#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dfm s ILE 3 N 0.00 0.53 0.05 -0.18 -4.36 -1.26 -0.70 121.20 115.28 1dfm s ILE 3 Ca 0.00 -0.64 0.08 0.00 -0.26 0.00 0.00 60.65 59.83 1dfm s ILE 3 Cb 0.00 -0.51 -0.03 0.00 1.25 0.00 0.00 42.46 43.16 1dfm s ILE 3 CO 0.00 -0.10 -0.21 -0.62 0.24 0.00 0.00 174.94 174.25 1dfm s ASP 4 N -0.80 3.57 0.06 4.36 2.15 -0.11 -4.96 116.67 120.93 1dfm s ASP 4 Ca -0.03 -0.51 0.05 0.00 0.43 0.00 0.00 52.55 52.49 1dfm s ASP 4 Cb -0.06 -0.48 -0.03 0.00 -0.30 0.00 0.00 42.92 42.06 1dfm s ASP 4 CO 0.00 0.25 -0.13 -0.63 -0.17 0.00 0.00 175.17 174.49 1dfm s ILE 5 N -0.91 1.00 -0.03 4.11 1.01 -1.26 -0.38 121.20 124.74 1dfm s ILE 5 Ca 0.14 -1.16 -0.01 0.00 0.00 0.00 0.00 60.65 59.62 1dfm s ILE 5 Cb -0.10 -0.96 0.03 0.00 0.01 0.00 0.00 42.46 41.43 1dfm s ILE 5 CO 0.05 -0.18 0.04 -0.89 0.00 0.00 0.00 174.94 173.95 1dfm s THR 6 N -1.15 -0.04 -0.12 2.92 2.01 -0.19 -5.00 115.64 114.07 1dfm s THR 6 Ca -0.02 0.27 -0.05 0.00 0.31 0.00 0.00 61.69 62.20 1dfm s THR 6 Cb -0.09 -0.14 -0.04 0.00 0.01 0.00 0.00 72.50 72.24 1dfm s THR 6 CO 0.02 0.13 0.07 -1.81 -0.69 0.00 0.00 174.62 172.34 1dfm s ASP 7 N 1.48 5.83 0.07 3.53 1.01 -1.26 -0.25 116.67 127.07 1dfm s ASP 7 Ca -0.04 0.29 0.09 0.00 0.71 0.00 0.00 52.55 53.60 1dfm s ASP 7 Cb -0.13 -1.82 -0.03 0.00 1.01 0.00 0.00 42.92 41.96 1dfm s ASP 7 CO -0.03 0.36 -0.24 -0.31 0.21 0.00 0.00 175.17 175.17 1dfm s TYR 8 N -0.77 2.09 -1.66 4.23 2.02 0.47 -4.71 117.35 119.01 1dfm s TYR 8 Ca 0.13 -0.39 -0.17 0.00 -0.37 0.00 0.00 57.07 56.26 1dfm s TYR 8 Cb -0.12 -1.22 0.14 0.00 -0.40 0.00 0.00 41.96 40.37 1dfm s TYR 8 CO 0.03 0.16 0.80 0.09 -1.57 0.00 0.00 175.55 175.06 1dfm n ASN 9 N 1.58 -3.39 -3.32 2.29 3.02 -1.26 -2.05 115.26 112.14 1dfm n ASN 9 Ca -0.17 -0.98 -0.24 0.00 -0.03 0.00 0.00 54.58 53.16 1dfm n ASN 9 Cb 0.53 -2.95 0.04 0.00 -0.61 0.00 0.00 39.78 36.79 1dfm n ASN 9 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1dfm n HIS 10 N -4.43 -2.24 -0.06 3.10 8.25 -1.26 -4.41 115.22 114.17 1dfm n HIS 10 Ca 0.05 0.69 0.19 0.00 -0.26 0.00 0.00 57.72 58.39 1dfm n HIS 10 Cb 0.51 -4.42 0.63 0.00 1.12 0.00 0.00 29.99 27.83 1dfm n HIS 10 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1dfm h ALA 11 N 1.00 2.39 -0.18 -1.41 0.00 -1.67 -0.20 119.26 119.20 1dfm h ALA 11 Ca -0.54 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 1dfm h ALA 11 Cb 1.36 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1dfm h ALA 11 CO 0.58 -0.56 0.07 0.38 0.00 0.00 0.00 179.25 179.72 1dfm h ASP 12 N 0.13 0.21 1.02 0.00 2.03 -1.89 0.94 116.42 118.86 1dfm h ASP 12 Ca 0.29 -0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.58 1dfm h ASP 12 Cb 0.98 -0.05 0.00 0.00 -0.83 0.00 0.00 39.33 39.43 1dfm h ASP 12 CO -0.04 0.20 -0.54 -0.33 -1.03 0.00 0.00 179.24 177.50 1dfm h GLU 13 N 0.24 0.00 0.00 4.15 5.08 -1.41 -3.37 114.58 119.27 1dfm h GLU 13 Ca 0.06 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.08 1dfm h GLU 13 Cb 0.05 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.24 1dfm h GLU 13 CO -0.01 0.00 -2.28 -0.89 -1.00 0.00 0.00 179.01 174.83 1dfm n ILE 14 N -2.24 1.29 -1.78 3.13 5.41 -0.96 -4.97 119.36 119.24 1dfm n ILE 14 Ca 0.03 -0.60 -0.42 0.00 1.00 0.00 0.00 62.75 62.76 1dfm n ILE 14 Cb 0.45 -1.02 -0.03 0.00 -0.71 0.00 0.00 39.64 38.33 1dfm n ILE 14 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 1dfm s LEU 15 N -5.97 4.39 0.12 1.39 2.96 0.29 -4.92 118.68 116.93 1dfm s LEU 15 Ca -0.23 2.70 -0.31 0.00 -0.22 0.00 0.00 54.13 56.07 1dfm s LEU 15 Cb 0.07 -3.57 -0.10 0.00 0.50 0.00 0.00 46.19 43.09 1dfm s LEU 15 CO 0.61 -0.96 1.71 0.21 -1.32 0.00 0.00 176.35 176.60 1dfm s ASN 16 N 2.34 6.51 0.33 3.68 3.84 -1.26 -4.90 114.94 125.48 1dfm s ASN 16 Ca 0.78 2.64 0.05 0.00 0.21 0.00 0.00 52.86 56.54 1dfm s ASN 16 Cb -0.45 -2.57 0.69 0.00 -0.55 0.00 0.00 41.25 38.37 1dfm s ASN 16 CO 0.35 -0.93 1.90 -0.65 -2.79 0.00 0.00 177.10 174.97 1dfm h PRO 17 N 8.05 0.81 -0.12 0.43 0.11 -1.96 -0.41 132.00 138.91 1dfm h PRO 17 Ca -0.44 -0.05 -0.19 0.00 0.11 0.00 0.00 66.00 65.43 1dfm h PRO 17 Cb 1.21 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 1dfm h PRO 17 CO 0.94 0.54 -0.71 0.37 -0.21 0.00 0.00 178.00 178.93 1dfm h GLN 18 N 0.84 0.56 -0.38 1.05 5.75 -1.99 0.84 115.11 121.77 1dfm h GLN 18 Ca 0.41 -0.43 -0.11 0.00 -0.15 0.00 0.00 58.65 58.37 1dfm h GLN 18 Cb 0.45 0.08 -0.01 0.00 1.07 0.00 0.00 27.48 29.07 1dfm h GLN 18 CO -0.17 1.06 -0.20 -0.07 -2.65 0.00 0.00 178.83 176.80 1dfm h LEU 19 N 0.39 0.83 -0.97 -2.39 3.38 -1.79 -2.11 115.31 112.65 1dfm h LEU 19 Ca -0.03 -0.41 -0.05 0.00 0.09 0.00 0.00 57.88 57.48 1dfm h LEU 19 Cb 1.29 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.79 1dfm h LEU 19 CO 0.13 1.06 0.19 -0.25 0.09 0.00 0.00 178.44 179.66 1dfm h TRP 20 N 0.60 0.96 -0.51 1.13 2.91 -0.99 -2.54 115.95 117.51 1dfm h TRP 20 Ca 0.08 -0.08 -0.04 0.00 1.13 0.00 0.00 58.89 59.98 1dfm h TRP 20 Cb 0.75 -0.28 -0.02 0.00 -0.51 0.00 0.00 29.16 29.09 1dfm h TRP 20 CO 0.06 0.77 0.16 -0.22 -1.03 0.00 0.00 178.44 178.18 1dfm h LYS 21 N 0.91 0.76 -0.62 2.65 3.64 -0.45 0.16 116.57 123.63 1dfm h LYS 21 Ca 0.20 -0.13 -0.06 0.00 -1.27 0.00 0.00 60.65 59.39 1dfm h LYS 21 Cb 0.27 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.93 1dfm h LYS 21 CO -0.01 0.66 0.15 0.93 -2.27 0.00 0.00 179.45 178.92 1dfm h GLU 22 N 0.74 0.96 -0.06 1.90 5.08 -0.99 -0.84 114.58 121.38 1dfm h GLU 22 Ca 0.17 -0.21 -0.13 0.00 -1.00 0.00 0.00 59.36 58.19 1dfm h GLU 22 Cb 0.22 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.34 1dfm h GLU 22 CO -0.01 0.85 -0.48 0.82 -1.00 0.00 0.00 179.01 179.20 1dfm h ILE 23 N 0.92 1.40 -0.38 3.13 1.08 -1.09 -3.10 117.51 119.47 1dfm h ILE 23 Ca 0.20 -1.88 -0.01 0.00 -0.39 0.00 0.00 64.86 62.78 1dfm h ILE 23 Cb 0.32 2.36 -0.02 0.00 -3.07 0.00 0.00 36.82 36.41 1dfm h ILE 23 CO -0.00 0.55 0.19 -0.08 -0.69 0.00 0.00 178.15 178.12 1dfm h GLU 24 N -0.03 0.55 -0.37 2.37 4.81 -0.50 -1.63 114.58 119.77 1dfm h GLU 24 Ca -0.04 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 59.06 1dfm h GLU 24 Cb 1.14 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.40 1dfm h GLU 24 CO 0.10 0.47 0.02 1.05 -0.73 0.00 0.00 179.01 179.92 1dfm h GLU 25 N 0.49 0.57 -0.21 1.92 4.11 -1.26 0.12 114.58 120.32 1dfm h GLU 25 Ca 0.13 -0.12 -0.02 0.00 0.07 0.00 0.00 59.36 59.42 1dfm h GLU 25 Cb 0.10 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1dfm h GLU 25 CO -0.02 0.58 0.05 1.15 0.07 0.00 0.00 179.01 180.84 1dfm h THR 26 N 0.55 1.21 -0.24 -1.06 2.02 -1.36 -1.84 112.91 112.19 1dfm h THR 26 Ca 0.12 -0.67 -0.12 0.00 0.77 0.00 0.00 66.41 66.51 1dfm h THR 26 Cb 0.32 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 1dfm h THR 26 CO 0.01 0.21 -0.36 -0.07 0.37 0.00 0.00 175.52 175.67 1dfm h LEU 27 N 0.15 0.56 -0.68 2.58 3.38 -0.87 -3.08 115.31 117.35 1dfm h LEU 27 Ca 0.07 -0.23 -0.12 0.00 0.09 0.00 0.00 57.88 57.68 1dfm h LEU 27 Cb 0.27 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1dfm h LEU 27 CO 0.00 0.87 -0.29 -0.07 0.09 0.00 0.00 178.44 179.05 1dfm h LEU 28 N 0.45 0.72 -5.32 1.67 3.38 -0.70 -3.43 115.31 112.09 1dfm h LEU 28 Ca 0.05 -0.28 -0.27 0.00 0.09 0.00 0.00 57.88 57.46 1dfm h LEU 28 Cb 0.84 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1dfm h LEU 28 CO 0.07 0.97 1.91 1.17 0.09 0.00 0.00 178.44 182.65 1dfm n LYS 29 N -4.09 1.61 -4.22 1.13 4.81 -0.70 -4.81 118.16 111.90 1dfm n LYS 29 Ca -0.01 -1.15 -0.13 0.00 -0.87 0.00 0.00 58.31 56.16 1dfm n LYS 29 Cb 0.46 -2.25 -0.10 0.00 0.02 0.00 0.00 35.03 33.16 1dfm n LYS 29 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1dfm s PRO 31 N 3.32 0.98 0.16 1.64 0.02 -1.26 -5.11 135.00 134.75 1dfm s PRO 31 Ca 0.33 -1.41 -0.31 0.00 0.02 0.00 0.00 61.00 59.62 1dfm s PRO 31 Cb 0.10 -0.44 -0.10 0.00 0.02 0.00 0.00 34.50 34.08 1dfm s PRO 31 CO -0.02 0.03 1.55 -1.17 -0.33 0.00 0.00 177.00 177.06 1dfm s LEU 32 N -3.12 4.37 -0.19 -5.54 2.96 -1.26 -4.73 118.68 111.17 1dfm s LEU 32 Ca 0.15 2.60 -0.09 0.00 -0.22 0.00 0.00 54.13 56.57 1dfm s LEU 32 Cb 0.04 -3.59 -0.05 0.00 0.50 0.00 0.00 46.19 43.09 1dfm s LEU 32 CO -0.01 -0.81 0.11 -1.00 -1.32 0.00 0.00 176.35 173.32 1dfm s HIS 33 N 1.10 3.38 0.24 5.38 3.76 -1.26 -0.51 115.29 127.38 1dfm s HIS 33 Ca 0.69 0.28 0.05 0.00 -0.15 0.00 0.00 55.06 55.93 1dfm s HIS 33 Cb -0.43 -2.12 -0.05 0.00 1.11 0.00 0.00 32.58 31.08 1dfm s HIS 33 CO 0.32 0.29 -0.05 0.14 -0.85 0.00 0.00 174.74 174.58 1dfm s VAL 34 N 0.26 1.40 0.27 -0.90 -7.23 -0.08 -0.67 120.40 113.46 1dfm s VAL 34 Ca 0.07 -2.10 -0.16 0.00 -1.81 0.00 0.00 61.98 57.98 1dfm s VAL 34 Cb -0.11 -2.30 0.01 0.00 0.56 0.00 0.00 36.38 34.53 1dfm s VAL 34 CO -0.01 -0.39 0.60 -1.59 -0.31 0.00 0.00 175.10 173.40 1dfm s LYS 35 N -3.76 1.70 0.10 4.82 -2.85 -0.55 -1.85 119.74 117.35 1dfm s LYS 35 Ca 0.27 -1.16 -0.29 0.00 -1.00 0.00 0.00 55.97 53.79 1dfm s LYS 35 Cb 0.04 0.54 -0.06 0.00 -2.06 0.00 0.00 37.83 36.29 1dfm s LYS 35 CO 0.09 -0.75 0.92 0.00 0.10 0.00 0.00 175.35 175.72 1dfm s ALA 36 N -3.86 3.27 0.60 0.59 0.00 -1.26 -1.23 121.76 119.86 1dfm s ALA 36 Ca 0.17 0.52 -0.15 0.00 0.00 0.00 0.00 51.96 52.50 1dfm s ALA 36 Cb -0.03 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.83 1dfm s ALA 36 CO 0.09 -0.00 1.05 0.45 0.00 0.00 0.00 175.76 177.34 1dfm s SER 37 N -0.04 5.82 -0.11 0.00 0.15 0.36 -4.83 113.70 115.06 1dfm s SER 37 Ca 0.45 1.77 0.15 0.00 0.70 0.00 0.00 55.95 59.03 1dfm s SER 37 Cb -0.23 -2.53 0.24 0.00 -1.71 0.00 0.00 66.02 61.79 1dfm s SER 37 CO 0.29 -1.14 1.12 -0.67 1.20 0.00 0.00 173.24 174.03 1dfm n ASP 38 N -2.11 2.09 -4.76 5.45 2.03 -1.26 -1.01 116.55 116.98 1dfm n ASP 38 Ca 0.08 -2.87 -0.40 0.00 0.52 0.00 0.00 54.79 52.12 1dfm n ASP 38 Cb 0.53 -0.37 -0.04 0.00 -0.72 0.00 0.00 41.12 40.52 1dfm n ASP 38 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 1dfm s GLN 39 N -2.43 4.58 0.26 -0.67 0.74 -1.26 -4.83 119.66 116.05 1dfm s GLN 39 Ca 0.26 1.81 -0.30 0.00 0.05 0.00 0.00 55.36 57.18 1dfm s GLN 39 Cb 0.23 -3.13 -0.14 0.00 1.10 0.00 0.00 33.01 31.07 1dfm s GLN 39 CO 0.02 0.15 1.22 0.00 -0.55 0.00 0.00 175.29 176.14 1dfm n ALA 40 N 1.06 0.33 -0.49 1.58 0.00 -1.26 -1.38 120.51 120.35 1dfm n ALA 40 Ca -0.01 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1dfm n ALA 40 Cb 0.45 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.76 1dfm n ALA 40 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1dfm n SER 41 N 1.63 0.00 -1.39 0.00 3.41 -1.26 -4.71 113.62 111.29 1dfm n SER 41 Ca 0.11 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.75 1dfm n SER 41 Cb 0.31 -0.72 0.06 0.00 -0.26 0.00 0.00 64.21 63.60 1dfm n SER 41 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1dfm n LYS 42 N -2.00 0.45 -1.82 4.33 2.85 -0.48 -5.07 118.16 116.42 1dfm n LYS 42 Ca 0.00 -2.37 -0.42 0.00 -1.05 0.00 0.00 58.31 54.47 1dfm n LYS 42 Cb 0.00 -0.43 -0.03 0.00 -0.65 0.00 0.00 35.03 33.92 1dfm n LYS 42 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1dfm s VAL 43 N -0.90 2.78 0.00 0.58 1.01 -1.04 -1.39 120.40 121.44 1dfm s VAL 43 Ca 0.35 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.59 1dfm s VAL 43 Cb 0.38 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.59 1dfm s VAL 43 CO -0.14 -0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.57 1dfm n GLY 44 N 4.12 2.55 3.76 4.51 0.00 -0.18 -4.96 105.19 114.99 1dfm n GLY 44 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1dfm n GLY 44 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dfm s SER 45 N -1.39 5.53 0.14 1.61 1.04 -0.49 -4.54 113.70 115.61 1dfm s SER 45 Ca 0.00 2.42 -0.28 0.00 0.48 0.00 0.00 55.95 58.57 1dfm s SER 45 Cb 0.00 -2.61 -0.07 0.00 0.10 0.00 0.00 66.02 63.44 1dfm s SER 45 CO 0.00 -1.36 0.88 -0.76 0.98 0.00 0.00 173.24 172.98 1dfm s LEU 46 N -3.64 4.55 0.07 2.42 1.43 -1.26 -0.48 118.68 121.77 1dfm s LEU 46 Ca 0.72 1.74 -0.00 0.00 -1.03 0.00 0.00 54.13 55.56 1dfm s LEU 46 Cb -0.31 -3.47 -0.04 0.00 0.03 0.00 0.00 46.19 42.39 1dfm s LEU 46 CO 0.36 0.06 -0.03 0.27 0.23 0.00 0.00 176.35 177.24 1dfm s ILE 47 N -0.55 0.33 0.20 -0.59 -4.36 -0.36 -4.55 121.20 111.32 1dfm s ILE 47 Ca 0.42 -1.86 -0.33 0.00 -0.26 0.00 0.00 60.65 58.63 1dfm s ILE 47 Cb -0.23 -1.64 -0.14 0.00 1.25 0.00 0.00 42.46 41.70 1dfm s ILE 47 CO 0.28 -0.89 1.43 0.33 0.24 0.00 0.00 174.94 176.33 1dfm n PHE 48 N 0.04 2.06 -3.49 1.37 7.35 -0.11 -1.48 117.46 123.21 1dfm n PHE 48 Ca -0.12 0.43 -0.42 0.00 -0.76 0.00 0.00 57.45 56.57 1dfm n PHE 48 Cb 0.61 -2.46 -0.09 0.00 0.35 0.00 0.00 39.48 37.90 1dfm n PHE 48 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1dfm s ASP 49 N 0.45 5.90 0.38 -2.13 2.15 0.16 -4.73 116.67 118.85 1dfm s ASP 49 Ca 0.73 -1.46 0.16 0.00 0.43 0.00 0.00 52.55 52.42 1dfm s ASP 49 Cb -0.70 -2.09 0.77 0.00 -0.30 0.00 0.00 42.92 40.60 1dfm s ASP 49 CO 0.46 -0.61 1.81 1.55 -0.17 0.00 0.00 175.17 178.21 1dfm h PRO 50 N 8.59 0.00 0.02 4.34 0.13 -1.92 -2.07 132.00 141.09 1dfm h PRO 50 Ca -0.26 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1dfm h PRO 50 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1dfm h PRO 50 CO 0.83 0.37 -0.01 0.28 -0.23 0.00 0.00 178.00 179.24 1dfm h VAL 51 N 0.00 1.27 -0.68 1.56 2.07 -1.96 -0.54 116.25 117.97 1dfm h VAL 51 Ca -0.00 -0.91 -0.08 0.00 0.82 0.00 0.00 66.70 66.52 1dfm h VAL 51 Cb 0.73 1.89 -0.03 0.00 -1.52 0.00 0.00 31.29 32.36 1dfm h VAL 51 CO 0.05 0.23 0.11 1.23 0.02 0.00 0.00 177.57 179.21 1dfm h GLY 52 N -0.42 1.21 0.92 2.17 0.00 -1.95 -1.28 103.07 103.71 1dfm h GLY 52 Ca -0.00 -0.80 -0.03 0.00 0.00 0.00 0.00 47.33 46.50 1dfm h GLY 52 CO 0.00 0.74 0.11 -0.84 0.00 0.00 0.00 176.54 176.56 1dfm h THR 53 N 1.05 1.21 -0.85 4.70 2.02 -1.36 -0.85 112.91 118.83 1dfm h THR 53 Ca 0.21 -0.68 -0.01 0.00 0.77 0.00 0.00 66.41 66.69 1dfm h THR 53 Cb 0.44 1.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.81 1dfm h THR 53 CO 0.01 0.24 0.47 0.78 0.37 0.00 0.00 175.52 177.39 1dfm h ASN 54 N 0.41 1.05 -0.24 4.18 2.35 -0.89 -1.81 115.58 120.63 1dfm h ASN 54 Ca 0.11 -0.09 -0.10 0.00 -0.55 0.00 0.00 56.30 55.67 1dfm h ASN 54 Cb 0.25 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 1dfm h ASN 54 CO -0.00 0.84 -0.20 -0.61 -1.65 0.00 0.00 177.43 175.81 1dfm h GLN 55 N 1.18 0.70 -0.31 0.81 5.75 -1.07 -1.89 115.11 120.28 1dfm h GLN 55 Ca 0.30 -0.26 -0.02 0.00 -0.15 0.00 0.00 58.65 58.52 1dfm h GLN 55 Cb 0.01 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.51 1dfm h GLN 55 CO -0.05 0.85 0.11 -0.92 -2.65 0.00 0.00 178.83 176.17 1dfm h TYR 56 N 0.62 0.47 -0.58 3.99 5.03 -0.75 -0.45 116.97 125.30 1dfm h TYR 56 Ca 0.09 -0.04 -0.04 0.00 2.58 0.00 0.00 58.73 61.32 1dfm h TYR 56 Cb 0.68 -0.14 -0.02 0.00 1.55 0.00 0.00 36.73 38.79 1dfm h TYR 56 CO 0.03 0.47 0.19 0.82 -1.32 0.00 0.00 178.16 178.35 1dfm h ILE 57 N 0.34 1.24 -0.17 1.81 2.04 -1.21 -1.80 117.51 119.75 1dfm h ILE 57 Ca 0.10 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 65.16 1dfm h ILE 57 Cb 0.20 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 1dfm h ILE 57 CO -0.01 0.30 0.11 0.50 0.00 0.00 0.00 178.15 179.06 1dfm h LYS 58 N 0.81 0.23 0.00 2.37 3.64 -1.14 -0.42 116.57 122.06 1dfm h LYS 58 Ca 0.19 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.54 1dfm h LYS 58 Cb 0.27 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1dfm h LYS 58 CO -0.01 0.16 -0.08 -0.44 -2.27 0.00 0.00 179.45 176.80 1dfm h ASP 59 N 0.23 0.00 0.18 4.20 3.32 -0.79 -1.76 116.42 121.81 1dfm h ASP 59 Ca 0.06 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.76 1dfm h ASP 59 Cb -0.02 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 1dfm h ASP 59 CO -0.01 0.08 -1.83 -0.33 -1.72 0.00 0.00 179.24 175.43 1dfm h GLU 60 N 0.00 0.34 0.14 3.56 4.39 -0.94 -3.39 114.58 118.67 1dfm h GLU 60 Ca -0.00 -0.58 -0.29 0.00 0.34 0.00 0.00 59.36 58.83 1dfm h GLU 60 Cb 0.20 0.22 0.01 0.00 -0.10 0.00 0.00 28.75 29.07 1dfm h GLU 60 CO 0.01 1.26 -1.31 -0.07 -1.16 0.00 0.00 179.01 177.74 1dfm h LEU 61 N 0.09 0.45 -0.52 1.33 3.38 -0.90 -3.29 115.31 115.86 1dfm h LEU 61 Ca -0.37 -0.51 0.02 0.00 0.09 0.00 0.00 57.88 57.11 1dfm h LEU 61 Cb 2.07 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 42.65 1dfm h LEU 61 CO 0.14 1.40 0.33 0.58 0.09 0.00 0.00 178.44 180.98 1dfm h VAL 62 N 0.08 1.09 0.00 1.22 2.07 -1.49 -0.81 116.25 118.41 1dfm h VAL 62 Ca -0.16 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 1dfm h VAL 62 Cb 2.00 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 32.14 1dfm h VAL 62 CO 0.20 0.12 -0.03 -0.65 0.02 0.00 0.00 177.57 177.24 1dfm h PRO 63 N 0.66 0.00 -0.37 1.57 0.11 -1.76 -1.10 132.00 131.10 1dfm h PRO 63 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1dfm h PRO 63 Cb -0.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.09 1dfm h PRO 63 CO -0.07 0.03 0.00 1.63 -0.21 0.00 0.00 178.00 179.37 1dfm n LYS 64 N -3.27 1.77 -1.28 1.05 5.02 -0.37 -4.89 118.16 116.20 1dfm n LYS 64 Ca -0.02 -1.02 -0.04 0.00 -2.02 0.00 0.00 58.31 55.21 1dfm n LYS 64 Cb 0.16 -1.31 -0.02 0.00 -0.02 0.00 0.00 35.03 33.85 1dfm n LYS 64 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1dfm n HIS 65 N 0.30 -0.03 -3.10 2.13 8.25 -0.42 -5.03 115.22 117.31 1dfm n HIS 65 Ca 0.09 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.16 1dfm n HIS 65 Cb 0.29 -1.18 -0.05 0.00 1.12 0.00 0.00 29.99 30.17 1dfm n HIS 65 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1dfm s TRP 66 N -2.16 3.73 0.18 4.41 0.52 -0.85 -4.84 118.94 119.93 1dfm s TRP 66 Ca 0.00 1.35 -0.20 0.00 0.02 0.00 0.00 56.10 57.27 1dfm s TRP 66 Cb 0.00 -2.70 -0.08 0.00 -1.15 0.00 0.00 33.47 29.54 1dfm s TRP 66 CO 0.00 0.34 0.69 0.15 0.02 0.00 0.00 176.95 178.15 1dfm s LYS 67 N -0.24 4.27 0.02 4.98 1.02 0.63 -4.19 119.74 126.23 1dfm s LYS 67 Ca 0.34 0.86 0.01 0.00 0.02 0.00 0.00 55.97 57.20 1dfm s LYS 67 Cb -0.20 -3.01 -0.04 0.00 -0.52 0.00 0.00 37.83 34.07 1dfm s LYS 67 CO 0.20 0.47 0.08 1.21 -0.92 0.00 0.00 175.35 176.39 1dfm s ASN 68 N -1.49 5.62 -1.32 2.83 3.84 -1.26 -1.19 114.94 121.98 1dfm s ASN 68 Ca 0.39 0.09 -0.11 0.00 0.21 0.00 0.00 52.86 53.44 1dfm s ASN 68 Cb -0.18 -1.58 0.00 0.00 -0.55 0.00 0.00 41.25 38.94 1dfm s ASN 68 CO 0.21 0.24 0.52 0.59 -2.79 0.00 0.00 177.10 175.87 1dfm n ASN 69 N 0.96 -2.18 -4.72 -4.21 5.03 0.05 -4.89 115.26 105.29 1dfm n ASN 69 Ca -0.12 -1.09 -0.42 0.00 0.87 0.00 0.00 54.58 53.83 1dfm n ASN 69 Cb 0.52 -2.77 -0.03 0.00 -1.02 0.00 0.00 39.78 36.49 1dfm n ASN 69 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1dfm s ILE 70 N -3.80 3.32 0.53 2.41 1.01 -0.81 -4.73 121.20 119.13 1dfm s ILE 70 Ca 0.21 0.96 -0.21 0.00 0.00 0.00 0.00 60.65 61.62 1dfm s ILE 70 Cb -0.09 -3.61 -0.06 0.00 0.01 0.00 0.00 42.46 38.71 1dfm s ILE 70 CO 0.91 0.08 1.19 -2.16 0.00 0.00 0.00 174.94 174.95 1dfm s PRO 71 N 0.98 3.34 0.01 2.79 0.04 -1.26 -1.04 135.00 139.86 1dfm s PRO 71 Ca 0.64 1.79 -0.16 0.00 0.04 0.00 0.00 61.00 63.31 1dfm s PRO 71 Cb -0.37 -2.13 -0.06 0.00 0.04 0.00 0.00 34.50 31.99 1dfm s PRO 71 CO 0.31 -0.90 0.45 0.42 0.04 0.00 0.00 177.00 177.32 1dfm s ILE 72 N -1.60 4.97 0.55 0.56 1.01 0.31 -4.83 121.20 122.17 1dfm s ILE 72 Ca 0.71 0.93 -0.21 0.00 0.00 0.00 0.00 60.65 62.08 1dfm s ILE 72 Cb -0.29 -3.76 -0.05 0.00 0.01 0.00 0.00 42.46 38.37 1dfm s ILE 72 CO 0.33 0.56 1.23 -2.65 0.00 0.00 0.00 174.94 174.41 1dfm n PRO 73 N 1.87 1.45 -0.32 2.79 -0.02 -1.26 -4.77 135.00 134.74 1dfm n PRO 73 Ca -0.13 0.54 0.18 0.00 -2.02 0.00 0.00 63.50 62.07 1dfm n PRO 73 Cb 0.52 -2.42 0.38 0.00 -0.02 0.00 0.00 33.50 31.96 1dfm n PRO 73 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1dfm h LYS 74 N 1.19 0.30 0.00 -0.52 1.57 -1.97 0.13 116.57 117.27 1dfm h LYS 74 Ca -0.50 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 1dfm h LYS 74 Cb 1.32 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.56 1dfm h LYS 74 CO 0.55 0.20 0.00 2.89 -0.57 0.00 0.00 179.45 182.52 1dfm n ARG 75 N -5.10 0.05 -0.36 3.15 0.00 -1.26 -1.47 116.66 111.67 1dfm n ARG 75 Ca 0.26 0.41 0.07 0.00 -0.00 0.00 0.00 57.85 58.60 1dfm n ARG 75 Cb 0.82 -1.63 0.12 0.00 -0.00 0.00 0.00 32.46 31.77 1dfm n ARG 75 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 1dfm n PHE 76 N -1.73 0.00 0.29 2.89 3.72 0.42 -4.82 117.46 118.22 1dfm n PHE 76 Ca 0.01 -0.91 0.15 0.00 -0.05 0.00 0.00 57.45 56.65 1dfm n PHE 76 Cb 0.11 -0.16 0.90 0.00 -0.94 0.00 0.00 39.48 39.39 1dfm n PHE 76 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 1dfm h ASP 77 N 0.29 0.00 0.64 4.37 2.03 -0.96 0.19 116.42 122.99 1dfm h ASP 77 Ca -0.02 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.28 1dfm h ASP 77 Cb 1.13 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.63 1dfm h ASP 77 CO 0.01 0.00 0.00 2.22 -1.03 0.00 0.00 179.24 180.44 1dfm n PHE 78 N -3.86 0.00 0.83 4.15 1.16 -1.26 -1.95 117.46 116.53 1dfm n PHE 78 Ca -0.02 0.00 0.12 0.00 -1.87 0.00 0.00 57.45 55.67 1dfm n PHE 78 Cb 0.11 -0.47 0.14 0.00 -1.61 0.00 0.00 39.48 37.65 1dfm n PHE 78 CO 0.00 0.00 0.00 1.28 -1.87 0.00 0.00 176.76 176.17 1dfm n LEU 79 N -1.47 0.61 0.00 5.98 4.77 0.67 -5.05 117.00 122.52 1dfm n LEU 79 Ca 0.06 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1dfm n LEU 79 Cb 0.22 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1dfm n LEU 79 CO 0.18 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1dfm n GLY 80 N 1.45 1.67 0.11 -0.72 0.00 -0.82 -4.98 105.19 101.90 1dfm n GLY 80 Ca 0.04 -1.63 -0.15 0.00 0.00 0.00 0.00 46.02 44.29 1dfm n GLY 80 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1dfm n THR 81 N -1.67 1.57 -3.84 2.61 -2.24 -1.26 -4.46 114.28 104.99 1dfm n THR 81 Ca 0.00 -0.71 -0.07 0.00 -2.27 0.00 0.00 64.05 61.00 1dfm n THR 81 Cb 0.00 -1.19 -0.01 0.00 -2.10 0.00 0.00 70.33 67.03 1dfm n THR 81 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1dfm s ASP 82 N -6.31 -0.19 0.01 3.42 -4.77 -1.26 -0.53 116.67 107.04 1dfm s ASP 82 Ca -0.19 -0.72 0.08 0.00 -3.30 0.00 0.00 52.55 48.41 1dfm s ASP 82 Cb 0.07 0.74 -0.03 0.00 -1.09 0.00 0.00 42.92 42.62 1dfm s ASP 82 CO 0.75 -1.39 -0.24 -0.63 0.70 0.00 0.00 175.17 174.35 1dfm s ILE 83 N -3.46 2.25 0.13 2.11 1.01 -0.21 -4.87 121.20 118.17 1dfm s ILE 83 Ca 0.12 -1.19 -0.26 0.00 0.00 0.00 0.00 60.65 59.32 1dfm s ILE 83 Cb -0.05 -1.84 -0.03 0.00 0.01 0.00 0.00 42.46 40.55 1dfm s ILE 83 CO 0.08 0.47 1.62 0.44 0.00 0.00 0.00 174.94 177.55 1dfm h ASP 84 N 5.11 -0.91 -5.12 3.58 3.32 -1.89 -2.10 116.42 118.41 1dfm h ASP 84 Ca -0.45 0.13 -0.09 0.00 0.02 0.00 0.00 57.03 56.65 1dfm h ASP 84 Cb 1.13 0.39 -0.15 0.00 0.22 0.00 0.00 39.33 40.92 1dfm h ASP 84 CO 0.46 -0.35 -0.32 -0.36 -1.72 0.00 0.00 179.24 176.96 1dfm s PHE 85 N -6.02 0.05 -0.08 4.55 0.08 -0.75 -0.77 117.98 115.04 1dfm s PHE 85 Ca -0.15 -0.39 -0.25 0.00 0.12 0.00 0.00 56.93 56.25 1dfm s PHE 85 Cb 0.10 0.01 0.06 0.00 -0.57 0.00 0.00 43.02 42.62 1dfm s PHE 85 CO 0.66 -0.54 0.58 0.20 -0.10 0.00 0.00 175.22 176.02 1dfm s GLY 86 N -2.61 -0.46 -0.17 4.36 0.00 -0.33 -0.85 107.32 107.27 1dfm s GLY 86 Ca 0.02 1.16 -0.09 0.00 0.00 0.00 0.00 44.72 45.81 1dfm s GLY 86 CO -0.09 0.86 0.40 1.25 0.00 0.00 0.00 173.10 175.52 1dfm s LYS 87 N -0.93 0.38 2.38 2.90 2.20 -0.75 -0.27 119.74 125.66 1dfm s LYS 87 Ca -0.09 0.77 0.00 0.00 -0.36 0.00 0.00 55.97 56.28 1dfm s LYS 87 Cb -0.02 -0.02 0.00 0.00 -1.51 0.00 0.00 37.83 36.28 1dfm s LYS 87 CO 0.07 -0.16 0.00 0.54 -0.36 0.00 0.00 175.35 175.44 1dfm n ARG 88 N 4.22 0.00 -0.41 4.03 1.74 -1.25 -1.23 116.66 123.76 1dfm n ARG 88 Ca -0.23 0.00 0.11 0.00 -0.77 0.00 0.00 57.85 56.95 1dfm n ARG 88 Cb 0.55 0.00 0.31 0.00 -1.02 0.00 0.00 32.46 32.31 1dfm n ARG 88 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1dfm n ASP 89 N 6.27 4.06 -4.27 0.55 5.68 -1.26 -1.77 116.55 125.81 1dfm n ASP 89 Ca 0.00 -2.12 -0.32 0.00 -0.50 0.00 0.00 54.79 51.85 1dfm n ASP 89 Cb 0.00 -0.49 -0.16 0.00 -1.14 0.00 0.00 41.12 39.33 1dfm n ASP 89 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1dfm s THR 90 N -1.23 2.38 0.03 2.12 2.01 -0.36 -0.07 115.64 120.52 1dfm s THR 90 Ca 0.47 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.57 1dfm s THR 90 Cb 0.26 -1.94 -0.04 0.00 0.01 0.00 0.00 72.50 70.79 1dfm s THR 90 CO 0.29 0.55 0.07 -0.22 -0.69 0.00 0.00 174.62 174.63 1dfm s LEU 91 N 0.33 3.83 -0.03 4.42 0.20 -0.78 -1.80 118.68 124.85 1dfm s LEU 91 Ca -0.16 0.08 0.02 0.00 0.69 0.00 0.00 54.13 54.76 1dfm s LEU 91 Cb -0.17 -2.34 0.01 0.00 -0.43 0.00 0.00 46.19 43.26 1dfm s LEU 91 CO 0.08 0.24 -0.07 -0.69 -0.29 0.00 0.00 176.35 175.61 1dfm s VAL 92 N -1.26 0.65 -0.07 1.68 1.01 -0.03 -0.93 120.40 121.46 1dfm s VAL 92 Ca 0.25 -0.27 0.04 0.00 0.00 0.00 0.00 61.98 62.00 1dfm s VAL 92 Cb -0.12 -0.60 0.00 0.00 0.00 0.00 0.00 36.38 35.66 1dfm s VAL 92 CO 0.17 0.22 -0.20 -1.61 0.00 0.00 0.00 175.10 173.67 1dfm s GLU 93 N 0.36 2.40 -0.30 2.72 0.41 -0.09 -1.81 118.70 122.38 1dfm s GLU 93 Ca -0.05 -0.72 -0.08 0.00 -0.41 0.00 0.00 54.97 53.70 1dfm s GLU 93 Cb -0.09 -1.92 -0.01 0.00 -1.78 0.00 0.00 34.13 30.33 1dfm s GLU 93 CO 0.00 0.19 0.12 0.08 -0.49 0.00 0.00 175.26 175.17 1dfm s VAL 94 N 0.26 4.37 -0.34 2.63 1.01 -1.26 -0.99 120.40 126.08 1dfm s VAL 94 Ca -0.12 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.42 1dfm s VAL 94 Cb -0.15 -3.20 0.10 0.00 0.00 0.00 0.00 36.38 33.13 1dfm s VAL 94 CO 0.05 0.12 0.10 -1.58 0.00 0.00 0.00 175.10 173.79 1dfm s GLN 95 N 1.58 1.12 -0.01 2.72 2.00 0.14 -4.86 119.66 122.35 1dfm s GLN 95 Ca 0.04 -1.55 0.04 0.00 -2.00 0.00 0.00 55.36 51.90 1dfm s GLN 95 Cb -0.17 -2.55 0.12 0.00 0.80 0.00 0.00 33.01 31.21 1dfm s GLN 95 CO 0.05 -0.99 1.09 1.19 -0.50 0.00 0.00 175.29 176.13 1dfm n PHE 96 N 4.41 0.16 -0.55 1.67 3.72 -1.26 -4.64 117.46 120.97 1dfm n PHE 96 Ca 0.02 -0.53 0.00 0.00 -0.05 0.00 0.00 57.45 56.89 1dfm n PHE 96 Cb 0.41 -0.05 0.00 0.00 -0.94 0.00 0.00 39.48 38.90 1dfm n PHE 96 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1dfm n SER 97 N -0.22 0.00 -4.77 4.37 2.88 -1.26 -4.39 113.62 110.23 1dfm n SER 97 Ca 0.05 -0.24 -0.34 0.00 -1.33 0.00 0.00 58.87 57.00 1dfm n SER 97 Cb 0.33 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.81 1dfm n SER 97 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1dfm s ASN 98 N -1.00 5.45 0.45 -3.46 6.03 -1.26 -1.01 114.94 120.14 1dfm s ASN 98 Ca 0.00 2.07 0.25 0.00 -1.03 0.00 0.00 52.86 54.16 1dfm s ASN 98 Cb 0.00 -2.56 1.28 0.00 -3.03 0.00 0.00 41.25 36.94 1dfm s ASN 98 CO 0.00 -1.40 1.78 0.10 -2.03 0.00 0.00 177.10 175.55 1dfm h TYR 99 N 0.62 0.41 0.00 1.54 -0.00 -1.17 -0.42 116.97 117.95 1dfm h TYR 99 Ca -0.48 0.01 0.00 0.00 0.00 0.00 0.00 58.73 58.26 1dfm h TYR 99 Cb 1.25 -0.12 0.00 0.00 0.00 0.00 0.00 36.73 37.86 1dfm h TYR 99 CO 0.53 0.02 0.00 -1.00 -0.00 0.00 0.00 178.16 177.72 1dfm h PRO 100 N 0.23 0.00 0.00 0.10 0.13 -1.90 -1.24 132.00 129.32 1dfm h PRO 100 Ca 0.59 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.71 1dfm h PRO 100 Cb 1.82 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.95 1dfm h PRO 100 CO -0.20 0.00 -0.03 0.74 -0.23 0.00 0.00 178.00 178.28 1dfm h PHE 101 N 0.00 0.00 -0.20 1.56 0.04 -1.41 -1.99 116.94 114.94 1dfm h PHE 101 Ca 0.00 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.77 1dfm h PHE 101 Cb 0.07 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.21 1dfm h PHE 101 CO 0.00 0.03 0.13 1.25 -0.60 0.00 0.00 178.31 179.12 1dfm h LEU 102 N 0.00 0.24 -0.46 1.54 7.12 -1.43 0.12 115.31 122.45 1dfm h LEU 102 Ca -0.00 -0.04 -0.17 0.00 0.13 0.00 0.00 57.88 57.80 1dfm h LEU 102 Cb 0.15 -0.06 -0.01 0.00 -0.53 0.00 0.00 40.66 40.21 1dfm h LEU 102 CO 0.00 0.21 -0.73 -0.07 -0.13 0.00 0.00 178.44 177.73 1dfm h LEU 103 N 0.25 0.34 -0.36 2.25 3.38 -1.56 0.63 115.31 120.24 1dfm h LEU 103 Ca 0.07 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 1dfm h LEU 103 Cb 0.01 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1dfm h LEU 103 CO -0.01 0.95 0.21 -1.13 0.09 0.00 0.00 178.44 178.55 1dfm h ASN 104 N 0.19 0.44 -0.15 -0.43 -0.73 -1.28 -0.60 115.58 113.02 1dfm h ASN 104 Ca -0.03 -0.06 -0.13 0.00 1.87 0.00 0.00 56.30 57.95 1dfm h ASN 104 Cb 1.29 -0.11 -0.01 0.00 0.27 0.00 0.00 38.32 39.76 1dfm h ASN 104 CO 0.12 0.37 -0.35 0.78 -0.37 0.00 0.00 177.43 177.98 1dfm h ASN 105 N 0.46 0.69 0.06 1.15 -0.26 -0.52 -0.75 115.58 116.41 1dfm h ASN 105 Ca 0.13 -0.29 -0.00 0.00 -0.56 0.00 0.00 56.30 55.58 1dfm h ASN 105 Cb 0.02 -0.19 0.00 0.00 -1.06 0.00 0.00 38.32 37.09 1dfm h ASN 105 CO -0.02 0.98 -0.03 0.74 -1.06 0.00 0.00 177.43 178.04 1dfm h THR 106 N 0.55 1.16 -0.48 2.81 2.02 -0.77 -2.14 112.91 116.06 1dfm h THR 106 Ca 0.06 -0.72 -0.04 0.00 0.77 0.00 0.00 66.41 66.47 1dfm h THR 106 Cb 0.86 1.63 -0.02 0.00 -1.74 0.00 0.00 68.15 68.88 1dfm h THR 106 CO 0.07 0.18 0.14 0.58 0.37 0.00 0.00 175.52 176.87 1dfm h VAL 107 N -0.40 1.23 -0.18 3.16 2.07 -1.06 -0.91 116.25 120.16 1dfm h VAL 107 Ca -0.01 -0.78 -0.08 0.00 0.82 0.00 0.00 66.70 66.66 1dfm h VAL 107 Cb 0.35 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1dfm h VAL 107 CO 0.01 0.28 -0.23 0.08 0.02 0.00 0.00 177.57 177.73 1dfm h ARG 108 N 0.65 0.32 -0.35 1.57 0.11 -1.16 -1.11 114.38 114.41 1dfm h ARG 108 Ca 0.15 -0.11 -0.07 0.00 0.10 0.00 0.00 59.98 60.06 1dfm h ARG 108 Cb 0.28 -0.03 -0.02 0.00 1.11 0.00 0.00 29.97 31.32 1dfm h ARG 108 CO -0.00 0.54 -0.06 0.77 0.10 0.00 0.00 179.97 181.31 1dfm h SER 109 N 0.29 0.55 -0.36 0.08 0.02 -1.06 0.74 113.55 113.82 1dfm h SER 109 Ca 0.05 -0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 60.85 1dfm h SER 109 Cb 0.57 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.95 1dfm h SER 109 CO 0.04 0.67 0.16 -0.08 -1.14 0.00 0.00 176.83 176.47 1dfm h GLU 110 N 0.54 0.53 -0.45 3.45 4.57 -0.29 -1.26 114.58 121.66 1dfm h GLU 110 Ca 0.11 -0.09 -0.07 0.00 -1.18 0.00 0.00 59.36 58.13 1dfm h GLU 110 Cb 0.44 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.93 1dfm h GLU 110 CO 0.02 0.50 -0.00 -0.07 -1.18 0.00 0.00 179.01 178.28 1dfm h LEU 111 N 0.43 0.79 -0.62 1.64 3.38 -0.57 -0.83 115.31 119.53 1dfm h LEU 111 Ca 0.12 -0.31 0.05 0.00 0.09 0.00 0.00 57.88 57.84 1dfm h LEU 111 Cb 0.16 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 1dfm h LEU 111 CO -0.01 0.90 0.34 -0.26 0.09 0.00 0.00 178.44 179.50 1dfm h PHE 112 N 0.65 0.63 -0.66 1.13 0.04 -0.73 -2.37 116.94 115.63 1dfm h PHE 112 Ca 0.13 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.90 1dfm h PHE 112 Cb 0.50 -0.19 -0.03 0.00 2.20 0.00 0.00 35.95 38.43 1dfm h PHE 112 CO 0.04 0.31 0.32 1.25 -0.60 0.00 0.00 178.31 179.62 1dfm h HIS 113 N 0.64 0.94 -0.66 -0.55 2.76 -0.87 -0.27 115.15 117.14 1dfm h HIS 113 Ca 0.28 -0.04 -0.03 0.00 -2.20 0.00 0.00 60.37 58.38 1dfm h HIS 113 Cb 0.16 -0.29 -0.03 0.00 1.55 0.00 0.00 27.41 28.80 1dfm h HIS 113 CO -0.08 0.70 0.31 0.87 -1.30 0.00 0.00 177.93 178.43 1dfm h LYS 114 N 0.91 0.94 0.00 5.26 1.57 -0.78 -2.21 116.57 122.26 1dfm h LYS 114 Ca 0.23 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1dfm h LYS 114 Cb 0.11 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.25 1dfm h LYS 114 CO -0.03 0.74 -0.33 -1.13 -0.57 0.00 0.00 179.45 178.13 1dfm n SER 115 N -4.33 0.34 -0.88 0.86 3.41 -0.93 -5.11 113.62 106.98 1dfm n SER 115 Ca 0.06 0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 1dfm n SER 115 Cb 0.14 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 1dfm n SER 115 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1dfm n ASN 116 N -1.52 -5.24 -4.32 4.04 5.15 -0.13 -5.09 115.26 108.15 1dfm n ASN 116 Ca 0.06 0.68 -0.30 0.00 -0.60 0.00 0.00 54.58 54.42 1dfm n ASN 116 Cb 0.34 -2.13 -0.15 0.00 -0.53 0.00 0.00 39.78 37.31 1dfm n ASN 116 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 1dfm s ASP 118 N -2.55 3.04 -0.05 1.20 1.01 -1.26 -4.71 116.67 113.34 1dfm s ASP 118 Ca 0.00 -0.54 -0.09 0.00 0.71 0.00 0.00 52.55 52.63 1dfm s ASP 118 Cb 0.00 -0.29 -0.03 0.00 1.01 0.00 0.00 42.92 43.61 1dfm s ASP 118 CO 0.00 0.27 -0.17 -0.38 0.21 0.00 0.00 175.17 175.10 1dfm n ILE 119 N 2.00 1.12 -3.43 0.77 5.41 0.14 -4.87 119.36 120.50 1dfm n ILE 119 Ca -0.17 0.26 -0.27 0.00 1.00 0.00 0.00 62.75 63.58 1dfm n ILE 119 Cb 0.52 -1.89 -0.10 0.00 -0.71 0.00 0.00 39.64 37.46 1dfm n ILE 119 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1dfm n ASP 120 N -3.76 0.38 -3.63 4.38 2.03 -0.73 -4.87 116.55 110.35 1dfm n ASP 120 Ca -0.07 -2.61 -0.29 0.00 0.52 0.00 0.00 54.79 52.34 1dfm n ASP 120 Cb 0.25 -0.61 0.04 0.00 -0.72 0.00 0.00 41.12 40.09 1dfm n ASP 120 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1dfm n GLU 121 N 2.33 -1.29 0.00 -0.67 1.02 -1.26 -3.96 120.64 116.80 1dfm n GLU 121 Ca 0.27 0.54 0.00 0.00 -0.02 0.00 0.00 57.16 57.95 1dfm n GLU 121 Cb 0.47 -4.22 0.00 0.00 -0.02 0.00 0.00 31.44 27.66 1dfm n GLU 121 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1dfm n GLU 122 N -3.95 0.00 0.00 3.49 2.13 -1.26 -4.96 120.64 116.09 1dfm n GLU 122 Ca -0.09 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.73 1dfm n GLU 122 Cb 0.59 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.30 1dfm n GLU 122 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1dfm n GLY 123 N -0.29 -1.49 0.00 8.31 0.00 -1.26 0.28 105.19 110.74 1dfm n GLY 123 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1dfm n GLY 123 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dfm n LYS 125 N 0.00 0.00 -3.55 1.61 5.02 0.90 -4.52 118.16 117.62 1dfm n LYS 125 Ca 0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.12 1dfm n LYS 125 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 34.95 1dfm n LYS 125 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1dfm s VAL 126 N -0.07 0.01 0.02 -0.18 0.11 -1.14 -4.32 120.40 114.83 1dfm s VAL 126 Ca 0.00 -0.09 0.08 0.00 -2.93 0.00 0.00 61.98 59.04 1dfm s VAL 126 Cb 0.00 -0.95 -0.02 0.00 -1.53 0.00 0.00 36.38 33.88 1dfm s VAL 126 CO 0.00 -0.05 -0.24 0.00 -3.33 0.00 0.00 175.10 171.48 1dfm s ALA 127 N -1.50 2.05 -0.13 1.54 0.00 -0.50 -1.87 121.76 121.35 1dfm s ALA 127 Ca -0.10 -1.14 0.01 0.00 0.00 0.00 0.00 51.96 50.74 1dfm s ALA 127 Cb -0.01 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.65 1dfm s ALA 127 CO 0.07 0.49 -0.17 0.42 0.00 0.00 0.00 175.76 176.56 1dfm s ILE 128 N -0.71 2.60 -0.19 0.00 1.01 -0.10 -0.69 121.20 123.12 1dfm s ILE 128 Ca 0.10 -0.82 0.00 0.00 0.00 0.00 0.00 60.65 59.94 1dfm s ILE 128 Cb -0.09 -2.06 0.01 0.00 0.01 0.00 0.00 42.46 40.33 1dfm s ILE 128 CO 0.01 0.53 -0.17 -0.63 0.00 0.00 0.00 174.94 174.68 1dfm s ILE 129 N 0.49 2.28 -0.20 2.92 1.01 -0.40 -0.92 121.20 126.39 1dfm s ILE 129 Ca -0.12 -0.86 -0.09 0.00 0.00 0.00 0.00 60.65 59.57 1dfm s ILE 129 Cb -0.16 -1.97 -0.05 0.00 0.01 0.00 0.00 42.46 40.28 1dfm s ILE 129 CO 0.05 0.52 0.12 -0.63 0.00 0.00 0.00 174.94 175.00 1dfm s ILE 130 N 1.31 5.26 0.17 2.92 1.01 -0.16 -0.67 121.20 131.04 1dfm s ILE 130 Ca 0.05 0.14 -0.00 0.00 0.00 0.00 0.00 60.65 60.83 1dfm s ILE 130 Cb -0.13 -3.40 -0.04 0.00 0.01 0.00 0.00 42.46 38.90 1dfm s ILE 130 CO -0.11 0.43 0.07 0.42 0.00 0.00 0.00 174.94 175.75 1dfm s THR 131 N 0.44 0.24 0.03 2.92 -4.23 0.01 -0.69 115.64 114.37 1dfm s THR 131 Ca 0.07 -1.96 0.01 0.00 -1.18 0.00 0.00 61.69 58.63 1dfm s THR 131 Cb -0.12 -2.25 -0.04 0.00 1.34 0.00 0.00 72.50 71.44 1dfm s THR 131 CO -0.01 -0.29 0.09 -1.59 -0.54 0.00 0.00 174.62 172.28 1dfm s LYS 132 N -4.05 3.04 0.67 3.99 -2.85 -1.26 -0.29 119.74 118.98 1dfm s LYS 132 Ca 0.30 -0.55 -0.15 0.00 -1.00 0.00 0.00 55.97 54.57 1dfm s LYS 132 Cb 0.07 -2.83 0.00 0.00 -2.06 0.00 0.00 37.83 33.01 1dfm s LYS 132 CO 0.06 0.61 1.11 0.20 0.10 0.00 0.00 175.35 177.44 1dfm s GLY 133 N -2.04 2.12 0.00 0.59 0.00 0.04 -0.31 107.32 107.72 1dfm s GLY 133 Ca 0.26 0.53 0.00 0.00 0.00 0.00 0.00 44.72 45.51 1dfm s GLY 133 CO 0.18 0.88 0.50 1.57 0.00 0.00 0.00 173.10 176.23 1dfm n HIS 134 N -2.49 0.00 0.00 1.90 -0.00 -1.26 -4.77 115.22 108.60 1dfm n HIS 134 Ca 0.10 -0.10 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1dfm n HIS 134 Cb 0.52 -0.39 0.00 0.00 -0.12 0.00 0.00 29.99 30.00 1dfm n HIS 134 CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 1dfm n PHE 136 N 3.15 0.00 -1.99 1.57 3.72 -1.26 -4.74 117.46 117.90 1dfm n PHE 136 Ca 0.00 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.03 1dfm n PHE 136 Cb 0.00 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.56 1dfm n PHE 136 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1dfm s PRO 137 N 0.00 3.25 0.23 -1.08 0.04 -1.26 -4.85 135.00 131.33 1dfm s PRO 137 Ca 0.00 1.97 -0.22 0.00 0.04 0.00 0.00 61.00 62.78 1dfm s PRO 137 Cb 0.00 -2.18 0.04 0.00 0.04 0.00 0.00 34.50 32.40 1dfm s PRO 137 CO 0.00 -1.02 0.84 0.00 0.04 0.00 0.00 177.00 176.86 1dfm s ALA 138 N -1.47 -1.37 0.44 8.56 0.00 -1.26 -0.93 121.76 125.73 1dfm s ALA 138 Ca 0.71 -0.17 -0.24 0.00 0.00 0.00 0.00 51.96 52.26 1dfm s ALA 138 Cb -0.34 0.75 -0.10 0.00 0.00 0.00 0.00 23.12 23.43 1dfm s ALA 138 CO 0.39 -1.04 1.00 -1.13 0.00 0.00 0.00 175.76 174.98 1dfm n SER 139 N -0.57 1.20 -4.73 0.00 3.41 -1.26 -4.88 113.62 106.79 1dfm n SER 139 Ca -0.05 1.01 -0.42 0.00 -0.26 0.00 0.00 58.87 59.15 1dfm n SER 139 Cb 0.60 -1.36 -0.01 0.00 -0.26 0.00 0.00 64.21 63.18 1dfm n SER 139 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1dfm n ASN 140 N 0.38 3.23 0.00 4.04 3.02 -1.26 -2.25 115.26 122.42 1dfm n ASN 140 Ca 0.10 1.20 0.00 0.00 -0.03 0.00 0.00 54.58 55.85 1dfm n ASN 140 Cb 0.40 -1.54 0.00 0.00 -0.61 0.00 0.00 39.78 38.03 1dfm n ASN 140 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1dfm n SER 141 N 0.93 -0.94 -4.77 6.41 7.64 -1.26 -4.98 113.62 116.65 1dfm n SER 141 Ca 0.05 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.52 1dfm n SER 141 Cb 0.37 -1.32 -0.02 0.00 -1.01 0.00 0.00 64.21 62.23 1dfm n SER 141 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1dfm s SER 142 N -2.42 6.70 0.45 6.43 1.04 -0.96 -0.68 113.70 124.26 1dfm s SER 142 Ca 0.00 2.74 -0.24 0.00 0.48 0.00 0.00 55.95 58.93 1dfm s SER 142 Cb 0.00 -2.65 -0.09 0.00 0.10 0.00 0.00 66.02 63.38 1dfm s SER 142 CO 0.00 -0.60 1.20 -0.11 0.98 0.00 0.00 173.24 174.70 1dfm n LEU 143 N 0.90 3.87 -4.19 2.42 7.94 -0.18 -4.66 117.00 123.10 1dfm n LEU 143 Ca 0.01 1.05 -0.14 0.00 -1.11 0.00 0.00 56.01 55.82 1dfm n LEU 143 Cb 0.41 -1.47 -0.11 0.00 0.53 0.00 0.00 43.42 42.79 1dfm n LEU 143 CO 0.60 -0.93 -0.41 -0.72 -1.11 0.00 0.00 177.39 174.82 1dfm s TYR 144 N -1.25 1.07 0.18 1.96 1.13 -1.26 -4.55 117.35 114.62 1dfm s TYR 144 Ca 0.64 -0.71 -0.15 0.00 -1.41 0.00 0.00 57.07 55.44 1dfm s TYR 144 Cb -0.50 -0.58 0.14 0.00 -1.10 0.00 0.00 41.96 39.93 1dfm s TYR 144 CO 0.56 -0.01 1.69 -0.92 -2.51 0.00 0.00 175.55 174.36 1dfm h TYR 145 N 3.34 -0.03 -0.27 -3.49 3.20 -0.96 -2.07 116.97 116.69 1dfm h TYR 145 Ca -0.37 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.48 1dfm h TYR 145 Cb 1.19 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.52 1dfm h TYR 145 CO 0.63 -0.10 -0.07 0.93 -1.64 0.00 0.00 178.16 177.92 1dfm h GLU 146 N 0.11 0.42 -0.29 1.82 3.07 -1.96 0.14 114.58 117.90 1dfm h GLU 146 Ca 0.22 -0.10 -0.10 0.00 -0.50 0.00 0.00 59.36 58.89 1dfm h GLU 146 Cb 0.32 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.17 1dfm h GLU 146 CO -0.37 0.51 -0.20 0.37 -1.40 0.00 0.00 179.01 177.92 1dfm h GLN 147 N 0.40 0.64 -0.66 2.33 4.15 -1.88 -0.86 115.11 119.22 1dfm h GLN 147 Ca 0.08 -0.30 -0.07 0.00 0.77 0.00 0.00 58.65 59.13 1dfm h GLN 147 Cb 0.37 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.03 1dfm h GLN 147 CO 0.02 0.90 0.12 0.00 -1.93 0.00 0.00 178.83 177.94 1dfm h ALA 148 N 0.73 0.96 -0.14 3.38 0.00 -0.65 -1.29 119.26 122.25 1dfm h ALA 148 Ca 0.06 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1dfm h ALA 148 Cb 0.74 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1dfm h ALA 148 CO 0.05 0.66 0.08 1.96 0.00 0.00 0.00 179.25 182.00 1dfm h GLN 149 N 1.02 0.17 -0.62 0.00 4.20 -0.58 -0.05 115.11 119.25 1dfm h GLN 149 Ca 0.21 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.83 1dfm h GLN 149 Cb 0.41 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.13 1dfm h GLN 149 CO 0.01 0.11 0.08 -0.91 -0.67 0.00 0.00 178.83 177.45 1dfm h ASN 150 N 0.18 0.98 -0.11 1.46 -0.26 -0.96 0.51 115.58 117.37 1dfm h ASN 150 Ca 0.05 -0.23 -0.05 0.00 -0.56 0.00 0.00 56.30 55.51 1dfm h ASN 150 Cb -0.01 -0.26 -0.00 0.00 -1.06 0.00 0.00 38.32 36.99 1dfm h ASN 150 CO -0.02 0.99 -0.11 1.56 -1.06 0.00 0.00 177.43 178.79 1dfm h GLN 151 N 0.95 0.27 -0.16 0.81 4.20 -1.03 -2.15 115.11 118.00 1dfm h GLN 151 Ca 0.19 -0.14 -0.08 0.00 0.06 0.00 0.00 58.65 58.68 1dfm h GLN 151 Cb 0.44 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 1dfm h GLN 151 CO 0.01 0.68 -0.24 -0.07 -0.67 0.00 0.00 178.83 178.54 1dfm h LEU 152 N -0.13 0.28 -0.60 1.46 3.38 -0.91 -1.34 115.31 117.45 1dfm h LEU 152 Ca 0.02 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1dfm h LEU 152 Cb 0.62 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 1dfm h LEU 152 CO 0.03 0.53 0.37 0.78 0.09 0.00 0.00 178.44 180.24 1dfm h ASN 153 N 0.26 0.71 -0.37 -0.43 -0.26 -0.82 0.16 115.58 114.84 1dfm h ASN 153 Ca 0.04 -0.05 -0.04 0.00 -0.56 0.00 0.00 56.30 55.70 1dfm h ASN 153 Cb 0.57 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.64 1dfm h ASN 153 CO 0.04 0.55 0.08 -1.28 -1.06 0.00 0.00 177.43 175.75 1dfm h SER 154 N 0.81 0.57 -0.89 5.81 0.87 -0.86 -1.85 113.55 118.01 1dfm h SER 154 Ca 0.22 -0.24 0.03 0.00 -1.23 0.00 0.00 61.79 60.56 1dfm h SER 154 Cb -0.04 -0.15 -0.05 0.00 -0.44 0.00 0.00 62.40 61.72 1dfm h SER 154 CO -0.04 0.67 0.58 -0.07 -0.53 0.00 0.00 176.83 177.43 1dfm h LEU 155 N 0.45 0.96 -0.79 2.23 4.07 -0.97 -2.48 115.31 118.77 1dfm h LEU 155 Ca 0.11 -0.01 -0.06 0.00 0.08 0.00 0.00 57.88 58.00 1dfm h LEU 155 Cb 0.33 -0.22 -0.03 0.00 1.08 0.00 0.00 40.66 41.82 1dfm h LEU 155 CO 0.00 0.67 0.17 0.00 -1.08 0.00 0.00 178.44 178.20 1dfm h ALA 156 N 1.36 1.01 -0.62 1.53 0.00 -0.76 -1.75 119.26 120.04 1dfm h ALA 156 Ca 0.35 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1dfm h ALA 156 Cb -0.01 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 1dfm h ALA 156 CO -0.11 0.64 0.41 1.49 0.00 0.00 0.00 179.25 181.68 1dfm h GLU 157 N 1.02 0.67 -0.63 0.00 4.81 -0.91 -1.77 114.58 117.78 1dfm h GLU 157 Ca 0.21 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 1dfm h GLU 157 Cb 0.35 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.58 1dfm h GLU 157 CO 0.00 0.44 0.00 0.66 -0.73 0.00 0.00 179.01 179.38 1dfm n TYR 158 N -4.47 1.64 -3.36 0.92 4.01 -0.84 -4.95 117.16 110.11 1dfm n TYR 158 Ca 0.08 -0.65 -0.24 0.00 -0.16 0.00 0.00 57.90 56.93 1dfm n TYR 158 Cb 0.17 -0.32 0.02 0.00 -0.31 0.00 0.00 39.34 38.90 1dfm n TYR 158 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1dfm n ASN 159 N 0.98 -4.78 0.03 7.72 3.02 -0.66 -4.90 115.26 116.67 1dfm n ASN 159 Ca 0.26 -0.43 -0.08 0.00 -0.03 0.00 0.00 54.58 54.30 1dfm n ASN 159 Cb 0.98 -3.89 0.07 0.00 -0.61 0.00 0.00 39.78 36.33 1dfm n ASN 159 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1dfm h VAL 160 N -1.36 1.34 -3.96 2.41 2.07 -1.60 -3.45 116.25 111.70 1dfm h VAL 160 Ca -0.49 -1.87 -0.32 0.00 0.82 0.00 0.00 66.70 64.84 1dfm h VAL 160 Cb 1.33 1.86 -0.24 0.00 -1.52 0.00 0.00 31.29 32.73 1dfm h VAL 160 CO 0.57 0.57 -0.75 0.72 0.02 0.00 0.00 177.57 178.70 1dfm s PHE 161 N -3.90 0.72 -0.59 1.57 -0.71 -1.26 -5.04 117.98 108.77 1dfm s PHE 161 Ca -0.06 -0.36 0.13 0.00 -1.04 0.00 0.00 56.93 55.59 1dfm s PHE 161 Cb 0.11 -0.43 -0.14 0.00 -1.21 0.00 0.00 43.02 41.35 1dfm s PHE 161 CO 0.83 -0.04 0.53 -0.25 -1.34 0.00 0.00 175.22 174.95 1dfm n ASP 162 N 1.93 0.63 -4.74 1.98 8.00 -1.26 -4.93 116.55 118.16 1dfm n ASP 162 Ca -0.19 -0.78 -0.41 0.00 0.71 0.00 0.00 54.79 54.11 1dfm n ASP 162 Cb 0.56 1.01 -0.03 0.00 -0.02 0.00 0.00 41.12 42.64 1dfm n ASP 162 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1dfm s VAL 163 N -2.22 2.98 0.13 2.53 0.11 -1.26 -4.85 120.40 117.82 1dfm s VAL 163 Ca 0.05 0.83 -0.31 0.00 -2.93 0.00 0.00 61.98 59.62 1dfm s VAL 163 Cb 0.10 -3.53 -0.08 0.00 -1.53 0.00 0.00 36.38 31.33 1dfm s VAL 163 CO 0.52 0.14 1.36 -2.84 -3.33 0.00 0.00 175.10 170.95 1dfm s PRO 164 N -0.43 4.34 -0.06 1.54 0.02 -1.26 -4.62 135.00 134.53 1dfm s PRO 164 Ca 0.56 2.06 -0.00 0.00 0.02 0.00 0.00 61.00 63.64 1dfm s PRO 164 Cb -0.38 -3.24 0.03 0.00 0.02 0.00 0.00 34.50 30.92 1dfm s PRO 164 CO 0.42 -0.39 -0.02 0.42 -0.33 0.00 0.00 177.00 177.10 1dfm s ILE 165 N 0.87 0.44 -0.38 2.83 1.01 -0.97 -1.41 121.20 123.59 1dfm s ILE 165 Ca 0.63 0.00 -0.15 0.00 0.00 0.00 0.00 60.65 61.13 1dfm s ILE 165 Cb -0.36 -0.53 0.00 0.00 0.01 0.00 0.00 42.46 41.57 1dfm s ILE 165 CO 0.32 0.24 0.31 -0.60 0.00 0.00 0.00 174.94 175.21 1dfm s ARG 166 N 1.42 3.27 -0.16 2.79 3.52 0.13 -0.39 118.95 129.53 1dfm s ARG 166 Ca -0.03 -0.74 -0.16 0.00 -0.13 0.00 0.00 55.73 54.67 1dfm s ARG 166 Cb -0.13 -3.89 -0.04 0.00 -1.56 0.00 0.00 34.95 29.33 1dfm s ARG 166 CO -0.03 -0.62 0.39 -1.17 -0.81 0.00 0.00 175.30 173.06 1dfm s LEU 167 N 1.83 4.22 -0.08 -0.88 2.96 0.65 -1.27 118.68 126.10 1dfm s LEU 167 Ca 0.08 0.61 0.02 0.00 -0.22 0.00 0.00 54.13 54.62 1dfm s LEU 167 Cb -0.18 -2.53 -0.02 0.00 0.50 0.00 0.00 46.19 43.96 1dfm s LEU 167 CO 0.11 -0.00 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.30 1dfm s VAL 168 N 0.86 2.95 -0.13 1.68 1.01 0.15 -1.03 120.40 125.89 1dfm s VAL 168 Ca 0.20 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.47 1dfm s VAL 168 Cb -0.14 -2.18 0.01 0.00 0.00 0.00 0.00 36.38 34.07 1dfm s VAL 168 CO 0.07 0.56 -0.22 -0.83 0.00 0.00 0.00 175.10 174.69 1dfm s GLY 169 N -0.24 1.34 -0.13 4.51 0.00 0.49 -0.81 107.32 112.48 1dfm s GLY 169 Ca 0.01 -1.07 -0.24 0.00 0.00 0.00 0.00 44.72 43.43 1dfm s GLY 169 CO 0.03 -0.04 0.74 1.08 0.00 0.00 0.00 173.10 174.91 1dfm s LEU 170 N 0.78 4.23 0.31 0.66 1.43 0.60 -0.94 118.68 125.74 1dfm s LEU 170 Ca -0.08 1.11 0.03 0.00 -1.03 0.00 0.00 54.13 54.16 1dfm s LEU 170 Cb -0.16 -3.10 -0.02 0.00 0.03 0.00 0.00 46.19 42.93 1dfm s LEU 170 CO -0.01 -0.26 0.30 0.27 0.23 0.00 0.00 176.35 176.88 1dfm s ILE 171 N 1.56 0.00 0.14 -0.59 -4.36 0.12 -0.78 121.20 117.28 1dfm s ILE 171 Ca 0.36 -1.90 -0.12 0.00 -0.26 0.00 0.00 60.65 58.74 1dfm s ILE 171 Cb -0.17 -2.52 0.01 0.00 1.25 0.00 0.00 42.46 41.03 1dfm s ILE 171 CO 0.14 0.00 0.31 -1.61 0.24 0.00 0.00 174.94 174.03 1dfm s GLU 172 N -3.51 1.07 0.46 0.37 0.41 -1.26 -0.84 118.70 115.40 1dfm s GLU 172 Ca 0.38 -0.96 -0.21 0.00 -0.41 0.00 0.00 54.97 53.76 1dfm s GLU 172 Cb 0.03 0.41 -0.09 0.00 -1.78 0.00 0.00 34.13 32.70 1dfm s GLU 172 CO 0.23 -0.40 1.04 -0.51 -0.49 0.00 0.00 175.26 175.13 1dfm s ASP 173 N -2.89 6.48 0.60 -0.19 1.01 -1.26 -5.03 116.67 115.39 1dfm s ASP 173 Ca 0.09 1.95 -0.12 0.00 0.71 0.00 0.00 52.55 55.18 1dfm s ASP 173 Cb 0.03 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.34 1dfm s ASP 173 CO -0.06 -0.69 1.02 -0.36 0.21 0.00 0.00 175.17 175.29 1dfm s PHE 174 N -1.90 3.59 -1.61 4.23 0.08 -1.26 -4.25 117.98 116.86 1dfm s PHE 174 Ca 0.64 1.32 -0.09 0.00 0.12 0.00 0.00 56.93 58.92 1dfm s PHE 174 Cb -0.18 -2.73 0.09 0.00 -0.57 0.00 0.00 43.02 39.63 1dfm s PHE 174 CO 0.22 -0.62 0.43 0.39 -0.10 0.00 0.00 175.22 175.54 1dfm n GLU 175 N -2.50 -2.13 -4.28 0.44 -0.58 0.40 -4.93 120.64 107.06 1dfm n GLU 175 Ca 0.06 0.26 -0.19 0.00 -0.42 0.00 0.00 57.16 56.87 1dfm n GLU 175 Cb 0.54 -4.45 -0.15 0.00 -0.57 0.00 0.00 31.44 26.81 1dfm n GLU 175 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1dfm s THR 176 N -3.78 0.64 -0.02 2.62 2.01 -1.26 -5.02 115.64 110.82 1dfm s THR 176 Ca 0.35 -0.26 -0.30 0.00 0.31 0.00 0.00 61.69 61.79 1dfm s THR 176 Cb -0.20 -0.59 -0.06 0.00 0.01 0.00 0.00 72.50 71.67 1dfm s THR 176 CO 0.96 0.21 1.52 -0.62 -0.69 0.00 0.00 174.62 176.00 1dfm s ASP 177 N 0.34 6.75 0.11 3.53 2.15 -1.26 -4.44 116.67 123.84 1dfm s ASP 177 Ca -0.05 2.18 0.00 0.00 0.43 0.00 0.00 52.55 55.12 1dfm s ASP 177 Cb -0.09 -2.55 -0.04 0.00 -0.30 0.00 0.00 42.92 39.94 1dfm s ASP 177 CO 0.00 -0.83 -0.00 0.27 -0.17 0.00 0.00 175.17 174.44 1dfm s ILE 178 N 3.15 0.36 0.15 4.11 -4.36 -0.11 -4.99 121.20 119.50 1dfm s ILE 178 Ca 0.68 -1.90 -0.14 0.00 -0.26 0.00 0.00 60.65 59.03 1dfm s ILE 178 Cb -0.33 -1.84 -0.07 0.00 1.25 0.00 0.00 42.46 41.48 1dfm s ILE 178 CO 0.27 -0.70 0.54 -1.81 0.24 0.00 0.00 174.94 173.49 1dfm s ASP 179 N -3.03 6.81 -0.00 4.36 1.01 -1.26 -1.01 116.67 123.54 1dfm s ASP 179 Ca 0.17 1.06 0.00 0.00 0.71 0.00 0.00 52.55 54.50 1dfm s ASP 179 Cb 0.07 -2.28 0.00 0.00 1.01 0.00 0.00 42.92 41.72 1dfm s ASP 179 CO -0.02 0.10 -0.01 -0.63 0.21 0.00 0.00 175.17 174.81 1dfm s ILE 180 N -1.47 0.13 -0.17 0.77 1.01 0.09 -4.10 121.20 117.45 1dfm s ILE 180 Ca 0.38 -0.05 -0.16 0.00 0.00 0.00 0.00 60.65 60.81 1dfm s ILE 180 Cb -0.15 -0.12 -0.04 0.00 0.01 0.00 0.00 42.46 42.16 1dfm s ILE 180 CO 0.19 0.04 0.40 -0.69 0.00 0.00 0.00 174.94 174.88 1dfm s VAL 181 N 0.05 5.22 -0.18 2.92 1.01 0.33 -1.14 120.40 128.61 1dfm s VAL 181 Ca -0.00 0.74 -0.02 0.00 0.00 0.00 0.00 61.98 62.70 1dfm s VAL 181 Cb -0.02 -3.73 -0.00 0.00 0.00 0.00 0.00 36.38 32.63 1dfm s VAL 181 CO -0.00 0.29 -0.11 -0.55 0.00 0.00 0.00 175.10 174.74 1dfm s SER 182 N 0.83 3.94 0.00 3.32 0.15 -0.06 -0.90 113.70 120.98 1dfm s SER 182 Ca 0.20 -0.43 0.08 0.00 0.70 0.00 0.00 55.95 56.50 1dfm s SER 182 Cb -0.14 -1.64 -0.02 0.00 -1.71 0.00 0.00 66.02 62.51 1dfm s SER 182 CO 0.08 0.04 -0.26 -0.89 1.20 0.00 0.00 173.24 173.41 1dfm s THR 183 N 1.08 2.04 -0.09 6.45 2.01 -0.77 -1.68 115.64 124.68 1dfm s THR 183 Ca 0.00 -1.18 0.03 0.00 0.31 0.00 0.00 61.69 60.85 1dfm s THR 183 Cb -0.15 -1.71 -0.01 0.00 0.01 0.00 0.00 72.50 70.65 1dfm s THR 183 CO -0.03 0.50 -0.18 -0.89 -0.69 0.00 0.00 174.62 173.33 1dfm s THR 184 N -0.66 2.62 0.34 -0.82 2.01 0.60 -4.49 115.64 115.24 1dfm s THR 184 Ca 0.10 -0.84 0.08 0.00 0.31 0.00 0.00 61.69 61.34 1dfm s THR 184 Cb -0.10 -2.04 -0.03 0.00 0.01 0.00 0.00 72.50 70.34 1dfm s THR 184 CO -0.00 0.55 0.25 -0.31 -0.69 0.00 0.00 174.62 174.43 1dfm s TYR 185 N 0.03 2.84 -0.26 4.92 2.02 -1.26 -0.23 117.35 125.40 1dfm s TYR 185 Ca -0.07 -0.34 0.25 0.00 -0.37 0.00 0.00 57.07 56.55 1dfm s TYR 185 Cb -0.15 -1.78 1.17 0.00 -0.40 0.00 0.00 41.96 40.81 1dfm s TYR 185 CO 0.05 0.21 1.76 0.00 -1.57 0.00 0.00 175.55 176.00 1dfm h ALA 186 N 1.32 1.00 -2.25 3.71 0.00 -1.14 -3.43 119.26 118.46 1dfm h ALA 186 Ca -0.44 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.31 1dfm h ALA 186 Cb 1.25 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.89 1dfm h ALA 186 CO 0.60 0.00 -0.69 -0.51 0.00 0.00 0.00 179.25 178.65 1dfm s ASP 187 N -4.38 0.69 0.50 0.00 1.01 -1.26 -5.05 116.67 108.19 1dfm s ASP 187 Ca 0.01 -0.99 0.32 0.00 0.71 0.00 0.00 52.55 52.60 1dfm s ASP 187 Cb 0.08 0.16 1.24 0.00 1.01 0.00 0.00 42.92 45.42 1dfm s ASP 187 CO 0.35 -0.55 1.92 0.11 0.21 0.00 0.00 175.17 177.21 1dfm h LYS 188 N 3.12 0.00 -3.81 8.23 1.57 -1.99 -3.40 116.57 120.30 1dfm h LYS 188 Ca -0.34 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.22 1dfm h LYS 188 Cb 1.15 0.00 -0.26 0.00 0.08 0.00 0.00 32.23 33.19 1dfm h LYS 188 CO 0.65 0.00 -0.72 1.03 -0.57 0.00 0.00 179.45 179.84 1dfm s ARG 189 N -3.58 0.08 0.00 3.15 0.52 -1.26 -4.61 118.95 113.24 1dfm s ARG 189 Ca 0.02 -0.14 0.00 0.00 -0.52 0.00 0.00 55.73 55.09 1dfm s ARG 189 Cb 0.09 0.01 0.00 0.00 0.52 0.00 0.00 34.95 35.57 1dfm s ARG 189 CO 0.54 -0.01 0.00 0.66 0.02 0.00 0.00 175.30 176.51 1dfm n TYR 190 N 2.75 0.00 -1.95 -0.53 4.01 -1.26 -4.97 117.16 115.21 1dfm n TYR 190 Ca -0.15 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.20 1dfm n TYR 190 Cb 0.59 -0.33 0.01 0.00 -0.31 0.00 0.00 39.34 39.30 1dfm n TYR 190 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1dfm s SER 191 N -1.21 5.95 0.00 7.72 0.15 -1.26 -4.90 113.70 120.15 1dfm s SER 191 Ca 0.00 2.71 0.06 0.00 0.70 0.00 0.00 55.95 59.42 1dfm s SER 191 Cb 0.00 -2.64 0.13 0.00 -1.71 0.00 0.00 66.02 61.80 1dfm s SER 191 CO 0.00 -1.10 1.00 0.54 1.20 0.00 0.00 173.24 174.87 1dfm n ARG 192 N -0.28 1.90 -2.97 5.44 1.74 -1.26 -4.88 116.66 116.35 1dfm n ARG 192 Ca 0.06 -1.50 -0.43 0.00 -0.77 0.00 0.00 57.85 55.21 1dfm n ARG 192 Cb 0.44 -1.14 -0.05 0.00 -1.02 0.00 0.00 32.46 30.68 1dfm n ARG 192 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1dfm s THR 193 N -0.84 4.69 0.04 0.55 2.01 -1.26 -5.02 115.64 115.81 1dfm s THR 193 Ca 0.11 0.60 -0.30 0.00 0.31 0.00 0.00 61.69 62.41 1dfm s THR 193 Cb 0.06 -4.27 -0.05 0.00 0.01 0.00 0.00 72.50 68.25 1dfm s THR 193 CO 0.09 -0.60 1.17 -0.63 -0.69 0.00 0.00 174.62 173.96 1dfm s ILE 194 N 3.20 4.18 -0.21 1.82 1.01 -1.26 -0.55 121.20 129.39 1dfm s ILE 194 Ca 0.30 1.56 0.15 0.00 0.00 0.00 0.00 60.65 62.66 1dfm s ILE 194 Cb -0.13 -4.00 -0.24 0.00 0.01 0.00 0.00 42.46 38.11 1dfm s ILE 194 CO 0.20 0.11 0.03 0.35 0.00 0.00 0.00 174.94 175.63 1dfm n THR 195 N 3.99 1.41 -3.64 2.92 -2.24 0.69 -4.81 114.28 112.60 1dfm n THR 195 Ca 0.09 -0.81 -0.13 0.00 -2.27 0.00 0.00 64.05 60.92 1dfm n THR 195 Cb 0.47 -0.64 -0.07 0.00 -2.10 0.00 0.00 70.33 67.99 1dfm n THR 195 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1dfm s LYS 196 N -2.50 0.80 -0.01 -0.78 2.20 -1.02 -4.99 119.74 113.44 1dfm s LYS 196 Ca -0.14 0.98 0.01 0.00 -0.36 0.00 0.00 55.97 56.46 1dfm s LYS 196 Cb 0.07 0.38 0.01 0.00 -1.51 0.00 0.00 37.83 36.77 1dfm s LYS 196 CO 0.79 -0.10 -0.02 0.50 -0.36 0.00 0.00 175.35 176.16 1dfm s ARG 197 N 0.46 0.28 0.04 4.03 3.52 -1.26 -0.29 118.95 125.73 1dfm s ARG 197 Ca -0.01 -0.06 -0.12 0.00 -0.13 0.00 0.00 55.73 55.42 1dfm s ARG 197 Cb -0.05 -0.32 0.01 0.00 -1.56 0.00 0.00 34.95 33.03 1dfm s ARG 197 CO -0.01 0.01 0.26 -0.51 -0.81 0.00 0.00 175.30 174.24 1dfm s ASP 198 N 0.26 -0.05 -0.22 -2.12 1.01 -0.67 -4.99 116.67 109.89 1dfm s ASP 198 Ca -0.02 -0.28 -0.10 0.00 0.71 0.00 0.00 52.55 52.86 1dfm s ASP 198 Cb -0.05 0.33 -0.05 0.00 1.01 0.00 0.00 42.92 44.16 1dfm s ASP 198 CO -0.01 -0.59 0.14 -0.89 0.21 0.00 0.00 175.17 174.03 1dfm s THR 199 N -2.59 5.35 0.27 -1.27 2.01 -1.26 -0.88 115.64 117.28 1dfm s THR 199 Ca -0.05 0.17 0.03 0.00 0.31 0.00 0.00 61.69 62.15 1dfm s THR 199 Cb -0.01 -3.47 -0.06 0.00 0.01 0.00 0.00 72.50 68.98 1dfm s THR 199 CO -0.04 0.39 0.05 0.68 -0.69 0.00 0.00 174.62 175.02 1dfm s VAL 200 N 0.71 0.92 0.24 3.82 -7.23 -0.29 -4.95 120.40 113.63 1dfm s VAL 200 Ca 0.08 -2.01 -0.13 0.00 -1.81 0.00 0.00 61.98 58.10 1dfm s VAL 200 Cb -0.12 -2.60 -0.08 0.00 0.56 0.00 0.00 36.38 34.14 1dfm s VAL 200 CO 0.01 -0.11 0.63 -0.54 -0.31 0.00 0.00 175.10 174.79 1dfm s LYS 201 N -3.93 3.96 0.05 4.82 1.02 -1.26 -0.73 119.74 123.66 1dfm s LYS 201 Ca 0.34 0.52 -0.06 0.00 0.02 0.00 0.00 55.97 56.79 1dfm s LYS 201 Cb 0.07 -2.66 0.02 0.00 -0.52 0.00 0.00 37.83 34.74 1dfm s LYS 201 CO 0.13 0.31 0.28 0.41 -0.92 0.00 0.00 175.35 175.55 1dfm n GLY 202 N 0.08 1.09 3.59 -3.33 0.00 -0.18 -0.16 105.19 106.28 1dfm n GLY 202 Ca -0.00 -0.98 -0.10 0.00 0.00 0.00 0.00 46.02 44.95 1dfm n GLY 202 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dfm s LYS 203 N -2.01 1.47 -0.31 1.61 -2.85 -0.50 -0.93 119.74 116.22 1dfm s LYS 203 Ca 0.06 -0.73 -0.08 0.00 -1.00 0.00 0.00 55.97 54.22 1dfm s LYS 203 Cb -0.01 0.58 0.02 0.00 -2.06 0.00 0.00 37.83 36.36 1dfm s LYS 203 CO 0.01 -0.65 0.11 0.08 0.10 0.00 0.00 175.35 175.00 1dfm s VAL 204 N -3.84 4.07 0.14 1.79 1.01 -1.26 -1.75 120.40 120.57 1dfm s VAL 204 Ca 0.06 -0.77 -0.31 0.00 0.00 0.00 0.00 61.98 60.96 1dfm s VAL 204 Cb -0.03 -3.16 -0.08 0.00 0.00 0.00 0.00 36.38 33.12 1dfm s VAL 204 CO -0.04 -0.01 1.37 -0.63 0.00 0.00 0.00 175.10 175.79 1dfm s ILE 205 N 1.50 3.27 -0.35 2.22 1.01 0.13 -0.46 121.20 128.52 1dfm s ILE 205 Ca 0.02 0.95 -0.20 0.00 0.00 0.00 0.00 60.65 61.42 1dfm s ILE 205 Cb -0.18 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.69 1dfm s ILE 205 CO 0.03 0.09 0.60 -0.62 0.00 0.00 0.00 174.94 175.05 1dfm s ASP 206 N 0.88 6.40 0.00 3.58 -1.08 -1.26 -1.60 116.67 123.58 1dfm s ASP 206 Ca 0.62 0.10 0.22 0.00 -0.52 0.00 0.00 52.55 52.98 1dfm s ASP 206 Cb -0.37 -2.31 0.49 0.00 -1.46 0.00 0.00 42.92 39.28 1dfm s ASP 206 CO 0.33 -0.56 1.44 0.35 0.52 0.00 0.00 175.17 177.24 1dfm n THR 207 N 5.54 0.52 -1.91 1.71 -2.24 -1.26 -4.97 114.28 111.66 1dfm n THR 207 Ca -0.02 -0.71 -0.36 0.00 -2.27 0.00 0.00 64.05 60.69 1dfm n THR 207 Cb 0.49 0.82 0.04 0.00 -2.10 0.00 0.00 70.33 69.58 1dfm n THR 207 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1dfm s ASN 208 N -1.42 5.02 0.48 3.42 0.01 -1.26 -5.02 114.94 116.17 1dfm s ASN 208 Ca 0.39 2.39 0.02 0.00 -0.71 0.00 0.00 52.86 54.94 1dfm s ASN 208 Cb 0.22 -2.60 -0.01 0.00 0.41 0.00 0.00 41.25 39.27 1dfm s ASN 208 CO 0.31 -1.71 0.04 0.42 -1.51 0.00 0.00 177.10 174.66 1dfm s THR 209 N -1.66 0.94 -0.14 1.60 -4.23 -1.26 -5.01 115.64 105.89 1dfm s THR 209 Ca 0.77 -2.00 0.29 0.00 -1.18 0.00 0.00 61.69 59.57 1dfm s THR 209 Cb -0.30 -2.18 0.33 0.00 1.34 0.00 0.00 72.50 71.68 1dfm s THR 209 CO 0.35 0.00 1.87 -0.65 -0.54 0.00 0.00 174.62 175.66 1dfm h PRO 210 N 1.47 0.00 -0.02 3.99 0.11 -1.98 -2.87 132.00 132.71 1dfm h PRO 210 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1dfm h PRO 210 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1dfm h PRO 210 CO 0.68 0.00 -0.37 0.09 -0.21 0.00 0.00 178.00 178.19 1dfm n ASN 211 N -2.68 1.89 -2.42 -2.05 3.02 -1.26 -4.88 115.26 106.88 1dfm n ASN 211 Ca 0.01 -1.43 0.00 0.00 -0.03 0.00 0.00 54.58 53.13 1dfm n ASN 211 Cb 0.25 0.34 0.00 0.00 -0.61 0.00 0.00 39.78 39.76 1dfm n ASN 211 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1dfm n THR 212 N -0.01 0.00 0.05 3.41 -2.24 -1.08 -5.04 114.28 109.37 1dfm n THR 212 Ca 0.11 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 1dfm n THR 212 Cb 0.45 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 1dfm n THR 212 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1dfm n ARG 213 N 0.00 0.00 0.00 -0.78 5.12 -1.26 -4.86 116.66 114.88 1dfm n ARG 213 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1dfm n ARG 213 Cb 0.00 -0.16 0.00 0.00 -1.16 0.00 0.00 32.46 31.14 1dfm n ARG 213 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1dfm n ARG 214 N -3.03 0.00 -0.32 5.56 5.12 -1.26 -4.91 116.66 117.81 1dfm n ARG 214 Ca 0.00 0.00 0.07 0.00 -1.93 0.00 0.00 57.85 55.99 1dfm n ARG 214 Cb 0.00 0.00 0.22 0.00 -1.16 0.00 0.00 32.46 31.52 1dfm n ARG 214 CO 0.00 0.00 0.00 2.89 -1.93 0.00 0.00 177.63 178.59 1dfm n ARG 215 N 0.00 2.43 -3.42 5.56 1.85 -1.26 -4.75 116.66 117.07 1dfm n ARG 215 Ca 0.00 -1.78 -0.37 0.00 -1.00 0.00 0.00 57.85 54.69 1dfm n ARG 215 Cb 0.00 -1.52 -0.07 0.00 -1.05 0.00 0.00 32.46 29.82 1dfm n ARG 215 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 1dfm s LYS 216 N -1.55 4.26 0.51 2.89 2.20 -1.26 -5.04 119.74 121.76 1dfm s LYS 216 Ca 0.33 0.24 -0.18 0.00 -0.36 0.00 0.00 55.97 56.00 1dfm s LYS 216 Cb 0.19 -3.46 -0.08 0.00 -1.51 0.00 0.00 37.83 32.97 1dfm s LYS 216 CO 0.19 0.14 0.99 1.03 -0.36 0.00 0.00 175.35 177.34 1dfm s ARG 217 N 0.75 3.90 0.93 4.03 0.52 -1.26 -4.73 118.95 123.09 1dfm s ARG 217 Ca 0.20 1.06 -0.14 0.00 -0.52 0.00 0.00 55.73 56.33 1dfm s ARG 217 Cb -0.14 -2.13 0.16 0.00 0.52 0.00 0.00 34.95 33.36 1dfm s ARG 217 CO 0.07 -0.31 1.21 0.20 0.02 0.00 0.00 175.30 176.49 1dfm s GLY 218 N -2.75 1.65 -0.12 -3.53 0.00 -1.26 -4.47 107.32 96.84 1dfm s GLY 218 Ca 0.61 -0.84 0.02 0.00 0.00 0.00 0.00 44.72 44.51 1dfm s GLY 218 CO 0.27 -0.19 -0.20 -1.59 0.00 0.00 0.00 173.10 171.39 1dfm s THR 219 N -3.54 2.32 -0.07 0.90 2.01 -0.63 -4.15 115.64 112.49 1dfm s THR 219 Ca 0.68 -0.91 -0.17 0.00 0.31 0.00 0.00 61.69 61.59 1dfm s THR 219 Cb -0.09 -1.92 -0.05 0.00 0.01 0.00 0.00 72.50 70.44 1dfm s THR 219 CO 0.52 0.55 0.45 -0.63 -0.69 0.00 0.00 174.62 174.82 1dfm s ILE 220 N 0.48 5.10 0.03 1.82 1.01 -1.26 0.18 121.20 128.57 1dfm s ILE 220 Ca -0.14 0.91 0.04 0.00 0.00 0.00 0.00 60.65 61.47 1dfm s ILE 220 Cb -0.17 -3.78 -0.02 0.00 0.01 0.00 0.00 42.46 38.50 1dfm s ILE 220 CO 0.05 0.43 -0.13 0.68 0.00 0.00 0.00 174.94 175.98 1dfm s VAL 221 N -0.10 1.04 0.17 2.92 -7.23 -0.72 -4.63 120.40 111.86 1dfm s VAL 221 Ca 0.25 -0.95 0.05 0.00 -1.81 0.00 0.00 61.98 59.52 1dfm s VAL 221 Cb -0.16 -0.95 -0.05 0.00 0.56 0.00 0.00 36.38 35.79 1dfm s VAL 221 CO 0.12 -0.00 -0.10 0.42 -0.31 0.00 0.00 175.10 175.22 1dfm s THR 222 N -0.83 1.29 0.00 5.32 -4.23 -1.26 -1.40 115.64 114.53 1dfm s THR 222 Ca 0.01 -2.09 0.00 0.00 -1.18 0.00 0.00 61.69 58.43 1dfm s THR 222 Cb -0.08 -1.95 0.00 0.00 1.34 0.00 0.00 72.50 71.81 1dfm s THR 222 CO 0.01 -0.66 0.45 -1.22 -0.54 0.00 0.00 174.62 172.66