#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 4.62 0.31 1.61 0.02 -1.26 -5.06 135.00 135.24 1tye s PRO 2 Ca 0.00 1.55 0.06 0.00 0.02 0.00 0.00 61.00 62.63 1tye s PRO 2 Cb 0.00 -3.36 -0.06 0.00 0.02 0.00 0.00 34.50 31.10 1tye s PRO 2 CO 0.00 0.08 -0.01 0.54 -0.33 0.00 0.00 177.00 177.28 1tye s ASN 3 N 0.25 2.80 0.56 2.53 2.20 -1.26 -5.01 114.94 117.01 1tye s ASN 3 Ca 0.50 -1.28 0.33 0.00 -0.94 0.00 0.00 52.86 51.47 1tye s ASN 3 Cb -0.25 -0.18 1.48 0.00 -2.00 0.00 0.00 41.25 40.30 1tye s ASN 3 CO 0.31 -0.45 1.81 -0.29 -2.94 0.00 0.00 177.10 175.54 1tye h ILE 4 N 2.15 0.40 0.09 0.54 6.09 -1.99 -0.80 117.51 123.99 1tye h ILE 4 Ca -0.41 0.00 -0.00 0.00 -1.37 0.00 0.00 64.86 63.08 1tye h ILE 4 Cb 1.24 0.46 0.00 0.00 0.47 0.00 0.00 36.82 38.99 1tye h ILE 4 CO 0.70 0.00 -0.04 0.00 -3.07 0.00 0.00 178.15 175.74 1tye h THR 6 N -0.94 1.00 0.00 0.00 2.02 -1.32 -3.30 112.91 110.37 1tye h THR 6 Ca -0.01 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 66.99 1tye h THR 6 Cb 0.52 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.38 1tye h THR 6 CO 0.02 0.09 0.00 0.41 0.37 0.00 0.00 175.52 176.41 1tye n THR 7 N -4.47 0.00 1.38 3.16 -1.04 -0.37 -4.51 114.28 108.42 1tye n THR 7 Ca 0.07 0.20 0.06 0.00 -2.04 0.00 0.00 64.05 62.33 1tye n THR 7 Cb 0.22 -0.89 0.20 0.00 -1.82 0.00 0.00 70.33 68.05 1tye n THR 7 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1tye n ARG 8 N 0.00 1.48 -1.74 -2.82 1.74 -1.26 -4.89 116.66 109.17 1tye n ARG 8 Ca 0.00 -0.74 -0.39 0.00 -0.77 0.00 0.00 57.85 55.95 1tye n ARG 8 Cb 0.00 -1.23 0.04 0.00 -1.02 0.00 0.00 32.46 30.25 1tye n ARG 8 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1tye n GLY 9 N 0.89 0.79 3.05 -0.13 0.00 -1.24 -5.02 105.19 103.53 1tye n GLY 9 Ca 0.10 0.07 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 1tye n GLY 9 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tye s VAL 10 N -1.27 1.42 0.06 1.61 1.01 -1.26 -5.08 120.40 116.90 1tye s VAL 10 Ca 0.69 -0.61 -0.38 0.00 0.00 0.00 0.00 61.98 61.68 1tye s VAL 10 Cb -0.43 -1.29 -0.18 0.00 0.00 0.00 0.00 36.38 34.48 1tye s VAL 10 CO 0.52 0.42 1.24 -0.24 0.00 0.00 0.00 175.10 177.04 1tye n SER 11 N 4.06 1.06 0.00 3.32 2.88 -1.26 -4.65 113.62 119.04 1tye n SER 11 Ca -0.20 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.48 1tye n SER 11 Cb 0.51 -1.10 0.00 0.00 -0.75 0.00 0.00 64.21 62.88 1tye n SER 11 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1tye n SER 12 N 2.16 0.00 0.06 -3.46 3.41 -1.26 -4.96 113.62 109.58 1tye n SER 12 Ca 0.19 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.75 1tye n SER 12 Cb 0.16 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.24 1tye n SER 12 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1tye h GLN 14 N 0.26 0.54 -0.21 0.00 4.15 -1.89 -2.89 115.11 115.07 1tye h GLN 14 Ca 0.01 -0.26 -0.08 0.00 0.77 0.00 0.00 58.65 59.09 1tye h GLN 14 Cb 1.00 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.67 1tye h GLN 14 CO 0.08 0.83 -0.21 1.96 -1.93 0.00 0.00 178.83 179.57 1tye h GLN 15 N 0.24 0.37 -0.88 1.69 4.20 -1.87 -2.76 115.11 116.11 1tye h GLN 15 Ca 0.05 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1tye h GLN 15 Cb 0.70 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.41 1tye h GLN 15 CO 0.05 0.57 0.55 0.00 -0.67 0.00 0.00 178.83 179.33 1tye h LEU 17 N 1.21 0.00 0.00 0.00 3.38 -1.30 -3.17 115.31 115.43 1tye h LEU 17 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 1tye h LEU 17 Cb -0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1tye h LEU 17 CO -0.06 0.41 0.00 0.00 0.09 0.00 0.00 178.44 178.88 1tye n ALA 18 N -2.24 2.21 0.11 1.53 0.00 -0.75 -3.87 120.51 117.50 1tye n ALA 18 Ca 0.01 -0.09 -0.11 0.00 0.00 0.00 0.00 53.44 53.25 1tye n ALA 18 Cb 0.63 -1.43 -0.07 0.00 0.00 0.00 0.00 19.45 18.58 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 0.64 -1.74 0.00 2.07 -1.46 -3.48 116.25 112.29 1tye h VAL 19 Ca 0.00 -0.87 0.02 0.00 0.82 0.00 0.00 66.70 66.67 1tye h VAL 19 Cb 0.46 1.03 -0.22 0.00 -1.52 0.00 0.00 31.29 31.04 1tye h VAL 19 CO 0.00 0.15 0.40 -0.55 0.02 0.00 0.00 177.57 177.59 1tye s SER 20 N -5.24 -0.49 0.65 0.57 0.15 -1.25 -5.03 113.70 103.05 1tye s SER 20 Ca -0.12 0.56 0.31 0.00 0.70 0.00 0.00 55.95 57.40 1tye s SER 20 Cb 0.01 0.44 1.66 0.00 -1.71 0.00 0.00 66.02 66.42 1tye s SER 20 CO 0.45 -0.44 1.96 -0.65 1.20 0.00 0.00 173.24 175.77 1tye h PRO 21 N 2.84 0.00 0.00 5.44 0.11 -1.80 -1.13 132.00 137.45 1tye h PRO 21 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1tye h PRO 21 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1tye h PRO 21 CO 0.33 0.00 -0.33 0.00 -0.21 0.00 0.00 178.00 177.79 1tye h MET 22 N 0.00 0.00 -6.73 1.05 -0.00 -1.96 -3.47 114.93 103.83 1tye h MET 22 Ca 0.04 0.00 -0.51 0.00 -0.00 0.00 0.00 59.70 59.23 1tye h MET 22 Cb 0.69 0.00 0.01 0.00 -0.00 0.00 0.00 31.60 32.30 1tye h MET 22 CO -0.00 0.00 0.49 0.00 -0.00 0.00 0.00 176.91 177.40 1tye s ALA 24 N -0.64 1.36 0.08 0.00 0.00 0.66 -4.74 121.76 118.49 1tye s ALA 24 Ca 0.48 -0.96 0.05 0.00 0.00 0.00 0.00 51.96 51.53 1tye s ALA 24 Cb -0.31 -0.20 -0.04 0.00 0.00 0.00 0.00 23.12 22.56 1tye s ALA 24 CO 0.38 0.26 -0.03 -0.46 0.00 0.00 0.00 175.76 175.91 1tye s TRP 25 N -0.96 2.92 -0.42 0.00 -0.11 -0.94 -1.68 118.94 117.74 1tye s TRP 25 Ca 0.03 -0.05 0.05 0.00 1.22 0.00 0.00 56.10 57.34 1tye s TRP 25 Cb -0.09 -1.53 0.19 0.00 -1.50 0.00 0.00 33.47 30.55 1tye s TRP 25 CO 0.02 0.45 0.41 0.00 -4.62 0.00 0.00 176.95 173.21 1tye s SER 27 N -0.41 6.41 0.00 0.00 0.15 -1.23 -4.86 113.70 113.75 1tye s SER 27 Ca 0.33 -1.78 0.00 0.00 0.70 0.00 0.00 55.95 55.20 1tye s SER 27 Cb 0.07 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.81 1tye s SER 27 CO -0.17 -1.60 0.00 -0.67 1.20 0.00 0.00 173.24 172.00 1tye n ASP 28 N 9.53 0.00 0.00 5.45 2.03 -1.26 -4.91 116.55 127.39 1tye n ASP 28 Ca 0.41 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.72 1tye n ASP 28 Cb 0.48 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.88 1tye n ASP 28 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 1tye n GLU 29 N 0.00 0.00 0.29 -0.67 0.28 -1.26 -4.88 120.64 114.40 1tye n GLU 29 Ca 0.00 0.00 0.16 0.00 -0.16 0.00 0.00 57.16 57.16 1tye n GLU 29 Cb 0.00 -0.11 0.87 0.00 1.43 0.00 0.00 31.44 33.64 1tye n GLU 29 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1tye h ALA 30 N 0.00 1.27 -2.69 -1.84 0.00 -1.95 -3.43 119.26 110.61 1tye h ALA 30 Ca 0.00 -0.05 -0.52 0.00 0.00 0.00 0.00 54.91 54.34 1tye h ALA 30 Cb 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.80 1tye h ALA 30 CO 0.00 0.07 0.52 -1.17 0.00 0.00 0.00 179.25 178.67 1tye s LEU 31 N -7.07 4.48 1.31 0.00 2.96 -1.26 -5.04 118.68 114.05 1tye s LEU 31 Ca -0.03 2.20 -0.20 0.00 -0.22 0.00 0.00 54.13 55.87 1tye s LEU 31 Cb 0.13 -3.61 0.31 0.00 0.50 0.00 0.00 46.19 43.52 1tye s LEU 31 CO 0.54 -0.28 0.71 -2.65 -1.32 0.00 0.00 176.35 173.34 1tye n PRO 32 N 2.20 -3.94 0.05 0.98 -0.02 -1.26 -4.97 135.00 128.05 1tye n PRO 32 Ca 0.03 -1.17 0.04 0.00 -2.02 0.00 0.00 63.50 60.38 1tye n PRO 32 Cb 0.45 -1.77 -0.06 0.00 -0.02 0.00 0.00 33.50 32.10 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 -4.21 0.82 0.09 2.45 4.77 -1.26 -4.03 117.00 115.64 1tye n LEU 33 Ca 0.11 0.35 0.12 0.00 -0.03 0.00 0.00 56.01 56.55 1tye n LEU 33 Cb 0.50 0.03 0.15 0.00 -2.33 0.00 0.00 43.42 41.77 1tye n LEU 33 CO 0.34 0.03 0.36 1.23 -1.33 0.00 0.00 177.39 178.02 1tye h GLY 34 N 3.83 0.00 -3.86 -0.72 0.00 -2.05 -3.47 103.07 96.80 1tye h GLY 34 Ca -0.11 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.72 1tye h GLY 34 CO 0.03 0.00 0.48 -0.45 0.00 0.00 0.00 176.54 176.60 1tye s SER 35 N -4.72 7.26 0.25 0.19 0.15 -1.26 -5.00 113.70 110.57 1tye s SER 35 Ca 0.05 2.24 -0.30 0.00 0.70 0.00 0.00 55.95 58.64 1tye s SER 35 Cb 0.12 -2.62 -0.10 0.00 -1.71 0.00 0.00 66.02 61.70 1tye s SER 35 CO 0.72 -0.16 1.41 -2.84 1.20 0.00 0.00 173.24 173.57 1tye s PRO 36 N -1.23 4.29 0.02 5.44 0.02 -1.26 -4.92 135.00 137.36 1tye s PRO 36 Ca 0.46 2.26 0.22 0.00 0.02 0.00 0.00 61.00 63.96 1tye s PRO 36 Cb -0.32 -3.12 -0.12 0.00 0.02 0.00 0.00 34.50 30.97 1tye s PRO 36 CO 0.40 -0.38 0.87 0.54 -0.33 0.00 0.00 177.00 178.10 1tye n ARG 37 N 2.23 0.28 -3.90 5.54 1.74 -1.26 -4.74 116.66 116.55 1tye n ARG 37 Ca 0.06 -0.05 -0.30 0.00 -0.77 0.00 0.00 57.85 56.79 1tye n ARG 37 Cb 0.41 -1.55 -0.15 0.00 -1.02 0.00 0.00 32.46 30.15 1tye n ARG 37 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1tye n ASP 39 N 4.22 -0.75 -4.74 0.00 -0.08 -0.67 -3.13 116.55 111.39 1tye n ASP 39 Ca 0.03 -2.36 -0.33 0.00 -1.51 0.00 0.00 54.79 50.62 1tye n ASP 39 Cb 0.40 1.50 0.08 0.00 2.34 0.00 0.00 41.12 45.44 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 3.27 0.23 -2.67 1.43 -1.26 -0.24 118.68 119.43 1tye s LEU 40 Ca 0.22 2.12 -0.08 0.00 -1.03 0.00 0.00 54.13 55.36 1tye s LEU 40 Cb 0.00 -4.56 0.21 0.00 0.03 0.00 0.00 46.19 41.87 1tye s LEU 40 CO 0.16 -2.04 1.90 0.50 0.23 0.00 0.00 176.35 177.10 1tye h LYS 41 N -0.41 1.20 -0.42 1.70 3.64 -1.89 -2.39 116.57 118.01 1tye h LYS 41 Ca -0.46 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 58.81 1tye h LYS 41 Cb 1.26 -0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 32.80 1tye h LYS 41 CO 0.51 0.82 0.19 1.05 -2.27 0.00 0.00 179.45 179.75 1tye h GLU 42 N 1.23 0.58 -0.03 1.90 9.09 -1.96 -2.01 114.58 123.39 1tye h GLU 42 Ca 0.33 -0.07 -0.02 0.00 0.05 0.00 0.00 59.36 59.65 1tye h GLU 42 Cb -0.10 -0.11 0.00 0.00 -1.65 0.00 0.00 28.75 26.88 1tye h GLU 42 CO -0.07 0.47 -0.05 -0.91 0.05 0.00 0.00 179.01 178.50 1tye h ASN 43 N 0.59 0.09 -0.38 3.06 2.35 -1.83 -2.21 115.58 117.25 1tye h ASN 43 Ca 0.15 -0.57 0.08 0.00 -0.55 0.00 0.00 56.30 55.41 1tye h ASN 43 Cb 0.08 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 1tye h ASN 43 CO -0.02 0.64 0.26 -0.07 -1.65 0.00 0.00 177.43 176.60 1tye h LEU 44 N -0.46 0.13 0.03 1.61 3.38 -1.24 -1.86 115.31 116.90 1tye h LEU 44 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1tye h LEU 44 Cb 0.63 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1tye h LEU 44 CO 0.01 0.08 -0.01 -0.07 0.09 0.00 0.00 178.44 178.54 1tye h LEU 45 N 0.15 -0.03 -0.85 1.67 3.38 -1.31 -2.61 115.31 115.71 1tye h LEU 45 Ca 0.17 -0.56 0.11 0.00 0.09 0.00 0.00 57.88 57.70 1tye h LEU 45 Cb 0.50 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.18 1tye h LEU 45 CO -0.02 0.55 0.48 0.50 0.09 0.00 0.00 178.44 180.04 1tye h LYS 46 N -0.63 0.75 0.00 1.13 3.11 -0.76 0.47 116.57 120.64 1tye h LYS 46 Ca -0.00 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.79 1tye h LYS 46 Cb 0.58 -0.17 0.00 0.00 -1.00 0.00 0.00 32.23 31.65 1tye h LYS 46 CO 0.01 0.50 0.00 -0.25 -2.81 0.00 0.00 179.45 176.89 1tye n ASP 47 N -4.76 0.00 -2.84 4.20 8.00 -0.76 -4.88 116.55 115.51 1tye n ASP 47 Ca 0.15 -0.62 -0.15 0.00 0.71 0.00 0.00 54.79 54.87 1tye n ASP 47 Cb 0.32 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.49 1tye n ASP 47 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1tye n ASN 48 N -0.97 -3.54 0.00 -2.24 4.13 0.16 -5.02 115.26 107.78 1tye n ASN 48 Ca 0.13 -0.44 0.00 0.00 1.68 0.00 0.00 54.58 55.95 1tye n ASN 48 Cb 0.06 -3.97 0.00 0.00 -1.54 0.00 0.00 39.78 34.33 1tye n ASN 48 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1tye n ALA 50 N -3.00 0.00 -0.30 0.00 0.00 -1.26 -4.76 120.51 111.19 1tye n ALA 50 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 1tye n ALA 50 Cb 0.00 0.00 0.30 0.00 0.00 0.00 0.00 19.45 19.75 1tye n ALA 50 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1tye h PRO 51 N 0.00 0.24 0.00 0.00 0.11 -1.96 0.10 132.00 130.49 1tye h PRO 51 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1tye h PRO 51 Cb 0.00 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.06 1tye h PRO 51 CO 0.00 0.16 0.00 -0.85 -0.21 0.00 0.00 178.00 177.10 1tye n GLU 52 N -5.18 0.57 -0.00 1.05 0.00 -1.26 -2.78 120.64 113.04 1tye n GLU 52 Ca 0.22 0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.40 1tye n GLU 52 Cb 0.69 -1.50 0.01 0.00 0.00 0.00 0.00 31.44 30.63 1tye n GLU 52 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 1tye n SER 53 N -1.05 1.30 -4.65 -1.84 3.41 0.34 -4.99 113.62 106.13 1tye n SER 53 Ca 0.14 -1.26 -0.42 0.00 -0.26 0.00 0.00 58.87 57.08 1tye n SER 53 Cb 0.09 -0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.99 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 -0.28 4.83 -0.63 -1.33 1.01 -1.12 -3.58 121.20 120.10 1tye s ILE 54 Ca 0.01 1.64 -0.18 0.00 0.00 0.00 0.00 60.65 62.13 1tye s ILE 54 Cb 0.01 -4.15 0.12 0.00 0.01 0.00 0.00 42.46 38.45 1tye s ILE 54 CO 0.01 -0.06 0.70 -1.61 0.00 0.00 0.00 174.94 173.98 1tye s GLU 55 N 2.73 3.13 -0.42 2.79 0.41 0.15 -4.98 118.70 122.50 1tye s GLU 55 Ca 0.37 -1.55 0.02 0.00 -0.41 0.00 0.00 54.97 53.40 1tye s GLU 55 Cb -0.16 -4.33 0.15 0.00 -1.78 0.00 0.00 34.13 28.01 1tye s GLU 55 CO 0.08 -1.49 0.26 0.12 -0.49 0.00 0.00 175.26 173.74 1tye s PHE 56 N 2.21 1.45 0.16 1.61 5.36 -1.26 -2.22 117.98 125.30 1tye s PHE 56 Ca 0.12 -2.16 -0.30 0.00 -0.96 0.00 0.00 56.93 53.62 1tye s PHE 56 Cb -0.23 -1.41 -0.08 0.00 -0.34 0.00 0.00 43.02 40.97 1tye s PHE 56 CO 0.03 -0.79 1.26 -2.14 -1.46 0.00 0.00 175.22 172.11 1tye s PRO 57 N 0.46 4.43 -0.07 10.12 0.02 -1.26 -5.04 135.00 143.65 1tye s PRO 57 Ca 0.21 1.94 0.04 0.00 0.02 0.00 0.00 61.00 63.21 1tye s PRO 57 Cb -0.18 -3.24 -0.01 0.00 0.02 0.00 0.00 34.50 31.09 1tye s PRO 57 CO -0.04 -0.21 -0.20 0.14 -0.33 0.00 0.00 177.00 176.36 1tye s VAL 58 N 0.31 2.48 0.31 3.83 -7.23 -1.26 -4.90 120.40 113.94 1tye s VAL 58 Ca 0.56 -0.91 -0.29 0.00 -1.81 0.00 0.00 61.98 59.54 1tye s VAL 58 Cb -0.34 -1.95 -0.10 0.00 0.56 0.00 0.00 36.38 34.55 1tye s VAL 58 CO 0.35 0.56 1.28 -0.44 -0.31 0.00 0.00 175.10 176.54 1tye s SER 59 N -0.15 6.86 0.05 4.85 0.01 -1.26 -4.87 113.70 119.18 1tye s SER 59 Ca -0.03 2.59 0.00 0.00 1.31 0.00 0.00 55.95 59.82 1tye s SER 59 Cb -0.14 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.45 1tye s SER 59 CO 0.04 -0.48 0.00 -1.84 0.41 0.00 0.00 173.24 171.37 1tye n GLU 60 N 1.10 0.00 -2.11 12.44 0.28 -0.12 -4.99 120.64 127.24 1tye n GLU 60 Ca 0.01 0.00 -0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1tye n GLU 60 Cb 0.42 -0.13 -0.00 0.00 1.43 0.00 0.00 31.44 33.16 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 -2.83 -3.27 -2.63 -1.84 0.00 -1.23 -4.89 120.51 103.83 1tye n ALA 61 Ca 0.00 0.38 -0.38 0.00 0.00 0.00 0.00 53.44 53.44 1tye n ALA 61 Cb 0.00 -0.74 -0.06 0.00 0.00 0.00 0.00 19.45 18.64 1tye n ALA 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1tye s ARG 62 N -0.83 3.83 -0.70 0.00 3.52 0.69 -4.90 118.95 120.56 1tye s ARG 62 Ca -0.02 0.24 -0.27 0.00 -0.13 0.00 0.00 55.73 55.55 1tye s ARG 62 Cb 0.00 -3.23 0.03 0.00 -1.56 0.00 0.00 34.95 30.19 1tye s ARG 62 CO 0.40 0.67 1.23 0.08 -0.81 0.00 0.00 175.30 176.87 1tye s VAL 63 N -0.89 3.84 0.00 7.11 1.01 -1.26 -1.56 120.40 128.64 1tye s VAL 63 Ca 0.21 0.43 0.00 0.00 0.00 0.00 0.00 61.98 62.62 1tye s VAL 63 Cb -0.15 -4.86 0.00 0.00 0.00 0.00 0.00 36.38 31.37 1tye s VAL 63 CO 0.10 -1.72 0.00 0.18 0.00 0.00 0.00 175.10 173.66 1tye n LEU 64 N 9.04 0.00 -4.68 3.92 4.32 -1.01 -4.88 117.00 123.71 1tye n LEU 64 Ca 0.03 0.00 -0.36 0.00 -0.02 0.00 0.00 56.01 55.66 1tye n LEU 64 Cb 0.49 0.00 -0.09 0.00 -1.62 0.00 0.00 43.42 42.20 1tye n LEU 64 CO 0.70 0.00 -0.18 -1.83 -1.22 0.00 0.00 177.39 174.86 1tye s GLU 65 N 0.00 4.10 -0.38 3.23 -1.05 -1.17 -5.02 118.70 118.41 1tye s GLU 65 Ca 0.00 -0.26 0.03 0.00 -0.15 0.00 0.00 54.97 54.60 1tye s GLU 65 Cb 0.00 -3.49 0.16 0.00 -0.44 0.00 0.00 34.13 30.36 1tye s GLU 65 CO 0.00 0.15 0.38 0.16 0.95 0.00 0.00 175.26 176.90 1tye s ASP 66 N 0.81 1.13 0.32 0.83 -4.77 -1.26 -1.52 116.67 112.21 1tye s ASP 66 Ca 0.08 -1.74 -0.28 0.00 -3.30 0.00 0.00 52.55 47.31 1tye s ASP 66 Cb -0.13 0.51 -0.09 0.00 -1.09 0.00 0.00 42.92 42.12 1tye s ASP 66 CO 0.02 -0.24 1.14 -0.13 0.70 0.00 0.00 175.17 176.66 1tye s ARG 67 N 1.27 4.44 1.22 2.11 1.81 -1.26 -4.94 118.95 123.59 1tye s ARG 67 Ca 0.19 1.84 -0.16 0.00 -1.72 0.00 0.00 55.73 55.87 1tye s ARG 67 Cb -0.14 -3.00 0.29 0.00 -0.45 0.00 0.00 34.95 31.65 1tye s ARG 67 CO -0.03 0.02 1.03 -2.14 -0.68 0.00 0.00 175.30 173.49 1tye s PRO 68 N -1.77 -1.33 -0.16 3.54 0.02 -1.26 -4.74 135.00 129.29 1tye s PRO 68 Ca 0.49 0.41 -0.21 0.00 0.02 0.00 0.00 61.00 61.72 1tye s PRO 68 Cb -0.32 -1.54 -0.03 0.00 0.02 0.00 0.00 34.50 32.63 1tye s PRO 68 CO 0.41 -3.89 0.60 -0.51 -0.33 0.00 0.00 177.00 173.28 1tye s LEU 69 N -7.22 4.20 1.14 -5.54 1.43 -1.26 -4.74 118.68 106.68 1tye s LEU 69 Ca 0.68 0.87 -0.13 0.00 -1.03 0.00 0.00 54.13 54.53 1tye s LEU 69 Cb -0.18 -2.87 0.27 0.00 0.03 0.00 0.00 46.19 43.44 1tye s LEU 69 CO 0.60 -0.19 1.04 -0.44 0.23 0.00 0.00 176.35 177.59 1tye s SER 70 N 1.02 1.22 -0.39 2.29 0.01 -0.96 -5.05 113.70 111.84 1tye s SER 70 Ca 0.29 1.52 0.08 0.00 1.31 0.00 0.00 55.95 59.16 1tye s SER 70 Cb -0.16 -2.27 0.26 0.00 0.21 0.00 0.00 66.02 64.06 1tye s SER 70 CO 0.12 -4.06 0.55 0.47 0.41 0.00 0.00 173.24 170.73 1tye n ASP 71 N -4.82 0.30 0.02 2.44 8.00 -1.26 -4.98 116.55 116.26 1tye n ASP 71 Ca 0.04 -2.74 0.00 0.00 0.71 0.00 0.00 54.79 52.80 1tye n ASP 71 Cb 0.54 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 41.01 1tye n ASP 71 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1tye n LYS 72 N 1.28 0.00 0.00 -1.24 2.85 -1.26 -5.01 118.16 114.77 1tye n LYS 72 Ca 0.22 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.48 1tye n LYS 72 Cb 0.54 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.92 1tye n LYS 72 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1tye n GLY 73 N -1.24 2.28 2.78 2.58 0.00 -1.23 -4.90 105.19 105.46 1tye n GLY 73 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1tye n GLY 73 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1tye n SER 74 N 0.00 2.19 0.00 1.61 7.64 -1.26 -4.25 113.62 119.54 1tye n SER 74 Ca 0.00 -2.75 0.00 0.00 1.01 0.00 0.00 58.87 57.13 1tye n SER 74 Cb 0.00 0.54 0.00 0.00 -1.01 0.00 0.00 64.21 63.74 1tye n SER 74 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tye n GLY 75 N 0.03 1.74 2.75 0.23 0.00 -1.26 -4.34 105.19 104.35 1tye n GLY 75 Ca -0.11 -0.25 -0.33 0.00 0.00 0.00 0.00 46.02 45.33 1tye n GLY 75 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1tye n ASP 76 N 5.09 5.37 0.00 1.61 8.00 -1.26 -4.87 116.55 130.49 1tye n ASP 76 Ca 0.00 -3.58 0.07 0.00 0.71 0.00 0.00 54.79 51.99 1tye n ASP 76 Cb 0.00 -0.87 0.40 0.00 -0.02 0.00 0.00 41.12 40.63 1tye n ASP 76 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1tye n SER 77 N 0.36 0.00 0.18 -2.24 3.41 -1.26 -4.23 113.62 109.83 1tye n SER 77 Ca 0.34 -0.97 0.04 0.00 -0.26 0.00 0.00 58.87 58.01 1tye n SER 77 Cb 0.35 0.00 0.31 0.00 -0.26 0.00 0.00 64.21 64.62 1tye n SER 77 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1tye h SER 78 N 0.00 0.00 -0.72 4.04 0.02 -1.97 -3.39 113.55 111.53 1tye h SER 78 Ca 0.00 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.62 1tye h SER 78 Cb 0.00 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 62.30 1tye h SER 78 CO 0.00 0.43 -0.72 0.00 -1.14 0.00 0.00 176.83 175.40 1tye n GLN 79 N -3.69 0.93 -3.15 3.45 6.02 -1.26 -5.15 117.38 114.53 1tye n GLN 79 Ca -0.01 -2.40 -0.24 0.00 -0.01 0.00 0.00 57.00 54.34 1tye n GLN 79 Cb 0.51 -1.31 -0.00 0.00 1.02 0.00 0.00 30.24 30.46 1tye n GLN 79 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1tye s VAL 80 N -0.49 4.72 -0.14 5.09 0.11 -1.26 -5.11 120.40 123.31 1tye s VAL 80 Ca 0.30 -0.39 0.01 0.00 -2.93 0.00 0.00 61.98 58.98 1tye s VAL 80 Cb 0.28 -3.74 0.00 0.00 -1.53 0.00 0.00 36.38 31.40 1tye s VAL 80 CO -0.10 -0.52 -0.19 0.42 -3.33 0.00 0.00 175.10 171.38 1tye s THR 81 N -2.45 2.41 -0.05 5.04 -4.23 -1.26 -4.93 115.64 110.17 1tye s THR 81 Ca 0.44 -0.87 0.09 0.00 -1.18 0.00 0.00 61.69 60.17 1tye s THR 81 Cb -0.10 -1.99 0.17 0.00 1.34 0.00 0.00 72.50 71.92 1tye s THR 81 CO 0.38 0.53 1.08 0.00 -0.54 0.00 0.00 174.62 176.07 1tye n GLN 82 N 3.95 0.42 -3.75 3.99 10.64 -1.26 -2.26 117.38 129.11 1tye n GLN 82 Ca -0.19 -1.70 -0.19 0.00 -1.83 0.00 0.00 57.00 53.09 1tye n GLN 82 Cb 0.52 -0.74 -0.17 0.00 -0.86 0.00 0.00 30.24 28.98 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 -0.92 0.04 0.00 -0.39 1.01 -1.26 -1.84 120.40 117.04 1tye s VAL 83 Ca 0.16 0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.41 1tye s VAL 83 Cb 0.15 -0.24 0.00 0.00 0.00 0.00 0.00 36.38 36.30 1tye s VAL 83 CO -0.02 0.18 0.00 -1.20 0.00 0.00 0.00 175.10 174.05 1tye n SER 84 N 4.89 -0.72 -4.38 3.32 7.64 0.98 -4.47 113.62 120.88 1tye n SER 84 Ca -0.12 0.00 -0.52 0.00 1.01 0.00 0.00 58.87 59.24 1tye n SER 84 Cb 0.50 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.60 1tye n SER 84 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1tye n PRO 85 N -0.72 0.52 0.03 1.43 -0.01 -1.26 -4.75 135.00 130.23 1tye n PRO 85 Ca 0.00 0.13 -0.03 0.00 -0.01 0.00 0.00 63.50 63.58 1tye n PRO 85 Cb 0.00 -2.01 0.21 0.00 -0.01 0.00 0.00 33.50 31.68 1tye n PRO 85 CO 0.00 0.00 0.00 1.96 -0.01 0.00 0.00 175.50 177.45 1tye h GLN 86 N 11.36 0.44 -2.92 -0.52 7.50 -1.49 -3.43 115.11 126.05 1tye h GLN 86 Ca -0.17 -0.17 -0.16 0.00 0.50 0.00 0.00 58.65 58.65 1tye h GLN 86 Cb 1.36 -0.02 -0.27 0.00 0.05 0.00 0.00 27.48 28.59 1tye h GLN 86 CO 1.10 0.69 -0.38 0.50 -1.50 0.00 0.00 178.83 179.23 1tye s ARG 87 N -4.44 0.32 0.03 1.46 3.52 -1.15 -0.33 118.95 118.36 1tye s ARG 87 Ca -0.06 0.55 0.02 0.00 -0.13 0.00 0.00 55.73 56.10 1tye s ARG 87 Cb 0.14 0.03 -0.02 0.00 -1.56 0.00 0.00 34.95 33.54 1tye s ARG 87 CO 0.79 -0.11 -0.07 0.96 -0.81 0.00 0.00 175.30 176.06 1tye s ILE 88 N 0.82 0.47 -0.37 4.11 -4.36 -0.10 -2.41 121.20 119.36 1tye s ILE 88 Ca -0.05 -0.90 -0.14 0.00 -0.26 0.00 0.00 60.65 59.29 1tye s ILE 88 Cb -0.06 -0.53 -0.00 0.00 1.25 0.00 0.00 42.46 43.12 1tye s ILE 88 CO -0.06 -0.30 0.30 0.00 0.24 0.00 0.00 174.94 175.12 1tye s ALA 89 N -1.15 3.49 -0.49 2.27 0.00 -0.60 -0.58 121.76 124.70 1tye s ALA 89 Ca -0.08 -1.46 -0.14 0.00 0.00 0.00 0.00 51.96 50.27 1tye s ALA 89 Cb -0.08 -2.80 0.09 0.00 0.00 0.00 0.00 23.12 20.32 1tye s ALA 89 CO 0.00 -1.20 0.41 -1.17 0.00 0.00 0.00 175.76 173.80 1tye s LEU 90 N 1.81 5.75 -0.17 0.00 2.96 0.79 -0.22 118.68 129.59 1tye s LEU 90 Ca 0.07 -1.53 -0.06 0.00 -0.22 0.00 0.00 54.13 52.40 1tye s LEU 90 Cb -0.18 -2.16 -0.03 0.00 0.50 0.00 0.00 46.19 44.32 1tye s LEU 90 CO 0.11 -0.70 0.02 -0.13 -1.32 0.00 0.00 176.35 174.33 1tye s ARG 91 N 1.58 3.83 -0.15 1.98 0.52 -1.26 -0.43 118.95 125.03 1tye s ARG 91 Ca 0.04 -0.43 -0.13 0.00 -0.52 0.00 0.00 55.73 54.69 1tye s ARG 91 Cb -0.26 -3.09 0.04 0.00 0.52 0.00 0.00 34.95 32.16 1tye s ARG 91 CO 0.04 0.24 0.39 -0.48 0.02 0.00 0.00 175.30 175.52 1tye s LEU 92 N 0.41 0.49 0.78 2.53 0.05 -0.79 -0.94 118.68 121.21 1tye s LEU 92 Ca -0.00 0.79 -0.12 0.00 0.05 0.00 0.00 54.13 54.85 1tye s LEU 92 Cb -0.13 1.33 0.06 0.00 -2.05 0.00 0.00 46.19 45.40 1tye s LEU 92 CO 0.01 -0.14 1.11 0.00 -0.55 0.00 0.00 176.35 176.79 1tye s ARG 93 N 0.25 2.25 0.13 1.48 1.70 -1.26 -2.78 118.95 120.71 1tye s ARG 93 Ca -0.00 0.49 -0.35 0.00 -0.47 0.00 0.00 55.73 55.39 1tye s ARG 93 Cb -0.03 -1.95 -0.16 0.00 -0.57 0.00 0.00 34.95 32.24 1tye s ARG 93 CO 0.00 -1.47 1.25 -0.35 -1.08 0.00 0.00 175.30 173.65 1tye n PRO 94 N -3.30 1.13 -0.48 3.89 -0.04 -1.26 -1.91 135.00 133.03 1tye n PRO 94 Ca 0.07 0.41 0.00 0.00 -0.04 0.00 0.00 63.50 63.94 1tye n PRO 94 Cb 0.57 -1.98 0.00 0.00 -0.04 0.00 0.00 33.50 32.06 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 2.27 0.00 -3.75 3.54 8.00 -1.18 -4.37 116.55 121.06 1tye n ASP 95 Ca 0.17 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.39 1tye n ASP 95 Cb 0.22 -1.97 0.20 0.00 -0.02 0.00 0.00 41.12 39.54 1tye n ASP 95 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1tye n ASP 96 N 0.00 -0.09 -3.77 -2.24 2.03 -0.80 -4.67 116.55 107.01 1tye n ASP 96 Ca 0.00 -1.42 -0.10 0.00 0.52 0.00 0.00 54.79 53.79 1tye n ASP 96 Cb 0.00 -0.95 -0.06 0.00 -0.72 0.00 0.00 41.12 39.40 1tye n ASP 96 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1tye s SER 97 N -5.43 -0.10 0.06 1.67 1.04 -1.26 -2.35 113.70 107.33 1tye s SER 97 Ca 0.70 -0.53 -0.09 0.00 0.48 0.00 0.00 55.95 56.51 1tye s SER 97 Cb -0.02 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.55 1tye s SER 97 CO 0.49 -0.86 0.19 -0.75 0.98 0.00 0.00 173.24 173.29 1tye s LYS 98 N -3.86 0.75 0.19 4.02 2.47 -0.68 -4.96 119.74 117.67 1tye s LYS 98 Ca 0.07 -0.77 0.09 0.00 -1.56 0.00 0.00 55.97 53.81 1tye s LYS 98 Cb 0.02 0.31 -0.04 0.00 -1.46 0.00 0.00 37.83 36.66 1tye s LYS 98 CO -0.08 -0.22 -0.19 0.54 0.16 0.00 0.00 175.35 175.56 1tye s ASN 99 N -2.40 2.92 -0.10 1.43 4.22 -1.26 -0.04 114.94 119.70 1tye s ASN 99 Ca -0.01 -0.92 -0.27 0.00 -2.14 0.00 0.00 52.86 49.52 1tye s ASN 99 Cb 0.01 -0.19 0.06 0.00 1.28 0.00 0.00 41.25 42.42 1tye s ASN 99 CO -0.07 -0.02 0.65 0.72 -2.04 0.00 0.00 177.10 176.34 1tye s PHE 100 N -2.23 -0.64 0.27 1.54 -0.71 0.35 -4.99 117.98 111.57 1tye s PHE 100 Ca 0.20 1.25 0.06 0.00 -1.04 0.00 0.00 56.93 57.40 1tye s PHE 100 Cb -0.05 0.34 -0.03 0.00 -1.21 0.00 0.00 43.02 42.07 1tye s PHE 100 CO 0.08 -0.52 0.34 -1.54 -1.34 0.00 0.00 175.22 172.25 1tye s SER 101 N -0.76 5.97 -0.08 1.98 1.04 -1.26 -0.48 113.70 120.11 1tye s SER 101 Ca -0.08 -0.11 -0.05 0.00 0.48 0.00 0.00 55.95 56.19 1tye s SER 101 Cb -0.02 -1.53 0.03 0.00 0.10 0.00 0.00 66.02 64.61 1tye s SER 101 CO 0.07 -0.17 0.19 -0.51 0.98 0.00 0.00 173.24 173.80 1tye s ILE 102 N -2.09 -0.03 -0.07 -1.02 2.07 0.64 -4.76 121.20 115.94 1tye s ILE 102 Ca 0.37 0.11 0.01 0.00 -1.41 0.00 0.00 60.65 59.73 1tye s ILE 102 Cb -0.09 -0.30 -0.03 0.00 0.13 0.00 0.00 42.46 42.18 1tye s ILE 102 CO 0.28 0.04 -0.09 -1.10 -1.91 0.00 0.00 174.94 172.16 1tye s GLN 103 N 0.83 2.79 -0.02 3.50 -0.21 -1.26 0.10 119.66 125.38 1tye s GLN 103 Ca -0.06 -0.60 0.02 0.00 0.02 0.00 0.00 55.36 54.74 1tye s GLN 103 Cb -0.08 -2.55 0.00 0.00 1.00 0.00 0.00 33.01 31.38 1tye s GLN 103 CO -0.05 0.59 -0.08 0.08 -2.12 0.00 0.00 175.29 173.71 1tye s VAL 104 N -0.62 0.70 -0.00 1.09 1.01 0.12 -0.02 120.40 122.68 1tye s VAL 104 Ca 0.09 -0.33 -0.01 0.00 0.00 0.00 0.00 61.98 61.74 1tye s VAL 104 Cb -0.11 -0.62 0.00 0.00 0.00 0.00 0.00 36.38 35.65 1tye s VAL 104 CO 0.02 0.22 0.02 0.00 0.00 0.00 0.00 175.10 175.35 1tye s ARG 105 N 0.12 0.04 -0.47 2.72 1.70 -0.77 0.62 118.95 122.91 1tye s ARG 105 Ca -0.02 -0.02 -0.29 0.00 -0.47 0.00 0.00 55.73 54.93 1tye s ARG 105 Cb -0.07 0.02 0.03 0.00 -0.57 0.00 0.00 34.95 34.35 1tye s ARG 105 CO 0.00 -0.01 1.19 -1.14 -1.08 0.00 0.00 175.30 174.27 1tye s GLN 106 N -0.10 3.69 -0.09 3.89 2.00 -0.75 -4.73 119.66 123.57 1tye s GLN 106 Ca -0.01 0.62 -0.01 0.00 -2.00 0.00 0.00 55.36 53.97 1tye s GLN 106 Cb -0.01 -3.93 -0.05 0.00 0.80 0.00 0.00 33.01 29.82 1tye s GLN 106 CO -0.00 -1.43 -0.09 1.55 -0.50 0.00 0.00 175.29 174.82 1tye n VAL 107 N 6.90 0.51 -0.56 1.34 3.14 -1.26 0.17 118.33 128.56 1tye n VAL 107 Ca 0.13 -0.18 -0.28 0.00 -2.96 0.00 0.00 64.34 61.05 1tye n VAL 107 Cb 0.49 -1.02 0.26 0.00 -1.06 0.00 0.00 33.84 32.51 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 -2.17 -1.11 0.19 1.45 2.02 -1.26 -3.52 118.70 114.29 1tye s GLU 108 Ca -0.12 0.74 -0.12 0.00 0.02 0.00 0.00 54.97 55.48 1tye s GLU 108 Cb 0.04 -1.54 -0.07 0.00 0.10 0.00 0.00 34.13 32.66 1tye s GLU 108 CO 0.19 -3.83 0.55 -0.51 0.02 0.00 0.00 175.26 171.69 1tye s ASP 109 N -2.60 6.73 0.26 -0.19 1.01 -1.26 -4.92 116.67 115.70 1tye s ASP 109 Ca 0.68 1.01 -0.29 0.00 0.71 0.00 0.00 52.55 54.66 1tye s ASP 109 Cb -0.24 -2.26 -0.09 0.00 1.01 0.00 0.00 42.92 41.33 1tye s ASP 109 CO 0.64 0.02 1.27 -0.31 0.21 0.00 0.00 175.17 177.00 1tye s TYR 110 N -1.64 3.23 0.05 4.23 2.02 -1.26 -4.79 117.35 119.19 1tye s TYR 110 Ca 0.43 1.37 -0.30 0.00 -0.37 0.00 0.00 57.07 58.19 1tye s TYR 110 Cb -0.13 -3.58 -0.05 0.00 -0.40 0.00 0.00 41.96 37.80 1tye s TYR 110 CO 0.20 -1.66 1.15 -2.14 -1.57 0.00 0.00 175.55 171.53 1tye s PRO 111 N -0.97 4.47 -0.01 -1.71 0.02 -1.26 -4.49 135.00 131.05 1tye s PRO 111 Ca 0.52 1.70 0.03 0.00 0.02 0.00 0.00 61.00 63.27 1tye s PRO 111 Cb -0.37 -3.37 -0.01 0.00 0.02 0.00 0.00 34.50 30.78 1tye s PRO 111 CO 0.44 -0.20 -0.11 0.08 -0.33 0.00 0.00 177.00 176.88 1tye s VAL 112 N 0.98 0.91 -0.13 3.83 1.01 -0.75 -1.26 120.40 124.99 1tye s VAL 112 Ca 0.57 -0.48 0.02 0.00 0.00 0.00 0.00 61.98 62.09 1tye s VAL 112 Cb -0.28 -0.76 -0.00 0.00 0.00 0.00 0.00 36.38 35.34 1tye s VAL 112 CO 0.29 0.26 -0.19 -1.81 0.00 0.00 0.00 175.10 173.65 1tye s ASP 113 N -0.20 3.43 -0.14 3.32 1.01 0.53 -1.78 116.67 122.86 1tye s ASP 113 Ca 0.03 -0.51 0.00 0.00 0.71 0.00 0.00 52.55 52.79 1tye s ASP 113 Cb -0.05 -1.50 0.02 0.00 1.01 0.00 0.00 42.92 42.40 1tye s ASP 113 CO -0.00 0.11 -0.13 -0.63 0.21 0.00 0.00 175.17 174.74 1tye s ILE 114 N 0.63 1.44 -0.17 0.77 1.01 -0.28 -0.78 121.20 123.82 1tye s ILE 114 Ca -0.10 -0.55 -0.02 0.00 0.00 0.00 0.00 60.65 59.98 1tye s ILE 114 Cb -0.16 -1.37 -0.01 0.00 0.01 0.00 0.00 42.46 40.93 1tye s ILE 114 CO 0.03 0.44 -0.09 -0.47 0.00 0.00 0.00 174.94 174.84 1tye s TYR 115 N 1.52 2.89 -0.17 3.97 5.04 -0.92 -1.97 117.35 127.70 1tye s TYR 115 Ca 0.04 -0.77 -0.12 0.00 -2.44 0.00 0.00 57.07 53.78 1tye s TYR 115 Cb -0.13 -1.97 -0.05 0.00 0.35 0.00 0.00 41.96 40.17 1tye s TYR 115 CO -0.10 -0.36 0.21 -0.47 -1.34 0.00 0.00 175.55 173.50 1tye s TYR 116 N 0.85 3.45 -0.29 4.97 5.04 -0.38 -1.00 117.35 129.99 1tye s TYR 116 Ca -0.03 0.47 -0.00 0.00 -2.44 0.00 0.00 57.07 55.07 1tye s TYR 116 Cb -0.15 -2.24 0.05 0.00 0.35 0.00 0.00 41.96 39.98 1tye s TYR 116 CO 0.01 0.29 -0.03 -1.17 -1.34 0.00 0.00 175.55 173.31 1tye s LEU 117 N 0.32 3.80 -0.12 6.97 2.96 0.10 -0.19 118.68 132.52 1tye s LEU 117 Ca 0.13 -1.32 -0.13 0.00 -0.22 0.00 0.00 54.13 52.58 1tye s LEU 117 Cb -0.12 -1.67 -0.05 0.00 0.50 0.00 0.00 46.19 44.85 1tye s LEU 117 CO 0.01 -0.24 0.31 -0.04 -1.32 0.00 0.00 176.35 175.06 1tye s MET 118 N 1.21 4.08 -0.53 1.98 -1.94 0.56 -1.66 119.30 123.01 1tye s MET 118 Ca -0.06 0.15 -0.24 0.00 -1.71 0.00 0.00 55.69 53.83 1tye s MET 118 Cb -0.20 -3.35 0.04 0.00 2.01 0.00 0.00 34.83 33.33 1tye s MET 118 CO -0.02 0.40 0.92 0.34 -0.01 0.00 0.00 175.02 176.65 1tye s ASP 119 N -0.05 6.37 -0.32 3.03 -1.08 -1.13 -1.27 116.67 122.23 1tye s ASP 119 Ca 0.18 -0.26 0.10 0.00 -0.52 0.00 0.00 52.55 52.06 1tye s ASP 119 Cb -0.14 -2.43 0.70 0.00 -1.46 0.00 0.00 42.92 39.59 1tye s ASP 119 CO 0.06 -1.16 1.75 0.18 0.52 0.00 0.00 175.17 176.51 1tye n LEU 120 N 7.33 5.73 -4.84 -1.34 4.32 -0.71 -4.78 117.00 122.70 1tye n LEU 120 Ca 0.02 -3.29 -0.31 0.00 -0.02 0.00 0.00 56.01 52.41 1tye n LEU 120 Cb 0.48 -0.72 0.02 0.00 -1.62 0.00 0.00 43.42 41.57 1tye n LEU 120 CO 0.63 0.86 0.71 -0.94 -1.22 0.00 0.00 177.39 177.43 1tye s SER 121 N -1.31 5.92 0.60 -1.43 1.04 -1.26 -0.57 113.70 116.69 1tye s SER 121 Ca 0.53 1.55 0.29 0.00 0.48 0.00 0.00 55.95 58.79 1tye s SER 121 Cb 0.43 -2.49 1.47 0.00 0.10 0.00 0.00 66.02 65.53 1tye s SER 121 CO 0.12 -1.08 1.88 0.22 0.98 0.00 0.00 173.24 175.36 1tye h TYR 122 N -0.26 0.00 0.00 5.02 3.20 -0.86 -0.04 116.97 124.02 1tye h TYR 122 Ca -0.44 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.43 1tye h TYR 122 Cb 1.20 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.47 1tye h TYR 122 CO 0.64 0.00 0.00 -1.13 -1.64 0.00 0.00 178.16 176.03 1tye n SER 123 N -3.62 0.00 -1.00 -2.11 3.41 -1.26 -2.34 113.62 106.70 1tye n SER 123 Ca 0.08 0.31 0.12 0.00 -0.26 0.00 0.00 58.87 59.12 1tye n SER 123 Cb 0.67 -0.41 0.22 0.00 -0.26 0.00 0.00 64.21 64.43 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 -1.41 2.32 -0.21 4.33 2.81 -0.03 -4.40 117.12 120.52 1tye n MET 124 Ca 0.06 -1.98 -0.03 0.00 -1.81 0.00 0.00 57.70 53.95 1tye n MET 124 Cb 0.18 -1.48 0.08 0.00 -0.71 0.00 0.00 33.22 31.29 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 4.14 0.63 -0.00 0.03 3.64 -1.61 0.36 116.57 123.75 1tye h LYS 125 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1tye h LYS 125 Cb 0.90 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.58 1tye h LYS 125 CO 0.00 0.42 -0.03 -0.40 -2.27 0.00 0.00 179.45 177.16 1tye n ASP 126 N -4.80 0.41 -0.08 4.20 5.75 -1.26 -3.27 116.55 117.49 1tye n ASP 126 Ca 0.07 -0.85 0.05 0.00 -0.01 0.00 0.00 54.79 54.05 1tye n ASP 126 Cb 0.15 -0.06 -0.03 0.00 -1.03 0.00 0.00 41.12 40.15 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 -0.82 0.71 -0.25 -1.12 9.92 -0.07 -4.72 116.55 120.21 1tye n ASP 127 Ca 0.19 -0.86 0.04 0.00 -0.53 0.00 0.00 54.79 53.63 1tye n ASP 127 Cb 0.22 0.81 0.17 0.00 -0.64 0.00 0.00 41.12 41.67 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 0.40 0.31 -0.54 0.64 5.85 -0.37 -1.44 115.31 120.15 1tye h LEU 128 Ca 0.00 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1tye h LEU 128 Cb 0.26 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 1tye h LEU 128 CO 0.00 0.14 0.26 -0.25 -0.34 0.00 0.00 178.44 178.25 1tye h TRP 129 N 0.47 0.78 -0.55 1.25 7.01 -1.84 -1.61 115.95 121.46 1tye h TRP 129 Ca 0.39 -0.04 0.03 0.00 2.11 0.00 0.00 58.89 61.37 1tye h TRP 129 Cb 0.54 -0.24 -0.04 0.00 -2.10 0.00 0.00 29.16 27.32 1tye h TRP 129 CO -0.15 0.61 0.32 0.77 -2.79 0.00 0.00 178.44 177.20 1tye h SER 130 N 0.73 0.52 1.19 2.65 0.02 -1.61 -0.69 113.55 116.36 1tye h SER 130 Ca 0.19 0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 61.03 1tye h SER 130 Cb 0.12 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 1tye h SER 130 CO -0.02 0.36 -0.55 0.16 -1.14 0.00 0.00 176.83 175.64 1tye h ILE 131 N 0.64 1.03 -0.02 3.27 3.07 -1.26 -1.53 117.51 122.72 1tye h ILE 131 Ca 0.22 -2.22 -0.17 0.00 1.55 0.00 0.00 64.86 64.24 1tye h ILE 131 Cb 0.04 2.34 -0.01 0.00 -0.27 0.00 0.00 36.82 38.91 1tye h ILE 131 CO -0.10 0.54 -0.76 1.56 -1.05 0.00 0.00 178.15 178.34 1tye h GLN 132 N 0.00 0.17 0.06 0.16 4.20 -1.03 -1.44 115.11 117.24 1tye h GLN 132 Ca -0.01 -0.16 -0.00 0.00 0.06 0.00 0.00 58.65 58.54 1tye h GLN 132 Cb 1.30 0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.12 1tye h GLN 132 CO 0.07 0.85 -0.03 -0.97 -0.67 0.00 0.00 178.83 178.08 1tye h ASN 133 N 0.11 -0.07 -0.23 1.46 -1.24 -1.05 -2.32 115.58 112.24 1tye h ASN 133 Ca -0.02 -0.38 0.00 0.00 0.71 0.00 0.00 56.30 56.61 1tye h ASN 133 Cb 1.33 0.02 -0.01 0.00 0.73 0.00 0.00 38.32 40.39 1tye h ASN 133 CO 0.11 0.35 0.16 0.25 -1.29 0.00 0.00 177.43 177.01 1tye h LEU 134 N -0.51 0.26 -0.73 0.34 5.85 -1.27 -0.04 115.31 119.21 1tye h LEU 134 Ca -0.01 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.60 1tye h LEU 134 Cb 0.45 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1tye h LEU 134 CO 0.01 0.19 -0.18 1.23 -0.34 0.00 0.00 178.44 179.35 1tye h GLY 135 N 0.31 0.84 0.35 3.75 0.00 -1.09 -1.56 103.07 105.67 1tye h GLY 135 Ca 0.09 -0.68 -0.00 0.00 0.00 0.00 0.00 47.33 46.73 1tye h GLY 135 CO -0.02 0.63 -0.04 -0.84 0.00 0.00 0.00 176.54 176.27 1tye h THR 136 N 0.69 1.19 -0.22 4.70 2.02 -0.71 -3.23 112.91 117.34 1tye h THR 136 Ca 0.10 -1.34 0.06 0.00 0.77 0.00 0.00 66.41 66.01 1tye h THR 136 Cb 0.68 2.01 -0.01 0.00 -1.74 0.00 0.00 68.15 69.09 1tye h THR 136 CO 0.05 0.31 0.20 0.11 0.37 0.00 0.00 175.52 176.56 1tye h LYS 137 N -0.75 0.00 0.15 6.66 6.56 -1.07 -2.63 116.57 125.48 1tye h LYS 137 Ca -0.01 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.57 1tye h LYS 137 Cb 0.59 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.25 1tye h LYS 137 CO 0.02 0.00 -0.07 1.25 -2.06 0.00 0.00 179.45 178.59 1tye h LEU 138 N 0.00 -0.17 -1.56 2.94 5.85 -1.30 0.19 115.31 121.26 1tye h LEU 138 Ca 0.11 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1tye h LEU 138 Cb 0.51 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.58 1tye h LEU 138 CO -0.00 0.02 0.00 0.00 -0.34 0.00 0.00 178.44 178.12 1tye h ALA 139 N 0.47 1.00 0.02 1.25 0.00 -1.56 -2.56 119.26 117.88 1tye h ALA 139 Ca -0.02 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1tye h ALA 139 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1tye h ALA 139 CO 0.03 0.00 -0.01 1.15 0.00 0.00 0.00 179.25 180.43 1tye h THR 140 N 0.00 0.00 -1.02 0.00 2.02 -1.24 -2.73 112.91 109.94 1tye h THR 140 Ca 0.00 -0.88 0.26 0.00 0.77 0.00 0.00 66.41 66.56 1tye h THR 140 Cb 0.38 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.67 1tye h THR 140 CO 0.00 0.00 0.62 -0.61 0.37 0.00 0.00 175.52 175.90 1tye h GLN 141 N -0.91 0.48 0.03 6.66 5.75 -0.58 0.62 115.11 127.17 1tye h GLN 141 Ca -0.00 -0.03 -0.22 0.00 -0.15 0.00 0.00 58.65 58.25 1tye h GLN 141 Cb 0.02 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.44 1tye h GLN 141 CO 0.00 0.32 -1.01 0.52 -2.65 0.00 0.00 178.83 176.01 1tye h MET 142 N 0.50 0.09 -0.05 1.69 2.86 -1.60 -3.21 114.93 115.21 1tye h MET 142 Ca 0.65 -0.14 -0.00 0.00 -2.06 0.00 0.00 59.70 58.15 1tye h MET 142 Cb 1.38 0.05 -0.00 0.00 0.06 0.00 0.00 31.60 33.08 1tye h MET 142 CO -0.45 1.02 0.02 -0.09 1.06 0.00 0.00 176.91 178.47 1tye h ARG 143 N 0.03 0.06 -0.81 1.72 9.65 -0.55 -0.11 114.38 124.37 1tye h ARG 143 Ca -0.04 -0.00 -0.11 0.00 -1.10 0.00 0.00 59.98 58.72 1tye h ARG 143 Cb 1.73 -0.01 -0.07 0.00 -1.39 0.00 0.00 29.97 30.23 1tye h ARG 143 CO 0.14 0.06 0.14 1.63 2.80 0.00 0.00 179.97 184.75 1tye n LYS 144 N -4.51 3.07 0.00 0.20 5.02 -0.97 -3.86 118.16 117.10 1tye n LYS 144 Ca -0.02 -2.10 0.00 0.00 -2.02 0.00 0.00 58.31 54.17 1tye n LYS 144 Cb 0.10 -1.95 0.00 0.00 -0.02 0.00 0.00 35.03 33.16 1tye n LYS 144 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1tye n LEU 145 N 0.09 0.00 -3.80 -0.35 7.94 -0.22 -5.08 117.00 115.59 1tye n LEU 145 Ca 0.26 0.00 -0.05 0.00 -1.11 0.00 0.00 56.01 55.11 1tye n LEU 145 Cb 1.02 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 44.96 1tye n LEU 145 CO 0.28 0.00 0.63 0.28 -1.11 0.00 0.00 177.39 177.47 1tye s THR 146 N -0.08 0.00 0.00 1.96 -1.32 -0.25 -4.90 115.64 111.06 1tye s THR 146 Ca 0.00 -0.79 0.00 0.00 -1.21 0.00 0.00 61.69 59.69 1tye s THR 146 Cb 0.00 -2.02 0.00 0.00 -1.51 0.00 0.00 72.50 68.97 1tye s THR 146 CO 0.00 0.00 0.17 -1.54 -2.21 0.00 0.00 174.62 171.04 1tye n SER 147 N -0.48 0.33 -3.24 8.08 3.41 -1.26 -4.24 113.62 116.21 1tye n SER 147 Ca -0.05 -0.66 -0.39 0.00 -0.26 0.00 0.00 58.87 57.50 1tye n SER 147 Cb 0.60 0.35 0.02 0.00 -0.26 0.00 0.00 64.21 64.92 1tye n SER 147 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1tye n ASN 148 N -0.35 7.11 -4.88 4.04 2.85 -1.26 -4.99 115.26 117.79 1tye n ASN 148 Ca 0.00 -3.75 -0.35 0.00 -0.11 0.00 0.00 54.58 50.37 1tye n ASN 148 Cb 0.04 -1.05 -0.05 0.00 1.24 0.00 0.00 39.78 39.95 1tye n ASN 148 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 1tye s LEU 149 N -4.14 4.38 -0.05 1.20 2.96 -1.26 -1.80 118.68 119.96 1tye s LEU 149 Ca 0.45 0.61 0.01 0.00 -0.22 0.00 0.00 54.13 54.98 1tye s LEU 149 Cb 0.31 -2.66 0.02 0.00 0.50 0.00 0.00 46.19 44.36 1tye s LEU 149 CO -0.25 0.26 -0.04 -0.13 -1.32 0.00 0.00 176.35 174.87 1tye s ARG 150 N -1.68 0.88 0.08 1.98 1.81 -0.73 -4.46 118.95 116.83 1tye s ARG 150 Ca 0.27 -0.09 0.02 0.00 -1.72 0.00 0.00 55.73 54.21 1tye s ARG 150 Cb -0.13 -0.94 -0.04 0.00 -0.45 0.00 0.00 34.95 33.39 1tye s ARG 150 CO 0.15 -0.12 -0.08 -1.50 -0.68 0.00 0.00 175.30 173.07 1tye s ILE 151 N 1.13 0.69 0.05 1.52 2.07 0.17 -1.12 121.20 125.71 1tye s ILE 151 Ca -0.08 -1.63 -0.17 0.00 -1.41 0.00 0.00 60.65 57.37 1tye s ILE 151 Cb -0.14 -1.31 0.06 0.00 0.13 0.00 0.00 42.46 41.20 1tye s ILE 151 CO -0.01 -0.68 0.76 0.61 -1.91 0.00 0.00 174.94 173.72 1tye n GLY 152 N 0.50 0.58 3.78 1.50 0.00 -0.83 0.15 105.19 110.87 1tye n GLY 152 Ca -0.16 -1.02 -0.06 0.00 0.00 0.00 0.00 46.02 44.78 1tye n GLY 152 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1tye s PHE 153 N -2.88 -0.20 0.16 1.61 -0.71 -0.36 -1.25 117.98 114.35 1tye s PHE 153 Ca 0.18 -0.17 -0.07 0.00 -1.04 0.00 0.00 56.93 55.82 1tye s PHE 153 Cb -0.01 0.67 -0.02 0.00 -1.21 0.00 0.00 43.02 42.45 1tye s PHE 153 CO 0.01 -1.05 0.23 0.20 -1.34 0.00 0.00 175.22 173.28 1tye s GLY 154 N -2.90 0.60 0.13 1.99 0.00 0.73 -1.69 107.32 106.19 1tye s GLY 154 Ca 0.10 -1.03 0.05 0.00 0.00 0.00 0.00 44.72 43.85 1tye s GLY 154 CO 0.03 -0.96 -0.12 0.00 0.00 0.00 0.00 173.10 172.06 1tye s ALA 155 N -3.99 1.41 0.04 3.20 0.00 0.83 -0.32 121.76 122.92 1tye s ALA 155 Ca 0.19 -1.34 -0.11 0.00 0.00 0.00 0.00 51.96 50.70 1tye s ALA 155 Cb 0.04 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.16 1tye s ALA 155 CO 0.01 0.01 0.24 -0.59 0.00 0.00 0.00 175.76 175.43 1tye s PHE 156 N -2.60 -0.02 0.00 0.00 -0.12 -0.40 0.27 117.98 115.11 1tye s PHE 156 Ca 0.11 -0.14 0.00 0.00 -0.05 0.00 0.00 56.93 56.85 1tye s PHE 156 Cb -0.02 0.03 0.00 0.00 -0.63 0.00 0.00 43.02 42.40 1tye s PHE 156 CO 0.02 -0.46 0.00 0.28 -0.05 0.00 0.00 175.22 175.01 1tye n VAL 157 N 0.69 0.00 -3.83 -2.49 0.31 -0.92 -1.74 118.33 110.35 1tye n VAL 157 Ca -0.19 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.11 1tye n VAL 157 Cb 0.59 -0.29 0.01 0.00 -0.91 0.00 0.00 33.84 33.23 1tye n VAL 157 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1tye s ASP 158 N 1.00 -0.05 0.05 4.52 -1.08 -1.14 -1.61 116.67 118.36 1tye s ASP 158 Ca 0.00 -0.56 -0.30 0.00 -0.52 0.00 0.00 52.55 51.17 1tye s ASP 158 Cb 0.00 0.47 -0.09 0.00 -1.46 0.00 0.00 42.92 41.85 1tye s ASP 158 CO 0.00 -0.92 1.82 -0.54 0.52 0.00 0.00 175.17 176.05 1tye s LYS 159 N -2.51 4.16 -0.73 4.34 1.02 -1.26 -3.53 119.74 121.22 1tye s LYS 159 Ca 0.19 2.49 -0.11 0.00 0.02 0.00 0.00 55.97 58.55 1tye s LYS 159 Cb -0.02 -3.87 -0.09 0.00 -0.52 0.00 0.00 37.83 33.34 1tye s LYS 159 CO 0.04 -0.86 1.91 -2.30 -0.92 0.00 0.00 175.35 173.21 1tye n PRO 160 N 6.58 1.60 -3.79 -1.68 -0.02 -1.26 -4.35 135.00 132.08 1tye n PRO 160 Ca 0.18 -1.45 -0.10 0.00 -2.02 0.00 0.00 63.50 60.11 1tye n PRO 160 Cb 0.40 -2.54 -0.07 0.00 -0.02 0.00 0.00 33.50 31.27 1tye n PRO 160 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1tye s VAL 161 N 4.21 0.11 0.37 -1.45 -7.23 -1.26 -4.93 120.40 110.21 1tye s VAL 161 Ca 0.42 -0.90 -0.25 0.00 -1.81 0.00 0.00 61.98 59.43 1tye s VAL 161 Cb 0.11 -1.14 -0.09 0.00 0.56 0.00 0.00 36.38 35.82 1tye s VAL 161 CO 0.03 -0.50 1.05 -0.55 -0.31 0.00 0.00 175.10 174.82 1tye s SER 162 N -2.52 6.92 0.00 4.85 0.15 -1.26 0.88 113.70 122.72 1tye s SER 162 Ca 0.00 2.07 0.28 0.00 0.70 0.00 0.00 55.95 59.01 1tye s SER 162 Cb 0.02 -2.59 1.13 0.00 -1.71 0.00 0.00 66.02 62.87 1tye s SER 162 CO -0.08 -0.38 1.82 -0.81 1.20 0.00 0.00 173.24 174.99 1tye n PRO 163 N 0.27 0.36 -0.18 5.44 -0.04 -1.26 -4.60 135.00 134.98 1tye n PRO 163 Ca 0.03 -0.11 -0.07 0.00 -0.04 0.00 0.00 63.50 63.32 1tye n PRO 163 Cb 0.49 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.47 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 0.26 0.66 -3.07 0.54 0.05 -1.39 -3.42 116.97 110.60 1tye h TYR 164 Ca 0.00 0.02 -0.62 0.00 0.05 0.00 0.00 58.73 58.18 1tye h TYR 164 Cb 0.41 -0.22 -0.09 0.00 1.01 0.00 0.00 36.73 37.84 1tye h TYR 164 CO 0.00 0.41 -0.39 1.41 -1.05 0.00 0.00 178.16 178.54 1tye s MET 165 N -6.15 3.97 0.06 4.88 1.75 0.25 -0.02 119.30 124.05 1tye s MET 165 Ca -0.13 0.01 -0.31 0.00 -1.25 0.00 0.00 55.69 54.01 1tye s MET 165 Cb 0.12 -3.33 -0.08 0.00 2.84 0.00 0.00 34.83 34.39 1tye s MET 165 CO 0.74 0.46 1.55 0.71 -0.65 0.00 0.00 175.02 177.84 1tye s TYR 166 N -0.18 2.69 -0.24 4.11 2.02 -1.26 -4.17 117.35 120.32 1tye s TYR 166 Ca 0.15 0.55 0.12 0.00 -0.37 0.00 0.00 57.07 57.53 1tye s TYR 166 Cb -0.13 -3.85 0.28 0.00 -0.40 0.00 0.00 41.96 37.86 1tye s TYR 166 CO 0.04 -3.28 1.19 0.44 -1.57 0.00 0.00 175.55 172.38 1tye n ILE 167 N 4.55 1.61 -3.59 2.71 -5.35 -1.26 -4.58 119.36 113.45 1tye n ILE 167 Ca 0.14 -1.64 -0.13 0.00 -0.27 0.00 0.00 62.75 60.85 1tye n ILE 167 Cb 0.41 0.07 -0.06 0.00 -1.74 0.00 0.00 39.64 38.32 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 -1.86 -0.55 1.25 7.28 1.04 -1.26 -4.73 113.70 114.88 1tye s SER 168 Ca 0.25 0.82 -0.21 0.00 0.48 0.00 0.00 55.95 57.29 1tye s SER 168 Cb 0.20 0.76 0.31 0.00 0.10 0.00 0.00 66.02 67.38 1tye s SER 168 CO 0.06 -0.34 1.10 -2.65 0.98 0.00 0.00 173.24 172.38 1tye n PRO 169 N 1.57 -3.18 0.30 4.02 -0.02 -1.26 -4.82 135.00 131.61 1tye n PRO 169 Ca -0.14 -1.75 0.18 0.00 -2.02 0.00 0.00 63.50 59.77 1tye n PRO 169 Cb 0.57 -1.65 0.96 0.00 -0.02 0.00 0.00 33.50 33.36 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 -2.00 -1.84 132.00 128.79 1tye h PRO 170 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1tye h PRO 170 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1tye h PRO 170 CO 0.27 0.03 0.00 0.93 -0.21 0.00 0.00 178.00 179.02 1tye h GLU 171 N 0.00 0.00 -0.00 1.05 3.07 -1.94 -2.94 114.58 113.82 1tye h GLU 171 Ca -0.00 0.00 -0.17 0.00 -0.50 0.00 0.00 59.36 58.69 1tye h GLU 171 Cb 0.18 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.07 1tye h GLU 171 CO 0.00 0.00 -0.80 0.00 -1.40 0.00 0.00 179.01 176.82 1tye h ALA 172 N 2.09 0.68 0.00 3.43 0.00 -1.48 -0.93 119.26 123.05 1tye h ALA 172 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 54.19 1tye h ALA 172 Cb 0.24 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1tye h ALA 172 CO 0.00 0.98 0.00 1.28 0.00 0.00 0.00 179.25 181.51 1tye n LEU 173 N -3.61 0.29 -0.02 0.00 7.99 -1.11 -2.05 117.00 118.50 1tye n LEU 173 Ca -0.01 0.59 -0.01 0.00 -0.01 0.00 0.00 56.01 56.57 1tye n LEU 173 Cb 0.76 -0.58 -0.03 0.00 -0.11 0.00 0.00 43.42 43.47 1tye n LEU 173 CO 0.45 -0.51 -0.61 -0.62 -1.51 0.00 0.00 177.39 174.59 1tye n GLU 174 N -1.84 3.17 -3.39 3.23 4.71 -1.19 -4.74 120.64 120.59 1tye n GLU 174 Ca 0.02 -0.00 -0.26 0.00 -0.01 0.00 0.00 57.16 56.90 1tye n GLU 174 Cb 0.13 -1.09 -0.10 0.00 -1.01 0.00 0.00 31.44 29.37 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 -3.36 1.90 0.00 1.62 2.47 -0.36 -3.95 114.94 113.26 1tye s ASN 175 Ca -0.02 -2.53 0.00 0.00 0.42 0.00 0.00 52.86 50.73 1tye s ASN 175 Cb 0.01 -0.24 0.00 0.00 -1.45 0.00 0.00 41.25 39.57 1tye s ASN 175 CO 0.14 -0.23 0.97 -2.65 -3.72 0.00 0.00 177.10 171.61 1tye n PRO 176 N 3.46 0.00 0.00 0.43 -0.02 -0.87 -0.38 135.00 137.62 1tye n PRO 176 Ca 0.21 0.47 0.12 0.00 -2.02 0.00 0.00 63.50 62.27 1tye n PRO 176 Cb 0.44 -1.50 0.13 0.00 -0.02 0.00 0.00 33.50 32.54 1tye n PRO 176 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tye h TYR 178 N 3.72 -0.33 -0.02 0.00 3.20 -0.83 0.18 116.97 122.88 1tye h TYR 178 Ca 0.00 0.06 0.01 0.00 3.14 0.00 0.00 58.73 61.94 1tye h TYR 178 Cb 0.86 0.26 -0.00 0.00 1.54 0.00 0.00 36.73 39.39 1tye h TYR 178 CO 0.00 -0.30 0.10 0.22 -1.64 0.00 0.00 178.16 176.54 1tye h ASP 179 N 0.01 0.00 -0.01 -2.11 3.58 -1.81 -1.84 116.42 114.24 1tye h ASP 179 Ca 0.35 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.80 1tye h ASP 179 Cb 0.55 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.60 1tye h ASP 179 CO -0.73 0.00 -0.07 0.23 -2.88 0.00 0.00 179.24 175.79 1tye n MET 180 N -3.17 1.94 -3.24 0.28 2.81 0.62 -4.95 117.12 111.41 1tye n MET 180 Ca -0.02 -1.49 -0.16 0.00 -1.81 0.00 0.00 57.70 54.22 1tye n MET 180 Cb 0.17 -1.47 0.06 0.00 -0.71 0.00 0.00 33.22 31.27 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 0.77 -5.45 -1.51 0.03 5.02 -0.69 -5.01 118.16 111.33 1tye n LYS 181 Ca 0.15 0.57 0.00 0.00 -2.02 0.00 0.00 58.31 57.01 1tye n LYS 181 Cb 0.51 -4.84 0.00 0.00 -0.02 0.00 0.00 35.03 30.68 1tye n LYS 181 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1tye n THR 182 N -4.15 0.00 -3.82 -0.18 -2.24 -1.21 -5.08 114.28 97.60 1tye n THR 182 Ca -0.01 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.65 1tye n THR 182 Cb 0.55 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.68 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 -2.06 0.06 0.29 4.28 -1.32 -1.26 -3.94 115.64 111.69 1tye s THR 183 Ca 0.00 -0.51 -0.16 0.00 -1.21 0.00 0.00 61.69 59.81 1tye s THR 183 Cb 0.00 -0.47 0.02 0.00 -1.51 0.00 0.00 72.50 70.54 1tye s THR 183 CO 0.00 -0.28 0.64 0.00 -2.21 0.00 0.00 174.62 172.77 1tye s LEU 185 N -3.00 3.82 1.05 0.00 1.43 -1.10 -4.46 118.68 116.41 1tye s LEU 185 Ca 0.16 1.70 -0.13 0.00 -1.03 0.00 0.00 54.13 54.84 1tye s LEU 185 Cb -0.04 -4.53 0.17 0.00 0.03 0.00 0.00 46.19 41.81 1tye s LEU 185 CO 0.09 -0.53 0.77 -0.81 0.23 0.00 0.00 176.35 176.09 1tye n PRO 186 N -1.02 -1.29 -3.12 1.29 -0.04 -1.25 -4.27 135.00 125.29 1tye n PRO 186 Ca 0.07 -0.34 -0.35 0.00 -0.04 0.00 0.00 63.50 62.85 1tye n PRO 186 Cb 0.54 -2.09 -0.06 0.00 -0.04 0.00 0.00 33.50 31.84 1tye n PRO 186 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 1tye s MET 187 N -4.16 4.17 0.11 0.54 1.75 -1.26 -4.84 119.30 115.61 1tye s MET 187 Ca 0.64 0.80 -0.05 0.00 -1.25 0.00 0.00 55.69 55.83 1tye s MET 187 Cb -0.22 -2.75 -0.02 0.00 2.84 0.00 0.00 34.83 34.68 1tye s MET 187 CO 0.64 0.33 0.14 -0.59 -0.65 0.00 0.00 175.02 174.88 1tye s PHE 188 N -1.65 0.48 0.00 4.11 -0.12 -1.26 -4.92 117.98 114.61 1tye s PHE 188 Ca 0.46 -0.90 0.00 0.00 -0.05 0.00 0.00 56.93 56.44 1tye s PHE 188 Cb -0.15 -0.23 0.00 0.00 -0.63 0.00 0.00 43.02 42.01 1tye s PHE 188 CO 0.20 -0.56 0.01 0.41 -0.05 0.00 0.00 175.22 175.23 1tye n GLY 189 N -0.08 1.37 2.87 1.99 0.00 -1.23 -2.88 105.19 107.24 1tye n GLY 189 Ca -0.10 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.16 0.73 -0.12 1.61 5.04 -1.26 -2.16 117.35 121.03 1tye s TYR 190 Ca 0.00 -0.20 0.01 0.00 -2.44 0.00 0.00 57.07 54.45 1tye s TYR 190 Cb 0.00 -0.67 0.02 0.00 0.35 0.00 0.00 41.96 41.65 1tye s TYR 190 CO 0.00 -0.21 -0.16 0.21 -1.34 0.00 0.00 175.55 174.06 1tye s LYS 191 N 1.05 2.30 -0.34 4.97 2.20 0.14 -1.55 119.74 128.52 1tye s LYS 191 Ca -0.09 -0.58 -0.22 0.00 -0.36 0.00 0.00 55.97 54.72 1tye s LYS 191 Cb -0.14 -1.98 0.00 0.00 -1.51 0.00 0.00 37.83 34.20 1tye s LYS 191 CO -0.01 -0.10 0.72 -1.58 -0.36 0.00 0.00 175.35 174.02 1tye s HIS 192 N 1.08 3.16 -0.28 4.03 5.65 -0.22 -0.12 115.29 128.59 1tye s HIS 192 Ca -0.04 0.57 -0.13 0.00 0.25 0.00 0.00 55.06 55.71 1tye s HIS 192 Cb -0.14 -3.21 -0.12 0.00 -1.18 0.00 0.00 32.58 27.92 1tye s HIS 192 CO -0.04 -0.62 -0.35 1.55 -0.65 0.00 0.00 174.74 174.64 1tye n VAL 193 N 5.60 1.53 -4.01 0.89 3.14 -1.01 -4.84 118.33 119.63 1tye n VAL 193 Ca 0.01 -0.40 -0.28 0.00 -2.96 0.00 0.00 64.34 60.72 1tye n VAL 193 Cb 0.48 -1.85 -0.17 0.00 -1.06 0.00 0.00 33.84 31.24 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 -7.45 1.40 0.88 6.55 2.96 -0.68 -4.99 118.68 117.34 1tye s LEU 194 Ca -0.39 -0.37 -0.11 0.00 -0.22 0.00 0.00 54.13 53.04 1tye s LEU 194 Cb 0.15 -0.96 0.12 0.00 0.50 0.00 0.00 46.19 45.99 1tye s LEU 194 CO 0.50 -0.08 1.09 -0.89 -1.32 0.00 0.00 176.35 175.65 1tye s THR 195 N 1.54 2.74 -0.28 3.68 2.01 -1.26 -1.22 115.64 122.85 1tye s THR 195 Ca 0.03 0.24 -0.28 0.00 0.31 0.00 0.00 61.69 61.99 1tye s THR 195 Cb -0.13 -2.64 -0.04 0.00 0.01 0.00 0.00 72.50 69.70 1tye s THR 195 CO -0.08 -0.31 2.03 -0.76 -0.69 0.00 0.00 174.62 174.80 1tye s LEU 196 N -6.24 3.46 0.28 4.42 1.43 -0.82 -4.27 118.68 116.93 1tye s LEU 196 Ca 0.63 1.59 0.03 0.00 -1.03 0.00 0.00 54.13 55.35 1tye s LEU 196 Cb -0.19 -3.48 -0.06 0.00 0.03 0.00 0.00 46.19 42.49 1tye s LEU 196 CO 0.57 -1.87 0.06 0.28 0.23 0.00 0.00 176.35 175.62 1tye s THR 197 N 7.75 0.91 -1.09 5.49 -1.32 0.12 -4.72 115.64 122.78 1tye s THR 197 Ca 0.91 -2.01 0.21 0.00 -1.21 0.00 0.00 61.69 59.59 1tye s THR 197 Cb -0.28 -2.62 -0.21 0.00 -1.51 0.00 0.00 72.50 67.89 1tye s THR 197 CO 0.34 -0.08 0.93 -0.90 -2.21 0.00 0.00 174.62 172.69 1tye n ASP 198 N -0.53 1.08 -3.32 8.08 5.68 -1.26 0.45 116.55 126.73 1tye n ASP 198 Ca -0.02 -1.03 -0.29 0.00 -0.50 0.00 0.00 54.79 52.95 1tye n ASP 198 Cb 0.66 0.94 -0.03 0.00 -1.14 0.00 0.00 41.12 41.55 1tye n ASP 198 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1tye n GLN 199 N -1.37 1.98 -0.34 0.11 6.02 -1.26 -4.71 117.38 117.80 1tye n GLN 199 Ca 0.04 -1.62 0.37 0.00 -0.01 0.00 0.00 57.00 55.78 1tye n GLN 199 Cb 0.34 -2.62 0.71 0.00 1.02 0.00 0.00 30.24 29.70 1tye n GLN 199 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1tye h VAL 200 N 3.74 0.22 -0.41 5.09 2.07 -1.95 0.29 116.25 125.30 1tye h VAL 200 Ca 0.48 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.95 1tye h VAL 200 Cb 0.32 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 1tye h VAL 200 CO 1.61 0.00 0.05 0.71 0.02 0.00 0.00 177.57 179.96 1tye h THR 201 N 0.00 1.25 -0.29 2.57 1.35 -2.00 -1.78 112.91 114.01 1tye h THR 201 Ca 0.60 -0.92 -0.04 0.00 -0.55 0.00 0.00 66.41 65.49 1tye h THR 201 Cb 2.62 1.05 -0.01 0.00 -1.73 0.00 0.00 68.15 70.08 1tye h THR 201 CO -0.01 0.32 0.01 -0.09 -0.25 0.00 0.00 175.52 175.50 1tye h ARG 202 N 0.54 0.51 -0.69 4.72 2.43 -0.83 -2.62 114.38 118.45 1tye h ARG 202 Ca 0.12 -0.16 0.05 0.00 -0.81 0.00 0.00 59.98 59.19 1tye h ARG 202 Cb 0.41 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.86 1tye h ARG 202 CO 0.01 0.65 0.40 0.35 -1.51 0.00 0.00 179.97 179.87 1tye h PHE 203 N 0.31 0.74 0.00 2.20 3.04 -1.40 -0.81 116.94 121.02 1tye h PHE 203 Ca 0.08 0.02 -0.05 0.00 3.98 0.00 0.00 57.97 62.01 1tye h PHE 203 Cb 0.41 -0.23 -0.01 0.00 2.56 0.00 0.00 35.95 38.68 1tye h PHE 203 CO 0.03 0.38 -0.24 -0.91 -2.02 0.00 0.00 178.31 175.55 1tye h ASN 204 N 0.75 0.00 0.07 0.41 -0.26 -1.21 -2.17 115.58 113.18 1tye h ASN 204 Ca 0.30 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 56.04 1tye h ASN 204 Cb 0.14 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.40 1tye h ASN 204 CO -0.16 0.24 -0.03 -0.33 -1.06 0.00 0.00 177.43 176.08 1tye h GLU 205 N 0.00 -0.09 -0.77 0.81 5.08 -0.95 -3.19 114.58 115.47 1tye h GLU 205 Ca -0.00 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.45 1tye h GLU 205 Cb 0.60 0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.80 1tye h GLU 205 CO 0.03 0.48 0.43 0.93 -1.00 0.00 0.00 179.01 179.88 1tye h GLU 206 N -0.84 0.71 0.00 2.33 3.07 -1.12 -0.62 114.58 118.11 1tye h GLU 206 Ca -0.01 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 58.80 1tye h GLU 206 Cb 0.62 -0.16 -0.00 0.00 -0.84 0.00 0.00 28.75 28.37 1tye h GLU 206 CO 0.02 0.47 -0.05 0.28 -1.40 0.00 0.00 179.01 178.33 1tye h VAL 207 N 0.73 0.52 0.00 3.13 2.07 -1.49 -1.91 116.25 119.31 1tye h VAL 207 Ca 0.37 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.69 1tye h VAL 207 Cb 0.34 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1tye h VAL 207 CO -0.24 0.04 -0.88 0.29 0.02 0.00 0.00 177.57 176.81 1tye n LYS 208 N -3.74 0.29 -0.87 1.57 5.02 -0.30 -3.83 118.16 116.29 1tye n LYS 208 Ca -0.03 0.03 -0.15 0.00 -2.02 0.00 0.00 58.31 56.15 1tye n LYS 208 Cb 0.14 -1.63 0.15 0.00 -0.02 0.00 0.00 35.03 33.68 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 -2.02 2.16 -4.17 1.97 5.02 -0.72 -4.91 118.16 115.49 1tye n LYS 209 Ca 0.02 -2.22 -0.29 0.00 -2.02 0.00 0.00 58.31 53.80 1tye n LYS 209 Cb 0.44 -1.89 -0.09 0.00 -0.02 0.00 0.00 35.03 33.47 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 -2.40 2.38 0.08 1.97 -1.52 -1.23 -5.03 119.66 113.90 1tye s GLN 210 Ca 0.42 -0.96 -0.16 0.00 -1.95 0.00 0.00 55.36 52.71 1tye s GLN 210 Cb 0.35 -2.42 0.03 0.00 -0.22 0.00 0.00 33.01 30.74 1tye s GLN 210 CO 0.09 0.51 0.37 -1.54 -0.25 0.00 0.00 175.29 174.47 1tye s SER 211 N -2.41 -0.20 1.05 5.90 1.04 -1.26 -5.11 113.70 112.71 1tye s SER 211 Ca 0.25 -0.21 -0.12 0.00 0.48 0.00 0.00 55.95 56.34 1tye s SER 211 Cb -0.11 0.43 0.22 0.00 0.10 0.00 0.00 66.02 66.66 1tye s SER 211 CO 0.17 -0.74 1.07 0.68 0.98 0.00 0.00 173.24 175.40 1tye s VAL 212 N -3.13 2.12 0.00 5.02 -7.23 -1.26 -4.83 120.40 111.10 1tye s VAL 212 Ca -0.01 0.04 0.00 0.00 -1.81 0.00 0.00 61.98 60.20 1tye s VAL 212 Cb 0.01 -2.33 0.00 0.00 0.56 0.00 0.00 36.38 34.62 1tye s VAL 212 CO -0.07 -0.05 0.00 -0.24 -0.31 0.00 0.00 175.10 174.43 1tye n SER 213 N -4.46 0.53 -4.12 4.85 2.88 0.26 -2.72 113.62 110.84 1tye n SER 213 Ca 0.05 -0.75 -0.16 0.00 -1.33 0.00 0.00 58.87 56.67 1tye n SER 213 Cb 0.55 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.90 1tye n SER 213 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1tye s ARG 214 N -1.26 0.70 0.14 -1.46 1.81 -1.26 -0.10 118.95 117.52 1tye s ARG 214 Ca 0.00 -0.86 -0.10 0.00 -1.72 0.00 0.00 55.73 53.05 1tye s ARG 214 Cb 0.00 -0.62 -0.00 0.00 -0.45 0.00 0.00 34.95 33.88 1tye s ARG 214 CO 0.00 0.13 0.27 1.21 -0.68 0.00 0.00 175.30 176.23 1tye s ASN 215 N -1.63 0.03 -0.14 0.23 3.04 -1.26 -4.72 114.94 110.48 1tye s ASN 215 Ca -0.05 -0.74 0.02 0.00 0.04 0.00 0.00 52.86 52.13 1tye s ASN 215 Cb -0.10 0.41 -0.23 0.00 -1.54 0.00 0.00 41.25 39.79 1tye s ASN 215 CO 0.01 -0.84 0.27 -1.14 -3.04 0.00 0.00 177.10 172.36 1tye n ARG 216 N -0.17 0.70 -4.25 0.43 0.63 0.97 -4.98 116.66 110.00 1tye n ARG 216 Ca -0.11 0.22 -0.35 0.00 -0.92 0.00 0.00 57.85 56.69 1tye n ARG 216 Cb 0.63 -1.67 -0.08 0.00 0.45 0.00 0.00 32.46 31.79 1tye n ARG 216 CO 0.00 0.00 0.00 0.16 -2.51 0.00 0.00 177.63 175.28 1tye s ASP 217 N -6.55 5.45 0.13 6.15 -4.77 -1.26 -5.04 116.67 110.78 1tye s ASP 217 Ca -0.20 0.17 -0.26 0.00 -3.30 0.00 0.00 52.55 48.96 1tye s ASP 217 Cb 0.07 -1.56 -0.06 0.00 -1.09 0.00 0.00 42.92 40.28 1tye s ASP 217 CO 0.75 0.35 1.45 0.00 0.70 0.00 0.00 175.17 178.42 1tye h ALA 218 N 4.84 -0.46 -2.88 2.11 0.00 -1.98 -3.40 119.26 117.49 1tye h ALA 218 Ca -0.51 0.10 -0.55 0.00 0.00 0.00 0.00 54.91 53.95 1tye h ALA 218 Cb 1.19 1.31 0.12 0.00 0.00 0.00 0.00 17.79 20.42 1tye h ALA 218 CO 0.57 -0.80 0.62 -2.30 0.00 0.00 0.00 179.25 177.34 1tye n PRO 219 N -4.85 2.12 -4.47 0.00 -0.02 -1.26 -4.64 135.00 121.87 1tye n PRO 219 Ca 0.02 0.76 -0.31 0.00 -2.02 0.00 0.00 63.50 61.94 1tye n PRO 219 Cb 0.21 -2.54 -0.05 0.00 -0.02 0.00 0.00 33.50 31.11 1tye n PRO 219 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1tye s GLU 220 N -2.38 2.23 -0.69 -0.52 0.41 -1.19 -4.81 118.70 111.76 1tye s GLU 220 Ca 0.61 -2.31 0.00 0.00 -0.41 0.00 0.00 54.97 52.86 1tye s GLU 220 Cb -0.47 -1.72 0.39 0.00 -1.78 0.00 0.00 34.13 30.56 1tye s GLU 220 CO 0.57 -0.50 1.78 0.41 -0.49 0.00 0.00 175.26 177.03 1tye n GLY 221 N -1.49 5.76 0.30 -1.39 0.00 -0.64 -1.68 105.19 106.06 1tye n GLY 221 Ca -0.15 -2.52 -0.06 0.00 0.00 0.00 0.00 46.02 43.29 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 2.65 1.02 1.64 -0.02 0.00 -1.91 -2.35 103.07 104.11 1tye h GLY 222 Ca 0.51 -0.68 0.05 0.00 0.00 0.00 0.00 47.33 47.20 1tye h GLY 222 CO 1.30 0.63 0.13 0.74 0.00 0.00 0.00 176.54 179.34 1tye h PHE 223 N 0.89 0.00 -0.24 5.60 -1.00 -1.85 0.23 116.94 120.57 1tye h PHE 223 Ca 0.17 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.86 1tye h PHE 223 Cb 0.45 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.00 1tye h PHE 223 CO 0.03 0.00 -0.26 -0.44 -1.61 0.00 0.00 178.31 176.03 1tye h ASP 224 N 0.00 0.46 0.38 2.17 5.19 -1.78 -2.51 116.42 120.33 1tye h ASP 224 Ca 0.08 -0.16 -0.28 0.00 -0.62 0.00 0.00 57.03 56.05 1tye h ASP 224 Cb 0.34 -0.13 0.02 0.00 0.18 0.00 0.00 39.33 39.74 1tye h ASP 224 CO -0.00 0.72 -1.21 0.00 -3.12 0.00 0.00 179.24 175.62 1tye h ALA 225 N 1.32 0.09 -0.82 3.45 0.00 -0.65 -3.02 119.26 119.64 1tye h ALA 225 Ca 0.06 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 54.16 1tye h ALA 225 Cb 0.67 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 1tye h ALA 225 CO 0.05 0.82 0.53 0.82 0.00 0.00 0.00 179.25 181.46 1tye h ILE 226 N 0.18 1.22 0.42 0.00 2.04 -0.77 0.12 117.51 120.71 1tye h ILE 226 Ca -0.16 -0.42 -0.02 0.00 1.00 0.00 0.00 64.86 65.26 1tye h ILE 226 Cb 1.90 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 38.01 1tye h ILE 226 CO 0.22 0.22 -0.20 -0.03 0.00 0.00 0.00 178.15 178.35 1tye h MET 227 N 1.11 -0.54 -0.62 2.37 4.05 -1.51 -1.71 114.93 118.09 1tye h MET 227 Ca 0.30 0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.74 1tye h MET 227 Cb -0.10 0.12 -0.03 0.00 -0.80 0.00 0.00 31.60 30.79 1tye h MET 227 CO -0.06 -0.31 0.31 1.96 0.23 0.00 0.00 176.91 179.03 1tye h GLN 228 N -0.64 0.86 0.00 0.39 1.08 -1.36 -1.15 115.11 114.28 1tye h GLN 228 Ca -0.06 -0.10 -0.08 0.00 -1.45 0.00 0.00 58.65 56.96 1tye h GLN 228 Cb 0.48 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.73 1tye h GLN 228 CO 0.09 0.66 -0.38 0.00 -0.95 0.00 0.00 178.83 178.25 1tye h ALA 229 N 1.48 0.98 0.18 3.87 0.00 -0.68 -2.22 119.26 122.88 1tye h ALA 229 Ca 0.22 -0.34 -0.30 0.00 0.00 0.00 0.00 54.91 54.48 1tye h ALA 229 Cb 0.07 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 17.82 1tye h ALA 229 CO -0.03 0.47 -1.35 1.15 0.00 0.00 0.00 179.25 179.49 1tye h THR 230 N 0.00 1.38 -0.15 0.00 2.02 -0.55 -3.38 112.91 112.23 1tye h THR 230 Ca -0.00 -2.85 0.00 0.00 0.77 0.00 0.00 66.41 64.33 1tye h THR 230 Cb 0.91 2.96 0.00 0.00 -1.74 0.00 0.00 68.15 70.29 1tye h THR 230 CO 0.05 0.84 0.00 1.33 0.37 0.00 0.00 175.52 178.11 1tye n VAL 231 N -3.64 0.23 -2.90 3.16 0.24 -0.51 -4.65 118.33 110.26 1tye n VAL 231 Ca -0.13 -0.62 -0.40 0.00 -2.04 0.00 0.00 64.34 61.16 1tye n VAL 231 Cb 1.06 1.18 0.00 0.00 -1.47 0.00 0.00 33.84 34.60 1tye n VAL 231 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1tye h ASP 233 N 4.73 -1.13 -0.83 0.00 3.32 -1.88 0.89 116.42 121.52 1tye h ASP 233 Ca 0.32 0.17 0.02 0.00 0.02 0.00 0.00 57.03 57.56 1tye h ASP 233 Cb 0.50 0.49 -0.04 0.00 0.22 0.00 0.00 39.33 40.50 1tye h ASP 233 CO 1.21 -0.14 0.55 -0.33 -1.72 0.00 0.00 179.24 178.81 1tye h GLU 234 N -0.03 1.04 -0.05 3.56 4.39 -1.92 0.34 114.58 121.91 1tye h GLU 234 Ca 0.08 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.69 1tye h GLU 234 Cb 0.23 -0.24 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1tye h GLU 234 CO -0.47 0.69 -0.06 0.87 -1.16 0.00 0.00 179.01 178.88 1tye h LYS 235 N 1.08 0.12 -0.22 2.33 1.79 -1.70 -3.29 116.57 116.68 1tye h LYS 235 Ca 0.32 -0.07 -0.20 0.00 -2.18 0.00 0.00 60.65 58.52 1tye h LYS 235 Cb -0.04 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.62 1tye h LYS 235 CO -0.08 0.60 -0.64 0.82 -1.08 0.00 0.00 179.45 179.06 1tye h ILE 236 N -0.34 1.28 0.00 1.86 1.08 -0.77 -3.45 117.51 117.17 1tye h ILE 236 Ca 0.01 -1.83 0.00 0.00 -0.39 0.00 0.00 64.86 62.64 1tye h ILE 236 Cb 0.58 1.80 0.00 0.00 -3.07 0.00 0.00 36.82 36.13 1tye h ILE 236 CO 0.01 0.59 0.00 0.61 -0.69 0.00 0.00 178.15 178.67 1tye n GLY 237 N 0.53 1.10 3.73 5.37 0.00 0.12 -1.95 105.19 114.08 1tye n GLY 237 Ca -0.06 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.16 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 2.88 -0.16 1.61 0.52 -1.22 -4.79 118.94 115.78 1tye s TRP 238 Ca 0.00 0.62 -0.10 0.00 0.02 0.00 0.00 56.10 56.64 1tye s TRP 238 Cb 0.00 -4.05 -0.05 0.00 -1.15 0.00 0.00 33.47 28.22 1tye s TRP 238 CO 0.00 -3.76 0.18 -0.98 0.02 0.00 0.00 176.95 172.41 1tye s ARG 239 N 0.38 3.94 0.25 4.98 1.70 -1.26 -4.94 118.95 124.00 1tye s ARG 239 Ca 0.68 -0.10 -0.07 0.00 -0.47 0.00 0.00 55.73 55.78 1tye s ARG 239 Cb -0.47 -3.33 0.45 0.00 -0.57 0.00 0.00 34.95 31.03 1tye s ARG 239 CO 0.39 0.47 1.63 -0.91 -1.08 0.00 0.00 175.30 175.80 1tye h ASN 240 N 6.00 -0.38 -0.41 -2.89 4.21 -2.01 -2.71 115.58 117.39 1tye h ASN 240 Ca -0.46 0.20 -0.28 0.00 1.21 0.00 0.00 56.30 56.98 1tye h ASN 240 Cb 1.18 0.36 -0.12 0.00 -1.12 0.00 0.00 38.32 38.63 1tye h ASN 240 CO 0.69 -0.20 0.34 -0.90 -1.29 0.00 0.00 177.43 176.07 1tye n ASP 241 N -5.37 6.27 -4.10 5.81 5.75 -1.26 -4.91 116.55 118.75 1tye n ASP 241 Ca 0.14 -2.96 -0.08 0.00 -0.01 0.00 0.00 54.79 51.89 1tye n ASP 241 Cb 0.49 -1.08 -0.10 0.00 -1.03 0.00 0.00 41.12 39.40 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 -1.48 0.59 -0.12 2.12 0.00 -1.02 -4.49 121.76 117.36 1tye s ALA 242 Ca 0.27 -1.24 -0.23 0.00 0.00 0.00 0.00 51.96 50.76 1tye s ALA 242 Cb 0.21 0.27 -0.03 0.00 0.00 0.00 0.00 23.12 23.57 1tye s ALA 242 CO -0.01 -0.35 0.71 -1.12 0.00 0.00 0.00 175.76 174.99 1tye s SER 243 N -2.94 6.91 -0.25 0.00 0.01 -0.39 -4.91 113.70 112.12 1tye s SER 243 Ca 0.08 1.10 -0.09 0.00 1.31 0.00 0.00 55.95 58.35 1tye s SER 243 Cb 0.08 -2.41 -0.04 0.00 0.21 0.00 0.00 66.02 63.86 1tye s SER 243 CO -0.09 -0.22 0.12 -1.00 0.41 0.00 0.00 173.24 172.46 1tye s HIS 244 N 1.38 3.16 0.00 2.43 0.09 -1.26 -0.34 115.29 120.75 1tye s HIS 244 Ca 0.36 -0.16 0.05 0.00 -0.00 0.00 0.00 55.06 55.31 1tye s HIS 244 Cb -0.17 -2.27 -0.03 0.00 -0.00 0.00 0.00 32.58 30.11 1tye s HIS 244 CO 0.15 -0.22 -0.15 -0.51 -0.00 0.00 0.00 174.74 174.00 1tye s LEU 245 N 1.52 2.72 -0.31 0.89 1.43 0.04 -0.27 118.68 124.71 1tye s LEU 245 Ca 0.06 -0.30 -0.00 0.00 -1.03 0.00 0.00 54.13 52.86 1tye s LEU 245 Cb -0.15 -1.57 0.10 0.00 0.03 0.00 0.00 46.19 44.59 1tye s LEU 245 CO 0.06 0.29 0.08 -0.22 0.23 0.00 0.00 176.35 176.80 1tye s LEU 246 N -1.15 2.57 -0.17 1.79 0.20 0.39 -2.18 118.68 120.13 1tye s LEU 246 Ca 0.14 -1.65 -0.22 0.00 0.69 0.00 0.00 54.13 53.08 1tye s LEU 246 Cb -0.11 -0.98 -0.02 0.00 -0.43 0.00 0.00 46.19 44.65 1tye s LEU 246 CO 0.04 -0.40 0.69 -0.69 -0.29 0.00 0.00 176.35 175.70 1tye s VAL 247 N 1.52 4.99 -0.15 1.68 1.01 -0.17 -1.06 120.40 128.22 1tye s VAL 247 Ca 0.09 1.34 -0.00 0.00 0.00 0.00 0.00 61.98 63.41 1tye s VAL 247 Cb -0.18 -4.01 -0.01 0.00 0.00 0.00 0.00 36.38 32.19 1tye s VAL 247 CO -0.21 0.11 -0.14 0.12 0.00 0.00 0.00 175.10 174.98 1tye s PHE 248 N 1.77 2.80 -0.02 5.22 5.36 -0.23 0.00 117.98 132.88 1tye s PHE 248 Ca 0.33 -0.93 0.07 0.00 -0.96 0.00 0.00 56.93 55.43 1tye s PHE 248 Cb -0.16 -1.89 -0.02 0.00 -0.34 0.00 0.00 43.02 40.60 1tye s PHE 248 CO 0.12 -0.41 -0.23 0.95 -1.46 0.00 0.00 175.22 174.19 1tye s THR 249 N 0.74 2.32 0.10 0.12 -4.23 -0.66 0.70 115.64 114.73 1tye s THR 249 Ca -0.06 -1.02 -0.26 0.00 -1.18 0.00 0.00 61.69 59.17 1tye s THR 249 Cb -0.15 -1.84 0.08 0.00 1.34 0.00 0.00 72.50 71.92 1tye s THR 249 CO 0.01 0.57 0.82 0.28 -0.54 0.00 0.00 174.62 175.76 1tye s THR 250 N -0.65 0.00 0.00 3.99 -1.32 -1.21 -2.82 115.64 113.63 1tye s THR 250 Ca 0.11 -0.27 0.00 0.00 -1.21 0.00 0.00 61.69 60.32 1tye s THR 250 Cb -0.10 -1.35 0.00 0.00 -1.51 0.00 0.00 72.50 69.54 1tye s THR 250 CO -0.00 0.00 0.73 -0.90 -2.21 0.00 0.00 174.62 172.24 1tye n ASP 251 N -0.35 1.26 -2.91 8.08 5.75 -1.26 -3.06 116.55 124.06 1tye n ASP 251 Ca -0.10 -1.53 -0.16 0.00 -0.01 0.00 0.00 54.79 52.99 1tye n ASP 251 Cb 0.62 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.65 1tye n ASP 251 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1tye n ALA 252 N -0.27 0.52 -0.95 2.12 0.00 -1.26 -4.81 120.51 115.86 1tye n ALA 252 Ca 0.00 -1.66 -0.06 0.00 0.00 0.00 0.00 53.44 51.72 1tye n ALA 252 Cb 0.25 1.34 0.08 0.00 0.00 0.00 0.00 19.45 21.12 1tye n ALA 252 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1tye n LYS 253 N -0.54 -2.01 -3.95 0.00 2.85 -1.26 -4.91 118.16 108.34 1tye n LYS 253 Ca 0.06 -0.52 -0.09 0.00 -1.05 0.00 0.00 58.31 56.72 1tye n LYS 253 Cb 0.52 -0.53 -0.09 0.00 -0.65 0.00 0.00 35.03 34.28 1tye n LYS 253 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 1tye s THR 254 N -1.54 0.15 0.45 0.58 -1.32 -1.26 -3.20 115.64 109.50 1tye s THR 254 Ca 0.22 -1.27 -0.18 0.00 -1.21 0.00 0.00 61.69 59.25 1tye s THR 254 Cb -0.03 -1.13 -0.09 0.00 -1.51 0.00 0.00 72.50 69.74 1tye s THR 254 CO 0.17 -0.70 0.92 -1.00 -2.21 0.00 0.00 174.62 171.80 1tye s HIS 255 N -3.19 3.39 0.25 9.09 3.76 -0.68 -4.82 115.29 123.10 1tye s HIS 255 Ca -0.00 1.46 0.02 0.00 -0.15 0.00 0.00 55.06 56.39 1tye s HIS 255 Cb 0.02 -2.76 -0.05 0.00 1.11 0.00 0.00 32.58 30.90 1tye s HIS 255 CO -0.07 -0.19 0.08 0.96 -0.85 0.00 0.00 174.74 174.67 1tye s ILE 256 N -2.35 0.63 0.34 0.60 -4.36 -1.26 -4.72 121.20 110.08 1tye s ILE 256 Ca 0.59 -2.00 -0.27 0.00 -0.26 0.00 0.00 60.65 58.71 1tye s ILE 256 Cb -0.10 -2.59 -0.13 0.00 1.25 0.00 0.00 42.46 40.90 1tye s ILE 256 CO 0.22 -0.05 1.10 0.00 0.24 0.00 0.00 174.94 176.45 1tye n ALA 257 N -0.46 0.38 -0.36 2.27 0.00 -1.12 -2.29 120.51 118.95 1tye n ALA 257 Ca -0.01 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1tye n ALA 257 Cb 0.66 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 18.00 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 0.90 0.00 0.07 0.00 4.77 -1.26 -4.90 117.00 116.57 1tye n LEU 258 Ca 0.08 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.04 1tye n LEU 258 Cb 0.35 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.38 1tye n LEU 258 CO 0.60 0.00 0.07 0.44 -1.33 0.00 0.00 177.39 177.17 1tye h ASP 259 N 0.00 0.00 0.03 -1.43 5.19 -1.83 -3.33 116.42 115.06 1tye h ASP 259 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1tye h ASP 259 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1tye h ASP 259 CO 0.00 0.71 0.00 1.23 -3.12 0.00 0.00 179.24 178.06 1tye h GLY 260 N 3.42 0.00 1.43 2.75 0.00 -1.80 -1.61 103.07 107.27 1tye h GLY 260 Ca -0.08 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.28 1tye h GLY 260 CO 0.08 0.00 0.32 -0.09 0.00 0.00 0.00 176.54 176.85 1tye h ARG 261 N 0.00 0.53 0.00 4.80 2.43 -1.57 0.19 114.38 120.76 1tye h ARG 261 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1tye h ARG 261 Cb 0.02 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.45 1tye h ARG 261 CO 0.00 0.35 0.08 -0.07 -1.51 0.00 0.00 179.97 178.83 1tye h LEU 262 N 0.55 0.00 -3.12 3.80 4.07 -1.57 0.45 115.31 119.49 1tye h LEU 262 Ca 0.19 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.14 1tye h LEU 262 Cb 0.08 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.82 1tye h LEU 262 CO -0.05 0.00 -0.03 0.00 -1.08 0.00 0.00 178.44 177.29 1tye n ALA 263 N -1.81 2.70 -1.32 1.53 0.00 0.44 -4.51 120.51 117.54 1tye n ALA 263 Ca -0.02 -2.56 -0.11 0.00 0.00 0.00 0.00 53.44 50.75 1tye n ALA 263 Cb 0.12 -0.52 -0.05 0.00 0.00 0.00 0.00 19.45 19.00 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 -1.06 1.23 3.48 0.00 0.00 0.16 -4.99 105.19 104.01 1tye n GLY 264 Ca 0.19 -0.46 -0.40 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.38 4.95 0.00 -0.61 1.01 0.08 -4.94 121.20 119.31 1tye s ILE 265 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 60.65 60.32 1tye s ILE 265 Cb 0.00 -3.54 0.00 0.00 0.01 0.00 0.00 42.46 38.93 1tye s ILE 265 CO 0.00 0.02 0.39 1.33 0.00 0.00 0.00 174.94 176.68 1tye n VAL 266 N 5.05 0.00 -2.35 2.92 0.24 -1.26 -2.32 118.33 120.60 1tye n VAL 266 Ca -0.13 -0.44 -0.43 0.00 -2.04 0.00 0.00 64.34 61.30 1tye n VAL 266 Cb 0.49 1.10 -0.02 0.00 -1.47 0.00 0.00 33.84 33.94 1tye n VAL 266 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1tye s GLN 267 N -0.11 3.80 0.54 7.34 0.74 -1.26 -4.90 119.66 125.80 1tye s GLN 267 Ca 0.00 1.23 -0.22 0.00 0.05 0.00 0.00 55.36 56.42 1tye s GLN 267 Cb 0.00 -3.94 -0.06 0.00 1.10 0.00 0.00 33.01 30.11 1tye s GLN 267 CO 0.00 -1.27 1.25 -0.35 -0.55 0.00 0.00 175.29 174.37 1tye n PRO 268 N 7.58 1.54 -1.68 1.67 -0.04 -1.26 -0.33 135.00 142.47 1tye n PRO 268 Ca 0.16 0.57 -0.43 0.00 -0.04 0.00 0.00 63.50 63.76 1tye n PRO 268 Cb 0.47 -2.44 -0.03 0.00 -0.04 0.00 0.00 33.50 31.45 1tye n PRO 268 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1tye n ASN 269 N -0.75 4.04 0.00 3.54 2.85 -1.26 -4.66 115.26 119.02 1tye n ASN 269 Ca 0.11 0.97 0.13 0.00 -0.11 0.00 0.00 54.58 55.68 1tye n ASN 269 Cb 0.44 -1.53 0.64 0.00 1.24 0.00 0.00 39.78 40.57 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 6.08 0.00 0.00 1.20 5.75 -1.26 -4.91 116.55 123.41 1tye n ASP 270 Ca 0.19 0.14 0.00 0.00 -0.01 0.00 0.00 54.79 55.11 1tye n ASP 270 Cb 0.38 -0.37 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 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 1.11 0.47 3.98 6.12 0.00 -1.26 -5.00 105.19 110.61 1tye n GLY 271 Ca 0.10 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.57 2.80 0.14 1.61 -0.21 -1.26 -4.93 119.66 117.24 1tye s GLN 272 Ca 0.00 -0.82 -0.29 0.00 0.02 0.00 0.00 55.36 54.27 1tye s GLN 272 Cb 0.00 -2.60 -0.07 0.00 1.00 0.00 0.00 33.01 31.35 1tye s GLN 272 CO 0.00 -0.42 0.91 0.00 -2.12 0.00 0.00 175.29 173.66 1tye n HIS 274 N 2.35 0.54 -3.66 0.00 8.25 -1.26 -5.02 115.22 116.43 1tye n HIS 274 Ca -0.00 -1.20 -0.39 0.00 -0.26 0.00 0.00 57.72 55.87 1tye n HIS 274 Cb 0.49 -0.19 -0.10 0.00 1.12 0.00 0.00 29.99 31.30 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 -1.74 3.95 0.00 1.59 1.01 -1.26 -1.20 120.40 122.75 1tye s VAL 275 Ca 0.33 -1.55 0.00 0.00 0.00 0.00 0.00 61.98 60.76 1tye s VAL 275 Cb 0.37 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 33.27 1tye s VAL 275 CO -0.11 -0.53 0.00 0.61 0.00 0.00 0.00 175.10 175.07 1tye n GLY 276 N 4.83 1.13 0.38 4.51 0.00 -1.24 -4.85 105.19 109.94 1tye n GLY 276 Ca -0.09 -1.83 0.15 0.00 0.00 0.00 0.00 46.02 44.25 1tye n GLY 276 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1tye h SER 277 N 0.00 0.64 0.33 1.61 4.64 -1.98 0.39 113.55 119.19 1tye h SER 277 Ca 0.00 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1tye h SER 277 Cb 0.00 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1tye h SER 277 CO 0.00 0.26 0.00 -0.90 -0.87 0.00 0.00 176.83 175.32 1tye n ASP 278 N -4.63 0.00 0.00 4.97 5.75 -1.26 -4.87 116.55 116.51 1tye n ASP 278 Ca 0.21 -0.06 0.00 0.00 -0.01 0.00 0.00 54.79 54.93 1tye n ASP 278 Cb 0.60 -0.26 0.00 0.00 -1.03 0.00 0.00 41.12 40.43 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 -1.26 -2.96 -4.83 -1.12 3.02 0.13 -4.95 115.26 103.28 1tye n ASN 279 Ca 0.10 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.34 1tye n ASN 279 Cb 0.15 -1.75 -0.06 0.00 -0.61 0.00 0.00 39.78 37.51 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 -1.84 3.33 -0.38 3.10 3.76 -1.26 -1.05 115.29 120.95 1tye s HIS 280 Ca 0.00 0.16 -0.29 0.00 -0.15 0.00 0.00 55.06 54.79 1tye s HIS 280 Cb 0.00 -1.69 0.01 0.00 1.11 0.00 0.00 32.58 32.01 1tye s HIS 280 CO 0.00 0.55 1.38 -0.47 -0.85 0.00 0.00 174.74 175.36 1tye s TYR 281 N -1.41 2.47 0.16 1.40 5.04 -0.59 -3.73 117.35 120.69 1tye s TYR 281 Ca 0.31 0.72 0.04 0.00 -2.44 0.00 0.00 57.07 55.70 1tye s TYR 281 Cb -0.12 -4.20 -0.03 0.00 0.35 0.00 0.00 41.96 37.95 1tye s TYR 281 CO 0.23 -1.92 1.37 0.66 -1.34 0.00 0.00 175.55 174.54 1tye h SER 282 N 10.31 0.17 -0.24 4.32 4.64 -1.51 -3.27 113.55 127.97 1tye h SER 282 Ca -0.27 -0.15 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1tye h SER 282 Cb 1.10 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1tye h SER 282 CO 1.07 0.98 0.00 0.00 -0.87 0.00 0.00 176.83 178.01 1tye n ALA 283 N -2.43 2.51 0.17 5.18 0.00 -1.26 -4.27 120.51 120.40 1tye n ALA 283 Ca -0.03 -0.45 0.18 0.00 0.00 0.00 0.00 53.44 53.14 1tye n ALA 283 Cb 0.83 -0.99 0.80 0.00 0.00 0.00 0.00 19.45 20.09 1tye n ALA 283 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1tye h SER 284 N 1.43 0.00 -0.26 0.00 0.87 -1.86 0.16 113.55 113.88 1tye h SER 284 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1tye h SER 284 Cb 0.40 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.36 1tye h SER 284 CO 0.02 0.00 0.00 0.35 -0.53 0.00 0.00 176.83 176.67 1tye n THR 285 N -3.77 0.76 -0.60 2.23 -2.24 -1.26 -4.55 114.28 104.84 1tye n THR 285 Ca 0.04 -0.88 0.00 0.00 -2.27 0.00 0.00 64.05 60.94 1tye n THR 285 Cb 0.43 0.68 0.00 0.00 -2.10 0.00 0.00 70.33 69.34 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 0.53 0.09 -3.92 4.28 -2.24 -0.26 -4.94 114.28 107.82 1tye n THR 286 Ca 0.10 -0.24 -0.13 0.00 -2.27 0.00 0.00 64.05 61.51 1tye n THR 286 Cb 0.39 1.42 -0.14 0.00 -2.10 0.00 0.00 70.33 69.89 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 -0.09 0.09 0.97 -0.78 0.00 -0.12 -4.60 119.30 114.77 1tye s MET 287 Ca 0.00 -0.02 -0.12 0.00 0.00 0.00 0.00 55.69 55.55 1tye s MET 287 Cb 0.00 -0.11 0.17 0.00 0.00 0.00 0.00 34.83 34.89 1tye s MET 287 CO 0.00 0.01 1.09 0.34 0.00 0.00 0.00 175.02 176.45 1tye s ASP 288 N 0.07 2.79 0.63 1.11 -1.08 0.55 -4.78 116.67 115.96 1tye s ASP 288 Ca -0.00 1.39 -0.16 0.00 -0.52 0.00 0.00 52.55 53.25 1tye s ASP 288 Cb -0.02 -2.06 -0.02 0.00 -1.46 0.00 0.00 42.92 39.37 1tye s ASP 288 CO -0.00 -3.05 1.10 -0.31 0.52 0.00 0.00 175.17 173.42 1tye s TYR 289 N -2.88 2.72 0.52 -5.34 2.02 -1.26 -4.17 117.35 108.95 1tye s TYR 289 Ca 0.65 1.54 -0.17 0.00 -0.37 0.00 0.00 57.07 58.72 1tye s TYR 289 Cb -0.19 -3.14 -0.08 0.00 -0.40 0.00 0.00 41.96 38.15 1tye s TYR 289 CO 0.58 -1.52 0.99 -1.25 -1.57 0.00 0.00 175.55 172.78 1tye s PRO 290 N -4.00 3.90 0.37 -1.71 0.04 -1.26 -3.72 135.00 128.62 1tye s PRO 290 Ca 0.67 1.01 -0.15 0.00 0.04 0.00 0.00 61.00 62.57 1tye s PRO 290 Cb -0.20 -2.13 -0.08 0.00 0.04 0.00 0.00 34.50 32.13 1tye s PRO 290 CO 0.39 -0.32 0.79 -1.54 0.04 0.00 0.00 177.00 176.36 1tye s SER 291 N -2.94 6.72 0.23 6.66 1.04 -1.26 -2.77 113.70 121.37 1tye s SER 291 Ca 0.60 1.31 -0.09 0.00 0.48 0.00 0.00 55.95 58.25 1tye s SER 291 Cb -0.11 -2.39 0.36 0.00 0.10 0.00 0.00 66.02 63.99 1tye s SER 291 CO 0.30 -0.30 1.66 -0.07 0.98 0.00 0.00 173.24 175.81 1tye h LEU 292 N 1.85 -0.25 -0.25 2.42 3.38 -1.97 -1.29 115.31 119.20 1tye h LEU 292 Ca -0.48 0.16 0.05 0.00 0.09 0.00 0.00 57.88 57.71 1tye h LEU 292 Cb 1.18 0.28 -0.05 0.00 0.09 0.00 0.00 40.66 42.16 1tye h LEU 292 CO 0.64 -0.12 -0.09 1.23 0.09 0.00 0.00 178.44 180.19 1tye h GLY 293 N 0.14 0.15 0.78 0.83 0.00 -1.93 0.46 103.07 103.49 1tye h GLY 293 Ca 0.36 0.11 0.06 0.00 0.00 0.00 0.00 47.33 47.86 1tye h GLY 293 CO -0.56 -0.12 0.65 -2.00 0.00 0.00 0.00 176.54 174.51 1tye h LEU 294 N -0.04 1.05 -0.26 3.11 7.12 -1.65 -0.39 115.31 124.26 1tye h LEU 294 Ca 0.13 0.00 -0.03 0.00 0.13 0.00 0.00 57.88 58.12 1tye h LEU 294 Cb 0.23 -0.22 -0.01 0.00 -0.53 0.00 0.00 40.66 40.13 1tye h LEU 294 CO -0.28 0.68 0.06 0.24 -0.13 0.00 0.00 178.44 179.01 1tye h MET 295 N 1.20 0.41 -0.38 1.25 2.86 -0.57 -2.48 114.93 117.23 1tye h MET 295 Ca 0.42 -0.10 0.07 0.00 -2.06 0.00 0.00 59.70 58.04 1tye h MET 295 Cb 0.12 -0.05 -0.07 0.00 0.06 0.00 0.00 31.60 31.66 1tye h MET 295 CO -0.16 0.51 -0.04 1.15 1.06 0.00 0.00 176.91 179.43 1tye h THR 296 N 0.24 0.68 -0.12 2.22 2.02 -0.13 0.93 112.91 118.75 1tye h THR 296 Ca 0.08 -0.02 0.04 0.00 0.77 0.00 0.00 66.41 67.28 1tye h THR 296 Cb 0.28 0.61 -0.04 0.00 -1.74 0.00 0.00 68.15 67.27 1tye h THR 296 CO 0.00 0.01 -0.12 -0.08 0.37 0.00 0.00 175.52 175.70 1tye h GLU 297 N 0.06 -0.14 -0.20 6.66 4.81 -0.95 -1.85 114.58 122.97 1tye h GLU 297 Ca 0.18 0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.31 1tye h GLU 297 Cb 0.27 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1tye h GLU 297 CO -0.34 -0.09 -0.37 0.87 -0.73 0.00 0.00 179.01 178.34 1tye h LYS 298 N -0.15 0.43 -0.46 1.92 1.79 -1.09 0.00 116.57 119.01 1tye h LYS 298 Ca 0.09 -0.20 -0.05 0.00 -2.18 0.00 0.00 60.65 58.31 1tye h LYS 298 Cb 0.27 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.89 1tye h LYS 298 CO -0.21 0.74 0.10 -0.07 -1.08 0.00 0.00 179.45 178.93 1tye h LEU 299 N 0.36 0.66 0.00 2.94 3.38 -0.48 -1.15 115.31 121.02 1tye h LEU 299 Ca 0.04 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1tye h LEU 299 Cb 0.82 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1tye h LEU 299 CO 0.07 0.66 -0.02 -1.28 0.09 0.00 0.00 178.44 177.95 1tye h SER 300 N 0.68 0.02 -0.36 -0.43 0.87 -1.11 -0.60 113.55 112.61 1tye h SER 300 Ca 0.15 -0.87 0.10 0.00 -1.23 0.00 0.00 61.79 59.95 1tye h SER 300 Cb 0.28 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.22 1tye h SER 300 CO -0.00 0.89 0.26 -0.61 -0.53 0.00 0.00 176.83 176.84 1tye h GLN 301 N -0.85 0.00 -0.16 2.24 4.15 -0.88 -1.14 115.11 118.48 1tye h GLN 301 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1tye h GLN 301 Cb 0.89 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.58 1tye h GLN 301 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 178.83 178.53 1tye n LYS 302 N -4.41 1.72 -3.48 1.69 4.76 -0.45 -5.01 118.16 112.98 1tye n LYS 302 Ca 0.06 -1.72 -0.15 0.00 -2.87 0.00 0.00 58.31 53.63 1tye n LYS 302 Cb 0.44 -1.34 0.00 0.00 -1.84 0.00 0.00 35.03 32.29 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 0.96 -6.10 -4.11 4.39 4.13 -0.43 -5.00 115.26 109.10 1tye n ASN 303 Ca 0.12 -0.60 -0.25 0.00 1.68 0.00 0.00 54.58 55.53 1tye n ASN 303 Cb 0.44 -3.26 -0.16 0.00 -1.54 0.00 0.00 39.78 35.27 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 -3.01 1.31 -0.29 2.41 1.01 -0.28 -4.26 121.20 118.08 1tye s ILE 304 Ca 0.02 -0.64 -0.11 0.00 0.00 0.00 0.00 60.65 59.92 1tye s ILE 304 Cb -0.01 -1.13 -0.04 0.00 0.01 0.00 0.00 42.46 41.29 1tye s ILE 304 CO 0.83 0.38 0.19 0.20 0.00 0.00 0.00 174.94 176.55 1tye s ASN 305 N 0.11 5.94 -0.09 3.58 0.01 0.63 -4.69 114.94 120.43 1tye s ASN 305 Ca -0.05 -0.13 -0.20 0.00 -0.71 0.00 0.00 52.86 51.77 1tye s ASN 305 Cb -0.11 -2.10 -0.04 0.00 0.41 0.00 0.00 41.25 39.40 1tye s ASN 305 CO 0.02 -0.09 0.56 -0.22 -1.51 0.00 0.00 177.10 175.85 1tye s LEU 306 N 1.73 4.31 -0.12 0.60 2.96 -1.26 -0.46 118.68 126.44 1tye s LEU 306 Ca 0.07 0.96 0.01 0.00 -0.22 0.00 0.00 54.13 54.96 1tye s LEU 306 Cb -0.16 -2.83 0.02 0.00 0.50 0.00 0.00 46.19 43.71 1tye s LEU 306 CO 0.10 -0.02 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.33 1tye s ILE 307 N 0.57 1.55 -0.42 6.68 1.01 -0.22 -2.41 121.20 127.96 1tye s ILE 307 Ca 0.30 -0.66 -0.21 0.00 0.00 0.00 0.00 60.65 60.07 1tye s ILE 307 Cb -0.16 -1.42 0.02 0.00 0.01 0.00 0.00 42.46 40.90 1tye s ILE 307 CO 0.13 0.45 0.67 -0.36 0.00 0.00 0.00 174.94 175.83 1tye s PHE 308 N 1.08 3.07 -0.73 3.97 0.08 0.19 -1.07 117.98 124.57 1tye s PHE 308 Ca -0.04 0.08 -0.08 0.00 0.12 0.00 0.00 56.93 57.01 1tye s PHE 308 Cb -0.14 -3.35 0.19 0.00 -0.57 0.00 0.00 43.02 39.14 1tye s PHE 308 CO -0.04 -0.83 0.60 0.00 -0.10 0.00 0.00 175.22 174.86 1tye s ALA 309 N 2.87 3.84 0.25 5.36 0.00 0.22 0.04 121.76 134.34 1tye s ALA 309 Ca 0.24 -3.33 0.12 0.00 0.00 0.00 0.00 51.96 48.99 1tye s ALA 309 Cb -0.14 -3.05 -0.05 0.00 0.00 0.00 0.00 23.12 19.88 1tye s ALA 309 CO 0.19 -2.19 -0.20 0.14 0.00 0.00 0.00 175.76 173.70 1tye s VAL 310 N -0.05 2.52 0.61 0.00 -7.23 -0.87 -3.28 120.40 112.09 1tye s VAL 310 Ca 0.18 -2.27 -0.14 0.00 -1.81 0.00 0.00 61.98 57.94 1tye s VAL 310 Cb -0.15 -2.29 -0.03 0.00 0.56 0.00 0.00 36.38 34.47 1tye s VAL 310 CO -0.06 -0.32 1.05 0.42 -0.31 0.00 0.00 175.10 175.88 1tye s THR 311 N -2.26 3.98 0.17 5.32 -4.23 -1.17 0.16 115.64 117.61 1tye s THR 311 Ca 0.28 0.85 -0.24 0.00 -1.18 0.00 0.00 61.69 61.39 1tye s THR 311 Cb -0.06 -3.44 0.03 0.00 1.34 0.00 0.00 72.50 70.37 1tye s THR 311 CO 0.14 -0.64 1.41 1.21 -0.54 0.00 0.00 174.62 176.20 1tye n GLU 312 N -2.30 -0.34 0.27 3.99 4.07 -1.26 -1.41 120.64 123.66 1tye n GLU 312 Ca 0.08 1.39 0.11 0.00 -0.06 0.00 0.00 57.16 58.68 1tye n GLU 312 Cb 0.53 -2.05 0.59 0.00 -0.06 0.00 0.00 31.44 30.46 1tye n GLU 312 CO 0.00 0.00 0.00 -2.95 -0.06 0.00 0.00 177.13 174.12 1tye h ASN 313 N 0.00 0.00 0.00 4.31 -1.07 -1.93 -2.19 115.58 114.70 1tye h ASN 313 Ca 0.20 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.57 1tye h ASN 313 Cb 0.43 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.68 1tye h ASN 313 CO -0.88 0.00 0.00 0.55 0.07 0.00 0.00 177.43 177.17 1tye n VAL 314 N -2.56 0.54 -0.09 6.14 3.14 -0.50 -4.81 118.33 120.19 1tye n VAL 314 Ca -0.01 -0.65 -0.07 0.00 -2.96 0.00 0.00 64.34 60.65 1tye n VAL 314 Cb 0.40 0.80 0.00 0.00 -1.06 0.00 0.00 33.84 33.98 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 0.62 0.97 -0.39 1.55 2.07 -1.14 -1.50 116.25 118.42 1tye h VAL 315 Ca 0.00 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.44 1tye h VAL 315 Cb 0.49 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 1tye h VAL 315 CO 0.00 0.06 0.26 0.78 0.02 0.00 0.00 177.57 178.69 1tye h ASN 316 N 0.31 0.38 0.23 0.57 2.35 -1.87 0.25 115.58 117.79 1tye h ASN 316 Ca 0.14 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 1tye h ASN 316 Cb 0.07 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.35 1tye h ASN 316 CO -0.11 0.27 -0.11 0.25 -1.65 0.00 0.00 177.43 176.08 1tye h LEU 317 N 0.44 -0.26 -1.41 1.61 5.85 -1.64 -2.04 115.31 117.87 1tye h LEU 317 Ca 0.16 -0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 1tye h LEU 317 Cb 0.08 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 1tye h LEU 317 CO -0.04 0.02 -0.23 1.88 -0.34 0.00 0.00 178.44 179.73 1tye h TYR 318 N -0.54 0.00 -0.36 1.25 0.05 -1.02 -2.07 116.97 114.27 1tye h TYR 318 Ca -0.03 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.69 1tye h TYR 318 Cb 0.40 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.13 1tye h TYR 318 CO 0.00 0.23 0.01 1.96 -1.05 0.00 0.00 178.16 179.31 1tye h GLN 319 N 0.00 0.63 -0.44 4.88 4.20 -0.86 0.69 115.11 124.23 1tye h GLN 319 Ca -0.00 -0.20 -0.04 0.00 0.06 0.00 0.00 58.65 58.47 1tye h GLN 319 Cb 0.60 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.30 1tye h GLN 319 CO 0.03 0.74 0.09 -0.91 -0.67 0.00 0.00 178.83 178.11 1tye h ASN 320 N 0.45 0.61 0.68 1.46 2.35 -0.90 -1.55 115.58 118.68 1tye h ASN 320 Ca 0.10 -0.10 -0.14 0.00 -0.55 0.00 0.00 56.30 55.61 1tye h ASN 320 Cb 0.44 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 1tye h ASN 320 CO 0.02 0.62 -0.68 1.88 -1.65 0.00 0.00 177.43 177.61 1tye h TYR 321 N 0.64 0.00 -0.57 1.19 0.05 -1.06 -3.08 116.97 114.14 1tye h TYR 321 Ca 0.14 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.89 1tye h TYR 321 Cb 0.27 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.98 1tye h TYR 321 CO 0.01 0.68 0.22 1.03 -1.05 0.00 0.00 178.16 179.05 1tye h SER 322 N 0.00 0.75 0.54 3.88 0.87 0.14 -1.78 113.55 117.95 1tye h SER 322 Ca -0.01 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 1tye h SER 322 Cb 1.21 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.97 1tye h SER 322 CO 0.09 0.69 0.00 -0.62 -0.53 0.00 0.00 176.83 176.45 1tye n GLU 323 N -4.32 0.09 0.00 2.24 1.02 -0.95 -2.18 120.64 116.54 1tye n GLU 323 Ca 0.05 0.16 0.08 0.00 -0.02 0.00 0.00 57.16 57.43 1tye n GLU 323 Cb 0.17 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.01 1tye n GLU 323 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1tye n LEU 324 N -1.43 0.99 -3.70 -4.62 4.77 -0.69 -4.63 117.00 107.69 1tye n LEU 324 Ca 0.06 -0.54 -0.29 0.00 -0.03 0.00 0.00 56.01 55.20 1tye n LEU 324 Cb 0.19 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.16 1tye n LEU 324 CO 0.16 0.23 -0.24 -0.63 -1.33 0.00 0.00 177.39 175.58 1tye s ILE 325 N -2.57 1.40 0.30 -0.08 1.01 -0.92 -4.88 121.20 115.45 1tye s ILE 325 Ca 0.08 -2.62 -0.30 0.00 0.00 0.00 0.00 60.65 57.82 1tye s ILE 325 Cb 0.14 -1.98 -0.13 0.00 0.01 0.00 0.00 42.46 40.50 1tye s ILE 325 CO 0.68 -0.92 1.38 -2.65 0.00 0.00 0.00 174.94 173.43 1tye n PRO 326 N 3.45 2.17 -0.51 2.79 -0.02 -1.25 -3.17 135.00 138.46 1tye n PRO 326 Ca 0.10 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 1tye n PRO 326 Cb 0.35 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 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 1.48 0.73 3.62 -1.23 0.00 -1.26 -5.06 105.19 103.46 1tye n GLY 327 Ca 0.08 -0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.00 3.82 0.19 2.61 -4.23 -1.19 -4.54 115.64 110.30 1tye s THR 328 Ca 0.00 -0.67 0.10 0.00 -1.18 0.00 0.00 61.69 59.94 1tye s THR 328 Cb 0.00 -2.66 -0.04 0.00 1.34 0.00 0.00 72.50 71.14 1tye s THR 328 CO 0.00 0.42 -0.15 0.42 -0.54 0.00 0.00 174.62 174.77 1tye s THR 329 N -1.00 2.86 -0.10 3.99 -4.23 -1.01 -4.91 115.64 111.24 1tye s THR 329 Ca 0.17 -1.82 0.01 0.00 -1.18 0.00 0.00 61.69 58.87 1tye s THR 329 Cb -0.11 -2.41 0.02 0.00 1.34 0.00 0.00 72.50 71.34 1tye s THR 329 CO 0.07 -0.12 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.21 1tye s VAL 330 N -1.72 1.34 0.02 2.29 1.01 -1.26 0.53 120.40 122.61 1tye s VAL 330 Ca 0.23 -0.54 0.05 0.00 0.00 0.00 0.00 61.98 61.72 1tye s VAL 330 Cb -0.08 -1.24 -0.02 0.00 0.00 0.00 0.00 36.38 35.03 1tye s VAL 330 CO 0.13 0.41 -0.15 -0.83 0.00 0.00 0.00 175.10 174.66 1tye s GLY 331 N 1.07 0.82 -0.08 4.51 0.00 0.11 -4.97 107.32 108.78 1tye s GLY 331 Ca -0.06 -0.80 -0.30 0.00 0.00 0.00 0.00 44.72 43.57 1tye s GLY 331 CO -0.02 -0.73 1.13 0.54 0.00 0.00 0.00 173.10 174.02 1tye s VAL 332 N -0.65 4.45 0.13 1.40 0.11 -1.26 -2.05 120.40 122.53 1tye s VAL 332 Ca 0.04 1.76 -0.22 0.00 -2.93 0.00 0.00 61.98 60.62 1tye s VAL 332 Cb -0.07 -4.13 -0.07 0.00 -1.53 0.00 0.00 36.38 30.57 1tye s VAL 332 CO 0.01 -0.00 0.69 -0.22 -3.33 0.00 0.00 175.10 172.24 1tye s LEU 333 N 2.18 4.55 0.00 2.54 2.96 0.12 -4.42 118.68 126.62 1tye s LEU 333 Ca 0.53 1.47 -0.12 0.00 -0.22 0.00 0.00 54.13 55.79 1tye s LEU 333 Cb -0.22 -3.15 0.04 0.00 0.50 0.00 0.00 46.19 43.36 1tye s LEU 333 CO 0.20 0.23 0.55 -1.54 -1.32 0.00 0.00 176.35 174.47 1tye n SER 334 N 1.59 -0.42 0.29 3.68 3.41 -1.26 -4.37 113.62 116.54 1tye n SER 334 Ca -0.07 -1.02 0.16 0.00 -0.26 0.00 0.00 58.87 57.68 1tye n SER 334 Cb 0.50 0.64 0.90 0.00 -0.26 0.00 0.00 64.21 65.98 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 0.00 -4.43 4.33 2.86 -1.96 -3.35 114.93 112.38 1tye h MET 335 Ca -0.08 0.00 -0.73 0.00 -2.06 0.00 0.00 59.70 56.83 1tye h MET 335 Cb 0.48 0.00 -0.22 0.00 0.06 0.00 0.00 31.60 31.92 1tye h MET 335 CO 0.12 0.05 0.10 0.34 1.06 0.00 0.00 176.91 178.58 1tye s ASP 336 N -5.88 6.33 -0.00 1.22 -1.08 -1.26 -4.93 116.67 111.06 1tye s ASP 336 Ca -0.04 -1.80 0.04 0.00 -0.52 0.00 0.00 52.55 50.23 1tye s ASP 336 Cb 0.13 -2.27 0.11 0.00 -1.46 0.00 0.00 42.92 39.43 1tye s ASP 336 CO 0.53 -0.96 1.04 -1.54 0.52 0.00 0.00 175.17 174.77 1tye n SER 337 N 5.69 0.79 0.05 -0.34 3.41 -1.26 -4.33 113.62 117.63 1tye n SER 337 Ca -0.03 -2.02 -0.12 0.00 -0.26 0.00 0.00 58.87 56.44 1tye n SER 337 Cb 0.43 -0.14 -0.06 0.00 -0.26 0.00 0.00 64.21 64.19 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 0.71 -1.11 -0.44 4.04 0.02 -1.92 -0.35 113.55 114.50 1tye h SER 338 Ca 0.00 0.14 0.09 0.00 -0.84 0.00 0.00 61.79 61.18 1tye h SER 338 Cb 0.23 0.45 -0.09 0.00 0.14 0.00 0.00 62.40 63.13 1tye h SER 338 CO 0.01 -0.41 -0.20 -1.13 -1.14 0.00 0.00 176.83 173.96 1tye h ASN 339 N -0.50 -0.68 -0.15 3.07 -0.73 -1.85 0.47 115.58 115.21 1tye h ASN 339 Ca 0.06 0.16 -0.09 0.00 1.87 0.00 0.00 56.30 58.30 1tye h ASN 339 Cb 0.60 0.37 0.00 0.00 0.27 0.00 0.00 38.32 39.56 1tye h ASN 339 CO -0.31 -0.23 -0.27 0.58 -0.37 0.00 0.00 177.43 176.83 1tye h VAL 340 N -0.11 1.36 -0.83 2.57 2.07 -1.73 -3.13 116.25 116.45 1tye h VAL 340 Ca 0.21 -1.52 0.10 0.00 0.82 0.00 0.00 66.70 66.31 1tye h VAL 340 Cb 0.43 1.96 -0.07 0.00 -1.52 0.00 0.00 31.29 32.09 1tye h VAL 340 CO -0.51 0.45 0.47 -0.07 0.02 0.00 0.00 177.57 177.94 1tye h LEU 341 N 0.08 0.68 -0.64 2.57 4.07 -0.74 -1.46 115.31 119.86 1tye h LEU 341 Ca 0.01 0.05 0.07 0.00 0.08 0.00 0.00 57.88 58.09 1tye h LEU 341 Cb 0.86 -0.08 -0.06 0.00 1.08 0.00 0.00 40.66 42.46 1tye h LEU 341 CO 0.06 0.38 0.33 1.56 -1.08 0.00 0.00 178.44 179.70 1tye h GLN 342 N 0.79 0.59 -0.19 1.13 1.08 -0.90 -0.79 115.11 116.82 1tye h GLN 342 Ca 0.40 -0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 57.57 1tye h GLN 342 Cb 0.37 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.66 1tye h GLN 342 CO -0.25 0.39 0.11 -0.07 -0.95 0.00 0.00 178.83 178.06 1tye h LEU 343 N 0.60 0.22 -0.76 1.46 3.38 -1.22 0.39 115.31 119.38 1tye h LEU 343 Ca 0.30 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 58.13 1tye h LEU 343 Cb 0.24 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1tye h LEU 343 CO -0.21 0.17 -0.47 0.40 0.09 0.00 0.00 178.44 178.41 1tye h ILE 344 N 0.25 1.33 -0.04 1.22 1.08 -0.90 -2.35 117.51 118.10 1tye h ILE 344 Ca 0.07 -1.68 -0.03 0.00 -0.39 0.00 0.00 64.86 62.83 1tye h ILE 344 Cb -0.01 1.74 0.00 0.00 -3.07 0.00 0.00 36.82 35.48 1tye h ILE 344 CO -0.01 0.51 -0.09 0.58 -0.69 0.00 0.00 178.15 178.45 1tye h VAL 345 N 0.29 1.44 -0.92 1.67 2.07 -0.62 -2.78 116.25 117.39 1tye h VAL 345 Ca 0.02 -1.43 0.16 0.00 0.82 0.00 0.00 66.70 66.27 1tye h VAL 345 Cb 0.94 2.29 -0.08 0.00 -1.52 0.00 0.00 31.29 32.92 1tye h VAL 345 CO 0.08 0.39 0.59 0.44 0.02 0.00 0.00 177.57 179.08 1tye h ASP 346 N -0.40 0.63 -0.17 0.57 3.32 -0.97 0.75 116.42 120.16 1tye h ASP 346 Ca 0.00 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1tye h ASP 346 Cb 0.67 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 1tye h ASP 346 CO 0.02 0.29 0.05 0.00 -1.72 0.00 0.00 179.24 177.88 1tye h ALA 347 N 1.60 0.22 -0.52 3.45 0.00 -1.37 -3.00 119.26 119.66 1tye h ALA 347 Ca 0.47 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.19 1tye h ALA 347 Cb 0.83 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1tye h ALA 347 CO -0.23 -0.15 0.10 -0.92 0.00 0.00 0.00 179.25 178.05 1tye h TYR 348 N 0.09 0.83 0.00 0.00 3.20 -0.85 -2.15 116.97 118.09 1tye h TYR 348 Ca 0.05 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.84 1tye h TYR 348 Cb 0.25 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.27 1tye h TYR 348 CO 0.00 0.72 0.00 0.41 -1.64 0.00 0.00 178.16 177.65 1tye n GLY 349 N -0.82 -0.70 0.01 1.82 0.00 0.10 -2.35 105.19 103.24 1tye n GLY 349 Ca 0.03 -0.08 0.09 0.00 0.00 0.00 0.00 46.02 46.07 1tye n GLY 349 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1tye n LYS 350 N -1.21 0.55 -1.69 1.61 5.02 -0.81 -4.98 118.16 116.65 1tye n LYS 350 Ca 0.08 -0.16 -0.44 0.00 -2.02 0.00 0.00 58.31 55.77 1tye n LYS 350 Cb 0.10 -1.42 -0.03 0.00 -0.02 0.00 0.00 35.03 33.66 1tye n LYS 350 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1tye n ILE 351 N -2.11 0.62 -4.17 -0.18 5.41 -0.99 -5.00 119.36 112.95 1tye n ILE 351 Ca -0.03 -0.16 -0.17 0.00 1.00 0.00 0.00 62.75 63.39 1tye n ILE 351 Cb 0.46 -1.61 -0.12 0.00 -0.71 0.00 0.00 39.64 37.66 1tye n ILE 351 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1tye s ARG 352 N 0.06 0.83 0.28 0.38 3.00 -1.26 -4.84 118.95 117.40 1tye s ARG 352 Ca 0.71 -1.00 0.05 0.00 0.00 0.00 0.00 55.73 55.50 1tye s ARG 352 Cb -0.62 -0.77 -0.06 0.00 0.00 0.00 0.00 34.95 33.50 1tye s ARG 352 CO 0.45 0.16 -0.02 -1.54 0.00 0.00 0.00 175.30 174.35 1tye s SER 353 N -1.89 2.48 0.01 0.23 1.04 -0.09 -4.93 113.70 110.56 1tye s SER 353 Ca -0.00 -1.23 0.03 0.00 0.48 0.00 0.00 55.95 55.22 1tye s SER 353 Cb -0.09 -0.11 -0.01 0.00 0.10 0.00 0.00 66.02 65.91 1tye s SER 353 CO 0.02 -0.43 -0.08 -1.59 0.98 0.00 0.00 173.24 172.14 1tye s LYS 354 N -3.79 0.59 -0.40 4.02 -2.85 -1.26 -1.10 119.74 114.95 1tye s LYS 354 Ca 0.30 -0.46 -0.13 0.00 -1.00 0.00 0.00 55.97 54.69 1tye s LYS 354 Cb 0.05 -0.52 0.03 0.00 -2.06 0.00 0.00 37.83 35.33 1tye s LYS 354 CO 0.12 0.13 0.26 0.08 0.10 0.00 0.00 175.35 176.03 1tye s VAL 355 N -0.59 4.88 -0.27 1.79 1.01 -0.16 -4.87 120.40 122.18 1tye s VAL 355 Ca -0.01 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.16 1tye s VAL 355 Cb -0.05 -3.74 0.08 0.00 0.00 0.00 0.00 36.38 32.66 1tye s VAL 355 CO 0.00 -0.29 0.02 -0.70 0.00 0.00 0.00 175.10 174.12 1tye s GLU 356 N 1.60 1.24 0.42 2.72 2.12 -1.26 -1.16 118.70 124.38 1tye s GLU 356 Ca 0.03 -1.09 -0.24 0.00 0.36 0.00 0.00 54.97 54.03 1tye s GLU 356 Cb -0.19 -2.47 -0.08 0.00 0.26 0.00 0.00 34.13 31.65 1tye s GLU 356 CO 0.08 -0.77 1.19 -0.51 -0.54 0.00 0.00 175.26 174.71 1tye s LEU 357 N 1.43 4.13 -0.02 2.70 1.43 -1.07 0.03 118.68 127.31 1tye s LEU 357 Ca 0.02 2.38 0.02 0.00 -1.03 0.00 0.00 54.13 55.52 1tye s LEU 357 Cb -0.18 -4.09 -0.00 0.00 0.03 0.00 0.00 46.19 41.95 1tye s LEU 357 CO -0.12 -0.79 -0.09 -1.83 0.23 0.00 0.00 176.35 173.75 1tye s GLU 358 N -2.44 0.83 -0.45 1.70 -1.05 -0.95 -4.85 118.70 111.49 1tye s GLU 358 Ca 0.59 -0.29 -0.18 0.00 -0.15 0.00 0.00 54.97 54.94 1tye s GLU 358 Cb -0.31 -0.79 0.04 0.00 -0.44 0.00 0.00 34.13 32.63 1tye s GLU 358 CO 0.39 0.13 0.51 0.08 0.95 0.00 0.00 175.26 177.32 1tye s VAL 359 N 0.06 5.01 -0.13 1.83 1.01 -1.26 -3.09 120.40 123.83 1tye s VAL 359 Ca -0.01 -0.41 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 1tye s VAL 359 Cb -0.07 -4.14 -0.05 0.00 0.00 0.00 0.00 36.38 32.13 1tye s VAL 359 CO 0.00 -0.56 0.25 -0.13 0.00 0.00 0.00 175.10 174.66 1tye s ARG 360 N 2.30 4.02 -0.37 2.72 0.52 -0.94 -4.75 118.95 122.45 1tye s ARG 360 Ca 0.13 0.05 -0.26 0.00 -0.52 0.00 0.00 55.73 55.13 1tye s ARG 360 Cb -0.18 -3.34 0.04 0.00 0.52 0.00 0.00 34.95 31.99 1tye s ARG 360 CO 0.13 0.43 0.51 -0.40 0.02 0.00 0.00 175.30 176.00 1tye n ASP 361 N 2.95 -6.38 -4.18 0.23 5.75 -1.26 -1.85 116.55 111.82 1tye n ASP 361 Ca -0.15 0.18 -0.33 0.00 -0.01 0.00 0.00 54.79 54.49 1tye n ASP 361 Cb 0.53 -2.72 -0.16 0.00 -1.03 0.00 0.00 41.12 37.73 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 -2.22 2.20 0.49 -2.12 2.96 -1.26 -4.15 118.68 114.58 1tye s LEU 362 Ca 0.27 -0.59 -0.20 0.00 -0.22 0.00 0.00 54.13 53.40 1tye s LEU 362 Cb -0.04 -1.48 -0.12 0.00 0.50 0.00 0.00 46.19 45.05 1tye s LEU 362 CO 0.72 0.06 0.32 -2.65 -1.32 0.00 0.00 176.35 173.47 1tye n PRO 363 N 4.24 0.34 0.31 0.98 -0.02 -1.26 -4.79 135.00 134.80 1tye n PRO 363 Ca -0.20 0.13 0.20 0.00 -2.02 0.00 0.00 63.50 61.61 1tye n PRO 363 Cb 0.51 -1.39 0.97 0.00 -0.02 0.00 0.00 33.50 33.58 1tye n PRO 363 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1tye h GLU 364 N 0.35 0.00 -0.28 -0.52 5.08 -2.04 -1.76 114.58 115.40 1tye h GLU 364 Ca -0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 1tye h GLU 364 Cb 1.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.67 1tye h GLU 364 CO 0.47 0.01 0.00 -0.85 -1.00 0.00 0.00 179.01 177.64 1tye n GLU 365 N -3.16 1.67 -4.24 2.33 0.00 -1.26 -4.86 120.64 111.12 1tye n GLU 365 Ca -0.02 -1.04 -0.21 0.00 0.00 0.00 0.00 57.16 55.90 1tye n GLU 365 Cb 0.17 -1.23 -0.12 0.00 0.00 0.00 0.00 31.44 30.26 1tye n GLU 365 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1tye s LEU 366 N -1.03 2.28 0.01 -1.84 1.02 -0.66 -2.08 118.68 116.37 1tye s LEU 366 Ca 0.20 -0.64 -0.01 0.00 0.02 0.00 0.00 54.13 53.70 1tye s LEU 366 Cb 0.10 -0.70 -0.01 0.00 0.02 0.00 0.00 46.19 45.61 1tye s LEU 366 CO 0.14 -0.01 0.00 -0.94 0.02 0.00 0.00 176.35 175.56 1tye s SER 367 N -1.80 0.11 0.15 2.29 1.04 -0.91 -4.82 113.70 109.77 1tye s SER 367 Ca 0.02 -0.25 0.09 0.00 0.48 0.00 0.00 55.95 56.30 1tye s SER 367 Cb -0.10 0.08 -0.04 0.00 0.10 0.00 0.00 66.02 66.06 1tye s SER 367 CO 0.03 -0.17 -0.17 -0.76 0.98 0.00 0.00 173.24 173.15 1tye s LEU 368 N -0.81 2.72 -0.03 2.42 1.43 -1.26 -0.94 118.68 122.21 1tye s LEU 368 Ca -0.09 -0.62 0.06 0.00 -1.03 0.00 0.00 54.13 52.45 1tye s LEU 368 Cb -0.06 -1.50 -0.01 0.00 0.03 0.00 0.00 46.19 44.65 1tye s LEU 368 CO -0.00 0.15 -0.21 -0.44 0.23 0.00 0.00 176.35 176.07 1tye s SER 369 N -2.44 2.53 -0.01 2.29 0.01 0.23 -4.94 113.70 111.38 1tye s SER 369 Ca 0.20 -0.40 0.08 0.00 1.31 0.00 0.00 55.95 57.14 1tye s SER 369 Cb -0.10 -0.48 -0.02 0.00 0.21 0.00 0.00 66.02 65.64 1tye s SER 369 CO 0.11 0.23 -0.25 -0.36 0.41 0.00 0.00 173.24 173.39 1tye s PHE 370 N -0.29 2.20 -0.28 2.43 0.40 -1.26 -1.18 117.98 120.00 1tye s PHE 370 Ca 0.03 -0.41 -0.00 0.00 -0.60 0.00 0.00 56.93 55.94 1tye s PHE 370 Cb -0.10 -1.40 0.09 0.00 0.51 0.00 0.00 43.02 42.11 1tye s PHE 370 CO 0.01 -0.01 0.05 -0.80 0.70 0.00 0.00 175.22 175.17 1tye s ASN 371 N -0.68 3.90 0.16 1.36 0.01 0.14 -0.68 114.94 119.15 1tye s ASN 371 Ca 0.10 -1.48 -0.23 0.00 -0.71 0.00 0.00 52.86 50.54 1tye s ASN 371 Cb -0.09 -0.97 -0.08 0.00 0.41 0.00 0.00 41.25 40.52 1tye s ASN 371 CO -0.00 -0.36 0.72 0.00 -1.51 0.00 0.00 177.10 175.95 1tye s ALA 372 N 1.53 3.47 -0.34 0.60 0.00 -1.00 -0.90 121.76 125.11 1tye s ALA 372 Ca 0.05 0.25 -0.00 0.00 0.00 0.00 0.00 51.96 52.26 1tye s ALA 372 Cb -0.18 -2.86 0.11 0.00 0.00 0.00 0.00 23.12 20.19 1tye s ALA 372 CO -0.17 0.32 0.15 0.99 0.00 0.00 0.00 175.76 177.06 1tye s THR 373 N -1.22 0.77 0.00 0.00 2.01 -0.13 -1.38 115.64 115.69 1tye s THR 373 Ca 0.36 -1.63 0.00 0.00 0.31 0.00 0.00 61.69 60.73 1tye s THR 373 Cb -0.21 -1.58 0.00 0.00 0.01 0.00 0.00 72.50 70.72 1tye s THR 373 CO 0.24 -0.78 0.00 0.00 -0.69 0.00 0.00 174.62 173.39 1tye h LEU 375 N 0.00 0.97 0.00 0.00 4.07 -1.89 -3.08 115.31 115.38 1tye h LEU 375 Ca 0.00 -0.52 0.00 0.00 0.08 0.00 0.00 57.88 57.44 1tye h LEU 375 Cb 0.00 -0.28 0.00 0.00 1.08 0.00 0.00 40.66 41.46 1tye h LEU 375 CO 0.00 1.32 0.00 -0.46 -1.08 0.00 0.00 178.44 178.22 1tye n ASN 376 N -4.01 0.00 -4.11 -0.43 2.04 -1.26 -4.84 115.26 102.65 1tye n ASN 376 Ca -0.04 -0.85 -0.29 0.00 -0.44 0.00 0.00 54.58 52.96 1tye n ASN 376 Cb 0.63 0.00 -0.05 0.00 -2.53 0.00 0.00 39.78 37.83 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 -0.54 -0.41 -4.08 0.53 4.13 -1.16 -4.96 115.26 108.76 1tye n ASN 377 Ca 0.01 -1.09 -0.32 0.00 1.68 0.00 0.00 54.58 54.86 1tye n ASN 377 Cb 0.00 -2.56 -0.16 0.00 -1.54 0.00 0.00 39.78 35.52 1tye n ASN 377 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1tye s GLU 378 N -6.86 2.61 -0.80 3.52 2.12 -1.26 -4.99 118.70 113.04 1tye s GLU 378 Ca 0.13 -0.90 -0.25 0.00 0.36 0.00 0.00 54.97 54.31 1tye s GLU 378 Cb -0.07 -2.55 0.04 0.00 0.26 0.00 0.00 34.13 31.81 1tye s GLU 378 CO 0.93 -0.32 1.28 0.08 -0.54 0.00 0.00 175.26 176.70 1tye s VAL 379 N 1.29 3.85 -0.33 3.70 1.01 -1.26 -4.06 120.40 124.60 1tye s VAL 379 Ca 0.01 0.01 -0.12 0.00 0.00 0.00 0.00 61.98 61.88 1tye s VAL 379 Cb -0.15 -4.93 -0.02 0.00 0.00 0.00 0.00 36.38 31.29 1tye s VAL 379 CO -0.10 -1.83 0.22 -0.63 0.00 0.00 0.00 175.10 172.76 1tye s ILE 380 N 5.32 5.16 0.63 2.22 1.01 -0.48 -4.96 121.20 130.10 1tye s ILE 380 Ca 0.36 -0.24 -0.17 0.00 0.00 0.00 0.00 60.65 60.60 1tye s ILE 380 Cb -0.07 -3.64 -0.02 0.00 0.01 0.00 0.00 42.46 38.74 1tye s ILE 380 CO 0.08 0.01 1.16 -2.84 0.00 0.00 0.00 174.94 173.35 1tye s PRO 381 N 1.70 2.85 0.00 2.79 0.02 -1.26 -2.38 135.00 138.72 1tye s PRO 381 Ca 0.06 1.63 0.00 0.00 0.02 0.00 0.00 61.00 62.71 1tye s PRO 381 Cb -0.17 -1.94 0.00 0.00 0.02 0.00 0.00 34.50 32.41 1tye s PRO 381 CO 0.10 -1.26 0.00 0.41 -0.33 0.00 0.00 177.00 175.92 1tye n GLY 382 N 0.08 1.57 3.73 0.52 0.00 0.15 -4.92 105.19 106.32 1tye n GLY 382 Ca 0.12 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 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 4.40 -0.25 0.99 2.96 -1.25 -4.65 118.68 120.89 1tye s LEU 383 Ca 0.00 2.41 0.13 0.00 -0.22 0.00 0.00 54.13 56.45 1tye s LEU 383 Cb 0.00 -3.60 0.46 0.00 0.50 0.00 0.00 46.19 43.55 1tye s LEU 383 CO 0.00 -0.58 1.17 2.29 -1.32 0.00 0.00 176.35 177.92 1tye n LYS 384 N 2.97 2.54 -3.64 1.98 2.85 -1.26 -2.55 118.16 121.06 1tye n LYS 384 Ca 0.08 -3.70 -0.08 0.00 -1.05 0.00 0.00 58.31 53.56 1tye n LYS 384 Cb 0.42 -1.83 -0.07 0.00 -0.65 0.00 0.00 35.03 32.90 1tye n LYS 384 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 1tye s SER 385 N -3.47 -0.93 0.02 -5.58 1.04 -1.26 -2.61 113.70 100.92 1tye s SER 385 Ca 0.42 1.50 0.08 0.00 0.48 0.00 0.00 55.95 58.43 1tye s SER 385 Cb 0.38 1.38 -0.03 0.00 0.10 0.00 0.00 66.02 67.86 1tye s SER 385 CO -0.01 -0.24 -0.24 0.00 0.98 0.00 0.00 173.24 173.73 1tye s MET 387 N -1.11 1.89 0.00 0.00 -1.94 -1.26 -0.99 119.30 115.89 1tye s MET 387 Ca 0.12 -2.07 0.00 0.00 -1.71 0.00 0.00 55.69 52.03 1tye s MET 387 Cb -0.10 -1.47 0.00 0.00 2.01 0.00 0.00 34.83 35.27 1tye s MET 387 CO 0.02 -0.08 0.00 0.41 -0.01 0.00 0.00 175.02 175.36 1tye n GLY 388 N -0.91 0.56 3.74 -0.03 0.00 -1.19 -4.87 105.19 102.49 1tye n GLY 388 Ca -0.04 -0.84 -0.41 0.00 0.00 0.00 0.00 46.02 44.73 1tye n GLY 388 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tye s LEU 389 N 0.00 4.54 0.00 0.99 2.01 -0.26 -4.86 118.68 121.10 1tye s LEU 389 Ca 0.00 1.88 0.00 0.00 0.01 0.00 0.00 54.13 56.02 1tye s LEU 389 Cb 0.00 -3.60 0.00 0.00 0.01 0.00 0.00 46.19 42.60 1tye s LEU 389 CO 0.00 -0.03 0.00 0.29 1.01 0.00 0.00 176.35 177.62 1tye n LYS 390 N 2.37 1.81 -2.63 1.70 5.02 -1.26 -0.92 118.16 124.25 1tye n LYS 390 Ca 0.01 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.89 1tye n LYS 390 Cb 0.48 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.45 1tye n LYS 390 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1tye s ILE 391 N 0.03 4.38 0.00 -0.18 -1.09 -1.26 -3.44 121.20 119.64 1tye s ILE 391 Ca 0.00 1.88 0.00 0.00 -2.23 0.00 0.00 60.65 60.30 1tye s ILE 391 Cb 0.00 -4.20 0.00 0.00 -1.58 0.00 0.00 42.46 36.68 1tye s ILE 391 CO 0.00 0.24 0.00 0.61 -1.23 0.00 0.00 174.94 174.56 1tye n GLY 392 N 2.50 2.68 3.77 6.18 0.00 0.45 -5.01 105.19 115.77 1tye n GLY 392 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 1tye n GLY 392 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tye s ASP 393 N -1.80 6.76 0.01 1.61 1.11 -1.22 -4.75 116.67 118.38 1tye s ASP 393 Ca 0.00 2.68 0.07 0.00 0.18 0.00 0.00 52.55 55.48 1tye s ASP 393 Cb 0.00 -2.65 -0.03 0.00 1.07 0.00 0.00 42.92 41.32 1tye s ASP 393 CO 0.00 -0.54 -0.21 -0.89 1.18 0.00 0.00 175.17 174.71 1tye s THR 394 N -1.15 2.53 -0.01 -1.27 2.01 -1.26 -1.82 115.64 114.68 1tye s THR 394 Ca 0.49 -1.10 0.01 0.00 0.31 0.00 0.00 61.69 61.41 1tye s THR 394 Cb -0.39 -1.99 0.00 0.00 0.01 0.00 0.00 72.50 70.13 1tye s THR 394 CO 0.52 0.46 -0.05 -0.69 -0.69 0.00 0.00 174.62 174.18 1tye s VAL 395 N -0.78 0.41 0.16 3.82 1.01 0.20 -4.69 120.40 120.55 1tye s VAL 395 Ca 0.12 -0.19 0.10 0.00 0.00 0.00 0.00 61.98 62.01 1tye s VAL 395 Cb -0.10 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.87 1tye s VAL 395 CO 0.02 0.13 -0.19 -0.94 0.00 0.00 0.00 175.10 174.12 1tye s SER 396 N 0.06 3.75 0.04 3.32 1.04 -0.91 0.10 113.70 121.11 1tye s SER 396 Ca -0.00 -0.70 0.04 0.00 0.48 0.00 0.00 55.95 55.77 1tye s SER 396 Cb -0.04 -0.45 -0.02 0.00 0.10 0.00 0.00 66.02 65.61 1tye s SER 396 CO -0.00 0.14 -0.12 -0.36 0.98 0.00 0.00 173.24 173.87 1tye s PHE 397 N -1.49 1.04 -0.17 5.02 0.08 0.11 -0.95 117.98 121.63 1tye s PHE 397 Ca 0.20 -0.36 -0.02 0.00 0.12 0.00 0.00 56.93 56.87 1tye s PHE 397 Cb -0.09 -0.62 -0.01 0.00 -0.57 0.00 0.00 43.02 41.73 1tye s PHE 397 CO 0.11 0.01 -0.08 0.45 -0.10 0.00 0.00 175.22 175.61 1tye s SER 398 N -1.17 4.21 -0.02 1.36 0.15 -0.08 -0.26 113.70 117.89 1tye s SER 398 Ca -0.01 -0.34 0.07 0.00 0.70 0.00 0.00 55.95 56.38 1tye s SER 398 Cb -0.08 -1.68 -0.02 0.00 -1.71 0.00 0.00 66.02 62.53 1tye s SER 398 CO 0.01 0.08 -0.23 -0.63 1.20 0.00 0.00 173.24 173.67 1tye s ILE 399 N 0.86 2.31 -0.12 6.45 1.09 0.37 -0.69 121.20 131.47 1tye s ILE 399 Ca -0.02 -1.07 0.00 0.00 -1.10 0.00 0.00 60.65 58.47 1tye s ILE 399 Cb -0.15 -1.84 0.02 0.00 -1.06 0.00 0.00 42.46 39.43 1tye s ILE 399 CO 0.01 0.55 -0.12 -0.70 -0.10 0.00 0.00 174.94 174.58 1tye s GLU 400 N -0.75 1.93 -0.25 2.79 2.12 -0.33 -0.50 118.70 123.71 1tye s GLU 400 Ca 0.11 -0.43 -0.09 0.00 0.36 0.00 0.00 54.97 54.92 1tye s GLU 400 Cb -0.10 -1.80 -0.04 0.00 0.26 0.00 0.00 34.13 32.45 1tye s GLU 400 CO -0.00 -0.19 0.13 0.00 -0.54 0.00 0.00 175.26 174.66 1tye s ALA 401 N 1.40 3.41 -0.13 6.30 0.00 0.94 -0.60 121.76 133.07 1tye s ALA 401 Ca 0.01 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 50.96 1tye s ALA 401 Cb -0.13 -2.25 -0.01 0.00 0.00 0.00 0.00 23.12 20.73 1tye s ALA 401 CO -0.07 -0.37 -0.16 0.21 0.00 0.00 0.00 175.76 175.37 1tye s LYS 402 N 1.40 3.25 0.12 0.00 2.20 -0.12 -1.69 119.74 124.91 1tye s LYS 402 Ca 0.06 -0.75 0.02 0.00 -0.36 0.00 0.00 55.97 54.94 1tye s LYS 402 Cb -0.15 -2.55 -0.04 0.00 -1.51 0.00 0.00 37.83 33.58 1tye s LYS 402 CO 0.06 0.14 0.23 0.14 -0.36 0.00 0.00 175.35 175.57 1tye s VAL 403 N 0.50 5.18 -0.40 4.02 -7.23 -0.99 -2.13 120.40 119.33 1tye s VAL 403 Ca -0.11 -0.66 -0.05 0.00 -1.81 0.00 0.00 61.98 59.34 1tye s VAL 403 Cb -0.16 -3.61 0.09 0.00 0.56 0.00 0.00 36.38 33.26 1tye s VAL 403 CO 0.05 -0.02 0.21 -0.60 -0.31 0.00 0.00 175.10 174.43 1tye s ARG 404 N -2.96 2.29 2.81 4.82 3.52 -0.88 -3.90 118.95 124.64 1tye s ARG 404 Ca 0.34 -1.64 0.00 0.00 -0.13 0.00 0.00 55.73 54.30 1tye s ARG 404 Cb -0.12 -3.63 0.00 0.00 -1.56 0.00 0.00 34.95 29.65 1tye s ARG 404 CO 0.27 -0.99 0.00 0.41 -0.81 0.00 0.00 175.30 174.18 1tye n GLY 405 N 4.73 -0.34 2.54 8.12 0.00 -1.26 -4.67 105.19 114.30 1tye n GLY 405 Ca -0.07 -1.06 -0.29 0.00 0.00 0.00 0.00 46.02 44.61 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 3.89 0.33 0.07 0.00 -0.02 -1.26 -5.00 135.00 133.01 1tye n PRO 407 Ca 0.11 0.16 -0.17 0.00 -2.02 0.00 0.00 63.50 61.58 1tye n PRO 407 Cb 0.36 -1.97 -0.08 0.00 -0.02 0.00 0.00 33.50 31.79 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 -0.41 0.50 -6.54 -0.52 4.20 -2.01 -3.42 115.11 106.89 1tye h GLN 408 Ca -0.46 -0.58 -0.58 0.00 0.06 0.00 0.00 58.65 57.09 1tye h GLN 408 Cb 1.34 0.18 0.06 0.00 0.30 0.00 0.00 27.48 29.36 1tye h GLN 408 CO 0.44 1.21 0.78 0.39 -0.67 0.00 0.00 178.83 180.98 1tye n GLU 409 N -3.75 2.20 -0.08 1.46 1.02 -1.26 -4.80 120.64 115.43 1tye n GLU 409 Ca -0.09 0.79 -0.09 0.00 -0.02 0.00 0.00 57.16 57.75 1tye n GLU 409 Cb 0.89 -2.55 -0.10 0.00 -0.02 0.00 0.00 31.44 29.66 1tye n GLU 409 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1tye n LYS 410 N 3.16 1.19 -3.85 3.49 3.00 -1.26 -4.85 118.16 119.04 1tye n LYS 410 Ca 0.16 0.04 -0.27 0.00 -0.00 0.00 0.00 58.31 58.24 1tye n LYS 410 Cb 0.30 -1.36 -0.17 0.00 0.00 0.00 0.00 35.03 33.80 1tye n LYS 410 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 1tye s GLU 411 N -2.35 1.17 0.34 1.64 2.56 -1.26 -3.73 118.70 117.06 1tye s GLU 411 Ca -0.14 -0.32 0.03 0.00 0.00 0.00 0.00 54.97 54.54 1tye s GLU 411 Cb 0.05 -1.72 -0.02 0.00 2.00 0.00 0.00 34.13 34.44 1tye s GLU 411 CO 0.51 -0.40 0.36 0.15 -0.56 0.00 0.00 175.26 175.32 1tye s LYS 412 N 1.75 1.82 -0.02 4.30 -0.14 -1.20 -5.06 119.74 121.20 1tye s LYS 412 Ca 0.02 -1.92 -0.28 0.00 -1.36 0.00 0.00 55.97 52.43 1tye s LYS 412 Cb -0.14 0.37 0.09 0.00 -1.68 0.00 0.00 37.83 36.47 1tye s LYS 412 CO -0.07 -0.71 0.81 -1.54 -0.76 0.00 0.00 175.35 173.07 1tye s SER 413 N -3.32 -0.48 0.18 2.83 1.04 -1.26 -2.05 113.70 110.65 1tye s SER 413 Ca 0.37 0.25 -0.02 0.00 0.48 0.00 0.00 55.95 57.03 1tye s SER 413 Cb 0.01 0.45 -0.04 0.00 0.10 0.00 0.00 66.02 66.54 1tye s SER 413 CO 0.25 -0.63 0.13 0.72 0.98 0.00 0.00 173.24 174.69 1tye s PHE 414 N -2.36 1.00 0.15 5.02 -0.71 -0.39 -4.87 117.98 115.82 1tye s PHE 414 Ca -0.01 -1.28 0.10 0.00 -1.04 0.00 0.00 56.93 54.70 1tye s PHE 414 Cb -0.01 -0.48 -0.04 0.00 -1.21 0.00 0.00 43.02 41.29 1tye s PHE 414 CO -0.03 -0.63 -0.23 0.99 -1.34 0.00 0.00 175.22 173.98 1tye s THR 415 N -4.11 2.09 -0.26 -4.49 2.01 -0.77 -0.78 115.64 109.32 1tye s THR 415 Ca 0.33 -1.81 -0.03 0.00 0.31 0.00 0.00 61.69 60.49 1tye s THR 415 Cb 0.07 -1.91 0.09 0.00 0.01 0.00 0.00 72.50 70.75 1tye s THR 415 CO 0.08 -0.06 0.09 -0.63 -0.69 0.00 0.00 174.62 173.42 1tye s ILE 416 N -1.40 0.38 -0.01 1.82 1.01 -0.05 -2.20 121.20 120.75 1tye s ILE 416 Ca 0.14 -0.87 0.02 0.00 0.00 0.00 0.00 60.65 59.95 1tye s ILE 416 Cb -0.09 -1.18 -0.01 0.00 0.01 0.00 0.00 42.46 41.19 1tye s ILE 416 CO 0.07 -0.55 -0.08 -1.59 0.00 0.00 0.00 174.94 172.78 1tye s LYS 417 N 1.89 0.66 0.28 2.79 -2.85 -1.18 -1.63 119.74 119.70 1tye s LYS 417 Ca 0.06 -0.30 -0.29 0.00 -1.00 0.00 0.00 55.97 54.44 1tye s LYS 417 Cb -0.17 -0.63 -0.10 0.00 -2.06 0.00 0.00 37.83 34.87 1tye s LYS 417 CO -0.24 0.17 1.29 -1.25 0.10 0.00 0.00 175.35 175.43 1tye s PRO 418 N -0.21 4.39 -0.05 1.78 0.04 -1.26 -2.23 135.00 137.46 1tye s PRO 418 Ca 0.03 2.13 -0.34 0.00 0.04 0.00 0.00 61.00 62.85 1tye s PRO 418 Cb -0.03 -3.12 -0.12 0.00 0.04 0.00 0.00 34.50 31.26 1tye s PRO 418 CO -0.00 -0.17 1.81 0.28 0.04 0.00 0.00 177.00 178.96 1tye n VAL 419 N 1.46 0.46 -0.39 -0.36 0.31 0.10 -1.68 118.33 118.24 1tye n VAL 419 Ca 0.02 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 1tye n VAL 419 Cb 0.42 -1.76 0.00 0.00 -0.91 0.00 0.00 33.84 31.59 1tye n VAL 419 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1tye n GLY 420 N 4.19 0.80 3.41 2.92 0.00 -1.26 -4.69 105.19 110.55 1tye n GLY 420 Ca 0.22 -0.07 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.00 2.31 -0.06 1.61 0.40 -0.67 -5.04 117.98 114.53 1tye s PHE 421 Ca 0.00 -0.37 0.06 0.00 -0.60 0.00 0.00 56.93 56.02 1tye s PHE 421 Cb 0.00 -1.20 -0.24 0.00 0.51 0.00 0.00 43.02 42.08 1tye s PHE 421 CO 0.00 0.41 0.61 0.87 0.70 0.00 0.00 175.22 177.81 1tye h LYS 422 N 3.58 0.09 -6.75 0.44 1.57 -1.98 -3.45 116.57 110.06 1tye h LYS 422 Ca -0.49 -0.16 -0.52 0.00 -1.87 0.00 0.00 60.65 57.61 1tye h LYS 422 Cb 1.19 0.06 0.04 0.00 0.08 0.00 0.00 32.23 33.60 1tye h LYS 422 CO 0.43 0.75 0.64 -0.51 -0.57 0.00 0.00 179.45 180.19 1tye s ASP 423 N -6.43 6.87 0.12 0.86 1.11 -1.26 -5.03 116.67 112.91 1tye s ASP 423 Ca -0.10 2.49 -0.06 0.00 0.18 0.00 0.00 52.55 55.07 1tye s ASP 423 Cb 0.08 -2.62 -0.02 0.00 1.07 0.00 0.00 42.92 41.42 1tye s ASP 423 CO 0.81 -0.51 0.16 -0.94 1.18 0.00 0.00 175.17 175.87 1tye s SER 424 N 0.01 0.19 -0.19 0.27 1.04 -1.26 -4.45 113.70 109.31 1tye s SER 424 Ca 0.54 -0.89 -0.04 0.00 0.48 0.00 0.00 55.95 56.04 1tye s SER 424 Cb -0.37 0.34 -0.02 0.00 0.10 0.00 0.00 66.02 66.07 1tye s SER 424 CO 0.43 -0.76 -0.04 -0.22 0.98 0.00 0.00 173.24 173.62 1tye s LEU 425 N -2.94 3.03 -0.28 2.42 2.96 -0.65 -4.65 118.68 118.57 1tye s LEU 425 Ca 0.13 -0.28 -0.09 0.00 -0.22 0.00 0.00 54.13 53.67 1tye s LEU 425 Cb 0.05 -1.75 -0.02 0.00 0.50 0.00 0.00 46.19 44.97 1tye s LEU 425 CO -0.05 0.07 0.12 -0.63 -1.32 0.00 0.00 176.35 174.54 1tye s ILE 426 N 0.97 4.53 -0.26 6.68 1.01 0.55 -0.87 121.20 133.81 1tye s ILE 426 Ca 0.00 -0.27 -0.09 0.00 0.00 0.00 0.00 60.65 60.29 1tye s ILE 426 Cb -0.15 -3.22 -0.04 0.00 0.01 0.00 0.00 42.46 39.07 1tye s ILE 426 CO 0.01 0.19 0.13 -0.69 0.00 0.00 0.00 174.94 174.58 1tye s VAL 427 N 1.62 4.84 -0.46 2.92 1.01 0.04 -0.93 120.40 129.44 1tye s VAL 427 Ca 0.05 0.01 -0.12 0.00 0.00 0.00 0.00 61.98 61.92 1tye s VAL 427 Cb -0.16 -3.28 0.09 0.00 0.00 0.00 0.00 36.38 33.03 1tye s VAL 427 CO 0.05 0.31 0.35 -1.10 0.00 0.00 0.00 175.10 174.71 1tye s GLN 428 N 1.59 2.77 0.18 2.72 -0.21 0.25 -1.26 119.66 125.69 1tye s GLN 428 Ca 0.06 -1.49 -0.30 0.00 0.02 0.00 0.00 55.36 53.65 1tye s GLN 428 Cb -0.15 -3.99 -0.07 0.00 1.00 0.00 0.00 33.01 29.79 1tye s GLN 428 CO 0.07 -1.06 0.97 0.14 -2.12 0.00 0.00 175.29 173.29 1tye s VAL 429 N 1.52 4.23 -0.04 1.09 -7.23 -0.87 -0.15 120.40 118.95 1tye s VAL 429 Ca 0.04 2.02 0.01 0.00 -1.81 0.00 0.00 61.98 62.24 1tye s VAL 429 Cb -0.25 -4.29 0.02 0.00 0.56 0.00 0.00 36.38 32.42 1tye s VAL 429 CO 0.03 0.40 -0.03 -0.89 -0.31 0.00 0.00 175.10 174.30 1tye s THR 430 N -0.58 0.43 -0.19 5.32 2.01 0.43 -3.23 115.64 119.84 1tye s THR 430 Ca 0.44 -0.08 -0.09 0.00 0.31 0.00 0.00 61.69 62.27 1tye s THR 430 Cb -0.25 -0.47 -0.05 0.00 0.01 0.00 0.00 72.50 71.74 1tye s THR 430 CO 0.32 0.19 0.11 -0.36 -0.69 0.00 0.00 174.62 174.19 1tye s PHE 431 N 0.82 3.37 -0.93 4.92 0.08 -1.24 -1.89 117.98 123.11 1tye s PHE 431 Ca -0.10 0.27 -0.02 0.00 0.12 0.00 0.00 56.93 57.19 1tye s PHE 431 Cb -0.13 -2.11 0.24 0.00 -0.57 0.00 0.00 43.02 40.44 1tye s PHE 431 CO -0.00 0.29 0.89 -3.47 -0.10 0.00 0.00 175.22 172.83 1tye n ASP 432 N 3.39 4.55 -0.04 1.36 -0.08 -1.12 -4.86 116.55 119.75 1tye n ASP 432 Ca -0.16 -3.17 -0.15 0.00 -1.51 0.00 0.00 54.79 49.80 1tye n ASP 432 Cb 0.52 -1.09 -0.14 0.00 2.34 0.00 0.00 41.12 42.76 1tye n ASP 432 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1tye s ASP 434 N -6.41 5.77 0.38 0.00 1.01 -1.26 -4.79 116.67 111.37 1tye s ASP 434 Ca -0.16 0.50 0.08 0.00 0.71 0.00 0.00 52.55 53.68 1tye s ASP 434 Cb 0.07 -1.65 -0.03 0.00 1.01 0.00 0.00 42.92 42.33 1tye s ASP 434 CO 0.78 -0.83 0.32 0.00 0.21 0.00 0.00 175.17 175.65 1tye n ALA 436 N -1.44 3.84 -0.83 0.00 0.00 -1.26 -4.47 120.51 116.34 1tye n ALA 436 Ca 0.01 -3.34 -0.01 0.00 0.00 0.00 0.00 53.44 50.10 1tye n ALA 436 Cb 0.61 -3.58 -0.00 0.00 0.00 0.00 0.00 19.45 16.47 1tye n ALA 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tye s GLN 438 N -1.69 4.29 -0.29 0.00 -0.21 -1.26 -5.00 119.66 115.50 1tye s GLN 438 Ca 0.00 1.07 -0.21 0.00 0.02 0.00 0.00 55.36 56.24 1tye s GLN 438 Cb 0.00 -3.58 0.14 0.00 1.00 0.00 0.00 33.01 30.57 1tye s GLN 438 CO 0.00 -0.37 1.05 0.00 -2.12 0.00 0.00 175.29 173.85 1tye s ALA 439 N 2.28 -2.14 -2.69 6.09 0.00 -1.26 -4.45 121.76 119.60 1tye s ALA 439 Ca 0.39 2.00 0.26 0.00 0.00 0.00 0.00 51.96 54.62 1tye s ALA 439 Cb -0.16 -1.60 0.72 0.00 0.00 0.00 0.00 23.12 22.08 1tye s ALA 439 CO 0.12 -0.27 1.56 1.04 0.00 0.00 0.00 175.76 178.21