#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dki n MET 1 N 0.00 1.59 -2.73 -0.41 0.00 -1.26 -4.94 117.12 109.38 3dki n MET 1 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 57.70 57.65 3dki n MET 1 Cb 0.00 -0.82 0.06 0.00 0.00 0.00 0.00 33.22 32.46 3dki n MET 1 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3dki n ALA 2 N -1.72 2.81 -2.63 3.04 0.00 -1.26 -5.08 120.51 115.66 3dki n ALA 2 Ca 0.00 -2.56 -0.38 0.00 0.00 0.00 0.00 53.44 50.50 3dki n ALA 2 Cb 0.32 -0.92 -0.10 0.00 0.00 0.00 0.00 19.45 18.76 3dki n ALA 2 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3dki s ARG 3 N -2.61 4.04 0.05 0.00 3.52 -1.26 -5.09 118.95 117.60 3dki s ARG 3 Ca 0.25 -0.18 0.07 0.00 -0.13 0.00 0.00 55.73 55.74 3dki s ARG 3 Cb 0.40 -3.59 -0.03 0.00 -1.56 0.00 0.00 34.95 30.17 3dki s ARG 3 CO -0.02 -0.08 -0.19 0.71 -0.81 0.00 0.00 175.30 174.91 3dki s TYR 4 N 1.47 1.66 -0.75 5.12 1.51 -1.26 -5.02 117.35 120.07 3dki s TYR 4 Ca 0.10 -0.38 0.25 0.00 -1.01 0.00 0.00 57.07 56.04 3dki s TYR 4 Cb -0.15 -0.97 0.61 0.00 -0.11 0.00 0.00 41.96 41.35 3dki s TYR 4 CO 0.08 0.10 1.55 -0.25 -1.11 0.00 0.00 175.55 175.91 3dki n ASP 5 N 1.72 0.64 -3.74 2.29 9.92 -1.26 -4.85 116.55 121.27 3dki n ASP 5 Ca -0.18 0.27 -0.13 0.00 -0.53 0.00 0.00 54.79 54.22 3dki n ASP 5 Cb 0.54 -0.22 -0.09 0.00 -0.64 0.00 0.00 41.12 40.70 3dki n ASP 5 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 3dki s SER 6 N -4.05 -0.33 0.39 -2.24 0.15 -1.26 -5.03 113.70 101.32 3dki s SER 6 Ca 0.09 0.51 0.17 0.00 0.70 0.00 0.00 55.95 57.43 3dki s SER 6 Cb 0.14 0.59 1.08 0.00 -1.71 0.00 0.00 66.02 66.13 3dki s SER 6 CO 0.66 -0.28 1.76 0.25 1.20 0.00 0.00 173.24 176.83 3dki h LEU 7 N 4.78 0.47 -1.55 3.45 5.85 -1.99 -2.00 115.31 124.32 3dki h LEU 7 Ca -0.28 0.09 0.19 0.00 0.84 0.00 0.00 57.88 58.73 3dki h LEU 7 Cb 1.18 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 42.17 3dki h LEU 7 CO 0.32 0.08 0.57 -0.07 -0.34 0.00 0.00 178.44 179.00 3dki h LEU 8 N 0.41 0.38 -0.41 2.25 3.38 -1.98 -1.89 115.31 117.45 3dki h LEU 8 Ca 0.61 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.62 3dki h LEU 8 Cb 1.51 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.22 3dki h LEU 8 CO -0.33 0.17 0.00 1.56 0.09 0.00 0.00 178.44 179.92 3dki h GLN 9 N 0.39 0.00 -1.06 1.13 4.20 -1.78 -3.21 115.11 114.78 3dki h GLN 9 Ca 0.44 0.00 -0.48 0.00 0.06 0.00 0.00 58.65 58.68 3dki h GLN 9 Cb 1.11 0.00 -0.25 0.00 0.30 0.00 0.00 27.48 28.64 3dki h GLN 9 CO -0.15 0.00 0.61 0.00 -0.67 0.00 0.00 178.83 178.61 3dki n ALA 10 N -1.81 5.37 -2.89 3.87 0.00 -0.71 -4.91 120.51 119.43 3dki n ALA 10 Ca 0.04 -2.57 -0.33 0.00 0.00 0.00 0.00 53.44 50.57 3dki n ALA 10 Cb 0.33 -1.46 -0.05 0.00 0.00 0.00 0.00 19.45 18.27 3dki n ALA 10 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3dki s LEU 11 N -2.89 4.34 0.00 0.00 1.98 -1.22 -4.45 118.68 116.44 3dki s LEU 11 Ca 0.50 0.34 0.00 0.00 -2.89 0.00 0.00 54.13 52.08 3dki s LEU 11 Cb 0.41 -2.56 0.00 0.00 0.66 0.00 0.00 46.19 44.69 3dki s LEU 11 CO 0.06 0.27 0.00 0.61 -1.89 0.00 0.00 176.35 175.40 3dki n GLY 12 N 1.01 -1.34 4.18 7.98 0.00 -1.26 -4.95 105.19 110.82 3dki n GLY 12 Ca -0.11 -1.28 -0.34 0.00 0.00 0.00 0.00 46.02 44.29 3dki n GLY 12 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3dki n ASN 13 N -0.20 -2.13 -4.83 1.61 3.02 -1.26 -4.93 115.26 106.54 3dki n ASN 13 Ca 0.00 -1.05 -0.32 0.00 -0.03 0.00 0.00 54.58 53.18 3dki n ASN 13 Cb 0.00 -2.67 -0.02 0.00 -0.61 0.00 0.00 39.78 36.47 3dki n ASN 13 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3dki s THR 14 N -3.54 4.33 0.54 3.41 -4.23 -1.26 -5.01 115.64 109.88 3dki s THR 14 Ca 0.50 1.11 -0.19 0.00 -1.18 0.00 0.00 61.69 61.93 3dki s THR 14 Cb -0.28 -3.63 -0.06 0.00 1.34 0.00 0.00 72.50 69.88 3dki s THR 14 CO 0.93 -0.65 1.13 -2.84 -0.54 0.00 0.00 174.62 172.65 3dki s PRO 15 N -4.10 3.35 -0.25 3.99 0.02 -1.26 -4.80 135.00 131.96 3dki s PRO 15 Ca 0.60 1.60 -0.01 0.00 0.02 0.00 0.00 61.00 63.21 3dki s PRO 15 Cb -0.12 -2.01 0.03 0.00 0.02 0.00 0.00 34.50 32.43 3dki s PRO 15 CO 0.33 -0.85 -0.08 -1.17 -0.33 0.00 0.00 177.00 174.91 3dki s LEU 16 N -3.82 3.17 -0.10 -5.54 2.96 -1.26 -1.13 118.68 112.97 3dki s LEU 16 Ca 0.72 -0.96 0.03 0.00 -0.22 0.00 0.00 54.13 53.70 3dki s LEU 16 Cb -0.23 -1.63 -0.01 0.00 0.50 0.00 0.00 46.19 44.81 3dki s LEU 16 CO 0.27 -0.13 -0.19 0.68 -1.32 0.00 0.00 176.35 175.66 3dki s VAL 17 N 1.28 2.56 0.19 1.68 -7.23 0.14 -4.91 120.40 114.11 3dki s VAL 17 Ca -0.01 -0.86 -0.30 0.00 -1.81 0.00 0.00 61.98 59.00 3dki s VAL 17 Cb -0.17 -2.01 -0.08 0.00 0.56 0.00 0.00 36.38 34.67 3dki s VAL 17 CO -0.05 0.55 1.27 -0.83 -0.31 0.00 0.00 175.10 175.73 3dki s GLY 18 N 0.12 2.53 -0.95 2.32 0.00 -1.26 -0.36 107.32 109.72 3dki s GLY 18 Ca -0.09 1.05 -0.11 0.00 0.00 0.00 0.00 44.72 45.56 3dki s GLY 18 CO 0.06 2.00 0.91 1.08 0.00 0.00 0.00 173.10 177.15 3dki s LEU 19 N -0.11 6.50 0.30 0.66 1.43 -0.38 -4.92 118.68 122.15 3dki s LEU 19 Ca 0.55 -3.14 0.07 0.00 -1.03 0.00 0.00 54.13 50.59 3dki s LEU 19 Cb -0.35 -2.19 0.46 0.00 0.03 0.00 0.00 46.19 44.14 3dki s LEU 19 CO 0.37 -0.42 1.69 1.56 0.23 0.00 0.00 176.35 179.78 3dki h GLN 20 N 7.20 0.19 0.18 1.70 4.20 -1.94 -1.64 115.11 124.99 3dki h GLN 20 Ca 0.14 -0.09 -0.27 0.00 0.06 0.00 0.00 58.65 58.49 3dki h GLN 20 Cb 0.96 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.76 3dki h GLN 20 CO 0.87 0.60 -1.25 0.00 -0.67 0.00 0.00 178.83 178.39 3dki h ARG 21 N 0.15 0.37 0.00 1.46 3.08 -1.91 -3.36 114.38 114.17 3dki h ARG 21 Ca 0.01 -0.63 0.00 0.00 0.07 0.00 0.00 59.98 59.43 3dki h ARG 21 Cb 0.85 0.24 0.00 0.00 0.08 0.00 0.00 29.97 31.14 3dki h ARG 21 CO 0.07 1.30 -0.17 -0.11 -1.07 0.00 0.00 179.97 179.99 3dki n LEU 22 N -3.90 0.79 -4.71 3.04 7.94 -1.22 -4.83 117.00 114.11 3dki n LEU 22 Ca -0.18 0.48 -0.42 0.00 -1.11 0.00 0.00 56.01 54.78 3dki n LEU 22 Cb 0.95 -0.28 -0.03 0.00 0.53 0.00 0.00 43.42 44.59 3dki n LEU 22 CO 0.51 -0.15 1.06 -0.44 -1.11 0.00 0.00 177.39 177.26 3dki s SER 23 N -4.45 6.86 0.21 1.96 0.01 -0.62 -4.94 113.70 112.73 3dki s SER 23 Ca 0.09 2.24 -0.14 0.00 1.31 0.00 0.00 55.95 59.46 3dki s SER 23 Cb 0.13 -2.58 0.22 0.00 0.21 0.00 0.00 66.02 64.00 3dki s SER 23 CO 0.63 -0.65 1.63 -0.65 0.41 0.00 0.00 173.24 174.61 3dki h PRO 24 N 7.06 -0.00 -2.57 12.44 0.11 -1.88 -3.36 132.00 143.80 3dki h PRO 24 Ca -0.41 0.00 -0.41 0.00 0.11 0.00 0.00 66.00 65.29 3dki h PRO 24 Cb 1.20 0.00 -0.37 0.00 0.11 0.00 0.00 31.00 31.94 3dki h PRO 24 CO 0.87 -0.00 -0.70 0.50 -0.21 0.00 0.00 178.00 178.46 3dki s ARG 25 N -6.23 0.21 0.04 1.05 3.52 -0.97 -4.96 118.95 111.62 3dki s ARG 25 Ca -0.14 -0.18 -0.18 0.00 -0.13 0.00 0.00 55.73 55.10 3dki s ARG 25 Cb 0.19 -1.11 -0.18 0.00 -1.56 0.00 0.00 34.95 32.29 3dki s ARG 25 CO 0.73 -0.89 1.23 2.35 -0.81 0.00 0.00 175.30 177.91 3dki h TRP 26 N 8.34 0.67 -3.06 5.12 2.91 -1.73 0.53 115.95 128.73 3dki h TRP 26 Ca -0.17 -0.29 -0.60 0.00 1.13 0.00 0.00 58.89 58.96 3dki h TRP 26 Cb 1.08 -0.10 -0.05 0.00 -0.51 0.00 0.00 29.16 29.58 3dki h TRP 26 CO 0.23 1.06 -0.25 -0.51 -1.03 0.00 0.00 178.44 177.95 3dki s ASP 27 N -6.63 6.67 0.21 2.65 1.01 -1.26 -4.74 116.67 114.59 3dki s ASP 27 Ca -0.13 0.82 -0.30 0.00 0.71 0.00 0.00 52.55 53.65 3dki s ASP 27 Cb 0.05 -2.19 -0.08 0.00 1.01 0.00 0.00 42.92 41.71 3dki s ASP 27 CO 0.82 0.22 1.13 -1.81 0.21 0.00 0.00 175.17 175.74 3dki s ASP 28 N -1.55 7.22 0.00 0.27 1.01 -1.26 -4.31 116.67 118.05 3dki s ASP 28 Ca 0.30 2.18 0.00 0.00 0.71 0.00 0.00 52.55 55.74 3dki s ASP 28 Cb -0.15 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.17 3dki s ASP 28 CO 0.16 -0.24 0.00 0.61 0.21 0.00 0.00 175.17 175.91 3dki n GLY 29 N 1.84 3.43 0.24 0.21 0.00 -1.16 -4.98 105.19 104.76 3dki n GLY 29 Ca 0.02 -0.47 -0.09 0.00 0.00 0.00 0.00 46.02 45.48 3dki n GLY 29 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3dki h ARG 30 N 0.00 0.69 -0.18 1.61 2.43 -2.02 -3.02 114.38 113.89 3dki h ARG 30 Ca 0.00 -0.36 0.00 0.00 -0.81 0.00 0.00 59.98 58.81 3dki h ARG 30 Cb 0.00 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 3dki h ARG 30 CO 0.00 0.97 0.00 -0.25 -1.51 0.00 0.00 179.97 179.18 3dki n ASP 31 N -4.03 1.73 0.00 -3.80 8.00 -1.26 -5.02 116.55 112.17 3dki n ASP 31 Ca -0.02 -1.73 0.00 0.00 0.71 0.00 0.00 54.79 53.75 3dki n ASP 31 Cb 0.53 -0.12 0.00 0.00 -0.02 0.00 0.00 41.12 41.51 3dki n ASP 31 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dki n GLY 32 N 1.14 1.31 3.74 0.44 0.00 -1.14 -5.01 105.19 105.67 3dki n GLY 32 Ca 0.16 -2.15 -0.33 0.00 0.00 0.00 0.00 46.02 43.70 3dki n GLY 32 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dki s PRO 33 N -1.20 2.28 0.57 1.61 0.04 -1.26 -2.99 135.00 134.05 3dki s PRO 33 Ca 0.00 1.53 -0.19 0.00 0.04 0.00 0.00 61.00 62.38 3dki s PRO 33 Cb 0.00 -1.87 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 3dki s PRO 33 CO 0.00 -1.68 1.20 -3.38 0.04 0.00 0.00 177.00 173.19 3dki s HIS 34 N -2.29 2.46 -0.30 0.56 -3.43 -1.26 -4.75 115.29 106.28 3dki s HIS 34 Ca 0.69 1.51 0.02 0.00 -0.80 0.00 0.00 55.06 56.48 3dki s HIS 34 Cb -0.24 -3.47 0.09 0.00 -1.43 0.00 0.00 32.58 27.53 3dki s HIS 34 CO 0.46 -2.11 0.02 0.08 -2.00 0.00 0.00 174.74 171.19 3dki s VAL 35 N -1.59 1.70 -0.01 -5.38 1.01 0.19 -2.44 120.40 113.88 3dki s VAL 35 Ca 0.75 -1.75 0.03 0.00 0.00 0.00 0.00 61.98 61.02 3dki s VAL 35 Cb -0.30 -2.15 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 3dki s VAL 35 CO 0.33 -0.45 -0.08 -0.13 0.00 0.00 0.00 175.10 174.77 3dki s ARG 36 N 1.24 2.54 -0.14 2.72 0.52 -0.62 -2.28 118.95 122.93 3dki s ARG 36 Ca 0.05 -0.72 -0.02 0.00 -0.52 0.00 0.00 55.73 54.52 3dki s ARG 36 Cb -0.19 -2.48 -0.02 0.00 0.52 0.00 0.00 34.95 32.78 3dki s ARG 36 CO -0.12 0.61 -0.07 -0.51 0.02 0.00 0.00 175.30 175.23 3dki s LEU 37 N -1.28 3.06 -0.13 2.53 1.02 -1.26 -0.57 118.68 122.05 3dki s LEU 37 Ca 0.16 -0.18 0.00 0.00 0.02 0.00 0.00 54.13 54.13 3dki s LEU 37 Cb -0.11 -1.71 0.02 0.00 0.02 0.00 0.00 46.19 44.41 3dki s LEU 37 CO 0.06 0.19 -0.11 0.26 0.02 0.00 0.00 176.35 176.77 3dki s TRP 38 N 0.20 1.82 -0.16 0.29 0.52 0.19 -1.25 118.94 120.55 3dki s TRP 38 Ca -0.04 -0.96 -0.18 0.00 0.02 0.00 0.00 56.10 54.93 3dki s TRP 38 Cb -0.14 -1.40 -0.04 0.00 -1.15 0.00 0.00 33.47 30.74 3dki s TRP 38 CO 0.04 -0.58 0.51 0.00 0.02 0.00 0.00 176.95 176.93 3dki s ALA 39 N 1.56 3.51 -0.45 0.98 0.00 0.51 -0.85 121.76 127.03 3dki s ALA 39 Ca 0.04 -0.30 -0.17 0.00 0.00 0.00 0.00 51.96 51.53 3dki s ALA 39 Cb -0.13 -2.75 0.04 0.00 0.00 0.00 0.00 23.12 20.28 3dki s ALA 39 CO -0.09 -0.25 0.46 0.21 0.00 0.00 0.00 175.76 176.09 3dki s LYS 40 N 1.20 3.07 -1.18 0.00 2.47 0.47 -0.68 119.74 125.10 3dki s LYS 40 Ca 0.25 -0.91 -0.16 0.00 -1.56 0.00 0.00 55.97 53.60 3dki s LYS 40 Cb -0.15 -4.03 0.14 0.00 -1.46 0.00 0.00 37.83 32.33 3dki s LYS 40 CO 0.10 -0.96 1.45 -0.51 0.16 0.00 0.00 175.35 175.59 3dki s LEU 41 N 2.13 4.75 0.00 5.43 1.43 -0.28 -1.64 118.68 130.50 3dki s LEU 41 Ca 0.11 -2.68 0.26 0.00 -1.03 0.00 0.00 54.13 50.78 3dki s LEU 41 Cb -0.19 -2.44 1.34 0.00 0.03 0.00 0.00 46.19 44.93 3dki s LEU 41 CO 0.12 -0.91 1.88 -0.62 0.23 0.00 0.00 176.35 177.05 3dki n GLU 42 N 6.45 0.44 0.00 1.70 -0.58 -0.40 -2.45 120.64 125.81 3dki n GLU 42 Ca 0.37 0.04 0.11 0.00 -0.42 0.00 0.00 57.16 57.26 3dki n GLU 42 Cb 0.45 -1.50 0.62 0.00 -0.57 0.00 0.00 31.44 30.44 3dki n GLU 42 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 3dki n ASP 43 N -1.24 0.00 -0.73 1.62 5.75 -1.24 -3.26 116.55 117.46 3dki n ASP 43 Ca 0.13 -0.28 0.04 0.00 -0.01 0.00 0.00 54.79 54.67 3dki n ASP 43 Cb 0.18 -0.19 0.14 0.00 -1.03 0.00 0.00 41.12 40.23 3dki n ASP 43 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3dki n ARG 44 N -1.19 1.99 -2.36 0.11 5.12 -1.02 -4.22 116.66 115.09 3dki n ARG 44 Ca 0.13 -1.12 -0.28 0.00 -1.93 0.00 0.00 57.85 54.65 3dki n ARG 44 Cb 0.15 -1.44 0.01 0.00 -1.16 0.00 0.00 32.46 30.02 3dki n ARG 44 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 3dki s ASN 45 N -0.74 6.12 0.30 0.55 0.01 -1.20 -4.89 114.94 115.08 3dki s ASN 45 Ca 0.20 1.04 0.02 0.00 -0.71 0.00 0.00 52.86 53.41 3dki s ASN 45 Cb 0.12 -2.21 0.75 0.00 0.41 0.00 0.00 41.25 40.32 3dki s ASN 45 CO 0.11 -0.76 1.61 -0.65 -1.51 0.00 0.00 177.10 175.89 3dki h PRO 46 N -0.02 0.09 -0.18 -0.60 0.11 -1.89 -0.62 132.00 128.90 3dki h PRO 46 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3dki h PRO 46 Cb 1.21 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3dki h PRO 46 CO 0.62 0.06 0.00 0.25 -0.21 0.00 0.00 178.00 178.72 3dki n THR 47 N -5.36 0.24 -0.43 -1.15 -2.24 -1.26 -4.96 114.28 99.12 3dki n THR 47 Ca 0.22 -0.62 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 3dki n THR 47 Cb 0.74 1.22 0.00 0.00 -2.10 0.00 0.00 70.33 70.18 3dki n THR 47 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dki n GLY 48 N 1.24 0.86 3.54 3.38 0.00 -0.24 -5.00 105.19 108.98 3dki n GLY 48 Ca 0.15 -0.40 -0.09 0.00 0.00 0.00 0.00 46.02 45.68 3dki n GLY 48 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dki s SER 49 N -2.37 -0.17 -0.54 1.61 1.04 -1.23 -3.90 113.70 108.15 3dki s SER 49 Ca 0.00 -0.67 -0.04 0.00 0.48 0.00 0.00 55.95 55.71 3dki s SER 49 Cb 0.00 0.57 -0.07 0.00 0.10 0.00 0.00 66.02 66.62 3dki s SER 49 CO 0.00 -1.08 1.95 0.00 0.98 0.00 0.00 173.24 175.09 3dki n ILE 50 N -0.34 1.86 0.00 -1.02 3.06 -0.47 -4.64 119.36 117.81 3dki n ILE 50 Ca -0.07 -1.07 0.00 0.00 -2.50 0.00 0.00 62.75 59.12 3dki n ILE 50 Cb 0.62 -1.94 0.00 0.00 0.54 0.00 0.00 39.64 38.86 3dki n ILE 50 CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 3dki n ASP 52 N 3.85 0.00 0.28 9.51 8.00 -1.26 -4.27 116.55 132.66 3dki n ASP 52 Ca 0.32 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.71 3dki n ASP 52 Cb 0.21 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.26 3dki n ASP 52 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3dki h ARG 53 N 0.00 -0.70 -0.99 -1.24 3.08 -1.98 -2.04 114.38 110.52 3dki h ARG 53 Ca 0.00 0.05 0.05 0.00 0.07 0.00 0.00 59.98 60.15 3dki h ARG 53 Cb 0.00 0.16 -0.06 0.00 0.08 0.00 0.00 29.97 30.15 3dki h ARG 53 CO 0.00 -0.47 0.64 -1.00 -1.07 0.00 0.00 179.97 178.07 3dki h PRO 54 N -0.84 1.18 0.07 0.04 0.13 -1.84 -2.11 132.00 128.63 3dki h PRO 54 Ca -0.07 -0.07 0.03 0.00 -0.87 0.00 0.00 66.00 65.01 3dki h PRO 54 Cb 0.56 -0.27 -0.04 0.00 0.13 0.00 0.00 31.00 31.38 3dki h PRO 54 CO 0.12 0.78 -0.34 0.00 -0.23 0.00 0.00 178.00 178.33 3dki h ALA 55 N 1.42 -0.55 -0.64 -0.56 0.00 -1.90 0.23 119.26 117.26 3dki h ALA 55 Ca 0.41 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.21 3dki h ALA 55 Cb 0.07 0.57 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 3dki h ALA 55 CO -0.14 -0.87 0.16 0.28 0.00 0.00 0.00 179.25 178.67 3dki h VAL 56 N -0.54 1.26 -0.23 0.00 2.07 -1.23 -2.62 116.25 114.97 3dki h VAL 56 Ca 0.04 -0.93 -0.16 0.00 0.82 0.00 0.00 66.70 66.47 3dki h VAL 56 Cb 0.59 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 3dki h VAL 56 CO -0.23 0.35 -0.50 -0.09 0.02 0.00 0.00 177.57 177.12 3dki h ARG 57 N 0.94 0.62 -0.36 1.57 2.43 -1.16 -1.57 114.38 116.86 3dki h ARG 57 Ca 0.20 -0.36 0.04 0.00 -0.81 0.00 0.00 59.98 59.05 3dki h ARG 57 Cb 0.36 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.90 3dki h ARG 57 CO 0.00 0.97 0.12 0.52 -1.51 0.00 0.00 179.97 180.08 3dki h MET 58 N 0.49 0.26 -0.06 0.20 2.86 -0.43 0.23 114.93 118.48 3dki h MET 58 Ca 0.02 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 3dki h MET 58 Cb 1.04 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.64 3dki h MET 58 CO 0.10 0.17 0.03 0.82 1.06 0.00 0.00 176.91 179.09 3dki h ILE 59 N 0.27 1.06 -0.61 -1.22 2.04 -1.37 0.25 117.51 117.92 3dki h ILE 59 Ca 0.17 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 3dki h ILE 59 Cb 0.15 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 3dki h ILE 59 CO -0.17 0.05 0.35 -0.33 0.00 0.00 0.00 178.15 178.05 3dki h GLU 60 N 0.02 0.85 -0.51 2.37 5.08 -1.16 -0.23 114.58 121.00 3dki h GLU 60 Ca 0.02 -0.09 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 3dki h GLU 60 Cb 0.06 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 3dki h GLU 60 CO -0.00 0.63 0.02 0.37 -1.00 0.00 0.00 179.01 179.02 3dki h GLN 61 N 0.83 0.84 -0.70 2.33 5.75 -0.39 -0.38 115.11 123.40 3dki h GLN 61 Ca 0.22 -0.23 -0.05 0.00 -0.15 0.00 0.00 58.65 58.44 3dki h GLN 61 Cb 0.01 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.43 3dki h GLN 61 CO -0.04 0.83 0.23 0.00 -2.65 0.00 0.00 178.83 177.21 3dki h ALA 62 N 1.23 1.09 0.02 3.38 0.00 -0.48 -0.92 119.26 123.58 3dki h ALA 62 Ca 0.15 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3dki h ALA 62 Cb 0.45 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3dki h ALA 62 CO 0.02 0.63 -0.01 0.93 0.00 0.00 0.00 179.25 180.81 3dki h GLU 63 N 1.03 -0.03 -0.98 0.00 5.08 -0.61 0.17 114.58 119.25 3dki h GLU 63 Ca 0.23 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.73 3dki h GLU 63 Cb 0.27 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.43 3dki h GLU 63 CO -0.01 0.11 0.60 0.00 -1.00 0.00 0.00 179.01 178.71 3dki h ALA 64 N 0.81 1.51 -0.03 3.43 0.00 -0.93 -2.03 119.26 122.02 3dki h ALA 64 Ca -0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3dki h ALA 64 Cb 0.15 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3dki h ALA 64 CO 0.01 0.13 0.00 -0.25 0.00 0.00 0.00 179.25 179.14 3dki n ASP 65 N -4.68 0.68 -0.07 0.00 8.00 -0.36 -4.92 116.55 115.19 3dki n ASP 65 Ca 0.19 -1.33 -0.01 0.00 0.71 0.00 0.00 54.79 54.35 3dki n ASP 65 Cb 0.41 -0.02 -0.00 0.00 -0.02 0.00 0.00 41.12 41.49 3dki n ASP 65 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dki n GLY 66 N 1.03 0.49 0.15 0.44 0.00 -0.77 -4.93 105.19 101.59 3dki n GLY 66 Ca 0.19 -0.34 -0.24 0.00 0.00 0.00 0.00 46.02 45.64 3dki n GLY 66 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3dki h LEU 67 N 0.00 0.80 -9.32 0.99 3.38 -1.20 -3.45 115.31 106.51 3dki h LEU 67 Ca -0.02 -0.85 -0.66 0.00 0.09 0.00 0.00 57.88 56.44 3dki h LEU 67 Cb 0.14 -0.26 -0.13 0.00 0.09 0.00 0.00 40.66 40.50 3dki h LEU 67 CO 0.03 1.66 -0.56 -0.76 0.09 0.00 0.00 178.44 178.90 3dki s LEU 68 N -7.56 3.88 0.05 1.67 1.43 -1.13 -4.97 118.68 112.04 3dki s LEU 68 Ca -0.08 0.21 -0.03 0.00 -1.03 0.00 0.00 54.13 53.19 3dki s LEU 68 Cb 0.05 -1.93 -0.02 0.00 0.03 0.00 0.00 46.19 44.31 3dki s LEU 68 CO 0.94 0.32 0.04 -0.13 0.23 0.00 0.00 176.35 177.76 3dki s ARG 69 N -0.53 0.63 0.03 1.70 0.52 -1.26 -4.56 118.95 115.48 3dki s ARG 69 Ca 0.10 -1.01 -0.04 0.00 -0.52 0.00 0.00 55.73 54.26 3dki s ARG 69 Cb -0.12 0.23 -0.00 0.00 0.52 0.00 0.00 34.95 35.58 3dki s ARG 69 CO 0.02 -0.14 0.24 -2.30 0.02 0.00 0.00 175.30 173.14 3dki n PRO 70 N 0.36 -0.06 -1.13 3.54 -0.02 -1.26 -1.22 135.00 135.20 3dki n PRO 70 Ca -0.16 0.24 -0.19 0.00 -2.02 0.00 0.00 63.50 61.36 3dki n PRO 70 Cb 0.60 -0.35 0.18 0.00 -0.02 0.00 0.00 33.50 33.91 3dki n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dki n GLY 71 N -1.05 4.73 3.86 -1.23 0.00 -1.26 -4.56 105.19 105.67 3dki n GLY 71 Ca 0.01 -1.22 -0.29 0.00 0.00 0.00 0.00 46.02 44.51 3dki n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dki s ALA 72 N -3.32 2.49 -0.05 4.61 0.00 -0.36 -4.84 121.76 120.28 3dki s ALA 72 Ca 0.54 -0.44 0.06 0.00 0.00 0.00 0.00 51.96 52.12 3dki s ALA 72 Cb 0.46 -3.02 -0.01 0.00 0.00 0.00 0.00 23.12 20.54 3dki s ALA 72 CO 0.07 -1.63 -0.24 0.99 0.00 0.00 0.00 175.76 174.95 3dki s THR 73 N -3.37 2.14 -0.17 0.00 2.01 -0.51 -2.34 115.64 113.40 3dki s THR 73 Ca 0.61 -1.05 -0.07 0.00 0.31 0.00 0.00 61.69 61.49 3dki s THR 73 Cb -0.12 -1.77 -0.04 0.00 0.01 0.00 0.00 72.50 70.58 3dki s THR 73 CO 0.52 0.57 0.06 -0.63 -0.69 0.00 0.00 174.62 174.45 3dki s ILE 74 N -0.29 4.76 -0.11 1.82 1.01 0.52 -1.28 121.20 127.63 3dki s ILE 74 Ca 0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 60.65 60.60 3dki s ILE 74 Cb -0.13 -3.12 -0.02 0.00 0.01 0.00 0.00 42.46 39.20 3dki s ILE 74 CO 0.02 0.49 -0.10 -0.76 0.00 0.00 0.00 174.94 174.59 3dki s LEU 75 N 0.13 2.90 -0.11 2.97 2.01 0.28 -0.51 118.68 126.34 3dki s LEU 75 Ca 0.05 -0.22 -0.05 0.00 0.01 0.00 0.00 54.13 53.91 3dki s LEU 75 Cb -0.12 -1.65 0.05 0.00 0.01 0.00 0.00 46.19 44.48 3dki s LEU 75 CO 0.01 0.22 0.26 -0.70 1.01 0.00 0.00 176.35 177.15 3dki s GLU 76 N 0.02 0.20 -0.93 1.70 2.56 -0.78 -3.70 118.70 117.77 3dki s GLU 76 Ca -0.03 0.60 -0.23 0.00 0.00 0.00 0.00 54.97 55.31 3dki s GLU 76 Cb -0.14 -0.10 0.06 0.00 2.00 0.00 0.00 34.13 35.96 3dki s GLU 76 CO 0.04 -0.19 1.33 -1.25 -0.56 0.00 0.00 175.26 174.62 3dki s PRO 77 N 1.53 3.50 0.09 4.30 0.04 -1.26 -1.06 135.00 142.14 3dki s PRO 77 Ca -0.07 -1.09 -0.26 0.00 0.04 0.00 0.00 61.00 59.62 3dki s PRO 77 Cb -0.11 -5.01 0.07 0.00 0.04 0.00 0.00 34.50 29.49 3dki s PRO 77 CO -0.09 -2.09 0.64 -0.08 0.04 0.00 0.00 177.00 175.42 3dki s THR 78 N 4.59 0.00 -0.02 1.26 -1.32 -0.78 -4.90 115.64 114.48 3dki s THR 78 Ca 0.40 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.91 3dki s THR 78 Cb -0.03 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 70.00 3dki s THR 78 CO -0.05 0.00 0.92 -1.54 -2.21 0.00 0.00 174.62 171.74 3dki n SER 79 N 0.02 0.47 0.00 8.08 3.41 -1.26 -4.19 113.62 120.15 3dki n SER 79 Ca -0.17 -1.96 0.00 0.00 -0.26 0.00 0.00 58.87 56.48 3dki n SER 79 Cb 0.62 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 3dki n SER 79 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dki n GLY 80 N -0.25 4.97 0.33 5.00 0.00 -1.26 -4.79 105.19 109.20 3dki n GLY 80 Ca 0.02 -1.86 0.01 0.00 0.00 0.00 0.00 46.02 44.20 3dki n GLY 80 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3dki h ASN 81 N 0.00 0.73 -0.78 1.61 2.35 -1.99 -2.22 115.58 115.27 3dki h ASN 81 Ca 0.00 -0.03 -0.05 0.00 -0.55 0.00 0.00 56.30 55.67 3dki h ASN 81 Cb 0.00 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.15 3dki h ASN 81 CO 0.00 0.55 0.28 0.74 -1.65 0.00 0.00 177.43 177.34 3dki h THR 82 N 0.85 1.26 -0.45 2.81 2.02 -1.98 -0.27 112.91 117.15 3dki h THR 82 Ca 0.22 -0.87 -0.12 0.00 0.77 0.00 0.00 66.41 66.41 3dki h THR 82 Cb -0.06 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 66.71 3dki h THR 82 CO -0.04 0.35 -0.20 1.23 0.37 0.00 0.00 175.52 177.23 3dki h GLY 83 N 1.14 0.99 0.90 2.16 0.00 -1.76 0.42 103.07 106.92 3dki h GLY 83 Ca 0.25 -0.84 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 3dki h GLY 83 CO -0.01 0.77 0.08 -2.22 0.00 0.00 0.00 176.54 175.16 3dki h ILE 84 N 0.79 1.15 -0.27 2.60 2.04 -1.28 0.22 117.51 122.77 3dki h ILE 84 Ca 0.11 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.53 3dki h ILE 84 Cb 0.75 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 3dki h ILE 84 CO 0.06 0.14 0.17 0.28 0.00 0.00 0.00 178.15 178.80 3dki h SER 85 N 0.15 0.31 -0.10 1.72 0.02 -0.84 -1.86 113.55 112.95 3dki h SER 85 Ca 0.06 -0.02 -0.08 0.00 -0.84 0.00 0.00 61.79 60.91 3dki h SER 85 Cb 0.15 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 3dki h SER 85 CO -0.01 0.24 -0.16 -0.07 -1.14 0.00 0.00 176.83 175.70 3dki h LEU 86 N 0.35 0.47 -0.43 5.07 3.38 -0.06 -1.23 115.31 122.87 3dki h LEU 86 Ca 0.10 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3dki h LEU 86 Cb -0.02 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 3dki h LEU 86 CO -0.02 0.65 0.17 0.00 0.09 0.00 0.00 178.44 179.34 3dki h ALA 87 N 1.39 0.56 -0.03 1.53 0.00 -0.67 0.29 119.26 122.34 3dki h ALA 87 Ca 0.08 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3dki h ALA 87 Cb 0.54 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 3dki h ALA 87 CO 0.03 0.16 0.01 1.98 0.00 0.00 0.00 179.25 181.44 3dki h MET 88 N 0.55 0.04 -0.10 0.00 1.85 -1.18 -2.97 114.93 113.13 3dki h MET 88 Ca 0.14 -0.01 -0.13 0.00 -0.61 0.00 0.00 59.70 59.09 3dki h MET 88 Cb 0.19 -0.01 0.01 0.00 0.43 0.00 0.00 31.60 32.22 3dki h MET 88 CO -0.01 0.19 -0.45 0.00 -0.40 0.00 0.00 176.91 176.24 3dki h ALA 89 N 0.85 0.18 -0.19 0.39 0.00 -1.04 -2.43 119.26 117.03 3dki h ALA 89 Ca 0.01 -0.49 0.05 0.00 0.00 0.00 0.00 54.91 54.49 3dki h ALA 89 Cb 0.16 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 3dki h ALA 89 CO -0.00 0.33 -0.21 0.00 0.00 0.00 0.00 179.25 179.37 3dki h ALA 90 N 0.47 -0.12 -0.47 0.00 0.00 -0.54 -0.62 119.26 117.97 3dki h ALA 90 Ca -0.03 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3dki h ALA 90 Cb 1.09 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 19.30 3dki h ALA 90 CO 0.09 -0.65 0.25 -0.09 0.00 0.00 0.00 179.25 178.86 3dki h ARG 91 N -0.24 0.66 -0.31 0.00 9.65 -1.50 0.26 114.38 122.91 3dki h ARG 91 Ca 0.12 -0.08 -0.07 0.00 -1.10 0.00 0.00 59.98 58.85 3dki h ARG 91 Cb 0.42 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.86 3dki h ARG 91 CO -0.33 0.53 -0.09 -0.07 2.80 0.00 0.00 179.97 182.80 3dki h LEU 92 N 0.62 0.49 -0.60 3.80 3.38 -1.20 -2.80 115.31 118.99 3dki h LEU 92 Ca 0.17 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3dki h LEU 92 Cb 0.06 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.68 3dki h LEU 92 CO -0.03 0.63 -0.03 0.29 0.09 0.00 0.00 178.44 179.39 3dki n LYS 93 N -4.22 1.33 -0.12 1.13 5.02 -0.26 -4.94 118.16 116.11 3dki n LYS 93 Ca 0.01 -0.60 0.00 0.00 -2.02 0.00 0.00 58.31 55.69 3dki n LYS 93 Cb 0.30 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 3dki n LYS 93 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dki n GLY 94 N 1.15 0.93 3.73 0.72 0.00 -0.45 -5.04 105.19 106.25 3dki n GLY 94 Ca 0.19 -0.07 -0.25 0.00 0.00 0.00 0.00 46.02 45.90 3dki n GLY 94 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dki s TYR 95 N -2.00 2.96 0.17 1.61 2.02 0.78 -4.62 117.35 118.28 3dki s TYR 95 Ca 0.00 -0.11 -0.16 0.00 -0.37 0.00 0.00 57.07 56.43 3dki s TYR 95 Cb 0.00 -1.39 -0.07 0.00 -0.40 0.00 0.00 41.96 40.10 3dki s TYR 95 CO 0.00 0.54 0.61 0.50 -1.57 0.00 0.00 175.55 175.62 3dki s ARG 96 N -3.33 4.07 -0.09 -0.62 3.52 -0.99 -3.45 118.95 118.05 3dki s ARG 96 Ca 0.30 0.61 0.03 0.00 -0.13 0.00 0.00 55.73 56.54 3dki s ARG 96 Cb -0.09 -2.91 0.01 0.00 -1.56 0.00 0.00 34.95 30.41 3dki s ARG 96 CO 0.22 0.45 -0.17 -1.17 -0.81 0.00 0.00 175.30 173.81 3dki s LEU 97 N -1.98 1.84 -0.19 -0.88 2.96 -1.26 -0.36 118.68 118.81 3dki s LEU 97 Ca 0.40 -0.44 -0.03 0.00 -0.22 0.00 0.00 54.13 53.84 3dki s LEU 97 Cb -0.15 -1.13 -0.01 0.00 0.50 0.00 0.00 46.19 45.39 3dki s LEU 97 CO 0.20 0.07 -0.07 -0.63 -1.32 0.00 0.00 176.35 174.60 3dki s ILE 98 N 0.68 3.31 -0.14 6.68 1.01 0.34 -1.08 121.20 132.00 3dki s ILE 98 Ca -0.13 -0.53 -0.10 0.00 0.00 0.00 0.00 60.65 59.89 3dki s ILE 98 Cb -0.16 -2.47 -0.05 0.00 0.01 0.00 0.00 42.46 39.79 3dki s ILE 98 CO 0.03 0.46 0.20 0.00 0.00 0.00 0.00 174.94 175.64 3dki s VAL 100 N -0.32 3.56 0.11 0.00 1.01 -0.23 -1.32 120.40 123.21 3dki s VAL 100 Ca 0.14 -0.45 -0.09 0.00 0.00 0.00 0.00 61.98 61.59 3dki s VAL 100 Cb -0.13 -2.59 -0.00 0.00 0.00 0.00 0.00 36.38 33.66 3dki s VAL 100 CO 0.03 0.45 0.22 0.00 0.00 0.00 0.00 175.10 175.80 3dki s MET 101 N 0.99 0.93 0.55 2.72 0.23 -0.95 -1.86 119.30 121.90 3dki s MET 101 Ca 0.00 -1.01 -0.21 0.00 -1.03 0.00 0.00 55.69 53.44 3dki s MET 101 Cb -0.15 0.35 -0.05 0.00 -1.53 0.00 0.00 34.83 33.45 3dki s MET 101 CO 0.01 -0.31 1.24 -2.30 -2.03 0.00 0.00 175.02 171.63 3dki n PRO 102 N -0.10 1.48 0.23 3.16 -0.02 -1.26 -0.35 135.00 138.13 3dki n PRO 102 Ca -0.13 0.55 0.11 0.00 -2.02 0.00 0.00 63.50 62.01 3dki n PRO 102 Cb 0.63 -2.44 0.70 0.00 -0.02 0.00 0.00 33.50 32.37 3dki n PRO 102 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3dki h GLU 103 N 1.24 0.00 -1.06 -0.52 5.08 -1.69 -2.03 114.58 115.59 3dki h GLU 103 Ca -0.50 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.27 3dki h GLU 103 Cb 1.32 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 30.30 3dki h GLU 103 CO 0.56 0.00 0.76 0.27 -1.00 0.00 0.00 179.01 179.60 3dki n ASN 104 N -4.38 6.62 -4.78 1.42 0.23 -1.26 -4.95 115.26 108.16 3dki n ASN 104 Ca -0.01 -3.63 -0.37 0.00 -0.53 0.00 0.00 54.58 50.03 3dki n ASN 104 Cb 0.17 -0.95 -0.04 0.00 -2.08 0.00 0.00 39.78 36.88 3dki n ASN 104 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 3dki s THR 105 N -4.11 3.62 0.36 5.53 2.01 -0.77 -5.00 115.64 117.28 3dki s THR 105 Ca 0.58 1.32 -0.27 0.00 0.31 0.00 0.00 61.69 63.62 3dki s THR 105 Cb 0.46 -3.72 -0.12 0.00 0.01 0.00 0.00 72.50 69.14 3dki s THR 105 CO 0.02 0.08 1.28 -1.20 -0.69 0.00 0.00 174.62 174.11 3dki n SER 106 N 0.17 2.71 -0.37 3.53 7.64 -1.26 -4.88 113.62 121.16 3dki n SER 106 Ca 0.04 1.19 -0.00 0.00 1.01 0.00 0.00 58.87 61.10 3dki n SER 106 Cb 0.48 -1.49 0.14 0.00 -1.01 0.00 0.00 64.21 62.33 3dki n SER 106 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3dki h VAL 107 N 2.45 1.20 -0.26 0.44 2.07 -1.98 -1.91 116.25 118.26 3dki h VAL 107 Ca -0.46 -0.45 0.06 0.00 0.82 0.00 0.00 66.70 66.67 3dki h VAL 107 Cb 1.29 -0.21 -0.06 0.00 -1.52 0.00 0.00 31.29 30.79 3dki h VAL 107 CO 0.62 0.24 -0.13 -0.33 0.02 0.00 0.00 177.57 177.99 3dki h GLU 108 N 1.30 -0.09 -0.17 1.57 5.08 -1.99 0.31 114.58 120.58 3dki h GLU 108 Ca 0.39 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.77 3dki h GLU 108 Cb -0.05 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 3dki h GLU 108 CO -0.11 -0.06 0.08 0.00 -1.00 0.00 0.00 179.01 177.92 3dki h ARG 109 N -0.10 0.17 -0.72 2.33 3.08 -1.81 -2.45 114.38 114.89 3dki h ARG 109 Ca 0.14 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.20 3dki h ARG 109 Cb 0.31 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.27 3dki h ARG 109 CO -0.32 0.11 0.46 -0.09 -1.07 0.00 0.00 179.97 179.06 3dki h ARG 110 N 0.18 0.89 0.00 0.04 2.43 -0.79 -2.61 114.38 114.52 3dki h ARG 110 Ca 0.07 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 59.08 3dki h ARG 110 Cb 0.02 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.35 3dki h ARG 110 CO -0.05 0.59 -0.53 1.96 -1.51 0.00 0.00 179.97 180.42 3dki h GLN 111 N 0.92 0.00 -0.18 0.20 4.20 -0.27 -2.29 115.11 117.69 3dki h GLN 111 Ca 0.28 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.96 3dki h GLN 111 Cb -0.03 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 3dki h GLN 111 CO -0.09 0.53 0.00 1.25 -0.67 0.00 0.00 178.83 179.86 3dki h LEU 112 N 0.00 0.31 -0.27 1.46 6.46 -1.07 -1.77 115.31 120.43 3dki h LEU 112 Ca -0.01 -0.30 0.03 0.00 -0.12 0.00 0.00 57.88 57.48 3dki h LEU 112 Cb 0.99 -0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 40.80 3dki h LEU 112 CO 0.07 0.54 0.10 -0.07 -0.62 0.00 0.00 178.44 178.46 3dki h LEU 113 N 0.07 0.12 -1.09 2.25 3.38 -1.39 -2.66 115.31 115.99 3dki h LEU 113 Ca 0.05 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.06 3dki h LEU 113 Cb 0.38 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.09 3dki h LEU 113 CO 0.01 0.10 0.62 -0.33 0.09 0.00 0.00 178.44 178.93 3dki h GLU 114 N 0.22 1.23 -0.00 1.13 5.08 -1.39 -2.12 114.58 118.73 3dki h GLU 114 Ca 0.12 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.32 3dki h GLU 114 Cb 0.08 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 3dki h GLU 114 CO -0.12 0.81 -0.41 1.37 -1.00 0.00 0.00 179.01 179.67 3dki h LEU 115 N 1.26 0.01 -0.00 1.33 -0.00 -1.02 -1.41 115.31 115.47 3dki h LEU 115 Ca 0.34 -0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.22 3dki h LEU 115 Cb -0.14 -0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.51 3dki h LEU 115 CO -0.07 0.41 -0.00 -1.22 -0.00 0.00 0.00 178.44 177.56 3dki n TYR 116 N -4.05 0.00 -0.32 0.17 4.01 -0.89 -4.92 117.16 111.17 3dki n TYR 116 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 3dki n TYR 116 Cb 0.44 -0.11 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 3dki n TYR 116 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3dki n GLY 117 N 1.11 0.83 3.76 2.72 0.00 -0.53 -4.59 105.19 108.50 3dki n GLY 117 Ca 0.20 -0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 3dki n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dki s ALA 118 N -2.00 3.42 0.30 4.61 0.00 -0.85 -4.71 121.76 122.53 3dki s ALA 118 Ca 0.00 1.02 -0.11 0.00 0.00 0.00 0.00 51.96 52.88 3dki s ALA 118 Cb 0.00 -3.38 -0.07 0.00 0.00 0.00 0.00 23.12 19.67 3dki s ALA 118 CO 0.00 -0.34 0.65 -1.14 0.00 0.00 0.00 175.76 174.92 3dki s GLN 119 N -1.62 3.83 -0.07 0.00 2.00 -0.24 -4.26 119.66 119.30 3dki s GLN 119 Ca 0.47 0.39 0.03 0.00 -2.00 0.00 0.00 55.36 54.25 3dki s GLN 119 Cb -0.34 -2.53 0.01 0.00 0.80 0.00 0.00 33.01 30.94 3dki s GLN 119 CO 0.45 0.19 -0.17 0.42 -0.50 0.00 0.00 175.29 175.68 3dki s ILE 120 N -2.01 1.50 -0.14 -2.34 1.01 -1.26 -0.77 121.20 117.19 3dki s ILE 120 Ca 0.50 -0.71 0.02 0.00 0.00 0.00 0.00 60.65 60.46 3dki s ILE 120 Cb -0.11 -1.32 0.00 0.00 0.01 0.00 0.00 42.46 41.04 3dki s ILE 120 CO 0.23 0.44 -0.20 -0.63 0.00 0.00 0.00 174.94 174.78 3dki s ILE 121 N 0.44 2.26 0.02 2.92 1.01 -0.44 -4.96 121.20 122.44 3dki s ILE 121 Ca -0.14 -0.92 -0.20 0.00 0.00 0.00 0.00 60.65 59.39 3dki s ILE 121 Cb -0.16 -1.91 -0.06 0.00 0.01 0.00 0.00 42.46 40.34 3dki s ILE 121 CO 0.05 0.54 0.60 -0.36 0.00 0.00 0.00 174.94 175.77 3dki s PHE 122 N 0.75 3.72 0.31 3.97 0.40 -1.26 -2.25 117.98 123.62 3dki s PHE 122 Ca -0.08 1.23 0.07 0.00 -0.60 0.00 0.00 56.93 57.55 3dki s PHE 122 Cb -0.16 -2.59 -0.03 0.00 0.51 0.00 0.00 43.02 40.75 3dki s PHE 122 CO -0.00 0.41 0.28 -1.54 0.70 0.00 0.00 175.22 175.06 3dki s SER 123 N -0.42 5.44 0.07 1.36 1.04 0.52 -4.88 113.70 116.83 3dki s SER 123 Ca 0.31 -0.38 -0.14 0.00 0.48 0.00 0.00 55.95 56.22 3dki s SER 123 Cb -0.19 -1.15 -0.03 0.00 0.10 0.00 0.00 66.02 64.75 3dki s SER 123 CO 0.18 -0.25 0.77 0.00 0.98 0.00 0.00 173.24 174.92 3dki n ALA 124 N -1.33 -0.29 0.00 5.32 0.00 -1.26 -2.21 120.51 120.74 3dki n ALA 124 Ca -0.04 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.79 3dki n ALA 124 Cb 0.59 -0.02 0.00 0.00 0.00 0.00 0.00 19.45 20.01 3dki n ALA 124 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3dki n THR 131 N -4.35 0.00 -0.32 0.00 -1.04 -1.26 -4.58 114.28 102.73 3dki n THR 131 Ca 0.01 0.00 0.05 0.00 -2.04 0.00 0.00 64.05 62.07 3dki n THR 131 Cb 0.12 0.00 0.21 0.00 -1.82 0.00 0.00 70.33 68.83 3dki n THR 131 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3dki h ALA 132 N 0.00 1.33 0.00 2.41 0.00 -1.93 -0.66 119.26 120.41 3dki h ALA 132 Ca 0.00 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3dki h ALA 132 Cb 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3dki h ALA 132 CO 0.00 0.11 -0.00 0.28 0.00 0.00 0.00 179.25 179.64 3dki h VAL 133 N 0.84 1.33 -0.59 0.00 2.07 -1.90 -1.78 116.25 116.22 3dki h VAL 133 Ca 0.45 -0.97 0.05 0.00 0.82 0.00 0.00 66.70 67.05 3dki h VAL 133 Cb 0.47 1.98 -0.05 0.00 -1.52 0.00 0.00 31.29 32.17 3dki h VAL 133 CO -0.27 0.25 0.32 0.00 0.02 0.00 0.00 177.57 177.88 3dki h ALA 134 N 0.58 0.77 -0.40 1.67 0.00 -1.97 -2.04 119.26 117.87 3dki h ALA 134 Ca -0.00 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 3dki h ALA 134 Cb 0.41 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3dki h ALA 134 CO 0.00 -0.01 -0.17 0.00 0.00 0.00 0.00 179.25 179.07 3dki h THR 135 N 0.60 1.26 -0.98 0.00 1.03 -1.09 -1.02 112.91 112.72 3dki h THR 135 Ca 0.26 -1.24 0.01 0.00 -0.01 0.00 0.00 66.41 65.43 3dki h THR 135 Cb 0.15 1.14 -0.05 0.00 -1.07 0.00 0.00 68.15 68.31 3dki h THR 135 CO -0.16 0.42 0.65 0.00 -0.01 0.00 0.00 175.52 176.41 3dki h ALA 136 N 1.14 1.32 -0.35 0.00 0.00 -1.05 -0.09 119.26 120.22 3dki h ALA 136 Ca 0.10 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 3dki h ALA 136 Cb 0.65 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 3dki h ALA 136 CO 0.05 0.63 -0.38 -0.22 0.00 0.00 0.00 179.25 179.33 3dki h LYS 137 N 1.31 0.87 -0.13 0.00 3.64 -0.73 0.13 116.57 121.66 3dki h LYS 137 Ca 0.36 -0.47 -0.00 0.00 -1.27 0.00 0.00 60.65 59.27 3dki h LYS 137 Cb -0.12 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 3dki h LYS 137 CO -0.09 1.12 0.08 0.93 -2.27 0.00 0.00 179.45 179.22 3dki h GLU 138 N 0.67 0.17 -0.24 1.90 5.08 -1.06 -1.61 114.58 119.49 3dki h GLU 138 Ca 0.05 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.44 3dki h GLU 138 Cb 0.97 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.14 3dki h GLU 138 CO 0.09 0.15 -0.02 -0.07 -1.00 0.00 0.00 179.01 178.16 3dki h LEU 139 N 0.14 -0.13 -1.74 1.33 3.38 -0.79 -2.39 115.31 115.11 3dki h LEU 139 Ca 0.05 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.09 3dki h LEU 139 Cb 0.02 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 3dki h LEU 139 CO -0.01 -0.04 0.19 0.00 0.09 0.00 0.00 178.44 178.68 3dki h ALA 140 N 1.21 1.84 0.00 1.53 0.00 -0.67 -2.35 119.26 120.84 3dki h ALA 140 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3dki h ALA 140 Cb 0.16 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3dki h ALA 140 CO -0.21 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.17 3dki n ALA 141 N -2.50 1.92 0.50 0.00 0.00 -0.62 -2.97 120.51 116.85 3dki n ALA 141 Ca 0.02 -0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.52 3dki n ALA 141 Cb 0.10 -1.33 0.30 0.00 0.00 0.00 0.00 19.45 18.52 3dki n ALA 141 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3dki h THR 142 N 0.00 0.00 -3.00 0.00 1.35 -1.40 -3.45 112.91 106.42 3dki h THR 142 Ca 0.00 -0.63 -0.24 0.00 -0.55 0.00 0.00 66.41 65.00 3dki h THR 142 Cb 0.36 1.55 -0.33 0.00 -1.73 0.00 0.00 68.15 68.00 3dki h THR 142 CO 0.00 0.00 -0.56 0.21 -0.25 0.00 0.00 175.52 174.92 3dki s ASN 143 N -4.93 0.28 0.61 5.36 3.84 -1.16 -5.01 114.94 113.94 3dki s ASN 143 Ca 0.09 0.48 0.41 0.00 0.21 0.00 0.00 52.86 54.04 3dki s ASN 143 Cb 0.11 0.47 2.17 0.00 -0.55 0.00 0.00 41.25 43.44 3dki s ASN 143 CO 0.64 -0.22 2.25 1.55 -2.79 0.00 0.00 177.10 178.53 3dki h PRO 144 N 7.97 0.00 -0.20 0.43 0.13 -1.87 -1.50 132.00 136.95 3dki h PRO 144 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 3dki h PRO 144 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 3dki h PRO 144 CO 0.22 0.00 0.00 0.45 -0.23 0.00 0.00 178.00 178.44 3dki n SER 145 N -2.97 2.55 -4.53 1.44 2.88 -1.26 -4.83 113.62 106.90 3dki n SER 145 Ca -0.02 -1.84 -0.34 0.00 -1.33 0.00 0.00 58.87 55.33 3dki n SER 145 Cb 0.09 -0.13 -0.11 0.00 -0.75 0.00 0.00 64.21 63.31 3dki n SER 145 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 3dki s TRP 146 N -1.75 3.10 -0.05 0.66 0.52 -0.57 -1.43 118.94 119.43 3dki s TRP 146 Ca 0.35 -0.21 0.02 0.00 0.02 0.00 0.00 56.10 56.27 3dki s TRP 146 Cb 0.20 -2.02 0.02 0.00 -1.15 0.00 0.00 33.47 30.52 3dki s TRP 146 CO 0.30 -0.01 -0.07 0.08 0.02 0.00 0.00 176.95 177.27 3dki s VAL 147 N 0.47 0.69 -0.29 4.03 1.01 -0.40 -4.76 120.40 121.15 3dki s VAL 147 Ca -0.01 -0.23 -0.12 0.00 0.00 0.00 0.00 61.98 61.61 3dki s VAL 147 Cb -0.14 -0.68 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 3dki s VAL 147 CO 0.02 0.25 0.25 -0.32 0.00 0.00 0.00 175.10 175.30 3dki s MET 148 N 0.75 3.90 0.06 2.72 1.75 -1.26 -0.56 119.30 126.66 3dki s MET 148 Ca -0.11 -0.27 -0.15 0.00 -1.25 0.00 0.00 55.69 53.91 3dki s MET 148 Cb -0.14 -3.68 -0.25 0.00 2.84 0.00 0.00 34.83 33.59 3dki s MET 148 CO 0.01 -0.25 1.15 -0.07 -0.65 0.00 0.00 175.02 175.21 3dki h LEU 149 N 8.46 0.87 -2.56 4.11 3.38 -1.98 -3.49 115.31 124.09 3dki h LEU 149 Ca -0.34 -0.77 0.00 0.00 0.09 0.00 0.00 57.88 56.86 3dki h LEU 149 Cb 1.18 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.66 3dki h LEU 149 CO 0.59 1.54 -0.25 0.00 0.09 0.00 0.00 178.44 180.41 3dki n TYR 150 N -3.87 -2.11 -0.24 1.13 9.36 -1.26 -4.52 117.16 115.66 3dki n TYR 150 Ca -0.12 0.84 0.19 0.00 3.32 0.00 0.00 57.90 62.13 3dki n TYR 150 Cb 0.90 -3.11 0.51 0.00 -0.63 0.00 0.00 39.34 37.02 3dki n TYR 150 CO 0.00 0.00 0.00 -0.56 0.22 0.00 0.00 176.86 176.52 3dki h GLN 151 N 1.06 0.39 0.00 2.98 3.07 -1.95 -1.26 115.11 119.40 3dki h GLN 151 Ca 0.00 -0.02 -0.00 0.00 0.09 0.00 0.00 58.65 58.72 3dki h GLN 151 Cb 0.69 -0.09 -0.00 0.00 0.08 0.00 0.00 27.48 28.16 3dki h GLN 151 CO 0.13 0.26 -0.00 1.88 0.09 0.00 0.00 178.83 181.19 3dki h TYR 152 N 0.40 0.00 0.00 0.06 0.05 -1.92 -3.30 116.97 112.26 3dki h TYR 152 Ca 0.46 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.24 3dki h TYR 152 Cb 1.15 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.89 3dki h TYR 152 CO -0.00 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.52 3dki n GLY 153 N 0.24 -0.51 3.63 3.88 0.00 -0.64 -3.36 105.19 108.42 3dki n GLY 153 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 3dki n GLY 153 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3dki s ASN 154 N -0.07 6.68 0.56 1.61 3.84 -0.57 -4.87 114.94 122.12 3dki s ASN 154 Ca 0.00 0.82 0.36 0.00 0.21 0.00 0.00 52.86 54.25 3dki s ASN 154 Cb 0.00 -2.38 1.64 0.00 -0.55 0.00 0.00 41.25 39.95 3dki s ASN 154 CO 0.00 -0.46 2.07 -0.65 -2.79 0.00 0.00 177.10 175.27 3dki h PRO 155 N 7.85 0.00 -0.11 0.43 0.11 -1.92 -1.23 132.00 137.13 3dki h PRO 155 Ca -0.25 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.89 3dki h PRO 155 Cb 1.11 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 3dki h PRO 155 CO 0.83 0.00 0.12 0.00 -0.21 0.00 0.00 178.00 178.73 3dki h ALA 156 N 2.02 1.74 0.84 -0.75 0.00 -1.92 0.52 119.26 121.72 3dki h ALA 156 Ca 0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3dki h ALA 156 Cb 0.35 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.16 3dki h ALA 156 CO 0.00 -0.17 -0.41 -0.97 0.00 0.00 0.00 179.25 177.70 3dki h ASN 157 N 0.00 -0.96 -0.49 0.00 -0.73 -1.49 -2.10 115.58 109.82 3dki h ASN 157 Ca 0.05 0.03 0.07 0.00 1.87 0.00 0.00 56.30 58.32 3dki h ASN 157 Cb 0.29 0.25 -0.06 0.00 0.27 0.00 0.00 38.32 39.07 3dki h ASN 157 CO -0.00 -0.60 0.16 0.74 -0.37 0.00 0.00 177.43 177.36 3dki h THR 158 N -1.30 0.82 -0.70 -3.57 2.02 -1.57 -2.12 112.91 106.49 3dki h THR 158 Ca -0.12 -0.11 0.16 0.00 0.77 0.00 0.00 66.41 67.11 3dki h THR 158 Cb 0.87 0.46 -0.04 0.00 -1.74 0.00 0.00 68.15 67.70 3dki h THR 158 CO 0.19 0.06 0.48 0.44 0.37 0.00 0.00 175.52 177.06 3dki h ASP 159 N 0.33 0.24 0.07 4.18 5.19 -0.92 -1.80 116.42 123.71 3dki h ASP 159 Ca 0.23 0.01 -0.07 0.00 -0.62 0.00 0.00 57.03 56.59 3dki h ASP 159 Cb 0.26 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 39.72 3dki h ASP 159 CO -0.25 0.12 -0.21 0.77 -3.12 0.00 0.00 179.24 176.55 3dki h SER 160 N 0.25 0.25 0.23 6.45 4.64 -0.65 -0.04 113.55 124.68 3dki h SER 160 Ca 0.34 -0.07 -0.35 0.00 -0.47 0.00 0.00 61.79 61.25 3dki h SER 160 Cb 0.98 -0.07 0.02 0.00 -0.31 0.00 0.00 62.40 63.03 3dki h SER 160 CO -0.08 0.47 -1.66 0.45 -0.87 0.00 0.00 176.83 175.15 3dki h HIS 161 N 0.24 0.79 -0.43 4.77 3.86 -1.43 -1.13 115.15 121.82 3dki h HIS 161 Ca 0.04 -0.58 0.07 0.00 -1.16 0.00 0.00 60.37 58.74 3dki h HIS 161 Cb 0.51 -0.03 -0.06 0.00 1.06 0.00 0.00 27.41 28.89 3dki h HIS 161 CO 0.01 1.63 0.10 -0.92 0.86 0.00 0.00 177.93 179.60 3dki h TYR 162 N 0.12 0.16 0.00 2.45 3.20 -1.22 0.16 116.97 121.85 3dki h TYR 162 Ca -0.31 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.58 3dki h TYR 162 Cb 2.12 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 40.38 3dki h TYR 162 CO 0.11 0.02 -0.56 0.00 -1.64 0.00 0.00 178.16 176.09 3dki n GLY 164 N 1.44 -0.05 0.12 0.00 0.00 -0.43 -4.75 105.19 101.52 3dki n GLY 164 Ca 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 3dki n GLY 164 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3dki h THR 165 N 0.00 0.82 0.17 2.61 2.02 -1.48 -2.48 112.91 114.58 3dki h THR 165 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 3dki h THR 165 Cb 0.00 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 3dki h THR 165 CO 0.00 0.00 -0.27 1.23 0.37 0.00 0.00 175.52 176.85 3dki h GLY 166 N -0.14 -1.08 -0.19 2.16 0.00 -0.91 -2.09 103.07 100.82 3dki h GLY 166 Ca 0.02 0.51 0.19 0.00 0.00 0.00 0.00 47.33 48.05 3dki h GLY 166 CO -0.06 -0.34 0.23 -2.55 0.00 0.00 0.00 176.54 173.82 3dki h PRO 167 N -0.46 0.28 -0.86 4.80 0.11 -1.74 -0.53 132.00 133.60 3dki h PRO 167 Ca -0.02 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 3dki h PRO 167 Cb 0.42 -0.06 -0.04 0.00 0.11 0.00 0.00 31.00 31.43 3dki h PRO 167 CO -0.09 0.18 0.53 0.93 -0.21 0.00 0.00 178.00 179.35 3dki h GLU 168 N 0.28 1.15 -0.21 1.05 5.08 -1.31 -0.03 114.58 120.60 3dki h GLU 168 Ca 0.48 -0.10 -0.05 0.00 -1.00 0.00 0.00 59.36 58.69 3dki h GLU 168 Cb 0.87 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 3dki h GLU 168 CO -0.55 0.80 -0.06 -0.07 -1.00 0.00 0.00 179.01 178.13 3dki h LEU 169 N 1.17 0.41 -1.24 1.33 3.38 -0.51 -1.72 115.31 118.14 3dki h LEU 169 Ca 0.31 -0.38 0.02 0.00 0.09 0.00 0.00 57.88 57.92 3dki h LEU 169 Cb -0.07 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 3dki h LEU 169 CO -0.06 0.69 0.52 0.25 0.09 0.00 0.00 178.44 179.93 3dki h LEU 170 N 0.13 0.88 -0.37 1.67 5.85 -0.92 0.30 115.31 122.85 3dki h LEU 170 Ca 0.05 -0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.67 3dki h LEU 170 Cb 0.52 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 3dki h LEU 170 CO 0.02 0.63 -0.08 0.00 -0.34 0.00 0.00 178.44 178.67 3dki h ALA 171 N 1.52 0.51 0.00 1.25 0.00 -0.91 -2.79 119.26 118.85 3dki h ALA 171 Ca 0.29 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3dki h ALA 171 Cb -0.08 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 3dki h ALA 171 CO -0.07 0.36 -0.55 -0.44 0.00 0.00 0.00 179.25 178.55 3dki h ASP 172 N 0.51 0.00 -1.85 0.00 3.32 -0.93 -3.40 116.42 114.08 3dki h ASP 172 Ca 0.10 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.64 3dki h ASP 172 Cb 0.59 0.00 -0.38 0.00 0.22 0.00 0.00 39.33 39.76 3dki h ASP 172 CO 0.03 0.07 -1.10 -0.11 -1.72 0.00 0.00 179.24 176.42 3dki n LEU 173 N -2.92 0.23 0.32 1.55 7.94 0.10 -4.94 117.00 119.29 3dki n LEU 173 Ca 0.01 -4.73 0.20 0.00 -1.11 0.00 0.00 56.01 50.38 3dki n LEU 173 Cb 0.57 0.69 1.05 0.00 0.53 0.00 0.00 43.42 46.26 3dki n LEU 173 CO 0.38 2.16 1.16 1.55 -1.11 0.00 0.00 177.39 181.53 3dki h PRO 174 N 3.56 0.00 -0.50 1.96 0.13 -1.69 -0.59 132.00 134.87 3dki h PRO 174 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 3dki h PRO 174 Cb 0.93 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.06 3dki h PRO 174 CO 0.46 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.38 3dki n GLU 175 N -3.13 2.03 -1.78 0.86 0.00 -1.26 -4.97 120.64 112.39 3dki n GLU 175 Ca -0.02 -1.16 -0.41 0.00 0.00 0.00 0.00 57.16 55.56 3dki n GLU 175 Cb 0.19 -1.45 -0.01 0.00 0.00 0.00 0.00 31.44 30.18 3dki n GLU 175 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.13 175.63 3dki s ILE 176 N -1.64 2.04 -0.03 3.84 2.07 -0.23 -4.50 121.20 122.75 3dki s ILE 176 Ca 0.21 0.04 0.04 0.00 -1.41 0.00 0.00 60.65 59.53 3dki s ILE 176 Cb 0.13 -3.02 -0.06 0.00 0.13 0.00 0.00 42.46 39.63 3dki s ILE 176 CO 0.11 0.01 0.05 0.35 -1.91 0.00 0.00 174.94 173.55 3dki n THR 177 N 1.36 0.16 -3.81 4.00 -2.24 -0.21 -4.84 114.28 108.71 3dki n THR 177 Ca 0.05 -0.14 -0.13 0.00 -2.27 0.00 0.00 64.05 61.55 3dki n THR 177 Cb 0.38 -0.30 -0.14 0.00 -2.10 0.00 0.00 70.33 68.17 3dki n THR 177 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3dki s HIS 178 N -2.20 -0.07 -0.17 4.78 3.76 -1.11 -1.23 115.29 119.05 3dki s HIS 178 Ca -0.02 0.23 -0.03 0.00 -0.15 0.00 0.00 55.06 55.09 3dki s HIS 178 Cb 0.02 -0.06 -0.02 0.00 1.11 0.00 0.00 32.58 33.63 3dki s HIS 178 CO 0.18 -0.07 -0.07 0.12 -0.85 0.00 0.00 174.74 174.05 3dki s PHE 179 N 0.52 2.93 -0.11 1.40 5.36 0.11 -0.72 117.98 127.48 3dki s PHE 179 Ca -0.04 -0.65 0.03 0.00 -0.96 0.00 0.00 56.93 55.31 3dki s PHE 179 Cb -0.06 -1.98 -0.00 0.00 -0.34 0.00 0.00 43.02 40.64 3dki s PHE 179 CO -0.02 -0.29 -0.22 0.08 -1.46 0.00 0.00 175.22 173.32 3dki s VAL 180 N 0.79 2.25 0.20 3.12 1.01 0.77 -0.17 120.40 128.38 3dki s VAL 180 Ca -0.03 -0.95 -0.11 0.00 0.00 0.00 0.00 61.98 60.90 3dki s VAL 180 Cb -0.15 -1.88 -0.00 0.00 0.00 0.00 0.00 36.38 34.35 3dki s VAL 180 CO 0.02 0.55 0.39 0.00 0.00 0.00 0.00 175.10 176.05 3dki s ALA 181 N 0.41 -0.17 0.45 5.51 0.00 -0.80 -1.97 121.76 125.19 3dki s ALA 181 Ca -0.16 -0.83 -0.17 0.00 0.00 0.00 0.00 51.96 50.80 3dki s ALA 181 Cb -0.17 0.97 -0.09 0.00 0.00 0.00 0.00 23.12 23.83 3dki s ALA 181 CO 0.07 -0.75 0.92 0.20 0.00 0.00 0.00 175.76 176.20 3dki s GLY 182 N -2.98 2.19 -0.36 0.00 0.00 -1.26 -0.35 107.32 104.56 3dki s GLY 182 Ca 0.19 0.20 -0.07 0.00 0.00 0.00 0.00 44.72 45.04 3dki s GLY 182 CO 0.04 0.46 0.15 -2.27 0.00 0.00 0.00 173.10 171.47 3dki s LEU 183 N -3.61 4.61 0.00 0.66 0.20 -0.93 -4.71 118.68 114.90 3dki s LEU 183 Ca 0.59 -1.32 0.00 0.00 0.69 0.00 0.00 54.13 54.08 3dki s LEU 183 Cb -0.10 -1.89 0.00 0.00 -0.43 0.00 0.00 46.19 43.77 3dki s LEU 183 CO 0.23 -0.40 0.00 0.61 -0.29 0.00 0.00 176.35 176.50 3dki n GLY 184 N 4.81 0.87 0.23 7.98 0.00 -1.26 -4.85 105.19 112.97 3dki n GLY 184 Ca -0.11 -0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.07 3dki n GLY 184 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3dki h THR 185 N 0.00 0.00 0.00 2.61 1.35 -1.93 -3.47 112.91 111.47 3dki h THR 185 Ca 0.00 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 3dki h THR 185 Cb 0.00 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 67.67 3dki h THR 185 CO 0.00 0.00 0.00 0.35 -0.25 0.00 0.00 175.52 175.62 3dki n THR 186 N -2.76 0.00 -0.21 6.82 -2.24 -1.26 -4.41 114.28 110.22 3dki n THR 186 Ca 0.01 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.71 3dki n THR 186 Cb 0.26 -0.01 0.03 0.00 -2.10 0.00 0.00 70.33 68.50 3dki n THR 186 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3dki h GLY 187 N 0.00 0.95 0.92 3.38 0.00 -1.91 0.48 103.07 106.88 3dki h GLY 187 Ca 0.00 -0.54 0.01 0.00 0.00 0.00 0.00 47.33 46.80 3dki h GLY 187 CO 0.00 0.51 0.02 -0.84 0.00 0.00 0.00 176.54 176.22 3dki h THR 188 N 0.81 0.97 -0.25 4.70 2.02 -1.90 -1.05 112.91 118.21 3dki h THR 188 Ca 0.19 -0.02 -0.06 0.00 0.77 0.00 0.00 66.41 67.29 3dki h THR 188 Cb 0.24 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 3dki h THR 188 CO -0.01 0.01 -0.07 -0.07 0.37 0.00 0.00 175.52 175.75 3dki h LEU 189 N 0.06 0.50 -0.44 2.58 3.38 -1.81 -1.05 115.31 118.52 3dki h LEU 189 Ca 0.04 -0.37 -0.10 0.00 0.09 0.00 0.00 57.88 57.54 3dki h LEU 189 Cb 0.03 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3dki h LEU 189 CO -0.05 0.76 -0.10 0.24 0.09 0.00 0.00 178.44 179.38 3dki h MET 190 N 0.23 0.85 0.03 1.13 2.86 -0.89 0.10 114.93 119.24 3dki h MET 190 Ca 0.06 -0.32 -0.00 0.00 -2.06 0.00 0.00 59.70 57.38 3dki h MET 190 Cb 0.54 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.15 3dki h MET 190 CO 0.03 0.95 -0.01 0.78 1.06 0.00 0.00 176.91 179.72 3dki h GLY 191 N 0.68 -0.04 0.91 8.32 0.00 -1.23 -2.22 103.07 109.50 3dki h GLY 191 Ca 0.11 0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.43 3dki h GLY 191 CO 0.04 -0.01 0.09 -0.84 0.00 0.00 0.00 176.54 175.82 3dki h THR 192 N -0.85 1.22 -0.31 4.70 2.02 -1.29 -2.74 112.91 115.65 3dki h THR 192 Ca -0.00 -0.72 0.02 0.00 0.77 0.00 0.00 66.41 66.47 3dki h THR 192 Cb 0.73 1.05 -0.03 0.00 -1.74 0.00 0.00 68.15 68.16 3dki h THR 192 CO 0.01 0.24 0.16 1.23 0.37 0.00 0.00 175.52 177.53 3dki h GLY 193 N 0.39 0.42 1.00 2.16 0.00 -0.89 -0.50 103.07 105.65 3dki h GLY 193 Ca 0.11 -0.11 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 3dki h GLY 193 CO -0.00 0.09 0.19 -0.09 0.00 0.00 0.00 176.54 176.73 3dki h ARG 194 N 0.33 0.90 -0.24 4.80 2.43 -1.41 -0.99 114.38 120.20 3dki h ARG 194 Ca 0.13 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 3dki h ARG 194 Cb 0.04 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 3dki h ARG 194 CO -0.09 0.81 0.13 0.35 -1.51 0.00 0.00 179.97 179.66 3dki h PHE 195 N 0.82 0.33 -0.25 2.20 3.57 -1.16 -2.58 116.94 119.87 3dki h PHE 195 Ca 0.19 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.59 3dki h PHE 195 Cb 0.28 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 3dki h PHE 195 CO 0.02 0.29 -0.21 -0.07 -2.23 0.00 0.00 178.31 176.10 3dki h LEU 196 N 0.28 0.44 -0.94 0.59 3.38 -0.92 -2.54 115.31 115.60 3dki h LEU 196 Ca 0.08 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 3dki h LEU 196 Cb 0.07 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3dki h LEU 196 CO -0.01 0.67 -0.29 0.03 0.09 0.00 0.00 178.44 178.92 3dki h ARG 197 N 0.40 0.42 0.00 1.13 2.47 -1.12 0.34 114.38 118.03 3dki h ARG 197 Ca 0.07 -0.17 0.00 0.00 -1.26 0.00 0.00 59.98 58.62 3dki h ARG 197 Cb 0.60 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.90 3dki h ARG 197 CO 0.04 0.68 0.00 0.39 0.56 0.00 0.00 179.97 181.64 3dki n GLU 198 N -4.10 0.07 0.00 0.04 1.02 -0.97 -4.28 120.64 112.41 3dki n GLU 198 Ca -0.01 0.19 0.00 0.00 -0.02 0.00 0.00 57.16 57.32 3dki n GLU 198 Cb 0.42 -1.60 0.00 0.00 -0.02 0.00 0.00 31.44 30.24 3dki n GLU 198 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3dki n HIS 199 N -1.72 0.00 -4.04 -0.32 8.25 -1.00 -5.03 115.22 111.36 3dki n HIS 199 Ca 0.05 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.16 3dki n HIS 199 Cb 0.28 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.28 3dki n HIS 199 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3dki s VAL 200 N -1.71 4.62 0.11 1.59 1.01 0.12 -5.02 120.40 121.12 3dki s VAL 200 Ca 0.00 -0.09 -0.28 0.00 0.00 0.00 0.00 61.98 61.60 3dki s VAL 200 Cb 0.00 -3.08 -0.09 0.00 0.00 0.00 0.00 36.38 33.21 3dki s VAL 200 CO 0.00 0.45 1.62 0.00 0.00 0.00 0.00 175.10 177.17 3dki h ALA 201 N 6.86 -0.55 -0.14 5.51 0.00 -1.87 -3.20 119.26 125.86 3dki h ALA 201 Ca -0.36 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.36 3dki h ALA 201 Cb 1.17 0.51 -0.15 0.00 0.00 0.00 0.00 17.79 19.32 3dki h ALA 201 CO 0.68 -0.87 -0.67 -1.71 0.00 0.00 0.00 179.25 176.68 3dki n ASN 202 N -5.42 2.13 -4.77 0.00 2.85 -1.26 -5.07 115.26 103.72 3dki n ASN 202 Ca -0.07 -3.49 -0.40 0.00 -0.11 0.00 0.00 54.58 50.51 3dki n ASN 202 Cb 0.33 -0.46 0.01 0.00 1.24 0.00 0.00 39.78 40.89 3dki n ASN 202 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 3dki s VAL 203 N -2.96 2.24 -0.13 3.44 0.11 -1.21 -4.99 120.40 116.90 3dki s VAL 203 Ca 0.39 0.22 -0.06 0.00 -2.93 0.00 0.00 61.98 59.61 3dki s VAL 203 Cb 0.38 -3.13 -0.04 0.00 -1.53 0.00 0.00 36.38 32.06 3dki s VAL 203 CO -0.07 0.04 0.08 -0.54 -3.33 0.00 0.00 175.10 171.28 3dki s LYS 204 N -2.28 3.44 -0.30 1.54 1.02 -0.37 -4.95 119.74 117.84 3dki s LYS 204 Ca 0.57 -0.26 -0.07 0.00 0.02 0.00 0.00 55.97 56.23 3dki s LYS 204 Cb -0.43 -3.08 0.01 0.00 -0.52 0.00 0.00 37.83 33.81 3dki s LYS 204 CO 0.56 0.63 0.09 0.42 -0.92 0.00 0.00 175.35 176.12 3dki s ILE 205 N -0.64 3.96 -0.17 2.17 -1.09 -1.26 -0.71 121.20 123.46 3dki s ILE 205 Ca 0.12 -0.74 0.00 0.00 -2.23 0.00 0.00 60.65 57.80 3dki s ILE 205 Cb -0.12 -3.07 0.00 0.00 -1.58 0.00 0.00 42.46 37.70 3dki s ILE 205 CO 0.02 0.05 -0.16 -0.69 -1.23 0.00 0.00 174.94 172.94 3dki s VAL 206 N 1.49 2.55 0.05 2.92 1.01 0.77 -1.31 120.40 127.87 3dki s VAL 206 Ca 0.02 -0.79 -0.20 0.00 0.00 0.00 0.00 61.98 61.00 3dki s VAL 206 Cb -0.17 -2.09 -0.06 0.00 0.00 0.00 0.00 36.38 34.06 3dki s VAL 206 CO 0.03 0.51 0.60 0.00 0.00 0.00 0.00 175.10 176.23 3dki s ALA 207 N 1.03 3.53 -0.18 5.51 0.00 -0.59 -1.91 121.76 129.16 3dki s ALA 207 Ca -0.01 0.06 -0.04 0.00 0.00 0.00 0.00 51.96 51.97 3dki s ALA 207 Cb -0.15 -2.71 -0.02 0.00 0.00 0.00 0.00 23.12 20.25 3dki s ALA 207 CO -0.04 0.29 -0.04 0.00 0.00 0.00 0.00 175.76 175.97 3dki s ALA 208 N -0.71 2.90 0.23 0.00 0.00 0.53 -0.87 121.76 123.84 3dki s ALA 208 Ca 0.30 -0.96 -0.00 0.00 0.00 0.00 0.00 51.96 51.30 3dki s ALA 208 Cb -0.19 -1.60 -0.03 0.00 0.00 0.00 0.00 23.12 21.30 3dki s ALA 208 CO 0.19 -0.04 0.19 -1.83 0.00 0.00 0.00 175.76 174.27 3dki s GLU 209 N 0.81 1.35 -0.13 0.00 -1.05 0.39 -2.18 118.70 117.89 3dki s GLU 209 Ca -0.01 -1.68 0.18 0.00 -0.15 0.00 0.00 54.97 53.31 3dki s GLU 209 Cb -0.15 0.30 -0.25 0.00 -0.44 0.00 0.00 34.13 33.59 3dki s GLU 209 CO 0.02 -0.47 0.26 -0.35 0.95 0.00 0.00 175.26 175.67 3dki n PRO 210 N -0.35 0.67 -3.16 -4.83 -0.04 -1.26 0.11 135.00 126.15 3dki n PRO 210 Ca 0.03 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.08 3dki n PRO 210 Cb 0.65 -1.57 -0.07 0.00 -0.04 0.00 0.00 33.50 32.47 3dki n PRO 210 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3dki s VAL 227 N -2.73 4.97 0.39 0.52 1.01 -1.26 -4.25 120.40 119.07 3dki s VAL 227 Ca -0.09 0.78 -0.27 0.00 0.00 0.00 0.00 61.98 62.40 3dki s VAL 227 Cb 0.08 -3.96 -0.10 0.00 0.00 0.00 0.00 36.38 32.40 3dki s VAL 227 CO 0.84 -0.11 1.39 -2.84 0.00 0.00 0.00 175.10 174.38 3dki s PRO 228 N 2.52 4.01 0.60 2.72 0.02 -1.26 -4.89 135.00 138.72 3dki s PRO 228 Ca 0.23 2.36 0.38 0.00 0.02 0.00 0.00 61.00 64.00 3dki s PRO 228 Cb -0.15 -2.85 1.82 0.00 0.02 0.00 0.00 34.50 33.34 3dki s PRO 228 CO 0.12 -0.53 2.15 1.49 -0.33 0.00 0.00 177.00 179.90 3dki h GLU 229 N 2.82 0.00 0.00 5.54 4.81 -1.87 -1.30 114.58 124.58 3dki h GLU 229 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 3dki h GLU 229 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 3dki h GLU 229 CO 0.63 0.01 -0.74 1.28 -0.73 0.00 0.00 179.01 179.46 3dki n LEU 230 N -3.12 0.65 -4.74 1.64 4.77 -1.21 -4.90 117.00 110.09 3dki n LEU 230 Ca -0.01 -0.12 -0.42 0.00 -0.03 0.00 0.00 56.01 55.43 3dki n LEU 230 Cb 0.20 -0.15 -0.01 0.00 -2.33 0.00 0.00 43.42 41.13 3dki n LEU 230 CO 0.24 0.13 1.14 0.00 -1.33 0.00 0.00 177.39 177.58 3dki n TYR 231 N -1.62 2.74 -4.34 -1.77 9.36 -0.49 -4.96 117.16 116.08 3dki n TYR 231 Ca 0.04 0.37 -0.33 0.00 3.32 0.00 0.00 57.90 61.30 3dki n TYR 231 Cb 0.36 -2.54 -0.16 0.00 -0.63 0.00 0.00 39.34 36.37 3dki n TYR 231 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 3dki s ASP 232 N 0.20 3.11 0.26 2.98 -1.08 -1.26 -4.99 116.67 115.89 3dki s ASP 232 Ca 0.60 -0.63 0.13 0.00 -0.52 0.00 0.00 52.55 52.13 3dki s ASP 232 Cb -0.52 -1.46 0.69 0.00 -1.46 0.00 0.00 42.92 40.17 3dki s ASP 232 CO 0.55 0.03 1.30 -2.65 0.52 0.00 0.00 175.17 174.92 3dki n PRO 233 N 4.40 0.09 -0.07 4.34 -0.02 -1.26 -3.10 135.00 139.38 3dki n PRO 233 Ca -0.21 0.55 0.03 0.00 -2.02 0.00 0.00 63.50 61.85 3dki n PRO 233 Cb 0.51 -1.98 0.04 0.00 -0.02 0.00 0.00 33.50 32.05 3dki n PRO 233 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3dki n GLU 234 N -1.97 1.80 -0.10 -0.52 1.02 -1.26 -4.70 120.64 114.91 3dki n GLU 234 Ca -0.01 -1.66 -0.20 0.00 -0.02 0.00 0.00 57.16 55.27 3dki n GLU 234 Cb 0.22 -1.05 -0.11 0.00 -0.02 0.00 0.00 31.44 30.48 3dki n GLU 234 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3dki h ILE 235 N 1.01 0.97 -3.73 -3.67 1.08 -1.97 -3.48 117.51 107.72 3dki h ILE 235 Ca 0.00 -2.14 -0.51 0.00 -0.39 0.00 0.00 64.86 61.82 3dki h ILE 235 Cb 0.80 2.25 0.02 0.00 -3.07 0.00 0.00 36.82 36.83 3dki h ILE 235 CO 0.00 0.33 0.52 -0.76 -0.69 0.00 0.00 178.15 177.55 3dki s LEU 236 N -7.93 4.50 -0.17 1.44 1.02 -1.26 -4.71 118.68 111.58 3dki s LEU 236 Ca -0.27 2.33 0.19 0.00 0.02 0.00 0.00 54.13 56.40 3dki s LEU 236 Cb 0.05 -3.62 -0.27 0.00 0.02 0.00 0.00 46.19 42.36 3dki s LEU 236 CO 0.58 -0.27 0.15 0.35 0.02 0.00 0.00 176.35 177.19 3dki n THR 237 N 1.50 1.11 -3.71 5.49 -2.24 -0.43 -4.98 114.28 111.02 3dki n THR 237 Ca 0.01 -0.79 -0.10 0.00 -2.27 0.00 0.00 64.05 60.90 3dki n THR 237 Cb 0.44 -0.37 -0.05 0.00 -2.10 0.00 0.00 70.33 68.25 3dki n THR 237 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dki s ALA 238 N -2.70 -0.74 -0.03 6.98 0.00 -1.13 -5.01 121.76 119.14 3dki s ALA 238 Ca -0.10 -0.24 -0.00 0.00 0.00 0.00 0.00 51.96 51.62 3dki s ALA 238 Cb 0.08 0.70 0.03 0.00 0.00 0.00 0.00 23.12 23.93 3dki s ALA 238 CO 0.85 -0.65 0.03 0.50 0.00 0.00 0.00 175.76 176.49 3dki s ARG 239 N -3.84 0.08 -0.18 0.00 3.52 -1.26 -1.54 118.95 115.74 3dki s ARG 239 Ca 0.05 0.20 -0.01 0.00 -0.13 0.00 0.00 55.73 55.85 3dki s ARG 239 Cb 0.02 -0.43 -0.00 0.00 -1.56 0.00 0.00 34.95 32.98 3dki s ARG 239 CO -0.09 -0.21 -0.12 0.71 -0.81 0.00 0.00 175.30 174.77 3dki s TYR 240 N 1.40 2.84 0.13 5.12 1.51 -0.05 -4.97 117.35 123.32 3dki s TYR 240 Ca -0.05 -1.06 -0.15 0.00 -1.01 0.00 0.00 57.07 54.81 3dki s TYR 240 Cb -0.13 -1.95 -0.07 0.00 -0.11 0.00 0.00 41.96 39.70 3dki s TYR 240 CO -0.03 -0.51 0.54 -1.12 -1.11 0.00 0.00 175.55 173.31 3dki s SER 241 N 1.03 6.84 -0.04 2.29 0.01 -1.26 -0.46 113.70 122.11 3dki s SER 241 Ca -0.01 1.07 -0.01 0.00 1.31 0.00 0.00 55.95 58.32 3dki s SER 241 Cb -0.15 -2.29 0.03 0.00 0.21 0.00 0.00 66.02 63.82 3dki s SER 241 CO -0.02 0.14 0.02 -0.69 0.41 0.00 0.00 173.24 173.09 3dki s VAL 242 N -1.40 0.10 0.71 3.43 1.01 0.30 -4.89 120.40 119.66 3dki s VAL 242 Ca 0.36 0.22 -0.11 0.00 0.00 0.00 0.00 61.98 62.45 3dki s VAL 242 Cb -0.15 -0.26 0.02 0.00 0.00 0.00 0.00 36.38 35.98 3dki s VAL 242 CO 0.19 0.17 1.07 -0.83 0.00 0.00 0.00 175.10 175.70 3dki s GLY 243 N 1.59 1.67 0.22 4.51 0.00 -1.26 -4.27 107.32 109.77 3dki s GLY 243 Ca -0.02 0.10 -0.07 0.00 0.00 0.00 0.00 44.72 44.73 3dki s GLY 243 CO -0.03 0.42 1.79 0.00 0.00 0.00 0.00 173.10 175.27 3dki h ALA 244 N -0.79 1.06 -0.44 3.20 0.00 -1.98 -1.07 119.26 119.24 3dki h ALA 244 Ca -0.44 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.26 3dki h ALA 244 Cb 1.22 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 3dki h ALA 244 CO 0.56 0.66 0.21 0.28 0.00 0.00 0.00 179.25 180.97 3dki h VAL 245 N 1.15 1.18 -0.39 0.00 2.07 -1.93 0.21 116.25 118.54 3dki h VAL 245 Ca 0.26 -0.51 -0.09 0.00 0.82 0.00 0.00 66.70 67.19 3dki h VAL 245 Cb 0.22 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 3dki h VAL 245 CO -0.02 0.20 -0.12 0.44 0.02 0.00 0.00 177.57 178.09 3dki h ASP 246 N 0.57 0.69 -0.01 0.57 3.32 -1.91 0.72 116.42 120.37 3dki h ASP 246 Ca 0.15 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 57.00 3dki h ASP 246 Cb 0.11 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.48 3dki h ASP 246 CO -0.02 0.83 0.01 0.00 -1.72 0.00 0.00 179.24 178.34 3dki h ALA 247 N 1.23 0.01 0.17 3.45 0.00 -0.56 -1.86 119.26 121.70 3dki h ALA 247 Ca 0.11 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3dki h ALA 247 Cb 0.57 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3dki h ALA 247 CO 0.04 -0.46 -0.08 0.28 0.00 0.00 0.00 179.25 179.02 3dki h VAL 248 N -0.03 0.88 -0.80 0.00 2.07 -0.44 -1.21 116.25 116.71 3dki h VAL 248 Ca 0.00 -0.20 0.16 0.00 0.82 0.00 0.00 66.70 67.48 3dki h VAL 248 Cb 0.05 1.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.66 3dki h VAL 248 CO -0.00 0.05 -0.23 -0.09 0.02 0.00 0.00 177.57 177.31 3dki h ARG 249 N -0.33 -0.02 -0.25 1.57 2.43 -0.83 -1.34 114.38 115.61 3dki h ARG 249 Ca -0.02 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 58.97 3dki h ARG 249 Cb 0.25 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.81 3dki h ARG 249 CO 0.04 -0.01 -0.56 0.00 -1.51 0.00 0.00 179.97 177.93 3dki h ARG 250 N -0.02 0.77 -0.66 0.20 2.47 -1.12 -1.49 114.38 114.54 3dki h ARG 250 Ca 0.37 -0.50 0.03 0.00 -1.26 0.00 0.00 59.98 58.63 3dki h ARG 250 Cb 0.59 0.06 -0.04 0.00 -1.65 0.00 0.00 29.97 28.93 3dki h ARG 250 CO -0.83 1.12 0.40 1.15 0.56 0.00 0.00 179.97 182.38 3dki h THR 251 N 0.59 1.07 -0.35 2.04 2.02 -0.30 0.42 112.91 118.39 3dki h THR 251 Ca 0.01 -0.27 -0.15 0.00 0.77 0.00 0.00 66.41 66.77 3dki h THR 251 Cb 1.15 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 3dki h THR 251 CO 0.12 0.14 -0.38 0.03 0.37 0.00 0.00 175.52 175.80 3dki h ARG 252 N 0.79 0.85 -0.72 6.66 3.08 -1.25 -2.99 114.38 120.80 3dki h ARG 252 Ca 0.27 -0.44 -0.01 0.00 0.07 0.00 0.00 59.98 59.87 3dki h ARG 252 Cb 0.04 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 3dki h ARG 252 CO -0.12 1.08 0.41 1.49 -1.07 0.00 0.00 179.97 181.77 3dki h GLU 253 N 0.70 0.98 -0.69 0.04 4.81 -0.87 -1.95 114.58 117.60 3dki h GLU 253 Ca 0.06 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 3dki h GLU 253 Cb 0.95 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 30.10 3dki h GLU 253 CO 0.09 0.72 0.44 1.25 -0.73 0.00 0.00 179.01 180.78 3dki h LEU 254 N 0.98 0.81 -0.22 1.64 5.85 -0.85 -1.30 115.31 122.22 3dki h LEU 254 Ca 0.25 -0.04 -0.22 0.00 0.84 0.00 0.00 57.88 58.72 3dki h LEU 254 Cb 0.00 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.83 3dki h LEU 254 CO -0.04 0.61 -0.88 1.62 -0.34 0.00 0.00 178.44 179.40 3dki h VAL 255 N 0.94 1.37 0.00 1.05 3.04 -1.37 -0.51 116.25 120.77 3dki h VAL 255 Ca 0.25 -2.30 -0.11 0.00 -1.01 0.00 0.00 66.70 63.53 3dki h VAL 255 Cb -0.08 2.29 -0.02 0.00 -2.01 0.00 0.00 31.29 31.48 3dki h VAL 255 CO -0.05 0.69 -0.52 -0.74 -1.01 0.00 0.00 177.57 175.94 3dki h HIS 256 N 0.29 0.00 0.00 3.17 2.76 -1.19 -2.64 115.15 117.54 3dki h HIS 256 Ca -0.07 0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.04 3dki h HIS 256 Cb 1.50 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.45 3dki h HIS 256 CO 0.06 0.52 -1.49 0.25 -1.30 0.00 0.00 177.93 175.98 3dki n THR 257 N -3.81 0.24 -0.01 6.26 -2.24 -0.51 -4.72 114.28 109.50 3dki n THR 257 Ca -0.01 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 3dki n THR 257 Cb 0.55 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 3dki n THR 257 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3dki n GLU 258 N -2.02 5.77 -0.82 -0.78 -0.58 -0.22 -4.77 120.64 117.23 3dki n GLU 258 Ca -0.07 -0.05 0.00 0.00 -0.42 0.00 0.00 57.16 56.62 3dki n GLU 258 Cb 0.46 -0.53 0.00 0.00 -0.57 0.00 0.00 31.44 30.80 3dki n GLU 258 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3dki n GLY 259 N 0.84 0.88 3.61 0.62 0.00 -0.99 -4.99 105.19 105.15 3dki n GLY 259 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3dki n GLY 259 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dki s ILE 260 N -3.49 5.12 -0.78 -0.61 1.01 -1.24 -4.94 121.20 116.28 3dki s ILE 260 Ca 0.00 0.68 -0.15 0.00 0.00 0.00 0.00 60.65 61.17 3dki s ILE 260 Cb 0.00 -3.77 0.19 0.00 0.01 0.00 0.00 42.46 38.89 3dki s ILE 260 CO 0.00 0.10 0.77 0.12 0.00 0.00 0.00 174.94 175.93 3dki s PHE 261 N 2.19 3.55 0.28 3.97 5.36 -1.26 -2.98 117.98 129.09 3dki s PHE 261 Ca 0.18 -1.74 0.07 0.00 -0.96 0.00 0.00 56.93 54.48 3dki s PHE 261 Cb -0.16 -3.89 -0.03 0.00 -0.34 0.00 0.00 43.02 38.60 3dki s PHE 261 CO 0.10 -1.08 0.27 0.00 -1.46 0.00 0.00 175.22 173.05 3dki s ALA 262 N 0.88 3.77 0.99 11.12 0.00 -1.26 -1.17 121.76 136.09 3dki s ALA 262 Ca 0.17 -1.45 -0.13 0.00 0.00 0.00 0.00 51.96 50.55 3dki s ALA 262 Cb -0.13 -1.37 0.18 0.00 0.00 0.00 0.00 23.12 21.79 3dki s ALA 262 CO -0.06 0.16 1.05 0.41 0.00 0.00 0.00 175.76 177.31 3dki n GLY 263 N -1.31 -1.37 0.17 0.00 0.00 -0.48 -3.38 105.19 98.81 3dki n GLY 263 Ca -0.06 -1.71 -0.04 0.00 0.00 0.00 0.00 46.02 44.21 3dki n GLY 263 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3dki h ILE 264 N -1.58 1.39 -0.04 -0.61 2.04 -1.90 -2.54 117.51 114.26 3dki h ILE 264 Ca -0.34 -1.95 -0.05 0.00 1.00 0.00 0.00 64.86 63.52 3dki h ILE 264 Cb 0.94 1.99 -0.01 0.00 -0.74 0.00 0.00 36.82 39.00 3dki h ILE 264 CO 0.24 0.57 -0.21 0.77 0.00 0.00 0.00 178.15 179.53 3dki h SER 265 N 0.16 0.06 0.29 1.72 4.64 -1.95 -1.19 113.55 117.28 3dki h SER 265 Ca -0.00 -0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.27 3dki h SER 265 Cb 1.08 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3dki h SER 265 CO 0.09 0.28 -0.15 0.74 -0.87 0.00 0.00 176.83 176.92 3dki h THR 266 N 0.06 0.81 -0.71 2.95 2.02 -1.74 -1.71 112.91 114.58 3dki h THR 266 Ca 0.01 -0.60 -0.06 0.00 0.77 0.00 0.00 66.41 66.53 3dki h THR 266 Cb 0.41 1.35 -0.03 0.00 -1.74 0.00 0.00 68.15 68.14 3dki h THR 266 CO 0.03 0.15 0.20 1.23 0.37 0.00 0.00 175.52 177.50 3dki h GLY 267 N 0.73 1.21 0.80 2.16 0.00 -1.25 0.14 103.07 106.85 3dki h GLY 267 Ca -0.00 -0.73 -0.00 0.00 0.00 0.00 0.00 47.33 46.59 3dki h GLY 267 CO 0.02 0.69 -0.04 0.00 0.00 0.00 0.00 176.54 177.20 3dki h ALA 268 N 1.10 -0.12 -0.79 3.60 0.00 -1.41 -1.97 119.26 119.67 3dki h ALA 268 Ca 0.23 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.09 3dki h ALA 268 Cb 0.34 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 3dki h ALA 268 CO -0.00 -0.47 0.46 0.28 0.00 0.00 0.00 179.25 179.52 3dki h VAL 269 N -0.33 0.97 -0.31 0.00 2.07 -1.17 -1.91 116.25 115.57 3dki h VAL 269 Ca -0.01 -0.28 -0.15 0.00 0.82 0.00 0.00 66.70 67.08 3dki h VAL 269 Cb 0.28 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 3dki h VAL 269 CO 0.02 0.15 -0.40 0.25 0.02 0.00 0.00 177.57 177.61 3dki h LEU 270 N 0.82 0.80 -0.11 2.57 5.85 -0.67 -0.74 115.31 123.83 3dki h LEU 270 Ca 0.36 -0.36 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 3dki h LEU 270 Cb 0.25 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 3dki h LEU 270 CO -0.20 1.10 0.07 -0.74 -0.34 0.00 0.00 178.44 178.32 3dki h HIS 271 N 0.62 0.14 -0.57 1.25 2.76 -0.98 -1.01 115.15 117.36 3dki h HIS 271 Ca 0.05 0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.25 3dki h HIS 271 Cb 0.95 -0.05 -0.04 0.00 1.55 0.00 0.00 27.41 29.82 3dki h HIS 271 CO 0.05 0.12 0.34 0.00 -1.30 0.00 0.00 177.93 177.14 3dki h ALA 272 N 1.01 0.74 -0.50 5.26 0.00 -1.25 -2.02 119.26 122.49 3dki h ALA 272 Ca 0.04 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 3dki h ALA 272 Cb 0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3dki h ALA 272 CO -0.01 0.06 -0.02 0.00 0.00 0.00 0.00 179.25 179.28 3dki h ALA 273 N 1.25 1.02 -0.18 0.00 0.00 -0.82 -0.85 119.26 119.68 3dki h ALA 273 Ca 0.23 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 3dki h ALA 273 Cb 0.03 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3dki h ALA 273 CO -0.10 0.60 -0.32 -0.07 0.00 0.00 0.00 179.25 179.36 3dki h LEU 274 N 0.79 0.38 -0.39 0.00 3.38 -1.10 0.14 115.31 118.50 3dki h LEU 274 Ca 0.15 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 3dki h LEU 274 Cb 0.50 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3dki h LEU 274 CO 0.03 0.69 0.01 1.23 0.09 0.00 0.00 178.44 180.48 3dki h GLY 275 N 1.08 0.75 0.95 0.83 0.00 -0.93 0.07 103.07 105.82 3dki h GLY 275 Ca 0.04 -0.55 -0.03 0.00 0.00 0.00 0.00 47.33 46.79 3dki h GLY 275 CO 0.06 0.50 0.15 -2.08 0.00 0.00 0.00 176.54 175.17 3dki h VAL 276 N 0.52 1.22 -0.38 4.60 2.07 -1.03 -1.89 116.25 121.36 3dki h VAL 276 Ca 0.11 -0.71 0.01 0.00 0.82 0.00 0.00 66.70 66.93 3dki h VAL 276 Cb 0.47 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 3dki h VAL 276 CO 0.02 0.26 0.24 1.23 0.02 0.00 0.00 177.57 179.34 3dki h GLY 277 N 0.57 0.53 0.48 2.17 0.00 -0.65 -1.44 103.07 104.73 3dki h GLY 277 Ca 0.14 -0.19 0.09 0.00 0.00 0.00 0.00 47.33 47.38 3dki h GLY 277 CO -0.01 0.18 0.38 0.00 0.00 0.00 0.00 176.54 177.09 3dki h ALA 278 N 1.15 1.03 -0.26 3.60 0.00 -0.89 -0.14 119.26 123.75 3dki h ALA 278 Ca 0.14 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.13 3dki h ALA 278 Cb -0.04 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3dki h ALA 278 CO -0.04 -0.02 0.08 0.78 0.00 0.00 0.00 179.25 180.05 3dki h GLY 279 N 0.64 0.32 1.53 0.00 0.00 -0.78 -0.78 103.07 104.00 3dki h GLY 279 Ca 0.36 -0.04 -0.06 0.00 0.00 0.00 0.00 47.33 47.59 3dki h GLY 279 CO -0.27 0.02 -0.04 0.00 0.00 0.00 0.00 176.54 176.25 3dki h ALA 280 N 1.17 1.27 -0.12 3.60 0.00 -0.84 -2.04 119.26 122.31 3dki h ALA 280 Ca 0.12 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 3dki h ALA 280 Cb 0.09 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 3dki h ALA 280 CO -0.13 0.49 -0.13 1.25 0.00 0.00 0.00 179.25 180.73 3dki h LEU 281 N 0.54 0.32 -1.73 0.00 5.85 -0.65 -1.42 115.31 118.22 3dki h LEU 281 Ca 0.11 -0.49 -0.02 0.00 0.84 0.00 0.00 57.88 58.32 3dki h LEU 281 Cb 0.41 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 3dki h LEU 281 CO 0.02 0.75 -0.07 0.00 -0.34 0.00 0.00 178.44 178.79 3dki h ALA 282 N 0.58 1.07 -0.30 1.25 0.00 -1.11 -2.70 119.26 118.05 3dki h ALA 282 Ca 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3dki h ALA 282 Cb 0.66 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3dki h ALA 282 CO 0.03 0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.37 3dki n ALA 283 N -2.16 2.45 -3.46 0.00 0.00 -0.77 -4.98 120.51 111.59 3dki n ALA 283 Ca -0.01 -0.86 -0.25 0.00 0.00 0.00 0.00 53.44 52.32 3dki n ALA 283 Cb 0.28 -0.92 0.03 0.00 0.00 0.00 0.00 19.45 18.84 3dki n ALA 283 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dki n GLY 284 N 1.41 -0.51 3.67 0.00 0.00 -1.01 -5.01 105.19 103.74 3dki n GLY 284 Ca 0.18 0.16 -0.26 0.00 0.00 0.00 0.00 46.02 46.10 3dki n GLY 284 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dki s GLU 285 N -6.15 2.42 0.26 1.61 2.02 -0.57 -4.73 118.70 113.55 3dki s GLU 285 Ca 0.48 -1.13 -0.30 0.00 0.02 0.00 0.00 54.97 54.04 3dki s GLU 285 Cb -0.23 -2.35 -0.09 0.00 0.10 0.00 0.00 34.13 31.56 3dki s GLU 285 CO 0.60 0.44 1.02 0.50 0.02 0.00 0.00 175.26 177.84 3dki s ARG 286 N -3.04 4.75 0.01 1.61 3.52 -1.26 -4.56 118.95 119.98 3dki s ARG 286 Ca 0.28 1.64 0.01 0.00 -0.13 0.00 0.00 55.73 57.54 3dki s ARG 286 Cb -0.09 -3.24 -0.01 0.00 -1.56 0.00 0.00 34.95 30.05 3dki s ARG 286 CO 0.19 0.36 -0.05 0.00 -0.81 0.00 0.00 175.30 174.99 3dki s ALA 287 N -1.13 0.40 -0.30 6.12 0.00 -1.02 -5.02 121.76 120.81 3dki s ALA 287 Ca 0.43 -0.41 -0.01 0.00 0.00 0.00 0.00 51.96 51.96 3dki s ALA 287 Cb -0.29 -0.02 0.10 0.00 0.00 0.00 0.00 23.12 22.91 3dki s ALA 287 CO 0.36 0.03 0.09 -0.51 0.00 0.00 0.00 175.76 175.73 3dki s ASP 288 N -0.73 3.93 -0.32 0.00 1.01 -1.26 -1.58 116.67 117.72 3dki s ASP 288 Ca -0.04 -1.56 -0.11 0.00 0.71 0.00 0.00 52.55 51.55 3dki s ASP 288 Cb -0.05 -0.82 -0.01 0.00 1.01 0.00 0.00 42.92 43.04 3dki s ASP 288 CO -0.00 -0.41 0.20 -0.63 0.21 0.00 0.00 175.17 174.54 3dki s ILE 289 N 1.66 5.00 -0.13 0.77 1.01 0.27 -1.04 121.20 128.74 3dki s ILE 289 Ca 0.09 -0.28 -0.20 0.00 0.00 0.00 0.00 60.65 60.26 3dki s ILE 289 Cb -0.17 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 3dki s ILE 289 CO -0.25 0.04 0.55 0.00 0.00 0.00 0.00 174.94 175.28 3dki s ALA 290 N 1.68 3.46 -0.02 9.38 0.00 0.10 -0.63 121.76 135.73 3dki s ALA 290 Ca 0.06 -0.15 0.05 0.00 0.00 0.00 0.00 51.96 51.92 3dki s ALA 290 Cb -0.17 -2.78 -0.01 0.00 0.00 0.00 0.00 23.12 20.16 3dki s ALA 290 CO 0.09 -0.15 -0.16 -0.48 0.00 0.00 0.00 175.76 175.06 3dki s LEU 291 N 0.95 2.01 -0.13 0.00 0.05 -0.03 -0.16 118.68 121.37 3dki s LEU 291 Ca 0.29 -0.29 -0.23 0.00 0.05 0.00 0.00 54.13 53.95 3dki s LEU 291 Cb -0.16 -0.82 -0.03 0.00 -2.05 0.00 0.00 46.19 43.13 3dki s LEU 291 CO 0.12 0.18 0.72 -0.69 -0.55 0.00 0.00 176.35 176.13 3dki s VAL 292 N -0.30 5.00 -0.54 1.48 1.01 -0.83 -0.39 120.40 125.82 3dki s VAL 292 Ca 0.05 1.43 -0.11 0.00 0.00 0.00 0.00 61.98 63.34 3dki s VAL 292 Cb -0.07 -4.04 0.14 0.00 0.00 0.00 0.00 36.38 32.41 3dki s VAL 292 CO -0.00 0.16 0.44 -0.69 0.00 0.00 0.00 175.10 175.00 3dki s VAL 293 N 1.43 4.61 0.08 2.92 1.01 -0.65 -4.75 120.40 125.04 3dki s VAL 293 Ca 0.36 -1.85 0.10 0.00 0.00 0.00 0.00 61.98 60.58 3dki s VAL 293 Cb -0.17 -3.99 -0.10 0.00 0.00 0.00 0.00 36.38 32.12 3dki s VAL 293 CO 0.15 -0.84 1.38 0.00 0.00 0.00 0.00 175.10 175.79 3dki h ALA 294 N 8.42 0.54 -2.96 5.51 0.00 -1.92 -1.06 119.26 127.78 3dki h ALA 294 Ca -0.19 -0.73 -0.05 0.00 0.00 0.00 0.00 54.91 53.94 3dki h ALA 294 Cb 1.07 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 3dki h ALA 294 CO 0.89 1.00 0.12 0.16 0.00 0.00 0.00 179.25 181.42 3dki s ASP 295 N -6.65 0.09 0.46 0.00 1.47 -1.26 -1.37 116.67 109.41 3dki s ASP 295 Ca 0.01 -1.05 0.07 0.00 1.18 0.00 0.00 52.55 52.76 3dki s ASP 295 Cb 0.10 0.75 0.02 0.00 -0.34 0.00 0.00 42.92 43.44 3dki s ASP 295 CO 0.79 -1.45 0.63 0.00 0.68 0.00 0.00 175.17 175.81 3dki s ALA 296 N -3.10 4.39 -0.80 2.11 0.00 -1.25 -1.39 121.76 121.73 3dki s ALA 296 Ca 0.18 -1.61 0.26 0.00 0.00 0.00 0.00 51.96 50.79 3dki s ALA 296 Cb -0.04 -1.73 0.95 0.00 0.00 0.00 0.00 23.12 22.30 3dki s ALA 296 CO 0.12 -0.41 1.79 0.41 0.00 0.00 0.00 175.76 177.66 3dki n GLY 297 N -1.98 -1.53 0.22 0.00 0.00 -0.32 -3.46 105.19 98.12 3dki n GLY 297 Ca 0.08 -0.03 -0.06 0.00 0.00 0.00 0.00 46.02 46.01 3dki n GLY 297 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3dki h TRP 298 N 0.00 -0.41 0.00 1.61 4.06 -1.89 -0.41 115.95 118.91 3dki h TRP 298 Ca 0.00 0.04 0.00 0.00 2.06 0.00 0.00 58.89 60.99 3dki h TRP 298 Cb 0.58 0.23 0.00 0.00 -1.00 0.00 0.00 29.16 28.97 3dki h TRP 298 CO 0.00 -0.24 0.00 0.36 -3.56 0.00 0.00 178.44 175.00 3dki n LYS 299 N -5.34 0.19 0.00 0.49 2.85 -1.26 -2.15 118.16 112.93 3dki n LYS 299 Ca 0.01 0.49 0.12 0.00 -1.05 0.00 0.00 58.31 57.88 3dki n LYS 299 Cb 0.26 -1.91 0.14 0.00 -0.65 0.00 0.00 35.03 32.86 3dki n LYS 299 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3dki n TYR 300 N -2.27 0.00 -0.12 5.58 4.01 -0.18 -4.50 117.16 119.67 3dki n TYR 300 Ca 0.01 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.71 3dki n TYR 300 Cb 0.18 -0.03 0.03 0.00 -0.31 0.00 0.00 39.34 39.21 3dki n TYR 300 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3dki h LEU 301 N 2.42 -0.21 -5.58 7.72 3.38 -1.29 -3.16 115.31 118.59 3dki h LEU 301 Ca 0.00 0.10 -0.13 0.00 0.09 0.00 0.00 57.88 57.94 3dki h LEU 301 Cb 0.71 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.65 3dki h LEU 301 CO 0.00 -0.06 1.40 -1.54 0.09 0.00 0.00 178.44 178.32 3dki n SER 302 N -5.22 1.84 -2.65 -0.43 3.41 -1.26 -4.54 113.62 104.77 3dki n SER 302 Ca 0.03 -2.05 -0.01 0.00 -0.26 0.00 0.00 58.87 56.58 3dki n SER 302 Cb 0.22 -0.66 0.01 0.00 -0.26 0.00 0.00 64.21 63.52 3dki n SER 302 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3dki n THR 303 N 4.34 0.00 1.05 6.66 -2.24 -1.19 -5.05 114.28 117.84 3dki n THR 303 Ca 0.16 -0.30 0.13 0.00 -2.27 0.00 0.00 64.05 61.77 3dki n THR 303 Cb 0.08 0.48 0.41 0.00 -2.10 0.00 0.00 70.33 69.21 3dki n THR 303 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dki n GLY 304 N -0.53 -1.28 0.42 3.38 0.00 -1.26 -4.59 105.19 101.33 3dki n GLY 304 Ca -0.00 -0.26 0.27 0.00 0.00 0.00 0.00 46.02 46.03 3dki n GLY 304 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dki h ALA 305 N 3.08 2.36 0.00 4.61 0.00 -1.81 -2.67 119.26 124.83 3dki h ALA 305 Ca 0.00 0.09 -0.21 0.00 0.00 0.00 0.00 54.91 54.79 3dki h ALA 305 Cb 0.49 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 3dki h ALA 305 CO 0.00 -0.86 -1.80 0.66 0.00 0.00 0.00 179.25 177.25 3dki n TYR 306 N -4.70 0.00 -4.31 0.00 4.01 -1.26 -4.78 117.16 106.12 3dki n TYR 306 Ca 0.30 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.70 3dki n TYR 306 Cb 1.07 -0.57 -0.12 0.00 -0.31 0.00 0.00 39.34 39.41 3dki n TYR 306 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3dki s ALA 307 N -2.28 3.07 0.00 -0.72 0.00 -1.01 -5.03 121.76 115.79 3dki s ALA 307 Ca -0.07 -0.82 0.00 0.00 0.00 0.00 0.00 51.96 51.07 3dki s ALA 307 Cb 0.04 -1.64 0.00 0.00 0.00 0.00 0.00 23.12 21.52 3dki s ALA 307 CO 0.46 0.18 0.00 0.41 0.00 0.00 0.00 175.76 176.81 3dki n GLY 308 N 3.59 0.97 3.82 0.00 0.00 -1.26 -4.78 105.19 107.53 3dki n GLY 308 Ca -0.17 -1.45 -0.37 0.00 0.00 0.00 0.00 46.02 44.03 3dki n GLY 308 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dki s SER 309 N -4.00 7.04 0.55 1.61 1.04 -1.26 -4.97 113.70 113.71 3dki s SER 309 Ca 0.00 1.32 0.23 0.00 0.48 0.00 0.00 55.95 57.98 3dki s SER 309 Cb 0.00 -2.38 1.54 0.00 0.10 0.00 0.00 66.02 65.28 3dki s SER 309 CO 0.00 0.12 2.20 -0.07 0.98 0.00 0.00 173.24 176.47 3dki h LEU 310 N 3.79 0.00 -0.12 2.42 3.38 -1.92 -2.19 115.31 120.67 3dki h LEU 310 Ca -0.48 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.41 3dki h LEU 310 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 3dki h LEU 310 CO 0.65 0.00 -0.21 0.44 0.09 0.00 0.00 178.44 179.41 3dki h ASP 311 N 0.00 0.39 -0.21 -0.43 5.19 -1.98 0.57 116.42 119.95 3dki h ASP 311 Ca 0.01 -0.55 0.02 0.00 -0.62 0.00 0.00 57.03 55.89 3dki h ASP 311 Cb 0.03 -0.11 -0.02 0.00 0.18 0.00 0.00 39.33 39.41 3dki h ASP 311 CO -0.00 0.86 0.09 0.44 -3.12 0.00 0.00 179.24 177.51 3dki h ASP 312 N -0.07 0.12 -0.21 6.45 3.32 -1.91 -1.13 116.42 122.97 3dki h ASP 312 Ca 0.01 0.02 0.04 0.00 0.02 0.00 0.00 57.03 57.12 3dki h ASP 312 Cb 0.79 -0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.29 3dki h ASP 312 CO 0.05 0.10 -0.06 0.00 -1.72 0.00 0.00 179.24 177.61 3dki h ALA 313 N 1.12 0.14 -0.97 3.45 0.00 -1.43 -1.71 119.26 119.86 3dki h ALA 313 Ca 0.09 0.08 0.14 0.00 0.00 0.00 0.00 54.91 55.22 3dki h ALA 313 Cb 0.04 0.17 -0.08 0.00 0.00 0.00 0.00 17.79 17.91 3dki h ALA 313 CO -0.08 -0.48 0.61 1.49 0.00 0.00 0.00 179.25 180.80 3dki h GLU 314 N -0.00 0.85 -0.17 0.00 4.81 -0.64 -0.69 114.58 118.74 3dki h GLU 314 Ca 0.10 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.15 3dki h GLU 314 Cb 0.16 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 3dki h GLU 314 CO -0.22 0.56 -0.45 1.15 -0.73 0.00 0.00 179.01 179.32 3dki h THR 315 N 0.87 1.32 0.00 0.32 2.02 -0.72 -3.50 112.91 113.22 3dki h THR 315 Ca 0.50 -1.64 0.00 0.00 0.77 0.00 0.00 66.41 66.04 3dki h THR 315 Cb 0.62 1.69 0.00 0.00 -1.74 0.00 0.00 68.15 68.72 3dki h THR 315 CO -0.26 0.50 0.00 0.00 0.37 0.00 0.00 175.52 176.13