.00 1.63 0.70 0.00 0.00 175.22 177.78 1tye n LYS 422 N -0.61 2.24 -1.99 0.44 5.02 -1.26 -4.92 118.16 117.09 1tye n LYS 422 Ca -0.05 0.01 -0.42 0.00 -2.02 0.00 0.00 58.31 55.83 1tye n LYS 422 Cb 0.64 -1.19 -0.03 0.00 -0.02 0.00 0.00 35.03 34.43 1tye n LYS 422 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1tye s ASP 423 N -4.14 6.66 0.18 4.39 1.11 -1.26 -5.00 116.67 118.61 1tye s ASP 423 Ca -0.06 2.35 0.05 0.00 0.18 0.00 0.00 52.55 55.08 1tye s ASP 423 Cb 0.02 -2.55 -0.05 0.00 1.07 0.00 0.00 42.92 41.42 1tye s ASP 423 CO 0.29 -0.88 -0.09 -0.94 1.18 0.00 0.00 175.17 174.72 1tye s SER 424 N 2.76 2.03 -0.32 0.27 1.04 -1.26 -4.48 113.70 113.73 1tye s SER 424 Ca 0.73 -1.06 -0.09 0.00 0.48 0.00 0.00 55.95 56.01 1tye s SER 424 Cb -0.36 -0.04 0.01 0.00 0.10 0.00 0.00 66.02 65.72 1tye s SER 424 CO 0.31 -0.33 0.14 -0.22 0.98 0.00 0.00 173.24 174.12 1tye s LEU 425 N -3.24 4.19 -0.15 2.42 2.96 -0.63 -4.61 118.68 119.61 1tye s LEU 425 Ca 0.21 -0.72 -0.12 0.00 -0.22 0.00 0.00 54.13 53.28 1tye s LEU 425 Cb 0.02 -1.96 -0.05 0.00 0.50 0.00 0.00 46.19 44.70 1tye s LEU 425 CO 0.04 -0.25 0.24 -0.63 -1.32 0.00 0.00 176.35 174.43 1tye s ILE 426 N 1.55 5.34 -0.18 6.68 1.01 0.37 -1.25 121.20 134.72 1tye s ILE 426 Ca 0.03 0.42 0.01 0.00 0.00 0.00 0.00 60.65 61.11 1tye s ILE 426 Cb -0.18 -3.56 0.02 0.00 0.01 0.00 0.00 42.46 38.75 1tye s ILE 426 CO 0.05 0.45 -0.19 -0.69 0.00 0.00 0.00 174.94 174.56 1tye s VAL 427 N 0.10 2.00 -0.34 2.92 1.01 0.17 -1.95 120.40 124.31 1tye s VAL 427 Ca 0.14 -0.92 -0.20 0.00 0.00 0.00 0.00 61.98 61.00 1tye s VAL 427 Cb -0.13 -1.82 -0.00 0.00 0.00 0.00 0.00 36.38 34.43 1tye s VAL 427 CO 0.03 0.51 0.63 -1.10 0.00 0.00 0.00 175.10 175.17 1tye s GLN 428 N 1.31 3.74 -0.16 2.72 -0.21 -0.17 -1.53 119.66 125.35 1tye s GLN 428 Ca 0.05 0.11 -0.12 0.00 0.02 0.00 0.00 55.36 55.42 1tye s GLN 428 Cb -0.13 -3.79 -0.05 0.00 1.00 0.00 0.00 33.01 30.05 1tye s GLN 428 CO -0.12 -0.68 0.22 0.08 -2.12 0.00 0.00 175.29 172.66 1tye s VAL 429 N 2.66 5.36 -0.08 1.09 1.01 0.13 0.24 120.40 130.80 1tye s VAL 429 Ca 0.24 0.38 0.01 0.00 0.00 0.00 0.00 61.98 62.61 1tye s VAL 429 Cb -0.15 -3.55 0.02 0.00 0.00 0.00 0.00 36.38 32.71 1tye s VAL 429 CO 0.14 0.45 -0.09 -0.89 0.00 0.00 0.00 175.10 174.70 1tye s THR 430 N 0.18 0.98 -0.42 3.92 2.01 0.43 -2.12 115.64 120.62 1tye s THR 430 Ca 0.13 -0.33 -0.16 0.00 0.31 0.00 0.00 61.69 61.64 1tye s THR 430 Cb -0.12 -0.95 0.02 0.00 0.01 0.00 0.00 72.50 71.46 1tye s THR 430 CO 0.02 0.34 0.35 -0.36 -0.69 0.00 0.00 174.62 174.27 1tye s PHE 431 N 1.13 3.22 -0.79 4.92 0.08 -1.23 -1.64 117.98 123.67 1tye s PHE 431 Ca -0.06 -0.55 -0.20 0.00 0.12 0.00 0.00 56.93 56.24 1tye s PHE 431 Cb -0.14 -2.72 0.11 0.00 -0.57 0.00 0.00 43.02 39.70 1tye s PHE 431 CO -0.02 -0.64 1.00 0.34 -0.10 0.00 0.00 175.22 175.81 1tye s ASP 432 N 1.78 6.42 -0.13 1.36 2.15 -0.98 -4.84 116.67 122.44 1tye s ASP 432 Ca 0.07 -1.64 -0.12 0.00 0.43 0.00 0.00 52.55 51.29 1tye s ASP 432 Cb -0.19 -2.38 -0.04 0.00 -0.30 0.00 0.00 42.92 40.01 1tye s ASP 432 CO 0.11 -1.18 -0.24 0.00 -0.17 0.00 0.00 175.17 173.69 1tye n ASP 434 N -3.88 1.42 -4.68 0.00 9.92 -1.26 -4.81 116.55 113.25 1tye n ASP 434 Ca -0.10 0.81 -0.24 0.00 -0.53 0.00 0.00 54.79 54.73 1tye n ASP 434 Cb 0.36 -1.48 0.10 0.00 -0.64 0.00 0.00 41.12 39.46 1tye n ASP 434 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1tye n ALA 436 N -2.88 1.83 -1.03 0.00 0.00 -1.26 -4.61 120.51 112.56 1tye n ALA 436 Ca 0.13 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.56 1tye n ALA 436 Cb 0.60 -1.09 -0.00 0.00 0.00 0.00 0.00 19.45 18.96 1tye n ALA 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tye n GLN 438 N -2.96 2.45 -4.14 0.00 1.13 -1.26 -5.01 117.38 107.59 1tye n GLN 438 Ca -0.01 0.89 -0.14 0.00 -1.94 0.00 0.00 57.00 55.80 1tye n GLN 438 Cb 0.04 -2.76 -0.11 0.00 0.11 0.00 0.00 30.24 27.52 1tye n GLN 438 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1tye s ALA 439 N 3.31 0.92 0.00 -1.58 0.00 -1.26 -4.61 121.76 118.53 1tye s ALA 439 Ca 0.87 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 51.79 1tye s ALA 439 Cb -0.59 0.04 0.00 0.00 0.00 0.00 0.00 23.12 22.56 1tye s ALA 439 CO 0.44 -0.03 0.00 1.04 0.00 0.00 0.00 175.76 177.21