#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dgg s ASP 6 N 0.00 5.97 0.40 0.55 -4.77 -1.26 -4.89 116.67 112.67 1dgg s ASP 6 Ca 0.00 1.84 0.16 0.00 -3.30 0.00 0.00 52.55 51.26 1dgg s ASP 6 Cb 0.00 -2.54 1.05 0.00 -1.09 0.00 0.00 42.92 40.34 1dgg s ASP 6 CO 0.00 -1.04 1.83 -0.65 0.70 0.00 0.00 175.17 176.01 1dgg h PRO 7 N 0.77 0.43 -0.56 2.11 0.11 -1.96 -1.57 132.00 131.33 1dgg h PRO 7 Ca -0.48 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 1dgg h PRO 7 Cb 1.22 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1dgg h PRO 7 CO 0.58 0.29 0.18 0.00 -0.21 0.00 0.00 178.00 178.84 1dgg h ALA 8 N 1.61 0.74 -0.23 -0.75 0.00 -1.92 -2.93 119.26 115.77 1dgg h ALA 8 Ca 0.51 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 55.12 1dgg h ALA 8 Cb 1.22 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1dgg h ALA 8 CO -0.22 0.39 -0.31 0.77 0.00 0.00 0.00 179.25 179.88 1dgg h SER 9 N 0.79 0.48 -0.18 0.00 0.02 -1.67 -2.98 113.55 110.01 1dgg h SER 9 Ca 0.18 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1dgg h SER 9 Cb 0.27 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.68 1dgg h SER 9 CO -0.01 0.78 0.00 0.47 -1.14 0.00 0.00 176.83 176.93 1dgg n ASP 10 N -4.08 1.86 -0.06 3.07 8.00 -1.04 -4.47 116.55 119.83 1dgg n ASP 10 Ca -0.01 -2.16 -0.10 0.00 0.71 0.00 0.00 54.79 53.23 1dgg n ASP 10 Cb 0.45 -0.39 -0.04 0.00 -0.02 0.00 0.00 41.12 41.12 1dgg n ASP 10 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 1dgg h GLN 11 N 1.18 -0.36 -0.61 -1.24 -0.00 -1.38 0.30 115.11 112.99 1dgg h GLN 11 Ca 0.00 0.02 -0.07 0.00 -0.00 0.00 0.00 58.65 58.61 1dgg h GLN 11 Cb 0.67 0.08 -0.03 0.00 0.00 0.00 0.00 27.48 28.20 1dgg h GLN 11 CO 0.08 -0.24 0.11 0.52 0.00 0.00 0.00 178.83 179.30 1dgg h MET 12 N -0.37 0.98 0.08 1.69 2.86 -1.87 -1.93 114.93 116.37 1dgg h MET 12 Ca 0.12 -0.24 -0.00 0.00 -2.06 0.00 0.00 59.70 57.52 1dgg h MET 12 Cb 0.58 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.11 1dgg h MET 12 CO -0.46 0.90 -0.04 1.96 1.06 0.00 0.00 176.91 180.33 1dgg h GLN 13 N 0.93 -0.10 -0.73 1.72 1.08 -1.67 0.38 115.11 116.71 1dgg h GLN 13 Ca 0.19 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.40 1dgg h GLN 13 Cb 0.39 0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 27.80 1dgg h GLN 13 CO 0.01 -0.04 0.47 0.45 -0.95 0.00 0.00 178.83 178.76 1dgg h HIS 14 N -0.13 0.94 -0.14 2.96 3.86 -0.86 0.14 115.15 121.91 1dgg h HIS 14 Ca -0.01 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1dgg h HIS 14 Cb 0.11 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.26 1dgg h HIS 14 CO -0.06 0.61 0.05 2.35 0.86 0.00 0.00 177.93 181.74 1dgg h TRP 15 N 1.00 0.23 -0.84 2.45 7.01 -0.98 -0.16 115.95 124.65 1dgg h TRP 15 Ca 0.27 -0.02 0.05 0.00 2.11 0.00 0.00 58.89 61.30 1dgg h TRP 15 Cb -0.08 -0.07 -0.06 0.00 -2.10 0.00 0.00 29.16 26.86 1dgg h TRP 15 CO 0.00 0.33 0.53 -0.22 -2.79 0.00 0.00 178.44 176.28 1dgg h LYS 16 N 0.06 0.95 -0.33 2.65 3.64 -0.08 -2.41 116.57 121.05 1dgg h LYS 16 Ca 0.05 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.26 1dgg h LYS 16 Cb 0.20 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 1dgg h LYS 16 CO -0.00 0.63 -0.25 0.93 -2.27 0.00 0.00 179.45 178.49 1dgg h GLU 17 N 0.98 0.66 0.00 1.90 5.08 -0.37 -2.86 114.58 119.96 1dgg h GLU 17 Ca 0.36 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1dgg h GLU 17 Cb 0.12 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1dgg h GLU 17 CO -0.16 0.85 0.00 1.96 -1.00 0.00 0.00 179.01 180.66 1dgg h GLN 18 N 0.57 0.00 -0.35 2.33 4.20 -0.50 0.13 115.11 121.49 1dgg h GLN 18 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1dgg h GLN 18 Cb 0.73 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.51 1dgg h GLN 18 CO 0.06 0.00 0.00 0.54 -0.67 0.00 0.00 178.83 178.76 1dgg n ARG 19 N -2.44 3.13 0.00 1.46 1.74 -1.08 -4.92 116.66 114.55 1dgg n ARG 19 Ca -0.01 -2.62 0.00 0.00 -0.77 0.00 0.00 57.85 54.45 1dgg n ARG 19 Cb 0.09 -1.70 0.00 0.00 -1.02 0.00 0.00 32.46 29.83 1dgg n ARG 19 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1dgg n ALA 20 N 0.07 0.00 -1.00 7.54 0.00 0.03 -2.34 120.51 124.82 1dgg n ALA 20 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1dgg n ALA 20 Cb 0.77 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.22 1dgg n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dgg n ALA 21 N -0.41 0.00 0.00 0.00 0.00 -1.26 -4.97 120.51 113.87 1dgg n ALA 21 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1dgg n ALA 21 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1dgg n ALA 21 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1dgg n GLN 22 N -0.32 0.00 -3.09 0.00 6.02 -0.99 -4.95 117.38 114.06 1dgg n GLN 22 Ca 0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.61 1dgg n GLN 22 Cb 0.00 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.20 1dgg n GLN 22 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1dgg s LYS 23 N 0.00 4.37 0.38 -1.09 2.20 -1.26 -5.02 119.74 119.32 1dgg s LYS 23 Ca 0.00 0.96 -0.27 0.00 -0.36 0.00 0.00 55.97 56.30 1dgg s LYS 23 Cb 0.00 -3.11 -0.10 0.00 -1.51 0.00 0.00 37.83 33.12 1dgg s LYS 23 CO 0.00 0.52 1.36 0.00 -0.36 0.00 0.00 175.35 176.87 1dgg s ALA 24 N -1.29 3.41 0.90 3.13 0.00 -1.26 -4.98 121.76 121.67 1dgg s ALA 24 Ca 0.37 1.35 -0.10 0.00 0.00 0.00 0.00 51.96 53.58 1dgg s ALA 24 Cb -0.20 -3.53 0.14 0.00 0.00 0.00 0.00 23.12 19.53 1dgg s ALA 24 CO 0.23 -0.87 1.13 -0.51 0.00 0.00 0.00 175.76 175.74 1dgg s ASP 25 N -0.48 3.14 0.05 0.00 -0.00 -1.26 -4.96 116.67 113.16 1dgg s ASP 25 Ca 0.54 2.06 -0.30 0.00 -0.00 0.00 0.00 52.55 54.84 1dgg s ASP 25 Cb -0.41 -2.53 -0.05 0.00 -0.00 0.00 0.00 42.92 39.93 1dgg s ASP 25 CO 0.55 -2.94 1.11 -0.69 -0.00 0.00 0.00 175.17 173.19 1dgg s VAL 26 N -2.70 4.32 -0.17 -1.27 1.01 -1.26 -4.99 120.40 115.34 1dgg s VAL 26 Ca 0.66 1.70 -0.29 0.00 0.00 0.00 0.00 61.98 64.04 1dgg s VAL 26 Cb -0.22 -4.09 -0.01 0.00 0.00 0.00 0.00 36.38 32.07 1dgg s VAL 26 CO 0.58 0.15 1.13 -0.22 0.00 0.00 0.00 175.10 176.74 1dgg s LEU 27 N 0.87 4.17 0.37 3.92 2.96 -1.26 -4.99 118.68 124.72 1dgg s LEU 27 Ca 0.55 1.56 0.06 0.00 -0.22 0.00 0.00 54.13 56.07 1dgg s LEU 27 Cb -0.26 -3.54 -0.07 0.00 0.50 0.00 0.00 46.19 42.81 1dgg s LEU 27 CO 0.29 -0.66 0.03 0.42 -1.32 0.00 0.00 176.35 175.12 1dgg s THR 28 N 3.01 1.63 0.87 3.68 -4.23 -1.26 -0.78 115.64 118.56 1dgg s THR 28 Ca 0.50 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.90 1dgg s THR 28 Cb -0.19 -2.91 0.16 0.00 1.34 0.00 0.00 72.50 70.91 1dgg s THR 28 CO 0.12 -0.00 1.20 0.42 -0.54 0.00 0.00 174.62 175.83 1dgg s THR 29 N -2.98 2.06 0.38 3.99 -4.23 -0.01 -4.89 115.64 109.96 1dgg s THR 29 Ca 0.36 -0.18 0.09 0.00 -1.18 0.00 0.00 61.69 60.77 1dgg s THR 29 Cb 0.09 -2.87 0.31 0.00 1.34 0.00 0.00 72.50 71.37 1dgg s THR 29 CO 0.17 0.00 1.95 1.23 -0.54 0.00 0.00 174.62 177.43 1dgg h GLY 30 N -1.23 0.88 -0.15 3.99 0.00 -1.91 -0.74 103.07 103.91 1dgg h GLY 30 Ca -0.42 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 46.64 1dgg h GLY 30 CO 0.42 0.17 0.00 0.00 0.00 0.00 0.00 176.54 177.13 1dgg n ALA 31 N -2.47 2.54 -0.61 3.60 0.00 -1.26 -4.90 120.51 117.41 1dgg n ALA 31 Ca 0.11 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1dgg n ALA 31 Cb 0.30 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.62 1dgg n ALA 31 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dgg n GLY 32 N 0.83 0.76 3.71 0.00 0.00 -0.28 -5.04 105.19 105.17 1dgg n GLY 32 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1dgg n GLY 32 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dgg s ASN 33 N -2.59 7.14 0.46 1.61 0.02 -1.26 -4.70 114.94 115.63 1dgg s ASN 33 Ca 0.00 1.93 -0.25 0.00 -1.02 0.00 0.00 52.86 53.52 1dgg s ASN 33 Cb 0.00 -2.58 -0.08 0.00 0.02 0.00 0.00 41.25 38.62 1dgg s ASN 33 CO 0.00 -0.43 1.43 -2.84 0.02 0.00 0.00 177.10 175.27 1dgg s PRO 34 N 1.12 3.61 -0.18 -0.60 0.02 -1.26 -0.83 135.00 136.88 1dgg s PRO 34 Ca 0.57 2.41 -0.05 0.00 0.02 0.00 0.00 61.00 63.95 1dgg s PRO 34 Cb -0.27 -2.61 -0.03 0.00 0.02 0.00 0.00 34.50 31.61 1dgg s PRO 34 CO 0.28 -0.88 0.01 0.08 -0.33 0.00 0.00 177.00 176.17 1dgg s VAL 35 N -1.21 4.21 -0.02 3.83 1.01 0.04 -4.84 120.40 123.42 1dgg s VAL 35 Ca 0.62 -0.23 -0.22 0.00 0.00 0.00 0.00 61.98 62.15 1dgg s VAL 35 Cb -0.44 -2.89 -0.24 0.00 0.00 0.00 0.00 36.38 32.82 1dgg s VAL 35 CO 0.56 0.45 1.05 1.23 0.00 0.00 0.00 175.10 178.40 1dgg h GLY 36 N 7.02 0.34 -6.74 4.51 0.00 -1.95 -3.45 103.07 102.80 1dgg h GLY 36 Ca -0.34 -0.61 -0.30 0.00 0.00 0.00 0.00 47.33 46.08 1dgg h GLY 36 CO 0.64 0.54 -0.61 -0.35 0.00 0.00 0.00 176.54 176.76 1dgg s ASP 37 N -6.58 1.16 -0.27 0.19 2.15 -1.26 -5.00 116.67 107.06 1dgg s ASP 37 Ca -0.14 -0.07 0.12 0.00 0.43 0.00 0.00 52.55 52.88 1dgg s ASP 37 Cb 0.02 0.45 0.60 0.00 -0.30 0.00 0.00 42.92 43.68 1dgg s ASP 37 CO 0.79 -0.31 1.58 1.17 -0.17 0.00 0.00 175.17 178.23 1dgg n LYS 38 N 5.33 2.79 0.00 4.34 4.81 -1.26 -4.33 118.16 129.83 1dgg n LYS 38 Ca -0.05 -3.03 0.01 0.00 -0.87 0.00 0.00 58.31 54.37 1dgg n LYS 38 Cb 0.50 -1.97 0.00 0.00 0.02 0.00 0.00 35.03 33.58 1dgg n LYS 38 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1dgg n LEU 39 N -0.63 0.78 -3.79 3.14 4.77 -1.26 -5.01 117.00 114.99 1dgg n LEU 39 Ca 0.33 -0.81 -0.13 0.00 -0.03 0.00 0.00 56.01 55.37 1dgg n LEU 39 Cb 1.13 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 42.10 1dgg n LEU 39 CO 0.28 0.18 -0.17 0.20 -1.33 0.00 0.00 177.39 176.55 1dgg s ASN 40 N -0.56 -0.19 0.55 -1.43 -0.87 -1.26 -5.16 114.94 106.02 1dgg s ASN 40 Ca 0.02 0.37 -0.05 0.00 -1.57 0.00 0.00 52.86 51.63 1dgg s ASN 40 Cb 0.02 0.36 -0.00 0.00 -0.02 0.00 0.00 41.25 41.60 1dgg s ASN 40 CO 0.05 -0.08 0.86 0.54 -2.57 0.00 0.00 177.10 175.90 1dgg s VAL 41 N 0.33 4.02 -0.25 1.60 0.11 -1.26 -4.96 120.40 119.99 1dgg s VAL 41 Ca -0.02 0.04 -0.22 0.00 -2.93 0.00 0.00 61.98 58.86 1dgg s VAL 41 Cb -0.03 -3.57 -0.01 0.00 -1.53 0.00 0.00 36.38 31.23 1dgg s VAL 41 CO -0.01 -0.57 0.70 -0.63 -3.33 0.00 0.00 175.10 171.25 1dgg s ILE 42 N -2.91 4.93 0.22 7.04 1.01 -1.26 -5.05 121.20 125.19 1dgg s ILE 42 Ca 0.52 1.29 0.06 0.00 0.00 0.00 0.00 60.65 62.52 1dgg s ILE 42 Cb -0.10 -4.00 -0.05 0.00 0.01 0.00 0.00 42.46 38.32 1dgg s ILE 42 CO 0.45 -0.01 -0.09 0.42 0.00 0.00 0.00 174.94 175.72 1dgg s THR 43 N 2.61 1.49 -0.71 2.92 -4.23 -1.26 -2.23 115.64 114.23 1dgg s THR 43 Ca 0.29 -2.13 -0.19 0.00 -1.18 0.00 0.00 61.69 58.48 1dgg s THR 43 Cb -0.15 -2.19 0.11 0.00 1.34 0.00 0.00 72.50 71.60 1dgg s THR 43 CO 0.08 -0.48 0.88 0.54 -0.54 0.00 0.00 174.62 175.10 1dgg s VAL 44 N -3.12 4.72 0.00 2.29 0.11 -1.10 -4.84 120.40 118.46 1dgg s VAL 44 Ca 0.25 -1.08 0.00 0.00 -2.93 0.00 0.00 61.98 58.22 1dgg s VAL 44 Cb 0.02 -4.61 0.00 0.00 -1.53 0.00 0.00 36.38 30.26 1dgg s VAL 44 CO 0.08 -1.30 0.00 0.61 -3.33 0.00 0.00 175.10 171.16 1dgg n GLY 45 N 5.24 -1.37 0.31 6.54 0.00 -1.26 -3.11 105.19 111.55 1dgg n GLY 45 Ca 0.02 -1.54 0.14 0.00 0.00 0.00 0.00 46.02 44.64 1dgg n GLY 45 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1dgg h PRO 46 N 0.00 0.31 -0.38 1.61 0.11 -2.02 -2.28 132.00 129.36 1dgg h PRO 46 Ca 0.00 -0.02 -0.21 0.00 0.11 0.00 0.00 66.00 65.88 1dgg h PRO 46 Cb 0.00 -0.07 -0.13 0.00 0.11 0.00 0.00 31.00 30.91 1dgg h PRO 46 CO 0.00 0.20 -0.12 0.54 -0.21 0.00 0.00 178.00 178.41 1dgg n ARG 47 N -5.11 1.93 -2.70 1.05 1.74 -1.26 -5.03 116.66 107.28 1dgg n ARG 47 Ca 0.23 -3.26 -0.21 0.00 -0.77 0.00 0.00 57.85 53.83 1dgg n ARG 47 Cb 0.70 -1.85 0.05 0.00 -1.02 0.00 0.00 32.46 30.34 1dgg n ARG 47 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1dgg s GLY 48 N -2.63 1.82 0.91 -0.13 0.00 -0.86 -5.03 107.32 101.41 1dgg s GLY 48 Ca 0.45 -1.50 -0.12 0.00 0.00 0.00 0.00 44.72 43.55 1dgg s GLY 48 CO -0.01 -1.16 1.10 -4.14 0.00 0.00 0.00 173.10 168.89 1dgg s PRO 49 N -4.79 1.18 0.13 2.90 0.02 -1.26 -4.39 135.00 128.79 1dgg s PRO 49 Ca 0.59 0.71 -0.30 0.00 0.02 0.00 0.00 61.00 62.02 1dgg s PRO 49 Cb -0.09 -1.81 -0.06 0.00 0.02 0.00 0.00 34.50 32.56 1dgg s PRO 49 CO 0.39 -2.26 0.95 -1.17 -0.33 0.00 0.00 177.00 174.58 1dgg s LEU 50 N -6.20 4.52 -0.06 -5.54 2.96 -1.26 -2.71 118.68 110.39 1dgg s LEU 50 Ca 0.63 1.80 -0.08 0.00 -0.22 0.00 0.00 54.13 56.27 1dgg s LEU 50 Cb -0.17 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 1dgg s LEU 50 CO 0.57 -0.03 0.22 -0.76 -1.32 0.00 0.00 176.35 175.03 1dgg s LEU 51 N -0.17 4.40 0.55 -0.68 2.01 -0.95 -4.99 118.68 118.85 1dgg s LEU 51 Ca 0.46 0.56 0.25 0.00 0.01 0.00 0.00 54.13 55.42 1dgg s LEU 51 Cb -0.24 -2.37 1.59 0.00 0.01 0.00 0.00 46.19 45.18 1dgg s LEU 51 CO 0.30 0.34 2.18 0.58 1.01 0.00 0.00 176.35 180.76 1dgg h VAL 52 N 3.57 0.67 -0.23 -1.59 2.07 -1.97 -2.06 116.25 116.71 1dgg h VAL 52 Ca -0.53 -0.15 0.07 0.00 0.82 0.00 0.00 66.70 66.91 1dgg h VAL 52 Cb 1.22 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 1dgg h VAL 52 CO 0.62 0.04 0.31 1.56 0.02 0.00 0.00 177.57 180.12 1dgg h GLN 53 N 0.00 0.00 -5.37 1.57 4.20 -1.96 -3.33 115.11 110.22 1dgg h GLN 53 Ca -0.00 0.00 -0.45 0.00 0.06 0.00 0.00 58.65 58.26 1dgg h GLN 53 Cb 0.09 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.83 1dgg h GLN 53 CO 0.00 0.00 1.49 -3.47 -0.67 0.00 0.00 178.83 176.19 1dgg n ASP 54 N -3.57 3.37 0.18 1.46 4.64 -0.78 -4.63 116.55 117.22 1dgg n ASP 54 Ca 0.03 -2.74 0.06 0.00 -1.38 0.00 0.00 54.79 50.76 1dgg n ASP 54 Cb 0.44 -1.66 0.28 0.00 -1.04 0.00 0.00 41.12 39.14 1dgg n ASP 54 CO 0.00 0.00 0.00 -0.37 -0.82 0.00 0.00 177.20 176.01 1dgg h VAL 55 N 5.78 0.81 -0.48 5.18 -1.51 -1.88 -2.63 116.25 121.52 1dgg h VAL 55 Ca 0.30 -1.62 -0.00 0.00 -1.23 0.00 0.00 66.70 64.15 1dgg h VAL 55 Cb 0.88 2.02 -0.02 0.00 -2.13 0.00 0.00 31.29 32.04 1dgg h VAL 55 CO 1.38 0.37 0.29 0.58 -1.23 0.00 0.00 177.57 178.96 1dgg h VAL 56 N 0.00 1.14 0.63 7.19 2.07 -1.94 0.36 116.25 125.70 1dgg h VAL 56 Ca -0.00 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.18 1dgg h VAL 56 Cb 0.99 0.49 0.01 0.00 -1.52 0.00 0.00 31.29 31.26 1dgg h VAL 56 CO 0.05 0.14 -0.30 0.15 0.02 0.00 0.00 177.57 177.63 1dgg h PHE 57 N 0.64 -0.78 -0.38 1.57 3.57 -1.90 -2.93 116.94 116.72 1dgg h PHE 57 Ca 0.17 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.71 1dgg h PHE 57 Cb -0.02 0.26 -0.05 0.00 2.79 0.00 0.00 35.95 38.92 1dgg h PHE 57 CO -0.03 -0.44 0.08 1.15 -2.23 0.00 0.00 178.31 176.83 1dgg h THR 58 N -0.99 0.81 -0.56 4.41 2.02 -1.27 0.00 112.91 117.33 1dgg h THR 58 Ca -0.09 -0.07 0.09 0.00 0.77 0.00 0.00 66.41 67.12 1dgg h THR 58 Cb 0.69 0.59 -0.07 0.00 -1.74 0.00 0.00 68.15 67.61 1dgg h THR 58 CO 0.14 0.04 0.16 -0.78 0.37 0.00 0.00 175.52 175.45 1dgg h ASP 59 N 0.20 0.11 -0.08 4.18 1.82 -0.32 0.11 116.42 122.44 1dgg h ASP 59 Ca 0.18 0.09 -0.12 0.00 -0.39 0.00 0.00 57.03 56.79 1dgg h ASP 59 Cb 0.21 0.09 0.01 0.00 0.68 0.00 0.00 39.33 40.32 1dgg h ASP 59 CO -0.24 0.08 -0.41 -0.08 -1.61 0.00 0.00 179.24 176.98 1dgg h GLU 60 N 0.32 0.42 -0.76 0.28 4.81 -1.27 -3.13 114.58 115.25 1dgg h GLU 60 Ca 0.28 -0.34 -0.04 0.00 -0.13 0.00 0.00 59.36 59.14 1dgg h GLU 60 Cb 0.37 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.79 1dgg h GLU 60 CO -0.32 0.98 0.33 1.98 -0.73 0.00 0.00 179.01 181.24 1dgg h MET 61 N -0.04 1.11 -0.52 1.92 4.05 -0.75 -1.73 114.93 118.98 1dgg h MET 61 Ca -0.03 -0.19 -0.00 0.00 -0.28 0.00 0.00 59.70 59.20 1dgg h MET 61 Cb 1.06 -0.19 -0.03 0.00 -0.80 0.00 0.00 31.60 31.64 1dgg h MET 61 CO 0.08 0.89 0.31 0.00 0.23 0.00 0.00 176.91 178.43 1dgg h ALA 62 N 1.16 1.57 -0.01 0.39 0.00 -0.86 0.31 119.26 121.82 1dgg h ALA 62 Ca 0.26 -0.06 -0.25 0.00 0.00 0.00 0.00 54.91 54.85 1dgg h ALA 62 Cb 0.18 -0.21 0.02 0.00 0.00 0.00 0.00 17.79 17.77 1dgg h ALA 62 CO -0.03 0.38 -1.00 1.25 0.00 0.00 0.00 179.25 179.85 1dgg h HIS 63 N 0.72 0.95 -0.77 0.00 6.17 -1.39 -3.06 115.15 117.77 1dgg h HIS 63 Ca 0.19 -0.51 -0.01 0.00 0.71 0.00 0.00 60.37 60.75 1dgg h HIS 63 Cb -0.02 -0.11 -0.04 0.00 2.52 0.00 0.00 27.41 29.76 1dgg h HIS 63 CO 0.00 1.34 0.44 0.35 0.71 0.00 0.00 177.93 180.77 1dgg h PHE 64 N 0.37 1.05 0.00 5.26 3.57 -0.82 -1.43 116.94 124.94 1dgg h PHE 64 Ca -0.11 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.37 1dgg h PHE 64 Cb 1.64 -0.34 0.00 0.00 2.79 0.00 0.00 35.95 40.05 1dgg h PHE 64 CO 0.09 0.72 0.00 -0.44 -2.23 0.00 0.00 178.31 176.45 1dgg h ASP 65 N 1.06 0.00 -0.06 0.41 3.45 -0.91 -2.59 116.42 117.78 1dgg h ASP 65 Ca 0.27 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.73 1dgg h ASP 65 Cb 0.01 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.78 1dgg h ASP 65 CO -0.05 0.00 0.00 0.54 -1.57 0.00 0.00 179.24 178.16 1dgg n ARG 66 N -2.53 1.98 -0.19 3.56 1.74 -0.58 -4.77 116.66 115.88 1dgg n ARG 66 Ca -0.01 -2.39 -0.04 0.00 -0.77 0.00 0.00 57.85 54.64 1dgg n ARG 66 Cb 0.09 -1.45 0.14 0.00 -1.02 0.00 0.00 32.46 30.22 1dgg n ARG 66 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1dgg h GLU 67 N 0.42 0.97 -6.65 5.56 5.08 -1.04 -3.44 114.58 115.47 1dgg h GLU 67 Ca 0.00 -0.19 -0.51 0.00 -1.00 0.00 0.00 59.36 57.66 1dgg h GLU 67 Cb 0.96 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.04 1dgg h GLU 67 CO 0.04 0.83 0.28 1.03 -1.00 0.00 0.00 179.01 180.19 1dgg s ARG 68 N -5.33 4.73 0.23 2.33 1.81 -1.26 -5.08 118.95 116.39 1dgg s ARG 68 Ca -0.11 1.35 0.10 0.00 -1.72 0.00 0.00 55.73 55.35 1dgg s ARG 68 Cb 0.16 -3.28 -0.05 0.00 -0.45 0.00 0.00 34.95 31.33 1dgg s ARG 68 CO 0.82 0.53 -0.18 0.96 -0.68 0.00 0.00 175.30 176.75 1dgg s ILE 69 N -1.12 2.11 0.40 1.52 -4.36 -1.26 -5.10 121.20 113.38 1dgg s ILE 69 Ca 0.39 -2.26 -0.27 0.00 -0.26 0.00 0.00 60.65 58.25 1dgg s ILE 69 Cb -0.25 -2.14 -0.10 0.00 1.25 0.00 0.00 42.46 41.22 1dgg s ILE 69 CO 0.30 -0.46 1.43 -2.65 0.24 0.00 0.00 174.94 173.79 1dgg n PRO 70 N -0.39 2.43 -1.71 0.37 -0.02 -1.26 -4.98 135.00 129.43 1dgg n PRO 70 Ca -0.07 0.86 -0.29 0.00 -2.02 0.00 0.00 63.50 61.97 1dgg n PRO 70 Cb 0.60 -2.59 0.12 0.00 -0.02 0.00 0.00 33.50 31.61 1dgg n PRO 70 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1dgg s GLU 71 N -2.17 1.37 0.38 -0.52 -1.05 -1.26 -4.93 118.70 110.53 1dgg s GLU 71 Ca 0.56 0.14 -0.27 0.00 -0.15 0.00 0.00 54.97 55.25 1dgg s GLU 71 Cb -0.48 -1.88 -0.10 0.00 -0.44 0.00 0.00 34.13 31.23 1dgg s GLU 71 CO 0.62 -2.01 1.38 1.03 0.95 0.00 0.00 175.26 177.23 1dgg s ARG 72 N -5.47 4.08 0.35 -4.83 0.52 -1.26 -4.89 118.95 107.45 1dgg s ARG 72 Ca 0.64 2.35 0.03 0.00 -0.52 0.00 0.00 55.73 58.22 1dgg s ARG 72 Cb -0.12 -2.90 0.64 0.00 0.52 0.00 0.00 34.95 33.09 1dgg s ARG 72 CO 0.52 -0.47 1.99 -0.24 0.02 0.00 0.00 175.30 177.12 1dgg h VAL 73 N 2.77 1.13 -3.85 3.52 3.04 -1.98 -3.37 116.25 117.50 1dgg h VAL 73 Ca -0.50 -0.30 -0.22 0.00 -1.01 0.00 0.00 66.70 64.67 1dgg h VAL 73 Cb 1.24 0.19 -0.15 0.00 -2.01 0.00 0.00 31.29 30.55 1dgg h VAL 73 CO 0.64 0.16 -0.70 0.68 -1.01 0.00 0.00 177.57 177.33 1dgg s VAL 74 N -5.74 0.66 -1.39 1.51 -7.23 -1.26 -4.85 120.40 102.10 1dgg s VAL 74 Ca -0.10 -1.84 -0.03 0.00 -1.81 0.00 0.00 61.98 58.19 1dgg s VAL 74 Cb 0.18 -1.57 0.00 0.00 0.56 0.00 0.00 36.38 35.56 1dgg s VAL 74 CO 0.77 -0.83 0.45 1.41 -0.31 0.00 0.00 175.10 176.59 1dgg n HIS 75 N 0.12 -1.58 -0.15 2.82 -0.00 -0.58 -4.93 115.22 110.92 1dgg n HIS 75 Ca -0.13 0.38 -0.08 0.00 -0.00 0.00 0.00 57.72 57.90 1dgg n HIS 75 Cb 0.60 -3.98 0.01 0.00 -0.00 0.00 0.00 29.99 26.62 1dgg n HIS 75 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1dgg h ALA 76 N 0.87 0.57 -2.24 -1.41 0.00 -1.73 -3.42 119.26 111.91 1dgg h ALA 76 Ca -0.46 -0.04 -0.62 0.00 0.00 0.00 0.00 54.91 53.80 1dgg h ALA 76 Cb 1.32 -0.18 -0.12 0.00 0.00 0.00 0.00 17.79 18.81 1dgg h ALA 76 CO 0.50 0.03 0.29 0.21 0.00 0.00 0.00 179.25 180.28 1dgg s LYS 77 N -6.13 3.75 0.14 0.00 2.47 -1.26 -4.67 119.74 114.04 1dgg s LYS 77 Ca -0.13 0.24 -0.02 0.00 -1.56 0.00 0.00 55.97 54.50 1dgg s LYS 77 Cb 0.11 -3.80 0.01 0.00 -1.46 0.00 0.00 37.83 32.69 1dgg s LYS 77 CO 0.73 -0.79 0.22 0.41 0.16 0.00 0.00 175.35 176.09 1dgg n GLY 78 N 4.55 2.42 3.04 5.54 0.00 -1.26 -2.43 105.19 117.05 1dgg n GLY 78 Ca 0.01 -1.37 -0.11 0.00 0.00 0.00 0.00 46.02 44.56 1dgg n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgg s ALA 79 N -1.87 -0.15 0.23 4.61 0.00 0.26 -4.90 121.76 119.94 1dgg s ALA 79 Ca 0.10 -0.22 0.04 0.00 0.00 0.00 0.00 51.96 51.88 1dgg s ALA 79 Cb -0.01 0.07 -0.05 0.00 0.00 0.00 0.00 23.12 23.13 1dgg s ALA 79 CO 0.07 -0.16 -0.02 0.20 0.00 0.00 0.00 175.76 175.85 1dgg s GLY 80 N -1.13 1.56 0.15 0.00 0.00 -1.26 0.42 107.32 107.05 1dgg s GLY 80 Ca -0.12 -1.76 -0.24 0.00 0.00 0.00 0.00 44.72 42.59 1dgg s GLY 80 CO 0.00 -1.69 0.79 0.00 0.00 0.00 0.00 173.10 172.21 1dgg s ALA 81 N -3.34 -1.57 0.15 3.20 0.00 -0.49 -4.56 121.76 115.15 1dgg s ALA 81 Ca 0.28 0.30 0.06 0.00 0.00 0.00 0.00 51.96 52.60 1dgg s ALA 81 Cb 0.05 0.71 -0.04 0.00 0.00 0.00 0.00 23.12 23.84 1dgg s ALA 81 CO 0.08 -0.90 -0.14 -0.06 0.00 0.00 0.00 175.76 174.75 1dgg s PHE 82 N -3.53 1.51 0.00 0.00 0.40 0.49 -0.84 117.98 116.01 1dgg s PHE 82 Ca 0.08 -0.57 0.00 0.00 -0.60 0.00 0.00 56.93 55.83 1dgg s PHE 82 Cb -0.02 -0.76 0.00 0.00 0.51 0.00 0.00 43.02 42.75 1dgg s PHE 82 CO -0.03 0.20 0.00 0.41 0.70 0.00 0.00 175.22 176.51 1dgg n GLY 83 N 0.23 1.26 3.43 4.36 0.00 -0.58 -0.97 105.19 112.92 1dgg n GLY 83 Ca -0.13 0.11 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 1dgg n GLY 83 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1dgg s TYR 84 N 1.09 0.22 -0.10 1.61 -0.85 0.47 -0.83 117.35 118.97 1dgg s TYR 84 Ca 0.00 -0.58 0.03 0.00 -0.52 0.00 0.00 57.07 56.00 1dgg s TYR 84 Cb 0.00 0.12 -0.01 0.00 0.38 0.00 0.00 41.96 42.46 1dgg s TYR 84 CO 0.00 -0.82 -0.21 0.12 -1.52 0.00 0.00 175.55 173.12 1dgg s PHE 85 N -3.94 2.62 -0.09 -3.49 5.36 0.13 -0.74 117.98 117.83 1dgg s PHE 85 Ca 0.15 -0.88 0.03 0.00 -0.96 0.00 0.00 56.93 55.27 1dgg s PHE 85 Cb 0.01 -1.73 0.01 0.00 -0.34 0.00 0.00 43.02 40.97 1dgg s PHE 85 CO 0.00 -0.32 -0.19 -2.00 -1.46 0.00 0.00 175.22 171.25 1dgg s GLU 86 N 0.26 2.46 0.09 10.12 2.12 -0.40 -0.72 118.70 132.63 1dgg s GLU 86 Ca -0.14 -0.67 -0.30 0.00 0.36 0.00 0.00 54.97 54.21 1dgg s GLU 86 Cb -0.17 -1.92 -0.06 0.00 0.26 0.00 0.00 34.13 32.24 1dgg s GLU 86 CO 0.07 0.10 1.15 0.08 -0.54 0.00 0.00 175.26 176.12 1dgg s VAL 87 N 0.53 4.06 -0.02 3.70 1.01 -0.94 -0.43 120.40 128.32 1dgg s VAL 87 Ca -0.16 1.55 0.05 0.00 0.00 0.00 0.00 61.98 63.42 1dgg s VAL 87 Cb -0.17 -3.99 -0.07 0.00 0.00 0.00 0.00 36.38 32.15 1dgg s VAL 87 CO 0.06 0.16 0.08 0.35 0.00 0.00 0.00 175.10 175.75 1dgg n THR 88 N 3.51 0.10 -4.32 3.92 -2.24 0.17 0.70 114.28 116.12 1dgg n THR 88 Ca 0.07 -0.14 -0.17 0.00 -2.27 0.00 0.00 64.05 61.54 1dgg n THR 88 Cb 0.47 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.60 1dgg n THR 88 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1dgg s HIS 89 N -2.28 1.52 -0.35 4.78 3.76 0.03 -4.87 115.29 117.88 1dgg s HIS 89 Ca -0.02 -0.91 -0.14 0.00 -0.15 0.00 0.00 55.06 53.84 1dgg s HIS 89 Cb 0.03 -0.87 -0.01 0.00 1.11 0.00 0.00 32.58 32.83 1dgg s HIS 89 CO 0.20 -0.04 0.28 0.34 -0.85 0.00 0.00 174.74 174.68 1dgg s ASP 90 N -3.29 6.10 -0.13 1.40 -1.08 -1.26 -4.71 116.67 113.70 1dgg s ASP 90 Ca 0.27 -0.42 0.15 0.00 -0.52 0.00 0.00 52.55 52.02 1dgg s ASP 90 Cb 0.05 -2.16 0.32 0.00 -1.46 0.00 0.00 42.92 39.68 1dgg s ASP 90 CO 0.08 -0.29 1.16 2.30 0.52 0.00 0.00 175.17 178.94 1dgg n ILE 91 N 5.16 1.58 0.29 4.11 -5.35 -1.26 -4.76 119.36 119.12 1dgg n ILE 91 Ca -0.11 -2.24 0.12 0.00 -0.27 0.00 0.00 62.75 60.24 1dgg n ILE 91 Cb 0.49 -0.01 0.56 0.00 -1.74 0.00 0.00 39.64 38.94 1dgg n ILE 91 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 1dgg h THR 92 N 2.00 0.00 0.00 7.28 1.35 -1.85 0.15 112.91 121.84 1dgg h THR 92 Ca -0.03 -0.13 0.00 0.00 -0.55 0.00 0.00 66.41 65.70 1dgg h THR 92 Cb 1.15 0.77 0.00 0.00 -1.73 0.00 0.00 68.15 68.34 1dgg h THR 92 CO 0.01 0.00 0.00 0.07 -0.25 0.00 0.00 175.52 175.35 1dgg h LYS 93 N 0.00 0.00 0.00 4.72 2.10 -1.99 -3.28 116.57 118.12 1dgg h LYS 93 Ca 0.00 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 58.34 1dgg h LYS 93 Cb 0.20 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 31.47 1dgg h LYS 93 CO 0.00 0.00 -2.18 0.66 -2.00 0.00 0.00 179.45 175.93 1dgg n TYR 94 N -2.72 0.00 -3.98 0.07 0.53 0.36 -4.72 117.16 106.71 1dgg n TYR 94 Ca 0.03 0.00 -0.14 0.00 -1.02 0.00 0.00 57.90 56.77 1dgg n TYR 94 Cb 0.35 -0.80 -0.14 0.00 -1.03 0.00 0.00 39.34 37.72 1dgg n TYR 94 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 1dgg s SER 95 N -6.03 0.25 0.00 7.72 0.15 -0.34 -2.87 113.70 112.59 1dgg s SER 95 Ca -0.28 -0.04 0.23 0.00 0.70 0.00 0.00 55.95 56.56 1dgg s SER 95 Cb 0.07 -0.04 0.74 0.00 -1.71 0.00 0.00 66.02 65.08 1dgg s SER 95 CO 0.48 0.01 1.55 2.29 1.20 0.00 0.00 173.24 178.77 1dgg n LYS 96 N 3.13 1.84 -1.64 5.44 2.85 0.11 -4.10 118.16 125.79 1dgg n LYS 96 Ca -0.14 -1.26 -0.48 0.00 -1.05 0.00 0.00 58.31 55.39 1dgg n LYS 96 Cb 0.58 -1.43 -0.05 0.00 -0.65 0.00 0.00 35.03 33.49 1dgg n LYS 96 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1dgg n ALA 97 N 0.49 0.50 0.02 0.58 0.00 -1.24 -4.84 120.51 116.02 1dgg n ALA 97 Ca 0.17 0.47 0.06 0.00 0.00 0.00 0.00 53.44 54.13 1dgg n ALA 97 Cb 0.38 -2.24 0.47 0.00 0.00 0.00 0.00 19.45 18.06 1dgg n ALA 97 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1dgg h LYS 98 N 5.22 0.44 -0.14 0.00 1.57 -1.93 -1.16 116.57 120.58 1dgg h LYS 98 Ca -0.46 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.34 1dgg h LYS 98 Cb 1.29 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 1dgg h LYS 98 CO 0.83 0.29 0.19 -0.24 -0.57 0.00 0.00 179.45 179.95 1dgg h VAL 99 N 0.45 0.37 -0.01 0.50 3.04 -1.95 -1.38 116.25 117.27 1dgg h VAL 99 Ca 0.15 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.84 1dgg h VAL 99 Cb 0.05 0.84 0.00 0.00 -2.01 0.00 0.00 31.29 30.17 1dgg h VAL 99 CO -0.03 0.00 -0.08 0.49 -1.01 0.00 0.00 177.57 176.94 1dgg n PHE 100 N -3.62 0.00 -0.26 3.17 3.72 -0.47 -4.79 117.46 115.21 1dgg n PHE 100 Ca 0.01 0.00 0.22 0.00 -0.05 0.00 0.00 57.45 57.63 1dgg n PHE 100 Cb 0.29 0.00 0.55 0.00 -0.94 0.00 0.00 39.48 39.38 1dgg n PHE 100 CO 0.00 0.00 0.00 1.05 -0.05 0.00 0.00 176.76 177.76 1dgg h GLU 101 N 2.14 0.32 -3.57 -1.08 4.11 -0.89 -3.43 114.58 112.19 1dgg h GLU 101 Ca 0.00 -0.02 -0.23 0.00 0.07 0.00 0.00 59.36 59.18 1dgg h GLU 101 Cb 0.49 -0.07 -0.29 0.00 0.50 0.00 0.00 28.75 29.38 1dgg h GLU 101 CO 0.00 0.21 -0.67 -1.01 0.07 0.00 0.00 179.01 177.61 1dgg s HIS 102 N -5.37 -0.05 0.16 2.06 3.76 -1.26 -4.97 115.29 109.62 1dgg s HIS 102 Ca -0.08 0.16 -0.32 0.00 -0.15 0.00 0.00 55.06 54.68 1dgg s HIS 102 Cb 0.23 -0.04 -0.10 0.00 1.11 0.00 0.00 32.58 33.78 1dgg s HIS 102 CO 0.79 -0.05 1.62 0.42 -0.85 0.00 0.00 174.74 176.67 1dgg s ILE 103 N 0.32 2.54 0.00 0.60 1.01 -1.26 -1.28 121.20 123.12 1dgg s ILE 103 Ca -0.02 0.35 0.00 0.00 0.00 0.00 0.00 60.65 60.97 1dgg s ILE 103 Cb -0.04 -3.22 0.00 0.00 0.01 0.00 0.00 42.46 39.21 1dgg s ILE 103 CO -0.01 0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.56 1dgg n GLY 104 N 3.84 0.53 3.69 6.18 0.00 0.22 -4.97 105.19 114.69 1dgg n GLY 104 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1dgg n GLY 104 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1dgg s LYS 105 N -0.84 4.39 -0.11 1.61 2.20 -0.41 -4.75 119.74 121.83 1dgg s LYS 105 Ca 0.00 1.66 -0.04 0.00 -0.36 0.00 0.00 55.97 57.23 1dgg s LYS 105 Cb 0.00 -3.50 -0.04 0.00 -1.51 0.00 0.00 37.83 32.78 1dgg s LYS 105 CO 0.00 -0.37 0.06 0.15 -0.36 0.00 0.00 175.35 174.83 1dgg s LYS 106 N 1.85 3.23 -0.07 4.03 1.02 -1.26 -2.21 119.74 126.33 1dgg s LYS 106 Ca 0.56 -0.29 0.01 0.00 0.02 0.00 0.00 55.97 56.27 1dgg s LYS 106 Cb -0.25 -2.98 0.02 0.00 -0.52 0.00 0.00 37.83 34.09 1dgg s LYS 106 CO 0.24 0.71 -0.10 0.99 -0.92 0.00 0.00 175.35 176.27 1dgg s THR 107 N -0.87 1.02 0.39 2.17 2.01 0.10 -4.94 115.64 115.53 1dgg s THR 107 Ca 0.13 -0.38 -0.27 0.00 0.31 0.00 0.00 61.69 61.48 1dgg s THR 107 Cb -0.12 -0.97 -0.10 0.00 0.01 0.00 0.00 72.50 71.32 1dgg s THR 107 CO 0.03 0.34 1.44 -2.84 -0.69 0.00 0.00 174.62 172.90 1dgg s PRO 108 N 0.96 4.03 0.09 4.92 0.02 -1.26 0.17 135.00 143.92 1dgg s PRO 108 Ca -0.09 2.47 0.03 0.00 0.02 0.00 0.00 61.00 63.43 1dgg s PRO 108 Cb -0.15 -2.89 -0.03 0.00 0.02 0.00 0.00 34.50 31.45 1dgg s PRO 108 CO 0.00 -0.56 -0.10 0.96 -0.33 0.00 0.00 177.00 176.98 1dgg s ILE 109 N -1.15 0.86 -0.02 2.83 -4.36 -0.01 -1.75 121.20 117.60 1dgg s ILE 109 Ca 0.55 -1.57 0.06 0.00 -0.26 0.00 0.00 60.65 59.43 1dgg s ILE 109 Cb -0.44 -1.27 -0.01 0.00 1.25 0.00 0.00 42.46 41.98 1dgg s ILE 109 CO 0.59 -0.55 -0.21 0.00 0.24 0.00 0.00 174.94 175.01 1dgg s ALA 110 N -2.35 1.77 0.03 2.27 0.00 -0.34 -1.52 121.76 121.63 1dgg s ALA 110 Ca 0.03 -0.91 0.02 0.00 0.00 0.00 0.00 51.96 51.11 1dgg s ALA 110 Cb -0.03 -0.47 -0.02 0.00 0.00 0.00 0.00 23.12 22.60 1dgg s ALA 110 CO -0.00 0.42 -0.08 0.08 0.00 0.00 0.00 175.76 176.18 1dgg s VAL 111 N -0.43 0.55 -0.03 0.00 1.01 -0.02 -0.14 120.40 121.34 1dgg s VAL 111 Ca 0.06 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.22 1dgg s VAL 111 Cb -0.09 -0.57 0.03 0.00 0.00 0.00 0.00 36.38 35.75 1dgg s VAL 111 CO -0.00 -0.20 0.04 -0.60 0.00 0.00 0.00 175.10 174.34 1dgg s ARG 112 N -1.11 0.00 0.15 2.72 3.52 -0.99 -1.40 118.95 121.84 1dgg s ARG 112 Ca -0.05 0.26 0.03 0.00 -0.13 0.00 0.00 55.73 55.83 1dgg s ARG 112 Cb -0.07 -0.41 -0.04 0.00 -1.56 0.00 0.00 34.95 32.87 1dgg s ARG 112 CO 0.00 -0.24 0.23 -0.06 -0.81 0.00 0.00 175.30 174.43 1dgg s PHE 113 N 1.57 3.38 0.04 5.12 0.40 0.17 -2.23 117.98 126.42 1dgg s PHE 113 Ca -0.03 0.08 -0.28 0.00 -0.60 0.00 0.00 56.93 56.10 1dgg s PHE 113 Cb -0.13 -1.62 0.10 0.00 0.51 0.00 0.00 43.02 41.88 1dgg s PHE 113 CO -0.03 0.52 1.10 -1.54 0.70 0.00 0.00 175.22 175.97 1dgg s SER 114 N -3.16 -0.15 0.08 1.36 1.04 -1.02 -0.57 113.70 111.28 1dgg s SER 114 Ca 0.33 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.54 1dgg s SER 114 Cb -0.11 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.34 1dgg s SER 114 CO 0.27 -0.59 0.00 0.35 0.98 0.00 0.00 173.24 174.25 1dgg n THR 115 N -0.42 0.00 0.03 2.02 -2.24 -1.02 0.40 114.28 113.04 1dgg n THR 115 Ca -0.07 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.71 1dgg n THR 115 Cb 0.61 -1.13 -0.00 0.00 -2.10 0.00 0.00 70.33 67.72 1dgg n THR 115 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1dgg n VAL 116 N -0.75 0.86 -0.01 2.28 0.31 -1.25 -3.81 118.33 115.95 1dgg n VAL 116 Ca 0.00 0.27 -0.16 0.00 -0.01 0.00 0.00 64.34 64.43 1dgg n VAL 116 Cb 0.00 -1.58 -0.12 0.00 -0.91 0.00 0.00 33.84 31.23 1dgg n VAL 116 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1dgg h ALA 117 N -0.03 0.04 -2.83 3.52 0.00 -1.93 -1.54 119.26 116.48 1dgg h ALA 117 Ca -0.01 -0.52 -0.57 0.00 0.00 0.00 0.00 54.91 53.82 1dgg h ALA 117 Cb 0.36 0.03 0.15 0.00 0.00 0.00 0.00 17.79 18.32 1dgg h ALA 117 CO -0.00 0.20 0.34 0.41 0.00 0.00 0.00 179.25 180.19 1dgg n GLY 118 N 1.12 0.17 2.67 0.00 0.00 -1.26 -4.91 105.19 102.98 1dgg n GLY 118 Ca -0.10 -0.01 -0.20 0.00 0.00 0.00 0.00 46.02 45.71 1dgg n GLY 118 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1dgg n GLU 119 N -0.76 -0.90 -2.28 1.61 4.71 -1.26 -4.02 120.64 117.75 1dgg n GLU 119 Ca 0.11 -1.42 -0.41 0.00 -0.01 0.00 0.00 57.16 55.43 1dgg n GLU 119 Cb 0.44 -0.95 -0.03 0.00 -1.01 0.00 0.00 31.44 29.90 1dgg n GLU 119 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 1dgg s SER 120 N -4.36 6.96 0.00 1.62 0.01 -1.26 -2.17 113.70 114.50 1dgg s SER 120 Ca 0.52 2.32 0.00 0.00 1.31 0.00 0.00 55.95 60.10 1dgg s SER 120 Cb -0.01 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.61 1dgg s SER 120 CO 0.37 -0.49 0.00 0.61 0.41 0.00 0.00 173.24 174.14 1dgg n GLY 121 N 2.47 1.70 3.54 3.44 0.00 -1.26 -5.03 105.19 110.04 1dgg n GLY 121 Ca 0.06 -0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 1dgg n GLY 121 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dgg s SER 122 N -0.06 1.52 0.36 1.61 1.04 -0.92 -4.99 113.70 112.26 1dgg s SER 122 Ca 0.00 1.66 -0.18 0.00 0.48 0.00 0.00 55.95 57.91 1dgg s SER 122 Cb 0.00 -2.35 -0.10 0.00 0.10 0.00 0.00 66.02 63.68 1dgg s SER 122 CO 0.00 -3.89 0.82 0.00 0.98 0.00 0.00 173.24 171.15 1dgg s ALA 123 N -2.54 3.22 0.01 5.32 0.00 -1.26 -4.84 121.76 121.68 1dgg s ALA 123 Ca 0.68 0.19 -0.19 0.00 0.00 0.00 0.00 51.96 52.64 1dgg s ALA 123 Cb -0.24 -2.92 -0.22 0.00 0.00 0.00 0.00 23.12 19.73 1dgg s ALA 123 CO 0.63 0.25 1.13 -0.44 0.00 0.00 0.00 175.76 177.33 1dgg h ASP 124 N 2.21 0.55 0.00 0.00 3.32 -1.00 -3.39 116.42 118.11 1dgg h ASP 124 Ca -0.48 -0.74 -0.67 0.00 0.02 0.00 0.00 57.03 55.16 1dgg h ASP 124 Cb 1.18 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.56 1dgg h ASP 124 CO 0.64 1.21 3.48 0.35 -1.72 0.00 0.00 179.24 183.19 1dgg n THR 125 N -4.22 3.81 -4.26 0.35 -2.24 -1.26 -4.89 114.28 101.57 1dgg n THR 125 Ca -0.10 -2.65 -0.17 0.00 -2.27 0.00 0.00 64.05 58.86 1dgg n THR 125 Cb 0.66 -2.58 -0.11 0.00 -2.10 0.00 0.00 70.33 66.20 1dgg n THR 125 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1dgg s VAL 126 N 2.72 1.35 -0.03 2.28 -7.23 -1.26 -4.45 120.40 113.77 1dgg s VAL 126 Ca 0.59 -1.86 -0.30 0.00 -1.81 0.00 0.00 61.98 58.60 1dgg s VAL 126 Cb 0.16 -1.67 -0.05 0.00 0.56 0.00 0.00 36.38 35.37 1dgg s VAL 126 CO -0.06 -0.52 1.49 -0.60 -0.31 0.00 0.00 175.10 175.10 1dgg s ARG 127 N -3.05 4.23 0.00 4.82 3.52 -1.26 -4.72 118.95 122.49 1dgg s ARG 127 Ca 0.13 2.04 0.00 0.00 -0.13 0.00 0.00 55.73 57.76 1dgg s ARG 127 Cb -0.03 -3.73 0.00 0.00 -1.56 0.00 0.00 34.95 29.63 1dgg s ARG 127 CO 0.03 -0.70 0.00 -3.47 -0.81 0.00 0.00 175.30 170.35 1dgg n ASP 128 N 6.13 0.00 -4.57 -2.12 4.64 -1.20 -5.03 116.55 114.39 1dgg n ASP 128 Ca 0.15 0.00 -0.28 0.00 -1.38 0.00 0.00 54.79 53.27 1dgg n ASP 128 Cb 0.43 0.00 0.21 0.00 -1.04 0.00 0.00 41.12 40.72 1dgg n ASP 128 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 1dgg s PRO 129 N -1.83 -0.20 -0.07 -0.67 0.04 -1.26 -4.80 135.00 126.20 1dgg s PRO 129 Ca 0.00 0.55 0.05 0.00 0.04 0.00 0.00 61.00 61.64 1dgg s PRO 129 Cb 0.00 -1.66 -0.00 0.00 0.04 0.00 0.00 34.50 32.88 1dgg s PRO 129 CO 0.00 -3.17 -0.23 1.03 0.04 0.00 0.00 177.00 174.67 1dgg s ARG 130 N -4.83 2.58 0.40 4.56 1.81 -1.26 -3.96 118.95 118.26 1dgg s ARG 130 Ca 0.67 -0.83 -0.23 0.00 -1.72 0.00 0.00 55.73 53.61 1dgg s ARG 130 Cb -0.20 -2.09 -0.10 0.00 -0.45 0.00 0.00 34.95 32.11 1dgg s ARG 130 CO 0.60 0.27 0.99 0.20 -0.68 0.00 0.00 175.30 176.68 1dgg s GLY 131 N 0.08 2.61 -0.46 -3.53 0.00 0.16 -0.20 107.32 105.99 1dgg s GLY 131 Ca -0.10 0.55 0.06 0.00 0.00 0.00 0.00 44.72 45.24 1dgg s GLY 131 CO 0.05 0.92 0.67 0.33 0.00 0.00 0.00 173.10 175.07 1dgg n PHE 132 N -0.23 -2.32 -3.16 1.90 -0.00 0.11 -2.44 117.46 111.31 1dgg n PHE 132 Ca 0.06 -2.37 -0.39 0.00 -0.00 0.00 0.00 57.45 54.74 1dgg n PHE 132 Cb 0.52 0.85 -0.05 0.00 -0.00 0.00 0.00 39.48 40.80 1dgg n PHE 132 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1dgg s ALA 133 N 0.16 3.43 -0.14 3.13 0.00 -0.95 -2.42 121.76 124.97 1dgg s ALA 133 Ca 0.32 0.04 0.02 0.00 0.00 0.00 0.00 51.96 52.34 1dgg s ALA 133 Cb 0.13 -2.81 0.01 0.00 0.00 0.00 0.00 23.12 20.46 1dgg s ALA 133 CO -0.16 0.04 -0.21 0.08 0.00 0.00 0.00 175.76 175.52 1dgg s VAL 134 N 0.29 1.98 -0.29 0.00 1.01 0.16 -2.35 120.40 121.20 1dgg s VAL 134 Ca 0.33 -0.92 -0.09 0.00 0.00 0.00 0.00 61.98 61.30 1dgg s VAL 134 Cb -0.18 -1.76 -0.02 0.00 0.00 0.00 0.00 36.38 34.42 1dgg s VAL 134 CO 0.17 0.53 0.13 -0.75 0.00 0.00 0.00 175.10 175.18 1dgg s LYS 135 N 0.95 3.51 -0.38 2.72 2.20 0.80 -0.82 119.74 128.73 1dgg s LYS 135 Ca -0.04 -0.59 -0.13 0.00 -0.36 0.00 0.00 55.97 54.85 1dgg s LYS 135 Cb -0.15 -3.49 0.02 0.00 -1.51 0.00 0.00 37.83 32.70 1dgg s LYS 135 CO -0.04 -0.31 0.24 -0.06 -0.36 0.00 0.00 175.35 174.82 1dgg s PHE 136 N 1.63 3.24 -1.07 4.03 0.40 0.83 -1.20 117.98 125.83 1dgg s PHE 136 Ca 0.05 -0.70 -0.21 0.00 -0.60 0.00 0.00 56.93 55.48 1dgg s PHE 136 Cb -0.16 -2.50 0.07 0.00 0.51 0.00 0.00 43.02 40.94 1dgg s PHE 136 CO 0.06 -0.58 1.46 0.71 0.70 0.00 0.00 175.22 177.57 1dgg s TYR 137 N 1.63 2.73 0.44 0.36 2.02 -0.72 -0.44 117.35 123.37 1dgg s TYR 137 Ca 0.04 -1.16 0.07 0.00 -0.37 0.00 0.00 57.07 55.65 1dgg s TYR 137 Cb -0.19 -4.63 0.02 0.00 -0.40 0.00 0.00 41.96 36.76 1dgg s TYR 137 CO 0.08 -1.81 0.60 0.95 -1.57 0.00 0.00 175.55 173.80 1dgg s THR 138 N 4.28 2.93 0.16 -0.71 -4.23 -1.00 -4.40 115.64 112.66 1dgg s THR 138 Ca 0.45 -0.97 0.30 0.00 -1.18 0.00 0.00 61.69 60.29 1dgg s THR 138 Cb -0.00 -2.96 0.32 0.00 1.34 0.00 0.00 72.50 71.20 1dgg s THR 138 CO -0.06 0.00 1.94 -0.33 -0.54 0.00 0.00 174.62 175.64 1dgg h GLU 139 N 0.56 0.00 -1.00 3.99 3.07 -1.95 -2.26 114.58 117.00 1dgg h GLU 139 Ca -0.40 0.00 -0.50 0.00 -0.50 0.00 0.00 59.36 57.96 1dgg h GLU 139 Cb 1.28 0.00 -0.30 0.00 -0.84 0.00 0.00 28.75 28.89 1dgg h GLU 139 CO 0.45 0.10 0.64 -0.25 -1.40 0.00 0.00 179.01 178.55 1dgg n ASP 140 N -3.27 3.77 0.00 1.42 10.43 -1.26 -4.58 116.55 123.07 1dgg n ASP 140 Ca 0.00 -3.55 0.00 0.00 2.57 0.00 0.00 54.79 53.81 1dgg n ASP 140 Cb 0.34 -0.83 0.00 0.00 1.84 0.00 0.00 41.12 42.47 1dgg n ASP 140 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1dgg n GLY 141 N -1.08 -0.15 3.78 0.44 0.00 -0.85 -4.64 105.19 102.69 1dgg n GLY 141 Ca 0.58 -1.84 -0.37 0.00 0.00 0.00 0.00 46.02 44.38 1dgg n GLY 141 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dgg s ASN 142 N -1.37 6.95 -0.20 1.61 0.01 -1.26 -2.39 114.94 118.29 1dgg s ASN 142 Ca 0.00 2.03 0.01 0.00 -0.71 0.00 0.00 52.86 54.19 1dgg s ASN 142 Cb 0.00 -2.59 0.04 0.00 0.41 0.00 0.00 41.25 39.11 1dgg s ASN 142 CO 0.00 -0.35 -0.15 0.86 -1.51 0.00 0.00 177.10 175.95 1dgg s TRP 143 N -1.58 2.77 -0.31 2.20 -0.00 0.42 -4.26 118.94 118.18 1dgg s TRP 143 Ca 0.54 -1.78 -0.09 0.00 -0.00 0.00 0.00 56.10 54.77 1dgg s TRP 143 Cb -0.23 -1.83 0.00 0.00 -0.00 0.00 0.00 33.47 31.42 1dgg s TRP 143 CO 0.29 -0.80 0.14 -0.51 -0.00 0.00 0.00 176.95 176.06 1dgg s ASP 144 N 1.28 5.44 -0.68 5.86 -0.00 -0.49 -0.12 116.67 127.97 1dgg s ASP 144 Ca -0.00 -0.63 -0.11 0.00 -0.00 0.00 0.00 52.55 51.80 1dgg s ASP 144 Cb -0.16 -1.97 0.17 0.00 -0.00 0.00 0.00 42.92 40.97 1dgg s ASP 144 CO -0.10 -0.21 0.58 -0.22 -0.00 0.00 0.00 175.17 175.22 1dgg s LEU 145 N 1.57 6.18 -1.04 1.23 2.96 0.00 -4.44 118.68 125.15 1dgg s LEU 145 Ca 0.04 -2.43 -0.18 0.00 -0.22 0.00 0.00 54.13 51.34 1dgg s LEU 145 Cb -0.17 -2.11 0.13 0.00 0.50 0.00 0.00 46.19 44.54 1dgg s LEU 145 CO 0.05 -0.60 1.28 -0.69 -1.32 0.00 0.00 176.35 175.06 1dgg s VAL 146 N 0.58 4.73 0.54 1.68 1.01 -1.26 -0.66 120.40 127.02 1dgg s VAL 146 Ca 0.13 -1.85 0.07 0.00 0.00 0.00 0.00 61.98 60.33 1dgg s VAL 146 Cb -0.18 -4.86 0.07 0.00 0.00 0.00 0.00 36.38 31.41 1dgg s VAL 146 CO -0.04 -1.60 0.61 0.61 0.00 0.00 0.00 175.10 174.68 1dgg n GLY 147 N 5.18 2.29 3.54 4.51 0.00 -1.01 -4.91 105.19 114.78 1dgg n GLY 147 Ca 0.30 -2.25 -0.25 0.00 0.00 0.00 0.00 46.02 43.81 1dgg n GLY 147 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dgg s ASN 148 N -4.29 2.96 -0.05 1.61 0.01 -0.77 0.09 114.94 114.51 1dgg s ASN 148 Ca 0.47 -1.49 0.04 0.00 -0.71 0.00 0.00 52.86 51.17 1dgg s ASN 148 Cb -0.04 0.10 0.20 0.00 0.41 0.00 0.00 41.25 41.93 1dgg s ASN 148 CO 0.30 -0.70 0.90 -0.46 -1.51 0.00 0.00 177.10 175.62 1dgg n ASN 149 N -0.97 1.97 -4.01 -1.22 6.94 0.72 -0.07 115.26 118.63 1dgg n ASN 149 Ca -0.06 -2.19 -0.13 0.00 -0.02 0.00 0.00 54.58 52.18 1dgg n ASN 149 Cb 0.66 -0.46 -0.12 0.00 -2.36 0.00 0.00 39.78 37.51 1dgg n ASN 149 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 1dgg s THR 150 N -1.52 0.38 -0.82 5.53 -1.32 -1.26 -4.68 115.64 111.95 1dgg s THR 150 Ca 0.14 -0.77 0.27 0.00 -1.21 0.00 0.00 61.69 60.12 1dgg s THR 150 Cb 0.10 -0.43 0.25 0.00 -1.51 0.00 0.00 72.50 70.90 1dgg s THR 150 CO 0.05 -0.26 1.78 -0.81 -2.21 0.00 0.00 174.62 173.17 1dgg n PRO 151 N 1.95 0.17 -3.82 7.08 -0.04 -1.26 -4.50 135.00 134.59 1dgg n PRO 151 Ca -0.20 0.13 -0.21 0.00 -0.04 0.00 0.00 63.50 63.18 1dgg n PRO 151 Cb 0.56 -1.69 -0.05 0.00 -0.04 0.00 0.00 33.50 32.28 1dgg n PRO 151 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1dgg n ILE 152 N -1.99 0.00 -4.06 0.52 -5.35 -1.26 -4.33 119.36 102.89 1dgg n ILE 152 Ca 0.06 -1.70 -0.10 0.00 -0.27 0.00 0.00 62.75 60.74 1dgg n ILE 152 Cb 0.40 0.47 -0.08 0.00 -1.74 0.00 0.00 39.64 38.69 1dgg n ILE 152 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 1dgg s PHE 153 N -2.46 0.65 0.25 4.28 2.19 -0.89 -5.00 117.98 117.01 1dgg s PHE 153 Ca 0.07 -0.98 -0.00 0.00 0.33 0.00 0.00 56.93 56.35 1dgg s PHE 153 Cb 0.00 -0.20 0.31 0.00 -1.31 0.00 0.00 43.02 41.82 1dgg s PHE 153 CO 0.05 -0.73 1.67 0.74 1.83 0.00 0.00 175.22 178.78 1dgg h PHE 154 N 2.55 0.65 -2.39 10.12 -1.00 -1.88 -3.40 116.94 121.59 1dgg h PHE 154 Ca -0.32 -0.15 -0.54 0.00 2.81 0.00 0.00 57.97 59.77 1dgg h PHE 154 Cb 1.23 -0.15 -0.14 0.00 3.61 0.00 0.00 35.95 40.50 1dgg h PHE 154 CO 0.39 0.80 -0.66 0.96 -1.61 0.00 0.00 178.31 178.19 1dgg s ILE 155 N -4.45 1.77 0.00 -0.55 -4.36 -1.26 -1.98 121.20 110.37 1dgg s ILE 155 Ca -0.07 -2.11 0.00 0.00 -0.26 0.00 0.00 60.65 58.20 1dgg s ILE 155 Cb 0.13 -2.60 0.00 0.00 1.25 0.00 0.00 42.46 41.24 1dgg s ILE 155 CO 0.81 -0.20 0.91 -2.11 0.24 0.00 0.00 174.94 174.58 1dgg n ARG 156 N -0.69 2.42 -3.73 0.37 1.85 -1.26 -4.62 116.66 110.99 1dgg n ARG 156 Ca -0.05 -1.32 -0.18 0.00 -1.00 0.00 0.00 57.85 55.30 1dgg n ARG 156 Cb 0.64 -0.94 -0.17 0.00 -1.05 0.00 0.00 32.46 30.95 1dgg n ARG 156 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1dgg s ASP 157 N -0.82 0.68 0.54 2.89 2.15 -1.26 -4.31 116.67 116.54 1dgg s ASP 157 Ca 0.00 0.05 0.22 0.00 0.43 0.00 0.00 52.55 53.24 1dgg s ASP 157 Cb 0.00 -0.13 1.44 0.00 -0.30 0.00 0.00 42.92 43.93 1dgg s ASP 157 CO 0.00 -0.19 2.14 1.55 -0.17 0.00 0.00 175.17 178.50 1dgg h PRO 158 N 7.89 0.00 0.00 4.34 0.13 -1.88 -2.63 132.00 139.85 1dgg h PRO 158 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1dgg h PRO 158 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1dgg h PRO 158 CO 0.31 0.00 0.00 1.51 -0.23 0.00 0.00 178.00 179.59 1dgg n ILE 159 N -4.30 1.10 0.46 -3.56 3.06 -1.26 -1.10 119.36 113.75 1dgg n ILE 159 Ca -0.00 0.43 0.11 0.00 -2.50 0.00 0.00 62.75 60.79 1dgg n ILE 159 Cb 0.21 -1.36 -0.07 0.00 0.54 0.00 0.00 39.64 38.95 1dgg n ILE 159 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 1dgg n LEU 160 N -2.01 0.52 -0.12 9.51 4.77 -0.99 -4.52 117.00 124.16 1dgg n LEU 160 Ca 0.01 -0.10 -0.05 0.00 -0.03 0.00 0.00 56.01 55.84 1dgg n LEU 160 Cb 0.12 -0.04 0.02 0.00 -2.33 0.00 0.00 43.42 41.19 1dgg n LEU 160 CO 0.13 0.06 0.82 0.15 -1.33 0.00 0.00 177.39 177.22 1dgg h PHE 161 N 0.00 -0.12 -0.67 -1.77 3.04 -1.23 -0.69 116.94 115.49 1dgg h PHE 161 Ca 0.00 0.03 0.05 0.00 3.98 0.00 0.00 57.97 62.04 1dgg h PHE 161 Cb 0.78 0.12 -0.05 0.00 2.56 0.00 0.00 35.95 39.35 1dgg h PHE 161 CO 0.00 -0.13 0.39 -1.35 -2.02 0.00 0.00 178.31 175.20 1dgg h PRO 162 N 0.05 0.70 -0.50 6.41 0.11 -1.79 -0.07 132.00 136.90 1dgg h PRO 162 Ca 0.19 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.24 1dgg h PRO 162 Cb 0.28 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 31.22 1dgg h PRO 162 CO -0.37 0.46 0.22 0.77 -0.21 0.00 0.00 178.00 178.87 1dgg h SER 163 N 0.72 0.67 0.00 -2.05 0.02 -1.71 0.65 113.55 111.85 1dgg h SER 163 Ca 0.30 -0.15 0.02 0.00 -0.84 0.00 0.00 61.79 61.11 1dgg h SER 163 Cb 0.16 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.50 1dgg h SER 163 CO -0.17 0.64 -0.12 0.15 -1.14 0.00 0.00 176.83 176.19 1dgg h PHE 164 N 0.66 -0.32 -0.53 3.45 -0.00 -0.53 0.20 116.94 119.88 1dgg h PHE 164 Ca 0.17 0.01 -0.02 0.00 -0.00 0.00 0.00 57.97 58.13 1dgg h PHE 164 Cb 0.16 0.14 -0.03 0.00 -0.00 0.00 0.00 35.95 36.23 1dgg h PHE 164 CO -0.00 -0.19 0.26 0.82 -0.00 0.00 0.00 178.31 179.21 1dgg h ILE 165 N -0.21 1.17 0.00 1.41 1.08 -0.78 -1.57 117.51 118.61 1dgg h ILE 165 Ca 0.04 -0.48 -0.00 0.00 -0.39 0.00 0.00 64.86 64.04 1dgg h ILE 165 Cb 0.27 0.49 0.00 0.00 -3.07 0.00 0.00 36.82 34.50 1dgg h ILE 165 CO -0.12 0.20 -0.00 0.45 -0.69 0.00 0.00 178.15 177.99 1dgg h HIS 166 N 0.74 -0.00 -0.04 1.37 3.86 0.16 -1.77 115.15 119.47 1dgg h HIS 166 Ca 0.19 -0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.41 1dgg h HIS 166 Cb 0.06 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.53 1dgg h HIS 166 CO 0.01 0.11 0.04 0.66 0.86 0.00 0.00 177.93 179.61 1dgg h SER 167 N -0.12 0.00 1.31 2.45 4.64 -0.04 -0.08 113.55 121.71 1dgg h SER 167 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1dgg h SER 167 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1dgg h SER 167 CO 0.00 0.00 -0.50 1.56 -0.87 0.00 0.00 176.83 177.02 1dgg h GLN 168 N 0.00 0.00 0.00 4.77 1.08 -0.62 -3.04 115.11 117.30 1dgg h GLN 168 Ca 0.02 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 1dgg h GLN 168 Cb 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.54 1dgg h GLN 168 CO -0.00 0.00 0.00 1.63 -0.95 0.00 0.00 178.83 179.51 1dgg n LYS 169 N -2.61 3.74 -2.85 1.46 5.02 -0.05 -4.92 118.16 117.95 1dgg n LYS 169 Ca 0.03 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.98 1dgg n LYS 169 Cb 0.50 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 35.45 1dgg n LYS 169 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1dgg s ARG 170 N 3.32 4.29 0.22 1.97 0.52 -1.26 -4.07 118.95 123.94 1dgg s ARG 170 Ca 0.00 1.11 -0.30 0.00 -0.52 0.00 0.00 55.73 56.02 1dgg s ARG 170 Cb 0.00 -2.37 -0.10 0.00 0.52 0.00 0.00 34.95 33.00 1dgg s ARG 170 CO 0.00 0.08 1.49 1.21 0.02 0.00 0.00 175.30 178.09 1dgg s ASN 171 N -2.04 6.62 0.62 0.23 3.84 0.11 -4.82 114.94 119.50 1dgg s ASN 171 Ca 0.58 2.66 0.31 0.00 0.21 0.00 0.00 52.86 56.62 1dgg s ASN 171 Cb -0.12 -2.61 1.70 0.00 -0.55 0.00 0.00 41.25 39.67 1dgg s ASN 171 CO 0.16 -0.75 2.03 1.55 -2.79 0.00 0.00 177.10 177.31 1dgg h PRO 172 N 5.57 0.00 0.00 0.43 0.13 -1.95 0.33 132.00 136.50 1dgg h PRO 172 Ca -0.45 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.36 1dgg h PRO 172 Cb 1.21 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.30 1dgg h PRO 172 CO 0.82 0.00 -2.02 0.94 -0.23 0.00 0.00 178.00 177.50 1dgg n GLN 173 N -3.42 0.46 0.19 0.86 7.27 -1.26 -4.69 117.38 116.79 1dgg n GLN 173 Ca 0.01 0.20 0.12 0.00 0.07 0.00 0.00 57.00 57.41 1dgg n GLN 173 Cb 0.38 -1.28 0.21 0.00 2.41 0.00 0.00 30.24 31.96 1dgg n GLN 173 CO 0.00 0.00 0.00 1.79 0.07 0.00 0.00 177.06 178.92 1dgg h THR 174 N -0.80 0.00 -0.71 1.69 1.35 -1.96 -3.47 112.91 109.02 1dgg h THR 174 Ca -0.48 -0.89 -0.30 0.00 -0.55 0.00 0.00 66.41 64.18 1dgg h THR 174 Cb 1.39 1.86 -0.12 0.00 -1.73 0.00 0.00 68.15 69.55 1dgg h THR 174 CO -0.29 0.00 -0.28 1.57 -0.25 0.00 0.00 175.52 176.27 1dgg n HIS 175 N -2.90 0.00 -4.12 4.73 -0.00 0.12 -4.90 115.22 108.14 1dgg n HIS 175 Ca 0.04 0.00 -0.26 0.00 0.46 0.00 0.00 57.72 57.96 1dgg n HIS 175 Cb 0.51 -2.74 -0.06 0.00 -0.12 0.00 0.00 29.99 27.58 1dgg n HIS 175 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 1dgg s LEU 176 N -3.38 3.65 0.33 0.27 1.43 -1.26 -4.60 118.68 115.11 1dgg s LEU 176 Ca 0.00 -0.22 -0.29 0.00 -1.03 0.00 0.00 54.13 52.59 1dgg s LEU 176 Cb 0.00 -2.27 -0.11 0.00 0.03 0.00 0.00 46.19 43.84 1dgg s LEU 176 CO 0.00 0.07 1.48 -0.54 0.23 0.00 0.00 176.35 177.60 1dgg s LYS 177 N -3.06 4.17 -0.30 1.70 -0.14 -1.26 0.05 119.74 120.91 1dgg s LYS 177 Ca 0.30 2.48 0.02 0.00 -1.36 0.00 0.00 55.97 57.41 1dgg s LYS 177 Cb -0.10 -3.02 0.09 0.00 -1.68 0.00 0.00 37.83 33.12 1dgg s LYS 177 CO 0.22 -0.49 0.03 0.34 -0.76 0.00 0.00 175.35 174.69 1dgg s ASP 178 N 0.04 4.29 0.58 2.83 -1.08 -1.26 -4.85 116.67 117.23 1dgg s ASP 178 Ca 0.56 -1.71 0.30 0.00 -0.52 0.00 0.00 52.55 51.17 1dgg s ASP 178 Cb -0.45 -1.28 1.77 0.00 -1.46 0.00 0.00 42.92 41.50 1dgg s ASP 178 CO 0.55 -0.34 2.22 1.55 0.52 0.00 0.00 175.17 179.67 1dgg h PRO 179 N 7.85 0.00 -0.38 4.34 0.13 -1.92 -0.17 132.00 141.85 1dgg h PRO 179 Ca -0.11 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.93 1dgg h PRO 179 Cb 1.03 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.15 1dgg h PRO 179 CO 0.47 0.02 -0.12 -0.44 -0.23 0.00 0.00 178.00 177.71 1dgg h ASP 180 N 0.00 0.77 -0.02 1.44 3.45 -1.93 0.11 116.42 120.24 1dgg h ASP 180 Ca -0.00 -0.38 -0.00 0.00 0.43 0.00 0.00 57.03 57.08 1dgg h ASP 180 Cb 0.07 -0.21 -0.00 0.00 -0.56 0.00 0.00 39.33 38.63 1dgg h ASP 180 CO 0.00 0.97 0.00 0.24 -1.57 0.00 0.00 179.24 178.88 1dgg h MET 181 N 0.56 0.03 0.23 3.56 2.86 -1.49 0.75 114.93 121.43 1dgg h MET 181 Ca 0.09 -0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.74 1dgg h MET 181 Cb 0.64 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.26 1dgg h MET 181 CO 0.04 0.25 -0.44 0.28 1.06 0.00 0.00 176.91 178.10 1dgg h VAL 182 N -0.19 0.13 0.00 -2.22 2.07 -0.96 -2.65 116.25 112.42 1dgg h VAL 182 Ca 0.01 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 1dgg h VAL 182 Cb 0.23 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 1dgg h VAL 182 CO 0.00 0.00 -0.20 -0.50 0.02 0.00 0.00 177.57 176.89 1dgg h TRP 183 N -0.74 0.00 -0.03 1.57 4.06 -0.79 -2.67 115.95 117.34 1dgg h TRP 183 Ca -0.00 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 1dgg h TRP 183 Cb 0.72 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.88 1dgg h TRP 183 CO -0.33 0.20 -0.01 0.22 -3.56 0.00 0.00 178.44 174.96 1dgg h ASP 184 N 0.00 0.06 0.22 -3.49 3.58 -0.78 -0.37 116.42 115.64 1dgg h ASP 184 Ca -0.00 -0.41 -0.00 0.00 0.42 0.00 0.00 57.03 57.04 1dgg h ASP 184 Cb 1.02 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 42.04 1dgg h ASP 184 CO 0.03 0.46 -0.18 0.15 -2.88 0.00 0.00 179.24 176.82 1dgg h PHE 185 N -0.33 -0.46 -0.86 0.28 3.04 -1.48 0.00 116.94 117.14 1dgg h PHE 185 Ca 0.01 -0.00 0.03 0.00 3.98 0.00 0.00 57.97 61.99 1dgg h PHE 185 Cb 0.43 0.17 -0.05 0.00 2.56 0.00 0.00 35.95 39.06 1dgg h PHE 185 CO 0.07 -0.27 0.56 -1.49 -2.02 0.00 0.00 178.31 175.15 1dgg h TRP 186 N -0.41 1.05 -0.19 0.41 6.55 -1.48 0.19 115.95 122.07 1dgg h TRP 186 Ca -0.01 0.03 -0.14 0.00 0.95 0.00 0.00 58.89 59.71 1dgg h TRP 186 Cb 0.36 -0.35 -0.01 0.00 -0.86 0.00 0.00 29.16 28.31 1dgg h TRP 186 CO -0.12 0.61 -0.49 0.66 -1.05 0.00 0.00 178.44 178.05 1dgg h SER 187 N 1.09 0.54 1.47 -3.49 4.64 -0.90 -2.78 113.55 114.12 1dgg h SER 187 Ca 0.34 -0.27 -0.04 0.00 -0.47 0.00 0.00 61.79 61.35 1dgg h SER 187 Cb -0.02 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 1dgg h SER 187 CO -0.11 0.95 -0.19 -0.07 -0.87 0.00 0.00 176.83 176.53 1dgg h LEU 188 N 0.39 0.00 -6.97 5.97 4.07 -0.61 -3.38 115.31 114.78 1dgg h LEU 188 Ca 0.02 0.00 -0.62 0.00 0.08 0.00 0.00 57.88 57.36 1dgg h LEU 188 Cb 1.01 0.00 -0.41 0.00 1.08 0.00 0.00 40.66 42.33 1dgg h LEU 188 CO 0.09 0.19 -0.65 -0.13 -1.08 0.00 0.00 178.44 176.86 1dgg s ARG 189 N -3.31 2.12 0.00 1.13 1.81 0.63 -4.97 118.95 116.37 1dgg s ARG 189 Ca 0.04 -3.05 0.07 0.00 -1.72 0.00 0.00 55.73 51.07 1dgg s ARG 189 Cb 0.07 -3.03 0.38 0.00 -0.45 0.00 0.00 34.95 31.92 1dgg s ARG 189 CO 0.67 -1.29 0.90 -0.35 -0.68 0.00 0.00 175.30 174.55 1dgg n PRO 190 N 2.24 0.18 0.25 3.54 -0.04 -1.21 -2.44 135.00 137.53 1dgg n PRO 190 Ca 0.20 0.05 0.13 0.00 -0.04 0.00 0.00 63.50 63.85 1dgg n PRO 190 Cb 0.37 -1.50 0.64 0.00 -0.04 0.00 0.00 33.50 32.97 1dgg n PRO 190 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1dgg h GLU 191 N 0.00 0.00 0.00 0.54 3.07 -1.86 -2.55 114.58 113.78 1dgg h GLU 191 Ca 0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1dgg h GLU 191 Cb 0.01 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.92 1dgg h GLU 191 CO 0.00 0.13 -0.02 0.66 -1.40 0.00 0.00 179.01 178.38 1dgg h SER 192 N 0.00 0.00 -0.98 1.42 4.64 -1.05 -3.31 113.55 114.27 1dgg h SER 192 Ca -0.00 0.00 0.32 0.00 -0.47 0.00 0.00 61.79 61.64 1dgg h SER 192 Cb 0.52 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 62.45 1dgg h SER 192 CO 0.02 0.02 0.46 -0.07 -0.87 0.00 0.00 176.83 176.39 1dgg h LEU 193 N 0.00 0.31 0.14 5.97 3.38 -1.70 0.21 115.31 123.62 1dgg h LEU 193 Ca -0.00 0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1dgg h LEU 193 Cb 0.36 0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1dgg h LEU 193 CO 0.00 -0.21 -0.07 -0.74 0.09 0.00 0.00 178.44 177.51 1dgg h HIS 194 N 0.22 -0.18 -0.15 1.13 2.76 -1.81 -2.53 115.15 114.59 1dgg h HIS 194 Ca 0.71 -0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 58.72 1dgg h HIS 194 Cb 1.65 0.06 -0.01 0.00 1.55 0.00 0.00 27.41 30.66 1dgg h HIS 194 CO -0.09 0.17 -0.58 0.37 -1.30 0.00 0.00 177.93 176.50 1dgg h GLN 195 N -0.55 0.46 -0.69 5.26 5.75 -1.60 -2.86 115.11 120.88 1dgg h GLN 195 Ca -0.02 -0.30 0.05 0.00 -0.15 0.00 0.00 58.65 58.23 1dgg h GLN 195 Cb 0.43 0.04 -0.05 0.00 1.07 0.00 0.00 27.48 28.97 1dgg h GLN 195 CO 0.03 0.91 0.40 0.28 -2.65 0.00 0.00 178.83 177.81 1dgg h VAL 196 N 0.35 1.01 -0.86 2.39 2.07 -0.68 0.34 116.25 120.87 1dgg h VAL 196 Ca 0.00 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 1dgg h VAL 196 Cb 1.11 0.19 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 1dgg h VAL 196 CO 0.10 0.14 0.48 0.28 0.02 0.00 0.00 177.57 178.59 1dgg h SER 197 N 0.75 1.07 -0.22 0.57 0.02 -1.30 -0.49 113.55 113.95 1dgg h SER 197 Ca 0.30 -0.09 -0.05 0.00 -0.84 0.00 0.00 61.79 61.11 1dgg h SER 197 Cb 0.14 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 1dgg h SER 197 CO -0.16 0.85 -0.07 -0.26 -1.14 0.00 0.00 176.83 176.05 1dgg h PHE 198 N 1.20 0.50 -0.67 3.45 0.05 -1.03 -2.95 116.94 117.49 1dgg h PHE 198 Ca 0.30 -0.11 0.07 0.00 3.82 0.00 0.00 57.97 62.05 1dgg h PHE 198 Cb 0.01 -0.12 -0.06 0.00 2.00 0.00 0.00 35.95 37.79 1dgg h PHE 198 CO 0.01 0.69 0.36 1.25 -0.18 0.00 0.00 178.31 180.44 1dgg h LEU 199 N 0.16 0.51 -1.03 1.54 5.85 0.21 -2.48 115.31 120.07 1dgg h LEU 199 Ca 0.05 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1dgg h LEU 199 Cb 0.54 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.52 1dgg h LEU 199 CO 0.03 0.32 0.00 0.49 -0.34 0.00 0.00 178.44 178.93 1dgg n PHE 200 N -4.82 0.28 -2.20 1.25 3.01 -0.24 -3.81 117.46 110.92 1dgg n PHE 200 Ca 0.09 -0.14 -0.13 0.00 1.01 0.00 0.00 57.45 58.28 1dgg n PHE 200 Cb 0.21 0.00 0.08 0.00 -0.01 0.00 0.00 39.48 39.75 1dgg n PHE 200 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1dgg n SER 201 N 0.26 0.55 -0.02 4.37 3.41 -0.93 -4.20 113.62 117.07 1dgg n SER 201 Ca 0.14 -1.52 0.13 0.00 -0.26 0.00 0.00 58.87 57.35 1dgg n SER 201 Cb 0.28 -0.40 0.55 0.00 -0.26 0.00 0.00 64.21 64.38 1dgg n SER 201 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1dgg h ASP 202 N -0.48 0.26 0.00 4.04 3.32 -1.90 -1.06 116.42 120.61 1dgg h ASP 202 Ca -0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.86 1dgg h ASP 202 Cb 0.65 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.15 1dgg h ASP 202 CO 0.18 0.16 0.00 0.54 -1.72 0.00 0.00 179.24 178.40 1dgg n ARG 203 N -4.46 0.90 0.20 3.56 1.74 -1.26 -3.35 116.66 113.98 1dgg n ARG 203 Ca 0.08 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.20 1dgg n ARG 203 Cb 0.36 -1.15 0.40 0.00 -1.02 0.00 0.00 32.46 31.05 1dgg n ARG 203 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 1dgg h GLY 204 N 5.13 0.00 -6.85 -0.13 0.00 -1.29 -3.35 103.07 96.58 1dgg h GLY 204 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.72 1dgg h GLY 204 CO 0.00 0.00 -0.76 -0.42 0.00 0.00 0.00 176.54 175.36 1dgg s ILE 205 N -4.18 1.46 0.65 2.60 1.01 -1.21 -3.27 121.20 118.26 1dgg s ILE 205 Ca -0.03 -2.96 -0.18 0.00 0.00 0.00 0.00 60.65 57.49 1dgg s ILE 205 Cb 0.14 -2.00 -0.01 0.00 0.01 0.00 0.00 42.46 40.61 1dgg s ILE 205 CO 0.71 -1.01 1.27 -2.84 0.00 0.00 0.00 174.94 173.07 1dgg s PRO 206 N -0.12 2.54 -1.29 2.79 0.02 -1.26 -0.58 135.00 137.11 1dgg s PRO 206 Ca 0.23 1.98 -0.13 0.00 0.02 0.00 0.00 61.00 63.09 1dgg s PRO 206 Cb -0.13 -1.86 0.13 0.00 0.02 0.00 0.00 34.50 32.66 1dgg s PRO 206 CO -0.09 -1.58 1.76 -3.47 -0.33 0.00 0.00 177.00 173.29 1dgg n ASP 207 N -1.99 4.91 0.00 2.53 4.64 0.10 -4.50 116.55 122.24 1dgg n ASP 207 Ca 0.15 -2.98 0.00 0.00 -1.38 0.00 0.00 54.79 50.58 1dgg n ASP 207 Cb 0.49 -1.59 0.00 0.00 -1.04 0.00 0.00 41.12 38.97 1dgg n ASP 207 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1dgg n GLY 208 N 3.98 -0.60 0.19 0.27 0.00 -1.26 -4.29 105.19 103.47 1dgg n GLY 208 Ca 0.43 -1.75 0.10 0.00 0.00 0.00 0.00 46.02 44.79 1dgg n GLY 208 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1dgg h HIS 209 N 0.00 0.00 0.00 1.61 3.86 -1.89 -3.32 115.15 115.41 1dgg h HIS 209 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1dgg h HIS 209 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1dgg h HIS 209 CO 0.00 0.11 0.00 0.00 0.86 0.00 0.00 177.93 178.90 1dgg h ARG 210 N 0.00 0.00 -0.81 2.45 3.08 -1.96 -3.32 114.38 113.82 1dgg h ARG 210 Ca -0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.52 1dgg h ARG 210 Cb 1.09 0.00 -0.29 0.00 0.08 0.00 0.00 29.97 30.85 1dgg h ARG 210 CO 0.01 0.00 0.24 0.72 -1.07 0.00 0.00 179.97 179.88 1dgg n HIS 211 N -2.60 2.68 -4.05 3.04 8.25 -1.25 -4.36 115.22 116.93 1dgg n HIS 211 Ca 0.05 -2.39 -0.09 0.00 -0.26 0.00 0.00 57.72 55.03 1dgg n HIS 211 Cb 0.45 -0.92 -0.11 0.00 1.12 0.00 0.00 29.99 30.53 1dgg n HIS 211 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1dgg s MET 212 N -3.58 0.50 0.70 -0.41 0.23 -1.25 -2.67 119.30 112.82 1dgg s MET 212 Ca 0.56 -0.92 -0.07 0.00 -1.03 0.00 0.00 55.69 54.24 1dgg s MET 212 Cb 0.46 0.04 0.06 0.00 -1.53 0.00 0.00 34.83 33.86 1dgg s MET 212 CO 0.02 -0.05 1.02 -0.80 -2.03 0.00 0.00 175.02 173.18 1dgg s ASN 213 N -2.15 4.89 0.02 -1.18 0.01 -1.26 -4.17 114.94 111.10 1dgg s ASN 213 Ca -0.04 0.52 0.04 0.00 -0.71 0.00 0.00 52.86 52.67 1dgg s ASN 213 Cb -0.02 -1.20 -0.02 0.00 0.41 0.00 0.00 41.25 40.42 1dgg s ASN 213 CO -0.04 -1.56 -0.14 -0.83 -1.51 0.00 0.00 177.10 173.02 1dgg s GLY 214 N -4.50 0.72 0.01 0.66 0.00 0.85 -4.18 107.32 100.89 1dgg s GLY 214 Ca 0.60 -0.72 0.00 0.00 0.00 0.00 0.00 44.72 44.60 1dgg s GLY 214 CO 0.45 -0.66 -0.02 -0.19 0.00 0.00 0.00 173.10 172.68 1dgg s TYR 215 N -0.63 0.15 -0.53 1.90 2.02 0.90 -0.38 117.35 120.78 1dgg s TYR 215 Ca 0.03 -0.28 0.25 0.00 -0.37 0.00 0.00 57.07 56.69 1dgg s TYR 215 Cb -0.07 -0.11 0.56 0.00 -0.40 0.00 0.00 41.96 41.95 1dgg s TYR 215 CO 0.01 -0.10 1.69 0.78 -1.57 0.00 0.00 175.55 176.35 1dgg h GLY 216 N 5.35 0.00 0.00 0.71 0.00 -1.58 -2.04 103.07 105.51 1dgg h GLY 216 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.05 1dgg h GLY 216 CO 0.46 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.44 1dgg n SER 217 N -2.78 0.00 -4.70 0.19 7.64 -1.26 -4.82 113.62 107.89 1dgg n SER 217 Ca 0.04 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.63 1dgg n SER 217 Cb 0.48 0.00 0.15 0.00 -1.01 0.00 0.00 64.21 63.83 1dgg n SER 217 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1dgg s HIS 218 N 0.00 2.21 -0.04 1.43 3.76 -1.26 -4.79 115.29 116.60 1dgg s HIS 218 Ca 0.00 1.20 -0.14 0.00 -0.15 0.00 0.00 55.06 55.97 1dgg s HIS 218 Cb 0.00 -3.19 -0.05 0.00 1.11 0.00 0.00 32.58 30.45 1dgg s HIS 218 CO 0.00 -2.59 0.38 0.99 -0.85 0.00 0.00 174.74 172.67 1dgg s THR 219 N -2.92 5.12 0.42 1.30 2.01 -1.26 -4.59 115.64 115.72 1dgg s THR 219 Ca 0.64 0.76 0.04 0.00 0.31 0.00 0.00 61.69 63.44 1dgg s THR 219 Cb -0.18 -3.68 -0.04 0.00 0.01 0.00 0.00 72.50 68.60 1dgg s THR 219 CO 0.57 0.54 0.04 -0.36 -0.69 0.00 0.00 174.62 174.73 1dgg s PHE 220 N -0.75 2.03 -0.05 4.92 0.08 0.07 -3.98 117.98 120.30 1dgg s PHE 220 Ca 0.22 -0.96 0.05 0.00 0.12 0.00 0.00 56.93 56.37 1dgg s PHE 220 Cb -0.16 -1.48 -0.02 0.00 -0.57 0.00 0.00 43.02 40.79 1dgg s PHE 220 CO 0.11 0.12 -0.21 0.21 -0.10 0.00 0.00 175.22 175.35 1dgg s LYS 221 N -3.80 2.52 -0.07 0.44 2.20 0.47 0.08 119.74 121.58 1dgg s LYS 221 Ca 0.23 -0.83 0.04 0.00 -0.36 0.00 0.00 55.97 55.06 1dgg s LYS 221 Cb 0.05 -2.25 -0.02 0.00 -1.51 0.00 0.00 37.83 34.11 1dgg s LYS 221 CO 0.12 0.47 -0.20 -0.51 -0.36 0.00 0.00 175.35 174.88 1dgg s LEU 222 N -0.37 2.38 -0.08 5.43 1.43 0.94 -0.14 118.68 128.28 1dgg s LEU 222 Ca 0.03 -0.39 0.04 0.00 -1.03 0.00 0.00 54.13 52.78 1dgg s LEU 222 Cb -0.12 -1.47 -0.00 0.00 0.03 0.00 0.00 46.19 44.62 1dgg s LEU 222 CO 0.02 0.25 -0.22 -0.69 0.23 0.00 0.00 176.35 175.94 1dgg s VAL 223 N -0.20 1.88 0.51 -1.59 1.01 -0.16 -1.63 120.40 120.22 1dgg s VAL 223 Ca -0.01 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 61.08 1dgg s VAL 223 Cb -0.13 -1.62 0.04 0.00 0.00 0.00 0.00 36.38 34.66 1dgg s VAL 223 CO 0.03 0.52 0.71 0.54 0.00 0.00 0.00 175.10 176.90 1dgg s ASN 224 N 0.22 5.34 0.55 3.32 2.20 -0.71 0.05 114.94 125.92 1dgg s ASN 224 Ca -0.13 -0.30 0.29 0.00 -0.94 0.00 0.00 52.86 51.78 1dgg s ASN 224 Cb -0.16 -0.59 1.46 0.00 -2.00 0.00 0.00 41.25 39.96 1dgg s ASN 224 CO 0.06 -1.06 1.92 0.00 -2.94 0.00 0.00 177.10 175.08 1dgg h ALA 225 N 0.27 2.56 -0.01 3.54 0.00 -1.89 0.14 119.26 123.87 1dgg h ALA 225 Ca -0.39 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1dgg h ALA 225 Cb 1.29 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1dgg h ALA 225 CO 0.47 -0.86 0.00 0.09 0.00 0.00 0.00 179.25 178.95 1dgg n ASN 226 N -4.14 0.23 0.00 0.00 5.03 -1.26 -4.88 115.26 110.24 1dgg n ASN 226 Ca 0.13 -1.20 0.00 0.00 0.87 0.00 0.00 54.58 54.38 1dgg n ASN 226 Cb 0.77 -0.01 0.00 0.00 -1.02 0.00 0.00 39.78 39.53 1dgg n ASN 226 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1dgg n GLY 227 N 0.96 0.72 3.74 7.41 0.00 0.50 -5.02 105.19 113.50 1dgg n GLY 227 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1dgg n GLY 227 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dgg s GLU 228 N -0.10 4.72 0.11 1.61 2.02 -1.26 -4.83 118.70 120.98 1dgg s GLU 228 Ca 0.00 1.41 0.10 0.00 0.02 0.00 0.00 54.97 56.50 1dgg s GLU 228 Cb 0.00 -3.34 -0.04 0.00 0.10 0.00 0.00 34.13 30.86 1dgg s GLU 228 CO 0.00 0.35 -0.26 0.00 0.02 0.00 0.00 175.26 175.36 1dgg s ALA 229 N -0.48 2.30 0.05 5.21 0.00 -1.26 -1.74 121.76 125.85 1dgg s ALA 229 Ca 0.43 -1.41 -0.03 0.00 0.00 0.00 0.00 51.96 50.95 1dgg s ALA 229 Cb -0.24 -0.38 -0.03 0.00 0.00 0.00 0.00 23.12 22.47 1dgg s ALA 229 CO 0.30 0.52 0.02 0.14 0.00 0.00 0.00 175.76 176.74 1dgg s VAL 230 N -1.02 0.19 0.28 0.00 -7.23 -0.65 -4.56 120.40 107.41 1dgg s VAL 230 Ca 0.13 -1.53 -0.03 0.00 -1.81 0.00 0.00 61.98 58.75 1dgg s VAL 230 Cb -0.10 -1.28 -0.04 0.00 0.56 0.00 0.00 36.38 35.52 1dgg s VAL 230 CO 0.05 -0.84 0.52 -0.31 -0.31 0.00 0.00 175.10 174.20 1dgg s TYR 231 N -3.48 3.49 0.24 2.82 2.02 -0.14 -0.04 117.35 122.26 1dgg s TYR 231 Ca 0.03 0.50 -0.12 0.00 -0.37 0.00 0.00 57.07 57.10 1dgg s TYR 231 Cb 0.04 -1.99 -0.01 0.00 -0.40 0.00 0.00 41.96 39.60 1dgg s TYR 231 CO -0.08 0.20 0.46 0.00 -1.57 0.00 0.00 175.55 174.56 1dgg s LYS 233 N -4.02 0.96 -0.16 0.00 -0.14 -0.60 -0.75 119.74 115.03 1dgg s LYS 233 Ca 0.23 -0.41 -0.06 0.00 -1.36 0.00 0.00 55.97 54.37 1dgg s LYS 233 Cb -0.00 -0.93 -0.04 0.00 -1.68 0.00 0.00 37.83 35.18 1dgg s LYS 233 CO 0.09 0.24 0.03 -0.06 -0.76 0.00 0.00 175.35 174.90 1dgg s PHE 234 N -0.24 3.21 -0.02 3.18 0.08 -1.26 -0.81 117.98 122.13 1dgg s PHE 234 Ca 0.04 0.03 0.03 0.00 0.12 0.00 0.00 56.93 57.15 1dgg s PHE 234 Cb -0.05 -2.00 -0.00 0.00 -0.57 0.00 0.00 43.02 40.40 1dgg s PHE 234 CO -0.00 0.20 -0.09 -1.01 -0.10 0.00 0.00 175.22 174.21 1dgg s HIS 235 N 0.09 0.86 -0.31 0.36 3.76 -0.25 -1.57 115.29 118.23 1dgg s HIS 235 Ca 0.04 -0.18 -0.02 0.00 -0.15 0.00 0.00 55.06 54.75 1dgg s HIS 235 Cb -0.13 -0.58 0.10 0.00 1.11 0.00 0.00 32.58 33.08 1dgg s HIS 235 CO 0.01 -0.05 0.12 1.52 -0.85 0.00 0.00 174.74 175.49 1dgg s TYR 236 N -0.02 1.24 0.20 1.40 -0.85 0.49 0.01 117.35 119.82 1dgg s TYR 236 Ca 0.01 -1.49 -0.30 0.00 -0.52 0.00 0.00 57.07 54.76 1dgg s TYR 236 Cb -0.06 -1.43 -0.08 0.00 0.38 0.00 0.00 41.96 40.77 1dgg s TYR 236 CO -0.00 -0.86 1.02 0.15 -1.52 0.00 0.00 175.55 174.34 1dgg s LYS 237 N 1.68 4.71 0.09 -3.49 -0.14 -0.55 -0.10 119.74 121.94 1dgg s LYS 237 Ca 0.10 1.60 -0.31 0.00 -1.36 0.00 0.00 55.97 56.01 1dgg s LYS 237 Cb -0.17 -3.28 -0.07 0.00 -1.68 0.00 0.00 37.83 32.63 1dgg s LYS 237 CO -0.26 0.28 1.24 -0.08 -0.76 0.00 0.00 175.35 175.76 1dgg s THR 238 N -0.68 3.80 -0.69 2.17 -1.32 -1.26 -0.37 115.64 117.28 1dgg s THR 238 Ca 0.45 1.32 0.26 0.00 -1.21 0.00 0.00 61.69 62.51 1dgg s THR 238 Cb -0.28 -3.85 0.24 0.00 -1.51 0.00 0.00 72.50 67.11 1dgg s THR 238 CO 0.34 0.12 1.67 0.44 -2.21 0.00 0.00 174.62 174.98 1dgg h ASP 239 N 6.55 0.00 0.09 8.08 3.45 -1.13 -3.06 116.42 130.40 1dgg h ASP 239 Ca -0.42 -0.05 0.00 0.00 0.43 0.00 0.00 57.03 56.99 1dgg h ASP 239 Cb 1.21 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.98 1dgg h ASP 239 CO 0.81 0.02 -0.02 0.00 -1.57 0.00 0.00 179.24 178.49 1dgg n GLN 240 N -2.28 1.08 0.00 3.56 3.00 -1.26 -5.00 117.38 116.47 1dgg n GLN 240 Ca 0.05 -0.28 0.00 0.00 -0.01 0.00 0.00 57.00 56.76 1dgg n GLN 240 Cb 0.44 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 29.18 1dgg n GLN 240 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1dgg n GLY 241 N 1.11 -2.67 3.69 1.08 0.00 -1.16 -4.89 105.19 102.36 1dgg n GLY 241 Ca 0.21 -1.29 -0.42 0.00 0.00 0.00 0.00 46.02 44.51 1dgg n GLY 241 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dgg s ILE 242 N -3.65 4.74 -0.04 -0.61 1.01 -1.26 -4.42 121.20 116.96 1dgg s ILE 242 Ca 0.00 2.00 -0.01 0.00 0.00 0.00 0.00 60.65 62.63 1dgg s ILE 242 Cb 0.00 -4.28 0.03 0.00 0.01 0.00 0.00 42.46 38.22 1dgg s ILE 242 CO 0.00 0.03 0.08 -0.75 0.00 0.00 0.00 174.94 174.30 1dgg s LYS 243 N 1.87 0.00 0.49 2.79 2.20 -1.09 -5.05 119.74 120.95 1dgg s LYS 243 Ca 0.50 0.30 0.05 0.00 -0.36 0.00 0.00 55.97 56.46 1dgg s LYS 243 Cb -0.19 -0.26 -0.01 0.00 -1.51 0.00 0.00 37.83 35.86 1dgg s LYS 243 CO 0.20 -0.20 0.24 -0.80 -0.36 0.00 0.00 175.35 174.43 1dgg s ASN 244 N 1.33 4.47 0.00 1.43 0.01 -1.26 0.00 114.94 120.93 1dgg s ASN 244 Ca -0.07 -1.25 0.06 0.00 -0.71 0.00 0.00 52.86 50.89 1dgg s ASN 244 Cb -0.12 0.08 -0.03 0.00 0.41 0.00 0.00 41.25 41.59 1dgg s ASN 244 CO -0.04 -0.84 -0.16 -0.76 -1.51 0.00 0.00 177.10 173.79 1dgg s LEU 245 N -4.06 2.67 0.61 0.60 1.43 0.26 -4.49 118.68 115.70 1dgg s LEU 245 Ca 0.31 -0.32 -0.16 0.00 -1.03 0.00 0.00 54.13 52.93 1dgg s LEU 245 Cb 0.01 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.64 1dgg s LEU 245 CO 0.18 0.29 1.08 -0.94 0.23 0.00 0.00 176.35 177.19 1dgg s SER 246 N -1.16 5.60 0.26 2.29 1.04 -1.26 -4.73 113.70 115.74 1dgg s SER 246 Ca 0.14 1.89 -0.01 0.00 0.48 0.00 0.00 55.95 58.45 1dgg s SER 246 Cb -0.11 -2.54 0.53 0.00 0.10 0.00 0.00 66.02 64.00 1dgg s SER 246 CO 0.04 -1.29 1.76 0.58 0.98 0.00 0.00 173.24 175.30 1dgg h VAL 247 N 0.39 0.73 -0.16 5.02 2.07 -1.98 0.22 116.25 122.54 1dgg h VAL 247 Ca -0.47 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 1dgg h VAL 247 Cb 1.23 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1dgg h VAL 247 CO 0.56 0.11 0.05 -0.08 0.02 0.00 0.00 177.57 178.24 1dgg h GLU 248 N 0.62 0.24 -0.21 1.57 4.81 -2.00 -1.96 114.58 117.65 1dgg h GLU 248 Ca 0.46 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.62 1dgg h GLU 248 Cb 0.65 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 1dgg h GLU 248 CO -0.36 0.35 0.04 -0.44 -0.73 0.00 0.00 179.01 177.86 1dgg h ASP 249 N 0.08 0.34 -0.97 1.04 3.45 -1.67 -1.94 116.42 116.75 1dgg h ASP 249 Ca 0.05 -0.26 0.10 0.00 0.43 0.00 0.00 57.03 57.35 1dgg h ASP 249 Cb 0.20 -0.09 -0.07 0.00 -0.56 0.00 0.00 39.33 38.81 1dgg h ASP 249 CO -0.00 0.51 0.62 0.00 -1.57 0.00 0.00 179.24 178.80 1dgg h ALA 250 N 0.84 1.54 -0.18 3.45 0.00 -0.58 0.65 119.26 124.97 1dgg h ALA 250 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1dgg h ALA 250 Cb 0.32 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1dgg h ALA 250 CO 0.00 0.26 0.00 0.00 0.00 0.00 0.00 179.25 179.52 1dgg h ALA 251 N 1.52 0.25 -0.50 0.00 0.00 -1.21 -0.50 119.26 118.83 1dgg h ALA 251 Ca 0.45 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1dgg h ALA 251 Cb 0.38 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1dgg h ALA 251 CO -0.21 -0.04 0.31 -0.09 0.00 0.00 0.00 179.25 179.21 1dgg h ARG 252 N 0.08 0.67 -0.24 0.00 2.43 -0.48 -2.72 114.38 114.11 1dgg h ARG 252 Ca 0.05 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 1dgg h ARG 252 Cb 0.38 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1dgg h ARG 252 CO 0.01 0.48 -0.28 -0.07 -1.51 0.00 0.00 179.97 178.60 1dgg h LEU 253 N 0.67 0.48 -2.88 3.80 3.38 -0.88 0.99 115.31 120.88 1dgg h LEU 253 Ca 0.18 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1dgg h LEU 253 Cb -0.02 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 1dgg h LEU 253 CO -0.03 0.75 -0.00 0.77 0.09 0.00 0.00 178.44 180.01 1dgg h SER 254 N 0.42 0.00 0.00 -0.43 4.64 -0.76 0.42 113.55 117.83 1dgg h SER 254 Ca 0.06 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.06 1dgg h SER 254 Cb 0.70 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.74 1dgg h SER 254 CO 0.05 0.00 -1.87 1.67 -0.87 0.00 0.00 176.83 175.82 1dgg n GLN 255 N -3.24 0.57 -0.11 4.77 0.00 -0.87 -4.05 117.38 114.45 1dgg n GLN 255 Ca -0.03 0.37 -0.09 0.00 -0.00 0.00 0.00 57.00 57.24 1dgg n GLN 255 Cb 0.07 -1.57 -0.02 0.00 0.00 0.00 0.00 30.24 28.73 1dgg n GLN 255 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 1dgg h GLU 256 N -1.00 0.47 -2.03 3.69 5.08 -0.46 -3.40 114.58 116.93 1dgg h GLU 256 Ca -0.48 -0.06 -0.41 0.00 -1.00 0.00 0.00 59.36 57.41 1dgg h GLU 256 Cb 1.38 -0.09 -0.32 0.00 0.50 0.00 0.00 28.75 30.22 1dgg h GLU 256 CO -0.29 0.42 -0.72 0.34 -1.00 0.00 0.00 179.01 177.75 1dgg s ASP 257 N -5.66 1.35 0.53 1.42 2.15 0.14 -4.99 116.67 111.61 1dgg s ASP 257 Ca -0.13 -1.78 0.32 0.00 0.43 0.00 0.00 52.55 51.38 1dgg s ASP 257 Cb 0.09 0.41 1.72 0.00 -0.30 0.00 0.00 42.92 44.84 1dgg s ASP 257 CO 0.73 -0.25 1.96 -0.65 -0.17 0.00 0.00 175.17 176.78 1dgg h PRO 258 N 6.88 0.00 -0.77 4.34 0.11 -1.70 -1.04 132.00 139.82 1dgg h PRO 258 Ca 0.07 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.67 1dgg h PRO 258 Cb 1.04 0.00 -0.29 0.00 0.11 0.00 0.00 31.00 31.86 1dgg h PRO 258 CO 0.21 0.00 0.12 -0.25 -0.21 0.00 0.00 178.00 177.87 1dgg n ASP 259 N -2.69 5.21 0.00 -2.05 8.00 -1.26 -0.36 116.55 123.40 1dgg n ASP 259 Ca -0.02 -3.76 -0.10 0.00 0.71 0.00 0.00 54.79 51.62 1dgg n ASP 259 Cb 0.15 -0.69 -0.03 0.00 -0.02 0.00 0.00 41.12 40.53 1dgg n ASP 259 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1dgg h TYR 260 N 1.71 -0.63 -0.85 1.24 5.03 -1.53 -1.39 116.97 120.55 1dgg h TYR 260 Ca 0.45 0.03 0.01 0.00 2.58 0.00 0.00 58.73 61.80 1dgg h TYR 260 Cb 1.45 0.30 -0.04 0.00 1.55 0.00 0.00 36.73 39.98 1dgg h TYR 260 CO 1.19 -0.32 0.56 0.78 -1.32 0.00 0.00 178.16 179.05 1dgg h GLY 261 N -0.30 1.20 0.79 1.82 0.00 -1.86 -0.43 103.07 104.28 1dgg h GLY 261 Ca 0.10 -0.44 -0.00 0.00 0.00 0.00 0.00 47.33 46.99 1dgg h GLY 261 CO -0.30 0.42 -0.00 -2.22 0.00 0.00 0.00 176.54 174.44 1dgg h ILE 262 N 1.14 1.16 -0.23 2.60 2.04 -1.83 -2.41 117.51 119.97 1dgg h ILE 262 Ca 0.31 -0.49 0.01 0.00 1.00 0.00 0.00 64.86 65.70 1dgg h ILE 262 Cb -0.12 1.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 1dgg h ILE 262 CO -0.07 0.13 0.12 -0.09 0.00 0.00 0.00 178.15 178.23 1dgg h ARG 263 N -0.22 0.25 -0.17 2.37 2.43 -1.10 -1.07 114.38 116.86 1dgg h ARG 263 Ca -0.00 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.19 1dgg h ARG 263 Cb 0.21 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 1dgg h ARG 263 CO 0.00 0.16 -0.05 0.22 -1.51 0.00 0.00 179.97 178.79 1dgg h ASP 264 N 0.26 -0.18 -0.13 -3.80 3.58 -1.08 -1.24 116.42 113.82 1dgg h ASP 264 Ca 0.09 0.06 -0.00 0.00 0.42 0.00 0.00 57.03 57.60 1dgg h ASP 264 Cb 0.01 0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.17 1dgg h ASP 264 CO -0.06 -0.07 0.07 0.25 -2.88 0.00 0.00 179.24 176.56 1dgg h LEU 265 N -0.01 0.16 0.16 2.28 5.85 -1.26 -1.27 115.31 121.23 1dgg h LEU 265 Ca 0.09 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.75 1dgg h LEU 265 Cb 0.14 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1dgg h LEU 265 CO -0.19 0.18 -0.22 0.15 -0.34 0.00 0.00 178.44 178.03 1dgg h PHE 266 N 0.13 -0.58 -0.61 1.25 3.04 -0.99 -2.34 116.94 116.84 1dgg h PHE 266 Ca 0.05 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.00 1dgg h PHE 266 Cb 0.06 0.24 -0.03 0.00 2.56 0.00 0.00 35.95 38.77 1dgg h PHE 266 CO -0.05 -0.32 0.38 -0.91 -2.02 0.00 0.00 178.31 175.39 1dgg h ASN 267 N -0.44 0.71 0.13 0.41 2.35 -1.19 0.29 115.58 117.85 1dgg h ASN 267 Ca 0.01 -0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1dgg h ASN 267 Cb 0.44 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1dgg h ASN 267 CO -0.09 0.54 -0.06 0.00 -1.65 0.00 0.00 177.43 176.16 1dgg h ALA 268 N 1.59 -0.18 -0.47 -0.83 0.00 -0.94 -0.10 119.26 118.33 1dgg h ALA 268 Ca 0.22 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 1dgg h ALA 268 Cb -0.06 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1dgg h ALA 268 CO -0.04 -0.59 -0.14 0.82 0.00 0.00 0.00 179.25 179.30 1dgg h ILE 269 N -0.20 1.27 -0.22 0.00 2.04 -1.14 0.61 117.51 119.86 1dgg h ILE 269 Ca -0.02 -1.28 -0.01 0.00 1.00 0.00 0.00 64.86 64.55 1dgg h ILE 269 Cb 0.16 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 1dgg h ILE 269 CO 0.03 0.44 0.09 0.00 0.00 0.00 0.00 178.15 178.71 1dgg h ALA 270 N 0.88 1.73 -0.57 1.87 0.00 -0.23 -2.55 119.26 120.38 1dgg h ALA 270 Ca 0.12 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1dgg h ALA 270 Cb 0.70 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1dgg h ALA 270 CO 0.05 0.22 0.00 0.25 0.00 0.00 0.00 179.25 179.77 1dgg n THR 271 N -4.44 0.76 -0.24 0.00 -2.24 -0.07 -4.94 114.28 103.11 1dgg n THR 271 Ca 0.00 -0.83 0.00 0.00 -2.27 0.00 0.00 64.05 60.95 1dgg n THR 271 Cb 0.12 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 68.95 1dgg n THR 271 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dgg n GLY 272 N 1.54 0.83 2.76 3.38 0.00 -0.96 -4.98 105.19 107.75 1dgg n GLY 272 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 1dgg n GLY 272 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dgg n LYS 273 N -2.00 3.50 -1.94 1.61 5.02 0.21 -4.96 118.16 119.60 1dgg n LYS 273 Ca 0.00 -3.18 -0.43 0.00 -2.02 0.00 0.00 58.31 52.68 1dgg n LYS 273 Cb 0.00 -3.00 -0.03 0.00 -0.02 0.00 0.00 35.03 31.99 1dgg n LYS 273 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1dgg s TYR 274 N 1.15 1.71 0.45 2.13 4.12 -1.26 -4.04 117.35 121.61 1dgg s TYR 274 Ca 0.45 0.60 -0.23 0.00 0.02 0.00 0.00 57.07 57.91 1dgg s TYR 274 Cb 0.12 -4.10 -0.08 0.00 -1.52 0.00 0.00 41.96 36.39 1dgg s TYR 274 CO -0.04 -3.15 1.16 -1.25 0.02 0.00 0.00 175.55 172.29 1dgg s PRO 275 N 5.73 3.81 0.04 -1.71 0.04 -1.24 -4.80 135.00 136.87 1dgg s PRO 275 Ca 0.83 1.76 -0.02 0.00 0.04 0.00 0.00 61.00 63.61 1dgg s PRO 275 Cb -0.24 -2.44 -0.03 0.00 0.04 0.00 0.00 34.50 31.83 1dgg s PRO 275 CO 0.34 -0.51 0.01 -1.54 0.04 0.00 0.00 177.00 175.34 1dgg s SER 276 N -1.35 0.36 0.05 6.66 1.04 -1.26 -2.00 113.70 117.20 1dgg s SER 276 Ca 0.63 -0.80 0.05 0.00 0.48 0.00 0.00 55.95 56.31 1dgg s SER 276 Cb -0.28 0.19 -0.02 0.00 0.10 0.00 0.00 66.02 66.01 1dgg s SER 276 CO 0.35 -0.53 -0.13 0.26 0.98 0.00 0.00 173.24 174.16 1dgg s TRP 277 N -3.21 1.16 -0.24 5.02 0.51 -0.20 -0.58 118.94 121.40 1dgg s TRP 277 Ca 0.00 -0.39 -0.16 0.00 -2.12 0.00 0.00 56.10 53.43 1dgg s TRP 277 Cb 0.03 -0.68 -0.03 0.00 -0.81 0.00 0.00 33.47 31.97 1dgg s TRP 277 CO -0.07 0.03 0.42 0.99 -0.51 0.00 0.00 176.95 177.81 1dgg s THR 278 N -1.00 5.15 -0.11 2.01 2.01 0.50 -0.62 115.64 123.57 1dgg s THR 278 Ca -0.00 0.70 -0.22 0.00 0.31 0.00 0.00 61.69 62.48 1dgg s THR 278 Cb -0.09 -3.74 -0.03 0.00 0.01 0.00 0.00 72.50 68.65 1dgg s THR 278 CO 0.01 0.17 0.65 0.12 -0.69 0.00 0.00 174.62 174.89 1dgg s PHE 279 N 1.89 3.51 0.27 4.92 5.36 0.20 -1.48 117.98 132.64 1dgg s PHE 279 Ca 0.18 1.11 0.02 0.00 -0.96 0.00 0.00 56.93 57.28 1dgg s PHE 279 Cb -0.15 -2.77 -0.05 0.00 -0.34 0.00 0.00 43.02 39.70 1dgg s PHE 279 CO 0.09 0.02 0.10 0.71 -1.46 0.00 0.00 175.22 174.68 1dgg s TYR 280 N 1.12 1.60 -0.01 10.12 2.02 0.10 -0.11 117.35 132.19 1dgg s TYR 280 Ca 0.33 -1.17 -0.08 0.00 -0.37 0.00 0.00 57.07 55.79 1dgg s TYR 280 Cb -0.17 -0.95 0.01 0.00 -0.40 0.00 0.00 41.96 40.45 1dgg s TYR 280 CO 0.14 -0.31 0.16 0.96 -1.57 0.00 0.00 175.55 174.94 1dgg s ILE 281 N -3.68 0.06 -0.03 2.71 -4.36 -0.16 -1.09 121.20 114.65 1dgg s ILE 281 Ca 0.37 -0.52 0.01 0.00 -0.26 0.00 0.00 60.65 60.25 1dgg s ILE 281 Cb 0.08 -0.41 -0.03 0.00 1.25 0.00 0.00 42.46 43.34 1dgg s ILE 281 CO 0.14 -0.29 -0.03 -1.10 0.24 0.00 0.00 174.94 173.90 1dgg s GLN 282 N -1.06 2.75 -0.04 0.37 -0.21 0.01 -0.81 119.66 120.68 1dgg s GLN 282 Ca -0.11 -0.59 0.06 0.00 0.02 0.00 0.00 55.36 54.73 1dgg s GLN 282 Cb -0.06 -2.63 -0.01 0.00 1.00 0.00 0.00 33.01 31.31 1dgg s GLN 282 CO 0.01 0.64 -0.22 0.08 -2.12 0.00 0.00 175.29 173.69 1dgg s VAL 283 N -0.97 1.77 -0.10 1.09 1.01 -1.26 -1.56 120.40 120.38 1dgg s VAL 283 Ca 0.16 -0.92 -0.02 0.00 0.00 0.00 0.00 61.98 61.21 1dgg s VAL 283 Cb -0.11 -1.49 0.04 0.00 0.00 0.00 0.00 36.38 34.81 1dgg s VAL 283 CO 0.06 0.50 0.01 -0.32 0.00 0.00 0.00 175.10 175.35 1dgg s MET 284 N -0.16 0.56 0.79 2.72 0.00 -0.55 -4.93 119.30 117.73 1dgg s MET 284 Ca -0.01 0.02 -0.11 0.00 0.00 0.00 0.00 55.69 55.59 1dgg s MET 284 Cb -0.12 -1.20 0.07 0.00 0.00 0.00 0.00 34.83 33.58 1dgg s MET 284 CO 0.02 -0.38 1.09 0.95 0.00 0.00 0.00 175.02 176.70 1dgg s THR 285 N 1.97 3.27 0.49 10.11 -4.23 -1.26 -0.97 115.64 125.01 1dgg s THR 285 Ca 0.04 0.41 0.14 0.00 -1.18 0.00 0.00 61.69 61.10 1dgg s THR 285 Cb -0.13 -2.99 0.26 0.00 1.34 0.00 0.00 72.50 70.98 1dgg s THR 285 CO -0.06 -0.54 2.11 -0.26 -0.54 0.00 0.00 174.62 175.33 1dgg h PHE 286 N -1.14 0.12 -0.39 3.99 -1.00 -1.96 0.19 116.94 116.74 1dgg h PHE 286 Ca -0.46 0.00 -0.09 0.00 2.81 0.00 0.00 57.97 60.24 1dgg h PHE 286 Cb 1.25 -0.04 -0.01 0.00 3.61 0.00 0.00 35.95 40.75 1dgg h PHE 286 CO 0.53 0.10 -0.10 -0.97 -1.61 0.00 0.00 178.31 176.26 1dgg h ASN 287 N 0.13 0.76 0.75 2.17 -1.24 -1.96 -2.93 115.58 113.26 1dgg h ASN 287 Ca 0.03 -0.36 -0.09 0.00 0.71 0.00 0.00 56.30 56.59 1dgg h ASN 287 Cb 0.03 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 38.86 1dgg h ASN 287 CO -0.00 0.95 -0.42 1.56 -1.29 0.00 0.00 177.43 178.22 1dgg h GLN 288 N 0.56 0.00 0.00 6.67 4.20 -1.57 -2.95 115.11 122.02 1dgg h GLN 288 Ca 0.10 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 1dgg h GLN 288 Cb 0.62 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.40 1dgg h GLN 288 CO 0.04 0.42 -0.03 0.00 -0.67 0.00 0.00 178.83 178.59 1dgg h ALA 289 N 1.58 1.08 0.19 3.87 0.00 -0.82 -2.52 119.26 122.64 1dgg h ALA 289 Ca -0.00 -0.02 -0.32 0.00 0.00 0.00 0.00 54.91 54.56 1dgg h ALA 289 Cb 0.91 -0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.73 1dgg h ALA 289 CO 0.05 0.03 -1.37 0.93 0.00 0.00 0.00 179.25 178.90 1dgg h GLU 290 N 0.00 0.59 0.00 0.00 4.39 -1.52 -3.35 114.58 114.69 1dgg h GLU 290 Ca -0.00 -0.89 0.00 0.00 0.34 0.00 0.00 59.36 58.81 1dgg h GLU 290 Cb 0.23 0.31 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 1dgg h GLU 290 CO 0.00 1.42 -0.28 1.79 -1.16 0.00 0.00 179.01 180.79 1dgg h THR 291 N 0.22 0.00 -1.81 1.13 1.35 -1.62 -3.47 112.91 108.71 1dgg h THR 291 Ca -0.23 -0.86 -0.66 0.00 -0.55 0.00 0.00 66.41 64.11 1dgg h THR 291 Cb 2.05 1.72 0.05 0.00 -1.73 0.00 0.00 68.15 70.23 1dgg h THR 291 CO 0.26 0.00 0.65 0.33 -0.25 0.00 0.00 175.52 176.51 1dgg n PHE 292 N -2.77 1.83 0.16 4.73 -0.00 -0.97 -4.82 117.46 115.61 1dgg n PHE 292 Ca 0.03 0.50 0.09 0.00 -0.00 0.00 0.00 57.45 58.07 1dgg n PHE 292 Cb 0.51 -2.42 0.47 0.00 -0.00 0.00 0.00 39.48 38.04 1dgg n PHE 292 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 1dgg n PRO 293 N 3.51 0.11 -4.48 -7.13 -0.02 -1.26 -4.68 135.00 121.05 1dgg n PRO 293 Ca 0.20 0.60 -0.25 0.00 -2.02 0.00 0.00 63.50 62.03 1dgg n PRO 293 Cb 0.21 -2.00 -0.08 0.00 -0.02 0.00 0.00 33.50 31.61 1dgg n PRO 293 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1dgg s PHE 294 N -3.43 1.78 -0.40 6.00 0.08 -1.26 -5.09 117.98 115.66 1dgg s PHE 294 Ca -0.02 -1.40 -0.29 0.00 0.12 0.00 0.00 56.93 55.35 1dgg s PHE 294 Cb 0.05 -1.07 0.02 0.00 -0.57 0.00 0.00 43.02 41.45 1dgg s PHE 294 CO 0.16 -0.44 1.13 1.21 -0.10 0.00 0.00 175.22 177.18 1dgg s ASN 295 N -3.59 6.75 0.00 1.36 3.84 -1.26 -4.88 114.94 117.17 1dgg s ASN 295 Ca 0.25 0.76 0.00 0.00 0.21 0.00 0.00 52.86 54.08 1dgg s ASN 295 Cb 0.02 -2.55 0.00 0.00 -0.55 0.00 0.00 41.25 38.17 1dgg s ASN 295 CO 0.17 -1.09 0.91 -0.81 -2.79 0.00 0.00 177.10 173.49 1dgg n PRO 296 N 7.42 0.00 -0.12 0.43 -0.04 -1.26 -1.13 135.00 140.29 1dgg n PRO 296 Ca 0.12 0.41 0.05 0.00 -0.04 0.00 0.00 63.50 64.05 1dgg n PRO 296 Cb 0.48 -1.51 0.12 0.00 -0.04 0.00 0.00 33.50 32.54 1dgg n PRO 296 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1dgg n PHE 297 N -1.41 0.31 -2.69 0.54 3.72 -1.26 -4.72 117.46 111.95 1dgg n PHE 297 Ca 0.00 -0.35 -0.43 0.00 -0.05 0.00 0.00 57.45 56.62 1dgg n PHE 297 Cb 0.01 -0.02 -0.02 0.00 -0.94 0.00 0.00 39.48 38.51 1dgg n PHE 297 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1dgg s ASP 298 N -0.97 6.94 0.00 4.37 3.68 -0.29 -4.48 116.67 125.93 1dgg s ASP 298 Ca 0.19 1.08 0.12 0.00 2.13 0.00 0.00 52.55 56.07 1dgg s ASP 298 Cb 0.11 -2.52 0.54 0.00 -1.45 0.00 0.00 42.92 39.59 1dgg s ASP 298 CO 0.15 -0.79 1.37 -0.11 0.13 0.00 0.00 175.17 175.92 1dgg n LEU 299 N 6.63 0.00 -0.74 -1.34 7.94 -1.26 -1.83 117.00 126.40 1dgg n LEU 299 Ca 0.11 0.45 0.11 0.00 -1.11 0.00 0.00 56.01 55.57 1dgg n LEU 299 Cb 0.47 -0.45 0.32 0.00 0.53 0.00 0.00 43.42 44.28 1dgg n LEU 299 CO 0.56 -0.27 0.75 0.35 -1.11 0.00 0.00 177.39 177.67 1dgg n THR 300 N -1.45 0.28 -4.38 1.96 -2.24 -1.26 -2.08 114.28 105.10 1dgg n THR 300 Ca 0.04 -0.46 -0.27 0.00 -2.27 0.00 0.00 64.05 61.09 1dgg n THR 300 Cb 0.13 0.58 -0.11 0.00 -2.10 0.00 0.00 70.33 68.84 1dgg n THR 300 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1dgg s LYS 301 N -1.72 1.71 0.36 -0.78 -0.14 -0.76 -4.89 119.74 113.52 1dgg s LYS 301 Ca 0.34 -1.46 0.08 0.00 -1.36 0.00 0.00 55.97 53.57 1dgg s LYS 301 Cb 0.19 -1.94 -0.07 0.00 -1.68 0.00 0.00 37.83 34.33 1dgg s LYS 301 CO 0.28 0.41 -0.04 0.14 -0.76 0.00 0.00 175.35 175.37 1dgg s VAL 302 N -1.74 2.01 -0.34 3.17 -7.23 -1.26 -4.85 120.40 110.15 1dgg s VAL 302 Ca 0.23 -2.11 -0.11 0.00 -1.81 0.00 0.00 61.98 58.18 1dgg s VAL 302 Cb -0.08 -2.75 0.00 0.00 0.56 0.00 0.00 36.38 34.11 1dgg s VAL 302 CO 0.12 -0.13 0.20 0.26 -0.31 0.00 0.00 175.10 175.23 1dgg s TRP 303 N -2.74 3.21 0.06 2.82 0.51 -1.26 -5.05 118.94 116.49 1dgg s TRP 303 Ca 0.33 -0.62 -0.35 0.00 -2.12 0.00 0.00 56.10 53.34 1dgg s TRP 303 Cb 0.06 -2.42 -0.14 0.00 -0.81 0.00 0.00 33.47 30.15 1dgg s TRP 303 CO 0.16 -0.51 1.60 -2.30 -0.51 0.00 0.00 176.95 175.40 1dgg n PRO 304 N 5.02 1.86 -0.10 4.98 -0.02 -1.26 -4.79 135.00 140.69 1dgg n PRO 304 Ca -0.13 0.67 0.20 0.00 -2.02 0.00 0.00 63.50 62.23 1dgg n PRO 304 Cb 0.48 -2.42 0.63 0.00 -0.02 0.00 0.00 33.50 32.17 1dgg n PRO 304 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1dgg h HIS 305 N 6.42 0.18 -0.18 6.00 3.86 -1.97 0.16 115.15 129.62 1dgg h HIS 305 Ca -0.46 0.01 0.03 0.00 -1.16 0.00 0.00 60.37 58.78 1dgg h HIS 305 Cb 1.28 -0.06 -0.03 0.00 1.06 0.00 0.00 27.41 29.67 1dgg h HIS 305 CO 0.68 0.06 0.02 -0.22 0.86 0.00 0.00 177.93 179.33 1dgg h LYS 306 N 0.15 0.08 0.00 2.45 3.64 -1.99 -2.43 116.57 118.47 1dgg h LYS 306 Ca 0.34 -0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.57 1dgg h LYS 306 Cb 1.11 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.89 1dgg h LYS 306 CO -0.05 0.05 -0.92 -0.44 -2.27 0.00 0.00 179.45 175.83 1dgg h ASP 307 N 0.08 0.00 -2.82 4.20 5.19 -1.69 -3.40 116.42 117.97 1dgg h ASP 307 Ca 0.08 0.00 -0.60 0.00 -0.62 0.00 0.00 57.03 55.89 1dgg h ASP 307 Cb 0.09 0.00 -0.39 0.00 0.18 0.00 0.00 39.33 39.21 1dgg h ASP 307 CO -0.13 0.58 -0.83 -0.31 -3.12 0.00 0.00 179.24 175.44 1dgg s TYR 308 N -2.92 1.54 0.54 4.55 2.02 -0.04 -5.06 117.35 117.99 1dgg s TYR 308 Ca 0.01 -2.30 -0.21 0.00 -0.37 0.00 0.00 57.07 54.20 1dgg s TYR 308 Cb 0.08 -1.40 -0.05 0.00 -0.40 0.00 0.00 41.96 40.19 1dgg s TYR 308 CO 0.78 -0.78 1.31 -2.14 -1.57 0.00 0.00 175.55 173.15 1dgg s PRO 309 N 0.22 3.18 0.13 -1.71 0.02 -0.92 -4.23 135.00 131.68 1dgg s PRO 309 Ca 0.24 2.11 -0.31 0.00 0.02 0.00 0.00 61.00 63.06 1dgg s PRO 309 Cb -0.12 -2.22 -0.08 0.00 0.02 0.00 0.00 34.50 32.11 1dgg s PRO 309 CO -0.09 -1.12 1.32 -0.51 -0.33 0.00 0.00 177.00 176.27 1dgg s LEU 310 N -3.56 4.39 -0.22 -5.54 1.43 -1.26 -4.59 118.68 109.31 1dgg s LEU 310 Ca 0.72 2.28 -0.05 0.00 -1.03 0.00 0.00 54.13 56.04 1dgg s LEU 310 Cb -0.37 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.24 1dgg s LEU 310 CO 0.44 -0.57 0.00 -0.63 0.23 0.00 0.00 176.35 175.82 1dgg s ILE 311 N 0.79 3.80 0.36 -0.59 1.01 0.01 -4.93 121.20 121.64 1dgg s ILE 311 Ca 0.61 -0.35 -0.28 0.00 0.00 0.00 0.00 60.65 60.63 1dgg s ILE 311 Cb -0.35 -2.74 -0.10 0.00 0.01 0.00 0.00 42.46 39.28 1dgg s ILE 311 CO 0.32 0.40 1.31 -2.16 0.00 0.00 0.00 174.94 174.81 1dgg s PRO 312 N 1.37 4.23 0.05 2.79 0.04 -1.26 -0.99 135.00 141.23 1dgg s PRO 312 Ca 0.05 2.21 0.00 0.00 0.04 0.00 0.00 61.00 63.29 1dgg s PRO 312 Cb -0.15 -2.97 0.00 0.00 0.04 0.00 0.00 34.50 31.42 1dgg s PRO 312 CO 0.00 -0.29 0.00 0.28 0.04 0.00 0.00 177.00 177.03 1dgg n VAL 313 N 0.58 0.24 -2.25 -0.36 0.31 0.84 -4.58 118.33 113.11 1dgg n VAL 313 Ca 0.01 0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.42 1dgg n VAL 313 Cb 0.42 -1.14 0.00 0.00 -0.91 0.00 0.00 33.84 32.21 1dgg n VAL 313 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1dgg n GLY 314 N 2.53 2.18 3.23 2.92 0.00 -0.83 0.43 105.19 115.64 1dgg n GLY 314 Ca 0.00 -0.65 -0.22 0.00 0.00 0.00 0.00 46.02 45.14 1dgg n GLY 314 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dgg s LYS 315 N 1.13 1.08 -0.22 1.61 -0.14 0.43 0.59 119.74 124.22 1dgg s LYS 315 Ca 0.00 -1.00 -0.02 0.00 -1.36 0.00 0.00 55.97 53.59 1dgg s LYS 315 Cb 0.00 -1.22 0.01 0.00 -1.68 0.00 0.00 37.83 34.95 1dgg s LYS 315 CO 0.00 0.29 -0.09 -1.17 -0.76 0.00 0.00 175.35 173.62 1dgg s LEU 316 N -1.59 2.84 -0.09 3.17 2.96 0.20 -1.27 118.68 124.90 1dgg s LEU 316 Ca 0.04 -0.67 0.03 0.00 -0.22 0.00 0.00 54.13 53.31 1dgg s LEU 316 Cb -0.09 -1.64 0.01 0.00 0.50 0.00 0.00 46.19 44.96 1dgg s LEU 316 CO 0.03 -0.06 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.13 1dgg s VAL 317 N 1.36 1.59 -0.35 1.68 1.01 0.08 -1.03 120.40 124.74 1dgg s VAL 317 Ca 0.03 -0.73 -0.07 0.00 0.00 0.00 0.00 61.98 61.21 1dgg s VAL 317 Cb -0.15 -1.42 0.04 0.00 0.00 0.00 0.00 36.38 34.86 1dgg s VAL 317 CO -0.06 0.46 0.14 -0.76 0.00 0.00 0.00 175.10 174.87 1dgg s LEU 318 N 0.67 4.48 -0.06 3.92 1.02 -0.85 -0.39 118.68 127.48 1dgg s LEU 318 Ca -0.13 -1.19 0.08 0.00 0.02 0.00 0.00 54.13 52.91 1dgg s LEU 318 Cb -0.16 -1.90 0.13 0.00 0.02 0.00 0.00 46.19 44.28 1dgg s LEU 318 CO 0.03 -0.36 1.01 -0.46 0.02 0.00 0.00 176.35 176.59 1dgg n ASN 319 N 4.84 1.38 -3.69 2.29 0.23 -0.50 -3.67 115.26 116.14 1dgg n ASN 319 Ca -0.12 -2.36 -0.12 0.00 -0.53 0.00 0.00 54.58 51.45 1dgg n ASN 319 Cb 0.44 -0.24 -0.12 0.00 -2.08 0.00 0.00 39.78 37.78 1dgg n ASN 319 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 1dgg s ARG 320 N -1.43 0.24 0.64 -3.83 3.52 -0.14 -4.98 118.95 112.95 1dgg s ARG 320 Ca 0.14 0.72 -0.10 0.00 -0.13 0.00 0.00 55.73 56.35 1dgg s ARG 320 Cb 0.12 -0.02 -0.02 0.00 -1.56 0.00 0.00 34.95 33.48 1dgg s ARG 320 CO 0.01 -0.21 1.02 -0.80 -0.81 0.00 0.00 175.30 174.51 1dgg s ASN 321 N 1.84 5.89 0.48 -2.12 0.01 -1.26 -0.38 114.94 119.40 1dgg s ASN 321 Ca -0.05 1.20 -0.21 0.00 -0.71 0.00 0.00 52.86 53.10 1dgg s ASN 321 Cb -0.11 -2.18 -0.08 0.00 0.41 0.00 0.00 41.25 39.29 1dgg s ASN 321 CO -0.10 -1.03 1.05 -2.84 -1.51 0.00 0.00 177.10 172.67 1dgg s PRO 322 N -5.19 3.80 -0.12 -0.60 0.02 -1.26 -4.82 135.00 126.84 1dgg s PRO 322 Ca 0.55 1.42 -0.06 0.00 0.02 0.00 0.00 61.00 62.94 1dgg s PRO 322 Cb -0.11 -2.15 -0.26 0.00 0.02 0.00 0.00 34.50 32.00 1dgg s PRO 322 CO 0.51 -0.44 0.38 0.28 -0.33 0.00 0.00 177.00 177.41 1dgg n VAL 323 N -0.87 1.78 -3.82 3.83 0.31 -1.26 -4.79 118.33 113.50 1dgg n VAL 323 Ca 0.09 -0.67 -0.28 0.00 -0.01 0.00 0.00 64.34 63.48 1dgg n VAL 323 Cb 0.52 -1.69 -0.16 0.00 -0.91 0.00 0.00 33.84 31.59 1dgg n VAL 323 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1dgg s ASN 324 N -6.99 2.81 0.13 4.52 3.84 -1.26 -5.05 114.94 112.95 1dgg s ASN 324 Ca -0.21 -0.71 -0.19 0.00 0.21 0.00 0.00 52.86 51.96 1dgg s ASN 324 Cb 0.07 -0.76 -0.02 0.00 -0.55 0.00 0.00 41.25 39.99 1dgg s ASN 324 CO 0.77 -0.24 1.73 0.22 -2.79 0.00 0.00 177.10 176.80 1dgg h TYR 325 N 8.17 0.07 0.39 0.43 3.20 -1.97 -1.58 116.97 125.69 1dgg h TYR 325 Ca -0.20 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.68 1dgg h TYR 325 Cb 1.11 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.37 1dgg h TYR 325 CO 0.40 0.02 -0.30 0.35 -1.64 0.00 0.00 178.16 176.99 1dgg h PHE 326 N 0.13 -0.79 -0.71 -3.82 3.04 -1.96 0.60 116.94 113.43 1dgg h PHE 326 Ca 0.10 -0.00 -0.00 0.00 3.98 0.00 0.00 57.97 62.05 1dgg h PHE 326 Cb 0.10 0.29 -0.03 0.00 2.56 0.00 0.00 35.95 38.87 1dgg h PHE 326 CO -0.15 -0.44 0.43 0.00 -2.02 0.00 0.00 178.31 176.13 1dgg h ALA 327 N -0.16 1.43 0.00 2.41 0.00 -1.96 -1.28 119.26 119.69 1dgg h ALA 327 Ca -0.03 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1dgg h ALA 327 Cb 0.59 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1dgg h ALA 327 CO -0.00 0.50 -1.91 0.39 0.00 0.00 0.00 179.25 178.22 1dgg n GLU 328 N -4.40 0.73 -0.03 0.00 1.02 -0.60 -4.47 120.64 112.90 1dgg n GLU 328 Ca 0.07 -0.13 -0.07 0.00 -0.02 0.00 0.00 57.16 57.02 1dgg n GLU 328 Cb 0.06 -1.43 -0.02 0.00 -0.02 0.00 0.00 31.44 30.03 1dgg n GLU 328 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1dgg n VAL 329 N -2.26 1.07 -0.29 2.62 0.31 0.20 -4.21 118.33 115.77 1dgg n VAL 329 Ca -0.10 0.12 -0.01 0.00 -0.01 0.00 0.00 64.34 64.34 1dgg n VAL 329 Cb 0.62 -1.81 0.16 0.00 -0.91 0.00 0.00 33.84 31.91 1dgg n VAL 329 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1dgg h GLU 330 N -0.41 1.15 -0.00 5.55 4.57 -1.19 -2.62 114.58 121.63 1dgg h GLU 330 Ca -0.11 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 57.97 1dgg h GLU 330 Cb 0.74 -0.25 0.00 0.00 -0.16 0.00 0.00 28.75 29.09 1dgg h GLU 330 CO -0.07 0.79 -0.20 1.04 -1.18 0.00 0.00 179.01 179.39 1dgg n GLN 331 N -4.38 0.29 -1.98 1.92 6.02 -0.50 -4.91 117.38 113.85 1dgg n GLN 331 Ca 0.09 -0.11 -0.36 0.00 -0.01 0.00 0.00 57.00 56.62 1dgg n GLN 331 Cb 0.05 -1.50 0.04 0.00 1.02 0.00 0.00 30.24 29.85 1dgg n GLN 331 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.06 174.55 1dgg s ILE 332 N -2.78 2.63 -0.05 5.09 2.07 -0.99 -4.90 121.20 122.27 1dgg s ILE 332 Ca 0.19 0.39 -0.02 0.00 -1.41 0.00 0.00 60.65 59.80 1dgg s ILE 332 Cb 0.19 -3.14 0.04 0.00 0.13 0.00 0.00 42.46 39.68 1dgg s ILE 332 CO 0.56 -0.09 0.09 0.00 -1.91 0.00 0.00 174.94 173.59 1dgg s ALA 333 N -1.63 -0.03 -0.10 1.50 0.00 -1.26 -5.02 121.76 115.22 1dgg s ALA 333 Ca 0.77 0.43 0.00 0.00 0.00 0.00 0.00 51.96 53.17 1dgg s ALA 333 Cb -0.30 -0.48 -0.02 0.00 0.00 0.00 0.00 23.12 22.32 1dgg s ALA 333 CO 0.34 -0.28 -0.11 -0.06 0.00 0.00 0.00 175.76 175.65 1dgg s PHE 334 N 1.53 2.83 -0.21 0.00 0.08 -1.26 -4.96 117.98 116.00 1dgg s PHE 334 Ca -0.04 -0.38 0.01 0.00 0.12 0.00 0.00 56.93 56.64 1dgg s PHE 334 Cb -0.12 -1.79 0.04 0.00 -0.57 0.00 0.00 43.02 40.58 1dgg s PHE 334 CO -0.04 -0.01 -0.11 -0.51 -0.10 0.00 0.00 175.22 174.44 1dgg s ASP 335 N -0.08 3.57 0.60 1.36 -0.00 -1.26 -4.86 116.67 116.00 1dgg s ASP 335 Ca -0.01 -0.96 0.29 0.00 -0.00 0.00 0.00 52.55 51.86 1dgg s ASP 335 Cb -0.14 -1.32 1.54 0.00 -0.00 0.00 0.00 42.92 43.01 1dgg s ASP 335 CO 0.03 -0.14 1.95 -0.65 -0.00 0.00 0.00 175.17 176.36 1dgg h PRO 336 N 7.93 0.00 0.00 8.23 0.11 -1.83 0.38 132.00 146.83 1dgg h PRO 336 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1dgg h PRO 336 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1dgg h PRO 336 CO 0.49 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.15 1dgg n SER 337 N -3.59 0.29 -4.57 -2.05 3.41 -1.26 -4.39 113.62 101.45 1dgg n SER 337 Ca 0.05 0.56 -0.39 0.00 -0.26 0.00 0.00 58.87 58.83 1dgg n SER 337 Cb 0.54 -0.63 -0.02 0.00 -0.26 0.00 0.00 64.21 63.85 1dgg n SER 337 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1dgg s ASN 338 N -3.55 6.38 -0.09 4.04 0.01 0.14 -4.91 114.94 116.96 1dgg s ASN 338 Ca 0.07 -1.97 0.02 0.00 -0.71 0.00 0.00 52.86 50.27 1dgg s ASN 338 Cb 0.11 -2.58 0.01 0.00 0.41 0.00 0.00 41.25 39.20 1dgg s ASN 338 CO 0.37 -1.64 -0.15 -0.04 -1.51 0.00 0.00 177.10 174.13 1dgg s MET 339 N 4.93 2.12 0.68 -0.60 -1.94 -1.26 -1.39 119.30 121.83 1dgg s MET 339 Ca 0.55 -0.54 -0.06 0.00 -1.71 0.00 0.00 55.69 53.93 1dgg s MET 339 Cb 0.02 -1.74 0.05 0.00 2.01 0.00 0.00 34.83 35.17 1dgg s MET 339 CO 0.04 0.01 0.98 -1.25 -0.01 0.00 0.00 175.02 174.79 1dgg s PRO 340 N 0.76 2.30 0.23 2.03 0.04 -1.26 -4.94 135.00 134.16 1dgg s PRO 340 Ca -0.12 -0.27 -0.31 0.00 0.04 0.00 0.00 61.00 60.34 1dgg s PRO 340 Cb -0.16 -2.21 -0.14 0.00 0.04 0.00 0.00 34.50 32.04 1dgg s PRO 340 CO 0.02 -1.14 1.40 -2.30 0.04 0.00 0.00 177.00 175.02 1dgg n PRO 341 N -2.84 1.98 0.00 0.56 -0.02 -1.26 -1.79 135.00 131.63 1dgg n PRO 341 Ca 0.08 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 1dgg n PRO 341 Cb 0.60 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 1dgg n PRO 341 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dgg n GLY 342 N 2.18 2.63 2.90 -1.23 0.00 -1.26 -3.62 105.19 106.79 1dgg n GLY 342 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 1dgg n GLY 342 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dgg s ILE 343 N -2.54 0.88 0.29 -0.61 1.01 -0.74 -0.99 121.20 118.50 1dgg s ILE 343 Ca 0.00 -0.23 0.02 0.00 0.00 0.00 0.00 60.65 60.44 1dgg s ILE 343 Cb 0.00 -0.91 -0.05 0.00 0.01 0.00 0.00 42.46 41.51 1dgg s ILE 343 CO 0.00 0.33 0.12 -1.61 0.00 0.00 0.00 174.94 173.78 1dgg s GLU 344 N 1.52 1.54 0.47 2.79 2.02 0.80 -4.30 118.70 123.54 1dgg s GLU 344 Ca 0.01 -1.86 -0.08 0.00 0.02 0.00 0.00 54.97 53.05 1dgg s GLU 344 Cb -0.13 -0.30 -0.05 0.00 0.10 0.00 0.00 34.13 33.75 1dgg s GLU 344 CO -0.05 -0.35 0.81 0.00 0.02 0.00 0.00 175.26 175.69 1dgg s ALA 345 N -3.62 3.34 0.39 5.21 0.00 -1.26 -0.40 121.76 125.43 1dgg s ALA 345 Ca 0.36 -0.32 0.08 0.00 0.00 0.00 0.00 51.96 52.07 1dgg s ALA 345 Cb 0.07 -2.70 -0.02 0.00 0.00 0.00 0.00 23.12 20.46 1dgg s ALA 345 CO 0.15 -0.25 0.35 -1.54 0.00 0.00 0.00 175.76 174.47 1dgg s SER 346 N -3.71 5.09 0.00 0.00 1.04 -1.26 -4.41 113.70 110.45 1dgg s SER 346 Ca 0.50 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 56.24 1dgg s SER 346 Cb -0.10 -0.67 0.00 0.00 0.10 0.00 0.00 66.02 65.34 1dgg s SER 346 CO 0.40 -0.57 0.46 -0.81 0.98 0.00 0.00 173.24 173.71 1dgg n PRO 347 N -1.49 0.51 -1.59 4.02 -0.04 -1.26 -4.67 135.00 130.48 1dgg n PRO 347 Ca 0.02 0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 63.03 1dgg n PRO 347 Cb 0.61 -1.05 -0.04 0.00 -0.04 0.00 0.00 33.50 32.98 1dgg n PRO 347 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1dgg n ASP 348 N -0.36 3.18 -0.35 3.54 -0.08 -1.26 -4.81 116.55 116.41 1dgg n ASP 348 Ca 0.00 0.45 0.16 0.00 -1.51 0.00 0.00 54.79 53.88 1dgg n ASP 348 Cb 0.02 -1.47 0.36 0.00 2.34 0.00 0.00 41.12 42.38 1dgg n ASP 348 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1dgg h LYS 349 N 13.12 0.63 -0.08 -0.67 1.57 -1.83 0.33 116.57 129.65 1dgg h LYS 349 Ca -0.40 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1dgg h LYS 349 Cb 1.26 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 33.43 1dgg h LYS 349 CO 0.97 0.42 0.04 0.52 -0.57 0.00 0.00 179.45 180.82 1dgg h MET 350 N 0.65 0.11 -0.89 3.15 2.86 -1.88 -1.42 114.93 117.52 1dgg h MET 350 Ca 0.62 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 58.24 1dgg h MET 350 Cb 1.10 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.70 1dgg h MET 350 CO -0.44 0.21 0.54 1.25 1.06 0.00 0.00 176.91 179.53 1dgg h LEU 351 N -0.01 1.07 -1.09 1.22 5.85 -1.54 -2.31 115.31 118.50 1dgg h LEU 351 Ca 0.03 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.69 1dgg h LEU 351 Cb 0.13 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.85 1dgg h LEU 351 CO -0.00 0.82 0.62 1.56 -0.34 0.00 0.00 178.44 181.09 1dgg h GLN 352 N 1.22 1.22 -0.42 1.25 1.08 -0.64 -1.11 115.11 117.71 1dgg h GLN 352 Ca 0.32 -0.07 -0.15 0.00 -1.45 0.00 0.00 58.65 57.30 1dgg h GLN 352 Cb -0.06 -0.27 -0.01 0.00 -0.05 0.00 0.00 27.48 27.09 1dgg h GLN 352 CO -0.06 0.80 -0.31 0.78 -0.95 0.00 0.00 178.83 179.09 1dgg h GLY 353 N 1.25 1.01 2.00 3.46 0.00 -0.82 -2.74 103.07 107.23 1dgg h GLY 353 Ca 0.34 -0.97 -0.04 0.00 0.00 0.00 0.00 47.33 46.67 1dgg h GLY 353 CO -0.08 0.88 -0.18 3.21 0.00 0.00 0.00 176.54 180.37 1dgg h ARG 354 N 0.78 0.00 -0.87 4.80 3.08 -0.87 -1.74 114.38 119.56 1dgg h ARG 354 Ca 0.08 0.00 0.12 0.00 0.07 0.00 0.00 59.98 60.25 1dgg h ARG 354 Cb 0.89 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.87 1dgg h ARG 354 CO 0.08 0.18 0.56 -0.07 -1.07 0.00 0.00 179.97 179.65 1dgg h LEU 355 N 0.00 0.69 0.00 3.04 4.07 -0.90 -3.01 115.31 119.21 1dgg h LEU 355 Ca -0.00 0.03 -0.23 0.00 0.08 0.00 0.00 57.88 57.75 1dgg h LEU 355 Cb 0.40 -0.11 -0.03 0.00 1.08 0.00 0.00 40.66 42.00 1dgg h LEU 355 CO 0.02 0.38 -1.28 0.15 -1.08 0.00 0.00 178.44 176.64 1dgg h PHE 356 N 0.75 0.02 -0.63 1.13 3.57 -1.46 -3.43 116.94 116.89 1dgg h PHE 356 Ca 0.42 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 62.03 1dgg h PHE 356 Cb 0.57 -0.00 -0.12 0.00 2.79 0.00 0.00 35.95 39.19 1dgg h PHE 356 CO -0.00 1.50 -0.13 0.00 -2.23 0.00 0.00 178.31 177.45 1dgg h ALA 357 N -0.47 0.46 0.55 2.41 0.00 -1.27 -2.80 119.26 118.14 1dgg h ALA 357 Ca -0.35 0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 1dgg h ALA 357 Cb 1.33 0.45 0.01 0.00 0.00 0.00 0.00 17.79 19.58 1dgg h ALA 357 CO -0.20 -0.42 -0.26 1.88 0.00 0.00 0.00 179.25 180.24 1dgg h TYR 358 N 0.02 -0.68 -0.32 0.00 0.05 -1.79 -0.51 116.97 113.74 1dgg h TYR 358 Ca 0.31 -0.02 -0.03 0.00 0.05 0.00 0.00 58.73 59.05 1dgg h TYR 358 Cb 0.48 0.23 -0.02 0.00 1.01 0.00 0.00 36.73 38.43 1dgg h TYR 358 CO -0.49 -0.40 0.08 -1.35 -1.05 0.00 0.00 178.16 174.95 1dgg h PRO 359 N -0.79 0.45 0.47 4.88 0.11 -1.82 -1.50 132.00 133.79 1dgg h PRO 359 Ca -0.08 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 65.95 1dgg h PRO 359 Cb 0.59 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.62 1dgg h PRO 359 CO 0.12 0.42 -0.24 0.22 -0.21 0.00 0.00 178.00 178.32 1dgg h ASP 360 N 0.45 -0.57 0.12 -2.05 3.58 -1.33 -2.07 116.42 114.56 1dgg h ASP 360 Ca 0.11 0.02 -0.05 0.00 0.42 0.00 0.00 57.03 57.54 1dgg h ASP 360 Cb 0.17 0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.37 1dgg h ASP 360 CO -0.00 -0.39 -0.17 0.00 -2.88 0.00 0.00 179.24 175.79 1dgg h THR 361 N -0.64 1.16 -0.25 2.25 1.03 -0.82 -2.80 112.91 112.83 1dgg h THR 361 Ca -0.06 -0.73 -0.14 0.00 -0.01 0.00 0.00 66.41 65.47 1dgg h THR 361 Cb 0.50 1.30 -0.01 0.00 -1.07 0.00 0.00 68.15 68.87 1dgg h THR 361 CO 0.09 0.22 -0.41 0.45 -0.01 0.00 0.00 175.52 175.86 1dgg h HIS 362 N 0.10 0.72 0.00 0.00 3.86 -1.03 0.63 115.15 119.43 1dgg h HIS 362 Ca 0.02 -0.21 -0.02 0.00 -1.16 0.00 0.00 60.37 59.00 1dgg h HIS 362 Cb 0.36 -0.15 -0.00 0.00 1.06 0.00 0.00 27.41 28.68 1dgg h HIS 362 CO 0.00 0.92 -0.09 0.00 0.86 0.00 0.00 177.93 179.62 1dgg h ARG 363 N 0.50 0.00 0.00 2.45 3.08 -1.10 -0.60 114.38 118.70 1dgg h ARG 363 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1dgg h ARG 363 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.98 1dgg h ARG 363 CO 0.08 0.09 -0.25 1.25 -1.07 0.00 0.00 179.97 180.08 1dgg h HIS 364 N 0.00 0.00 -0.61 3.04 2.76 -1.38 -3.03 115.15 115.94 1dgg h HIS 364 Ca -0.00 0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.24 1dgg h HIS 364 Cb 0.38 0.00 -0.06 0.00 1.55 0.00 0.00 27.41 29.28 1dgg h HIS 364 CO 0.00 0.00 0.29 -0.09 -1.30 0.00 0.00 177.93 176.83 1dgg h ARG 365 N -0.79 0.53 0.00 5.26 2.43 -0.91 -3.35 114.38 117.54 1dgg h ARG 365 Ca 0.00 -0.03 -0.31 0.00 -0.81 0.00 0.00 59.98 58.82 1dgg h ARG 365 Cb 0.25 -0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 29.63 1dgg h ARG 365 CO 0.00 0.35 -2.01 1.28 -1.51 0.00 0.00 179.97 178.08 1dgg n LEU 366 N -4.88 1.72 0.00 3.80 4.77 -0.30 -4.43 117.00 117.68 1dgg n LEU 366 Ca 0.08 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.35 1dgg n LEU 366 Cb 0.20 -0.70 0.00 0.00 -2.33 0.00 0.00 43.42 40.59 1dgg n LEU 366 CO 0.27 0.31 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 1dgg n GLY 367 N 1.55 3.90 0.40 -0.72 0.00 -0.81 -4.88 105.19 104.62 1dgg n GLY 367 Ca -0.39 -1.40 0.24 0.00 0.00 0.00 0.00 46.02 44.47 1dgg n GLY 367 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1dgg h PRO 368 N 0.00 0.37 -0.85 1.61 0.11 -1.85 -1.08 132.00 130.32 1dgg h PRO 368 Ca 0.00 -0.02 -0.53 0.00 0.11 0.00 0.00 66.00 65.55 1dgg h PRO 368 Cb 0.00 -0.08 -0.29 0.00 0.11 0.00 0.00 31.00 30.74 1dgg h PRO 368 CO 0.00 0.24 0.39 0.09 -0.21 0.00 0.00 178.00 178.51 1dgg n ASN 369 N -4.70 5.38 0.04 -2.05 5.03 -1.26 -4.72 115.26 112.98 1dgg n ASN 369 Ca 0.27 -3.74 0.19 0.00 0.87 0.00 0.00 54.58 52.18 1dgg n ASN 369 Cb 0.93 -0.78 0.71 0.00 -1.02 0.00 0.00 39.78 39.61 1dgg n ASN 369 CO 0.00 0.00 0.00 0.10 -1.83 0.00 0.00 177.26 175.53 1dgg h TYR 370 N 1.61 0.00 0.00 3.10 -0.00 -1.52 0.25 116.97 120.41 1dgg h TYR 370 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.24 1dgg h TYR 370 Cb 1.58 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.31 1dgg h TYR 370 CO 1.32 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 180.76 1dgg n LEU 371 N -4.27 0.08 0.16 0.10 4.77 -1.26 -1.42 117.00 115.16 1dgg n LEU 371 Ca 0.08 0.52 0.06 0.00 -0.03 0.00 0.00 56.01 56.65 1dgg n LEU 371 Cb 0.56 -0.52 0.07 0.00 -2.33 0.00 0.00 43.42 41.20 1dgg n LEU 371 CO 0.35 -0.36 0.55 0.45 -1.33 0.00 0.00 177.39 177.05 1dgg h HIS 372 N 0.00 0.00 -2.48 -1.77 3.86 -0.83 -3.15 115.15 110.77 1dgg h HIS 372 Ca 0.00 0.00 -0.54 0.00 -1.16 0.00 0.00 60.37 58.67 1dgg h HIS 372 Cb 0.19 0.00 0.04 0.00 1.06 0.00 0.00 27.41 28.70 1dgg h HIS 372 CO 0.00 0.32 1.07 -0.89 0.86 0.00 0.00 177.93 179.29 1dgg n ILE 373 N -3.16 0.29 -0.31 2.45 5.41 -0.50 -4.73 119.36 118.80 1dgg n ILE 373 Ca 0.02 -0.05 -0.00 0.00 1.00 0.00 0.00 62.75 63.72 1dgg n ILE 373 Cb 0.66 -2.04 0.04 0.00 -0.71 0.00 0.00 39.64 37.59 1dgg n ILE 373 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1dgg n PRO 374 N 5.24 -0.18 0.30 0.38 -0.02 -1.26 0.32 135.00 139.78 1dgg n PRO 374 Ca 0.18 1.25 0.20 0.00 -2.02 0.00 0.00 63.50 63.10 1dgg n PRO 374 Cb 0.36 -1.85 0.92 0.00 -0.02 0.00 0.00 33.50 32.91 1dgg n PRO 374 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 1dgg h VAL 375 N 0.00 0.00 0.00 -1.45 3.04 -1.90 -2.35 116.25 113.60 1dgg h VAL 375 Ca 0.29 -0.28 0.00 0.00 -1.01 0.00 0.00 66.70 65.70 1dgg h VAL 375 Cb 0.49 1.28 0.00 0.00 -2.01 0.00 0.00 31.29 31.05 1dgg h VAL 375 CO -0.81 0.00 -1.28 0.59 -1.01 0.00 0.00 177.57 175.07 1dgg n ASN 376 N -3.07 0.68 -4.74 3.17 3.02 0.15 -4.91 115.26 109.55 1dgg n ASN 376 Ca -0.01 -0.64 -0.41 0.00 -0.03 0.00 0.00 54.58 53.49 1dgg n ASN 376 Cb 0.20 1.25 -0.02 0.00 -0.61 0.00 0.00 39.78 40.60 1dgg n ASN 376 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dgg n PRO 378 N 2.47 3.57 0.00 0.00 -0.04 -1.26 -4.76 135.00 134.99 1dgg n PRO 378 Ca 0.07 -2.91 0.01 0.00 -0.04 0.00 0.00 63.50 60.62 1dgg n PRO 378 Cb 0.40 -2.96 0.04 0.00 -0.04 0.00 0.00 33.50 30.95 1dgg n PRO 378 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1dgg n TYR 379 N 4.12 0.00 -0.81 0.54 4.11 -1.26 -1.37 117.16 122.49 1dgg n TYR 379 Ca 0.57 0.00 0.08 0.00 -0.00 0.00 0.00 57.90 58.55 1dgg n TYR 379 Cb 0.32 -0.22 0.31 0.00 -0.00 0.00 0.00 39.34 39.74 1dgg n TYR 379 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 1dgg n ARG 380 N -1.22 3.60 -3.92 -3.48 1.74 -1.26 -4.94 116.66 107.18 1dgg n ARG 380 Ca 0.01 -2.85 -0.10 0.00 -0.77 0.00 0.00 57.85 54.14 1dgg n ARG 380 Cb 0.01 -1.90 -0.10 0.00 -1.02 0.00 0.00 32.46 29.45 1dgg n ARG 380 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1dgg s ALA 381 N -2.42 -0.12 -0.42 7.54 0.00 -0.47 -3.94 121.76 121.92 1dgg s ALA 381 Ca 0.45 -0.43 -0.19 0.00 0.00 0.00 0.00 51.96 51.79 1dgg s ALA 381 Cb 0.33 0.19 0.02 0.00 0.00 0.00 0.00 23.12 23.67 1dgg s ALA 381 CO 0.14 -0.27 0.54 0.50 0.00 0.00 0.00 175.76 176.68 1dgg s ARG 382 N -2.10 3.21 -0.34 0.00 3.52 -1.26 -4.88 118.95 117.10 1dgg s ARG 382 Ca -0.09 -0.54 -0.29 0.00 -0.13 0.00 0.00 55.73 54.68 1dgg s ARG 382 Cb -0.04 -3.95 0.01 0.00 -1.56 0.00 0.00 34.95 29.40 1dgg s ARG 382 CO -0.02 -0.91 1.31 0.08 -0.81 0.00 0.00 175.30 174.95 1dgg s VAL 383 N 2.47 4.10 -0.14 7.11 1.01 -1.26 -4.97 120.40 128.72 1dgg s VAL 383 Ca 0.17 1.21 -0.03 0.00 0.00 0.00 0.00 61.98 63.33 1dgg s VAL 383 Cb -0.16 -4.20 0.05 0.00 0.00 0.00 0.00 36.38 32.07 1dgg s VAL 383 CO 0.16 -0.57 0.05 0.00 0.00 0.00 0.00 175.10 174.74 1dgg s ALA 384 N 4.60 0.66 0.00 5.51 0.00 -1.26 -5.05 121.76 126.23 1dgg s ALA 384 Ca 0.57 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 52.19 1dgg s ALA 384 Cb -0.15 -0.96 0.00 0.00 0.00 0.00 0.00 23.12 22.01 1dgg s ALA 384 CO 0.26 -0.91 0.00 0.27 0.00 0.00 0.00 175.76 175.37 1dgg n ASN 385 N 5.17 0.00 -0.72 0.00 2.04 -1.26 -4.90 115.26 115.59 1dgg n ASN 385 Ca -0.07 -0.17 0.06 0.00 -0.44 0.00 0.00 54.58 53.95 1dgg n ASN 385 Cb 0.49 0.00 0.21 0.00 -2.53 0.00 0.00 39.78 37.95 1dgg n ASN 385 CO 0.00 0.00 0.00 -1.22 -0.44 0.00 0.00 177.26 175.60 1dgg n TYR 386 N 0.00 0.65 -3.44 -2.53 4.02 -1.26 -4.88 117.16 109.72 1dgg n TYR 386 Ca 0.00 -1.14 -0.38 0.00 -0.01 0.00 0.00 57.90 56.37 1dgg n TYR 386 Cb 0.00 -0.31 -0.06 0.00 -0.02 0.00 0.00 39.34 38.95 1dgg n TYR 386 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 1dgg s GLN 387 N -2.98 4.08 0.12 -0.72 -0.21 -1.26 -4.87 119.66 113.82 1dgg s GLN 387 Ca 0.40 0.42 -0.03 0.00 0.02 0.00 0.00 55.36 56.17 1dgg s GLN 387 Cb 0.34 -3.30 -0.03 0.00 1.00 0.00 0.00 33.01 31.03 1dgg s GLN 387 CO 0.04 0.51 0.11 1.03 -2.12 0.00 0.00 175.29 174.85 1dgg s ARG 388 N -0.50 0.93 4.74 2.91 1.81 -1.26 -4.94 118.95 122.63 1dgg s ARG 388 Ca 0.24 -1.31 0.00 0.00 -1.72 0.00 0.00 55.73 52.94 1dgg s ARG 388 Cb -0.16 0.28 0.00 0.00 -0.45 0.00 0.00 34.95 34.62 1dgg s ARG 388 CO 0.12 -0.28 0.00 -0.25 -0.68 0.00 0.00 175.30 174.21 1dgg n ASP 389 N -0.09 0.00 0.00 0.23 8.00 -1.26 -5.06 116.55 118.37 1dgg n ASP 389 Ca -0.08 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.42 1dgg n ASP 389 Cb 0.63 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.73 1dgg n ASP 389 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dgg n GLY 390 N 0.00 0.15 3.62 0.44 0.00 -1.26 -4.77 105.19 103.37 1dgg n GLY 390 Ca 0.00 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.93 1dgg n GLY 390 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1dgg n PRO 391 N 0.36 1.48 -3.66 1.61 -0.02 -1.26 -3.38 135.00 130.14 1dgg n PRO 391 Ca 0.00 0.53 -0.28 0.00 -2.02 0.00 0.00 63.50 61.73 1dgg n PRO 391 Cb 0.00 -2.06 0.03 0.00 -0.02 0.00 0.00 33.50 31.45 1dgg n PRO 391 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1dgg n MET 392 N 0.31 -1.18 -2.72 -0.52 2.81 -1.26 -4.28 117.12 110.28 1dgg n MET 392 Ca 0.09 0.61 -0.42 0.00 -1.81 0.00 0.00 57.70 56.17 1dgg n MET 392 Cb 0.37 -3.78 -0.03 0.00 -0.71 0.00 0.00 33.22 29.07 1dgg n MET 392 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1dgg n MET 394 N 8.12 0.13 -3.45 0.00 1.56 -1.26 -4.90 117.12 117.32 1dgg n MET 394 Ca 0.16 -0.05 -0.23 0.00 -0.27 0.00 0.00 57.70 57.32 1dgg n MET 394 Cb 0.49 -1.50 0.02 0.00 2.15 0.00 0.00 33.22 34.38 1dgg n MET 394 CO 0.00 0.00 0.00 1.04 -0.73 0.00 0.00 175.97 176.28 1dgg n GLN 395 N -1.39 0.71 0.00 2.12 6.02 -1.26 -4.96 117.38 118.61 1dgg n GLN 395 Ca 0.08 -3.13 0.03 0.00 -0.01 0.00 0.00 57.00 53.97 1dgg n GLN 395 Cb 0.33 0.19 0.17 0.00 1.02 0.00 0.00 30.24 31.94 1dgg n GLN 395 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1dgg n ASP 396 N -1.99 0.00 -3.03 1.08 5.75 -1.26 -4.80 116.55 112.31 1dgg n ASP 396 Ca 0.03 -0.44 -0.21 0.00 -0.01 0.00 0.00 54.79 54.16 1dgg n ASP 396 Cb 0.58 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.68 1dgg n ASP 396 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1dgg n ASN 397 N -0.78 -4.98 -2.18 -1.12 5.15 -1.26 -1.03 115.26 109.05 1dgg n ASN 397 Ca 0.04 -0.24 -0.21 0.00 -0.60 0.00 0.00 54.58 53.57 1dgg n ASN 397 Cb 0.02 -4.08 -0.03 0.00 -0.53 0.00 0.00 39.78 35.15 1dgg n ASN 397 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1dgg n GLN 398 N -3.70 -1.63 0.00 1.20 6.02 -1.26 -4.84 117.38 113.17 1dgg n GLN 398 Ca -0.09 1.07 0.00 0.00 -0.01 0.00 0.00 57.00 57.96 1dgg n GLN 398 Cb 0.60 -5.65 0.00 0.00 1.02 0.00 0.00 30.24 26.20 1dgg n GLN 398 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1dgg n GLY 399 N -0.84 2.81 1.68 1.08 0.00 -0.19 -2.81 105.19 106.92 1dgg n GLY 399 Ca -0.24 -0.07 0.09 0.00 0.00 0.00 0.00 46.02 45.80 1dgg n GLY 399 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dgg n GLY 400 N 0.00 2.78 3.77 -0.02 0.00 -1.26 -5.00 105.19 105.46 1dgg n GLY 400 Ca 0.00 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.73 1dgg n GLY 400 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgg n ALA 401 N 1.06 2.47 -1.61 4.61 0.00 -1.13 -4.88 120.51 121.03 1dgg n ALA 401 Ca 0.27 0.35 -0.50 0.00 0.00 0.00 0.00 53.44 53.56 1dgg n ALA 401 Cb 0.97 -2.44 -0.05 0.00 0.00 0.00 0.00 19.45 17.93 1dgg n ALA 401 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1dgg n PRO 402 N 0.96 1.39 -0.99 0.00 -0.02 -1.26 -4.89 135.00 130.19 1dgg n PRO 402 Ca 0.03 0.50 -0.05 0.00 -2.02 0.00 0.00 63.50 61.96 1dgg n PRO 402 Cb 0.38 -2.14 0.30 0.00 -0.02 0.00 0.00 33.50 32.03 1dgg n PRO 402 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1dgg n ASN 403 N 2.56 4.83 -3.93 2.55 2.04 -1.26 -4.89 115.26 117.16 1dgg n ASN 403 Ca 0.17 -3.16 -0.13 0.00 -0.44 0.00 0.00 54.58 51.03 1dgg n ASN 403 Cb 0.23 -0.74 -0.13 0.00 -2.53 0.00 0.00 39.78 36.60 1dgg n ASN 403 CO 0.00 0.00 0.00 -0.72 -0.44 0.00 0.00 177.26 176.10 1dgg s TYR 404 N -2.88 0.25 -0.08 -2.53 -0.85 -1.26 -4.89 117.35 105.11 1dgg s TYR 404 Ca 0.53 -0.17 0.04 0.00 -0.52 0.00 0.00 57.07 56.95 1dgg s TYR 404 Cb 0.42 -0.16 0.00 0.00 0.38 0.00 0.00 41.96 42.61 1dgg s TYR 404 CO 0.13 -0.05 -0.20 -0.47 -1.52 0.00 0.00 175.55 173.45 1dgg s TYR 405 N -0.45 2.11 0.77 -3.49 5.04 -1.26 -3.99 117.35 116.07 1dgg s TYR 405 Ca -0.03 -0.77 -0.12 0.00 -2.44 0.00 0.00 57.07 53.71 1dgg s TYR 405 Cb -0.03 -1.43 0.05 0.00 0.35 0.00 0.00 41.96 40.90 1dgg s TYR 405 CO -0.00 -0.31 1.13 -1.25 -1.34 0.00 0.00 175.55 173.78 1dgg s PRO 406 N 0.30 2.32 0.12 4.97 0.04 -1.26 -5.21 135.00 136.28 1dgg s PRO 406 Ca -0.13 0.32 -0.17 0.00 0.04 0.00 0.00 61.00 61.06 1dgg s PRO 406 Cb -0.16 -1.97 0.04 0.00 0.04 0.00 0.00 34.50 32.45 1dgg s PRO 406 CO 0.06 -1.39 0.43 0.54 0.04 0.00 0.00 177.00 176.68 1dgg s ASN 407 N -4.39 -0.29 -0.09 6.66 2.20 -1.26 -5.04 114.94 112.72 1dgg s ASN 407 Ca 0.60 -0.22 0.19 0.00 -0.94 0.00 0.00 52.86 52.49 1dgg s ASN 407 Cb -0.12 0.49 0.70 0.00 -2.00 0.00 0.00 41.25 40.32 1dgg s ASN 407 CO 0.51 -0.84 1.61 -1.20 -2.94 0.00 0.00 177.10 174.23 1dgg n SER 408 N -0.15 4.60 -1.06 3.54 7.64 -1.26 -4.52 113.62 122.41 1dgg n SER 408 Ca -0.17 -2.38 0.08 0.00 1.01 0.00 0.00 58.87 57.41 1dgg n SER 408 Cb 0.63 -0.56 0.27 0.00 -1.01 0.00 0.00 64.21 63.54 1dgg n SER 408 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1dgg n PHE 409 N 1.16 1.04 -0.96 1.43 3.01 -1.26 -4.99 117.46 116.88 1dgg n PHE 409 Ca 0.25 -0.72 0.00 0.00 1.01 0.00 0.00 57.45 57.99 1dgg n PHE 409 Cb 0.84 -0.25 0.00 0.00 -0.01 0.00 0.00 39.48 40.06 1dgg n PHE 409 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1dgg n GLY 410 N 0.15 0.48 3.59 1.37 0.00 -1.26 -4.93 105.19 104.58 1dgg n GLY 410 Ca 0.20 -0.37 -0.29 0.00 0.00 0.00 0.00 46.02 45.56 1dgg n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgg s ALA 411 N -2.00 0.50 0.18 4.61 0.00 -1.26 -4.91 121.76 118.88 1dgg s ALA 411 Ca 0.00 -0.67 -0.32 0.00 0.00 0.00 0.00 51.96 50.97 1dgg s ALA 411 Cb 0.00 -3.00 -0.16 0.00 0.00 0.00 0.00 23.12 19.96 1dgg s ALA 411 CO 0.00 -3.44 1.02 -2.30 0.00 0.00 0.00 175.76 171.04 1dgg n PRO 412 N -4.65 0.88 -4.32 0.00 -0.02 -1.26 -5.00 135.00 120.63 1dgg n PRO 412 Ca 0.09 0.31 -0.30 0.00 -2.02 0.00 0.00 63.50 61.58 1dgg n PRO 412 Cb 0.58 -1.71 -0.10 0.00 -0.02 0.00 0.00 33.50 32.26 1dgg n PRO 412 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1dgg s GLU 413 N -0.63 2.27 0.41 -0.52 0.41 -1.26 -5.02 118.70 114.36 1dgg s GLU 413 Ca 0.71 -0.93 -0.24 0.00 -0.41 0.00 0.00 54.97 54.11 1dgg s GLU 413 Cb -0.88 -2.37 -0.09 0.00 -1.78 0.00 0.00 34.13 29.01 1dgg s GLU 413 CO 0.55 0.54 1.08 1.14 -0.49 0.00 0.00 175.26 178.07 1dgg s GLN 414 N -1.94 4.06 -0.37 1.61 -2.07 -1.26 -5.02 119.66 114.67 1dgg s GLN 414 Ca 0.20 1.57 -0.05 0.00 -1.82 0.00 0.00 55.36 55.26 1dgg s GLN 414 Cb -0.11 -2.50 0.07 0.00 -1.09 0.00 0.00 33.01 29.38 1dgg s GLN 414 CO 0.12 -0.24 0.15 1.14 -1.32 0.00 0.00 175.29 175.13 1dgg s GLN 415 N -2.56 2.39 0.38 9.60 -2.07 -1.26 -4.99 119.66 121.14 1dgg s GLN 415 Ca 0.59 -1.46 0.21 0.00 -1.82 0.00 0.00 55.36 52.88 1dgg s GLN 415 Cb -0.23 -3.52 1.28 0.00 -1.09 0.00 0.00 33.01 29.45 1dgg s GLN 415 CO 0.29 -0.85 1.62 -1.35 -1.32 0.00 0.00 175.29 173.68 1dgg h PRO 416 N 8.17 0.13 -0.45 9.60 0.11 -2.01 -1.28 132.00 146.27 1dgg h PRO 416 Ca -0.20 -0.01 0.13 0.00 0.11 0.00 0.00 66.00 66.04 1dgg h PRO 416 Cb 1.07 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 1dgg h PRO 416 CO 0.65 0.09 0.41 0.66 -0.21 0.00 0.00 178.00 179.60 1dgg h SER 417 N 0.14 0.00 -0.01 -2.05 4.64 -2.05 -0.30 113.55 113.91 1dgg h SER 417 Ca 0.80 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.12 1dgg h SER 417 Cb 2.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.24 1dgg h SER 417 CO -0.61 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.35 1dgg n ALA 418 N -2.45 2.64 -1.60 5.18 0.00 -0.48 -4.93 120.51 118.88 1dgg n ALA 418 Ca 0.08 -0.25 -0.40 0.00 0.00 0.00 0.00 53.44 52.87 1dgg n ALA 418 Cb 0.60 -1.38 0.03 0.00 0.00 0.00 0.00 19.45 18.70 1dgg n ALA 418 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1dgg n LEU 419 N -0.64 2.78 -4.86 0.00 4.77 -0.13 -4.89 117.00 114.04 1dgg n LEU 419 Ca 0.20 0.93 -0.31 0.00 -0.03 0.00 0.00 56.01 56.81 1dgg n LEU 419 Cb 0.16 -1.35 0.01 0.00 -2.33 0.00 0.00 43.42 39.92 1dgg n LEU 419 CO 0.16 -1.75 0.72 -1.61 -1.33 0.00 0.00 177.39 173.58 1dgg s GLU 420 N -2.26 3.53 -0.08 3.23 8.01 -1.26 -5.02 118.70 124.86 1dgg s GLU 420 Ca 0.68 0.78 -0.30 0.00 0.01 0.00 0.00 54.97 56.14 1dgg s GLU 420 Cb -0.50 -2.07 -0.03 0.00 -4.31 0.00 0.00 34.13 27.22 1dgg s GLU 420 CO 0.54 -0.62 1.22 -1.58 0.01 0.00 0.00 175.26 174.82 1dgg s HIS 421 N -3.15 3.10 -0.15 1.61 5.65 -1.26 -5.03 115.29 116.06 1dgg s HIS 421 Ca 0.55 1.15 -0.12 0.00 0.25 0.00 0.00 55.06 56.90 1dgg s HIS 421 Cb -0.11 -3.45 -0.05 0.00 -1.18 0.00 0.00 32.58 27.79 1dgg s HIS 421 CO 0.53 -1.44 0.23 -1.54 -0.65 0.00 0.00 174.74 171.88 1dgg s SER 422 N 1.61 6.39 0.09 9.88 1.04 -1.26 -5.10 113.70 126.35 1dgg s SER 422 Ca 0.56 0.45 0.08 0.00 0.48 0.00 0.00 55.95 57.52 1dgg s SER 422 Cb -0.24 -2.14 -0.03 0.00 0.10 0.00 0.00 66.02 63.70 1dgg s SER 422 CO 0.20 0.19 -0.20 -0.63 0.98 0.00 0.00 173.24 173.78 1dgg s ILE 423 N 0.09 1.64 -0.23 -1.02 1.01 -1.26 -5.12 121.20 116.30 1dgg s ILE 423 Ca 0.14 -1.49 -0.15 0.00 0.00 0.00 0.00 60.65 59.15 1dgg s ILE 423 Cb -0.12 -1.49 -0.04 0.00 0.01 0.00 0.00 42.46 40.81 1dgg s ILE 423 CO 0.03 -0.06 0.38 -1.58 0.00 0.00 0.00 174.94 173.71 1dgg s GLN 424 N -1.83 4.10 -0.08 2.79 -0.44 -1.26 -5.06 119.66 117.87 1dgg s GLN 424 Ca 0.05 0.12 0.02 0.00 -2.50 0.00 0.00 55.36 53.05 1dgg s GLN 424 Cb -0.10 -3.59 -0.03 0.00 -1.64 0.00 0.00 33.01 27.66 1dgg s GLN 424 CO 0.04 -0.15 -0.11 0.71 0.50 0.00 0.00 175.29 176.28 1dgg s TYR 425 N 1.66 2.82 0.11 1.67 2.02 -1.26 -5.12 117.35 119.24 1dgg s TYR 425 Ca 0.17 -0.20 0.09 0.00 -0.37 0.00 0.00 57.07 56.76 1dgg s TYR 425 Cb -0.15 -1.72 -0.04 0.00 -0.40 0.00 0.00 41.96 39.65 1dgg s TYR 425 CO 0.09 0.14 -0.20 -1.12 -1.57 0.00 0.00 175.55 172.88 1dgg s SER 426 N -0.48 3.72 0.00 2.29 0.01 -1.26 -5.07 113.70 112.91 1dgg s SER 426 Ca 0.06 -0.59 0.00 0.00 1.31 0.00 0.00 55.95 56.73 1dgg s SER 426 Cb -0.12 -0.47 0.00 0.00 0.21 0.00 0.00 66.02 65.64 1dgg s SER 426 CO 0.02 0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.47 1dgg n GLY 427 N 0.94 3.52 3.80 3.44 0.00 -1.26 -5.09 105.19 110.54 1dgg n GLY 427 Ca -0.16 -1.82 -0.32 0.00 0.00 0.00 0.00 46.02 43.72 1dgg n GLY 427 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dgg s GLU 428 N -2.74 3.04 -0.59 1.61 2.02 -1.26 -4.98 118.70 115.79 1dgg s GLU 428 Ca 0.00 1.13 -0.20 0.00 0.02 0.00 0.00 54.97 55.91 1dgg s GLU 428 Cb 0.00 -2.00 0.08 0.00 0.10 0.00 0.00 34.13 32.32 1dgg s GLU 428 CO 0.00 -1.03 0.78 0.08 0.02 0.00 0.00 175.26 175.11 1dgg s VAL 429 N -2.70 4.67 0.34 2.63 1.01 -1.26 -4.96 120.40 120.13 1dgg s VAL 429 Ca 0.62 -0.67 -0.17 0.00 0.00 0.00 0.00 61.98 61.76 1dgg s VAL 429 Cb -0.16 -4.52 0.06 0.00 0.00 0.00 0.00 36.38 31.77 1dgg s VAL 429 CO 0.46 -1.17 0.86 -2.11 0.00 0.00 0.00 175.10 173.14 1dgg n ARG 430 N 6.75 1.02 -2.89 2.72 1.85 -1.26 -5.11 116.66 119.73 1dgg n ARG 430 Ca -0.07 -2.05 -0.43 0.00 -1.00 0.00 0.00 57.85 54.31 1dgg n ARG 430 Cb 0.44 2.60 -0.05 0.00 -1.05 0.00 0.00 32.46 34.40 1dgg n ARG 430 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 1dgg s ARG 431 N -2.08 3.41 -0.23 2.89 0.52 -1.26 -5.02 118.95 117.18 1dgg s ARG 431 Ca 0.18 -0.10 -0.18 0.00 -0.52 0.00 0.00 55.73 55.11 1dgg s ARG 431 Cb -0.04 -3.97 -0.03 0.00 0.52 0.00 0.00 34.95 31.42 1dgg s ARG 431 CO 0.10 -1.25 0.51 -0.06 0.02 0.00 0.00 175.30 174.62 1dgg s PHE 432 N 3.58 3.32 0.28 -0.53 0.08 -1.26 -5.05 117.98 118.40 1dgg s PHE 432 Ca 0.32 0.69 -0.29 0.00 0.12 0.00 0.00 56.93 57.76 1dgg s PHE 432 Cb -0.12 -2.68 -0.10 0.00 -0.57 0.00 0.00 43.02 39.55 1dgg s PHE 432 CO 0.22 -0.18 1.29 1.21 -0.10 0.00 0.00 175.22 177.67 1dgg s ASN 433 N 1.34 6.86 -0.01 1.36 2.47 -1.26 -4.91 114.94 120.78 1dgg s ASN 433 Ca 0.22 2.55 0.02 0.00 0.42 0.00 0.00 52.86 56.07 1dgg s ASN 433 Cb -0.15 -2.63 0.03 0.00 -1.45 0.00 0.00 41.25 37.05 1dgg s ASN 433 CO 0.09 -0.50 0.79 0.35 -3.72 0.00 0.00 177.10 174.12 1dgg n THR 434 N 1.56 0.44 0.25 -5.21 -2.24 -1.26 -4.82 114.28 102.99 1dgg n THR 434 Ca 0.02 -0.48 0.10 0.00 -2.27 0.00 0.00 64.05 61.42 1dgg n THR 434 Cb 0.42 0.64 0.64 0.00 -2.10 0.00 0.00 70.33 69.94 1dgg n THR 434 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1dgg h ALA 435 N 0.00 1.45 -0.57 6.98 0.00 -2.00 -2.93 119.26 122.18 1dgg h ALA 435 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1dgg h ALA 435 Cb 0.96 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1dgg h ALA 435 CO 0.00 0.18 0.00 0.09 0.00 0.00 0.00 179.25 179.52 1dgg n ASN 436 N -3.91 3.54 -4.73 0.00 5.03 -1.26 -4.77 115.26 109.16 1dgg n ASN 436 Ca -0.02 -1.99 -0.36 0.00 0.87 0.00 0.00 54.58 53.08 1dgg n ASN 436 Cb 0.24 -0.38 0.07 0.00 -1.02 0.00 0.00 39.78 38.69 1dgg n ASN 436 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1dgg s ASP 437 N -1.18 4.53 -0.73 6.41 -0.00 -1.11 -4.66 116.67 119.92 1dgg s ASP 437 Ca 0.43 2.56 -0.38 0.00 -0.00 0.00 0.00 52.55 55.16 1dgg s ASP 437 Cb 0.23 -2.61 -0.20 0.00 -0.00 0.00 0.00 42.92 40.34 1dgg s ASP 437 CO 0.31 -2.05 2.41 -0.67 -0.00 0.00 0.00 175.17 175.17 1dgg n ASP 438 N -2.08 0.58 -1.07 0.27 2.03 -1.26 -4.78 116.55 110.24 1dgg n ASP 438 Ca 0.15 0.43 0.12 0.00 0.52 0.00 0.00 54.79 56.01 1dgg n ASP 438 Cb 0.49 -0.92 0.22 0.00 -0.72 0.00 0.00 41.12 40.19 1dgg n ASP 438 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1dgg n ASN 439 N 9.04 3.22 0.00 1.67 3.02 -1.26 -4.69 115.26 126.26 1dgg n ASN 439 Ca 0.60 -1.96 0.00 0.00 -0.03 0.00 0.00 54.58 53.18 1dgg n ASN 439 Cb 0.00 -0.21 0.00 0.00 -0.61 0.00 0.00 39.78 38.97 1dgg n ASN 439 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1dgg n VAL 440 N 1.35 0.00 -0.32 2.41 0.24 -1.26 -4.60 118.33 116.16 1dgg n VAL 440 Ca 0.19 0.00 -0.08 0.00 -2.04 0.00 0.00 64.34 62.40 1dgg n VAL 440 Cb 0.58 -0.33 -0.08 0.00 -1.47 0.00 0.00 33.84 32.55 1dgg n VAL 440 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1dgg n THR 441 N -1.90 -0.52 0.12 3.34 -1.04 -1.26 0.14 114.28 113.17 1dgg n THR 441 Ca 0.00 2.07 0.01 0.00 -2.04 0.00 0.00 64.05 64.09 1dgg n THR 441 Cb 0.27 -2.58 0.33 0.00 -1.82 0.00 0.00 70.33 66.53 1dgg n THR 441 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 1dgg h GLN 442 N 0.00 0.19 -0.56 -2.82 4.20 -1.91 -2.23 115.11 111.98 1dgg h GLN 442 Ca 0.12 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.71 1dgg h GLN 442 Cb 0.31 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 1dgg h GLN 442 CO -0.71 0.45 0.11 0.28 -0.67 0.00 0.00 178.83 178.29 1dgg h VAL 443 N 0.18 1.25 -0.59 -0.54 2.07 -0.99 -2.20 116.25 115.42 1dgg h VAL 443 Ca 0.03 -0.93 -0.04 0.00 0.82 0.00 0.00 66.70 66.58 1dgg h VAL 443 Cb 0.57 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 31.10 1dgg h VAL 443 CO 0.04 0.34 0.21 -0.09 0.02 0.00 0.00 177.57 178.09 1dgg h ARG 444 N 0.81 0.91 -0.57 1.57 2.43 0.21 -1.99 114.38 117.75 1dgg h ARG 444 Ca 0.17 -0.18 0.04 0.00 -0.81 0.00 0.00 59.98 59.19 1dgg h ARG 444 Cb 0.38 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.75 1dgg h ARG 444 CO 0.01 0.80 0.33 0.00 -1.51 0.00 0.00 179.97 179.59 1dgg h ALA 445 N 1.07 0.74 -0.22 2.80 0.00 -1.23 0.11 119.26 122.53 1dgg h ALA 445 Ca 0.19 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.12 1dgg h ALA 445 Cb 0.25 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1dgg h ALA 445 CO -0.01 0.02 0.10 0.35 0.00 0.00 0.00 179.25 179.71 1dgg h PHE 446 N 0.64 0.18 -0.22 0.00 3.57 -1.11 1.08 116.94 121.08 1dgg h PHE 446 Ca 0.24 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.73 1dgg h PHE 446 Cb 0.08 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 1dgg h PHE 446 CO -0.07 0.10 0.06 -0.92 -2.23 0.00 0.00 178.31 175.25 1dgg h TYR 447 N 0.21 0.36 0.10 0.41 5.03 -0.87 -2.21 116.97 120.00 1dgg h TYR 447 Ca 0.09 -0.04 -0.16 0.00 2.58 0.00 0.00 58.73 61.20 1dgg h TYR 447 Cb 0.03 -0.10 0.01 0.00 1.55 0.00 0.00 36.73 38.22 1dgg h TYR 447 CO -0.10 0.44 -0.76 0.28 -1.32 0.00 0.00 178.16 176.70 1dgg h VAL 448 N 0.18 1.46 0.00 1.81 2.07 -0.63 -3.37 116.25 117.78 1dgg h VAL 448 Ca 0.07 -2.45 -0.32 0.00 0.82 0.00 0.00 66.70 64.82 1dgg h VAL 448 Cb 0.26 3.11 -0.06 0.00 -1.52 0.00 0.00 31.29 33.08 1dgg h VAL 448 CO -0.00 0.67 -1.94 0.59 0.02 0.00 0.00 177.57 176.91 1dgg n ASN 449 N -4.22 0.66 -0.01 0.57 5.03 0.37 -4.60 115.26 113.06 1dgg n ASN 449 Ca -0.16 0.27 -0.20 0.00 0.87 0.00 0.00 54.58 55.36 1dgg n ASN 449 Cb 0.75 0.24 -0.14 0.00 -1.02 0.00 0.00 39.78 39.61 1dgg n ASN 449 CO 0.00 0.00 0.00 0.58 -1.83 0.00 0.00 177.26 176.01 1dgg h VAL 450 N 0.00 1.21 -3.25 2.41 2.07 -1.26 -3.48 116.25 113.96 1dgg h VAL 450 Ca -0.38 -2.39 -0.52 0.00 0.82 0.00 0.00 66.70 64.23 1dgg h VAL 450 Cb 2.09 2.83 -0.01 0.00 -1.52 0.00 0.00 31.29 34.68 1dgg h VAL 450 CO 0.06 0.64 -0.14 -0.76 0.02 0.00 0.00 177.57 177.40 1dgg s LEU 451 N -7.75 4.07 0.59 2.57 1.43 -1.00 -5.07 118.68 113.52 1dgg s LEU 451 Ca -0.20 0.75 0.09 0.00 -1.03 0.00 0.00 54.13 53.75 1dgg s LEU 451 Cb 0.03 -3.56 0.09 0.00 0.03 0.00 0.00 46.19 42.78 1dgg s LEU 451 CO 0.74 -0.18 0.81 0.54 0.23 0.00 0.00 176.35 178.50 1dgg s ASN 452 N -3.02 5.05 0.15 2.29 2.20 -1.26 -4.76 114.94 115.58 1dgg s ASN 452 Ca 0.44 -0.83 -0.17 0.00 -0.94 0.00 0.00 52.86 51.36 1dgg s ASN 452 Cb -0.11 0.31 0.03 0.00 -2.00 0.00 0.00 41.25 39.48 1dgg s ASN 452 CO 0.29 -1.38 1.74 -0.33 -2.94 0.00 0.00 177.10 174.47 1dgg h GLU 453 N 0.13 0.20 0.00 3.55 4.39 -1.98 -0.81 114.58 120.06 1dgg h GLU 453 Ca -0.30 -0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.34 1dgg h GLU 453 Cb 1.29 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.89 1dgg h GLU 453 CO 0.41 0.13 -0.21 1.05 -1.16 0.00 0.00 179.01 179.22 1dgg h GLU 454 N 0.20 0.00 -0.09 2.33 4.11 -1.99 -0.85 114.58 118.29 1dgg h GLU 454 Ca 0.14 0.00 -0.23 0.00 0.07 0.00 0.00 59.36 59.34 1dgg h GLU 454 Cb 0.13 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.39 1dgg h GLU 454 CO -0.16 0.21 -0.86 1.96 0.07 0.00 0.00 179.01 180.23 1dgg h GLN 455 N 0.00 0.70 -0.74 1.06 4.20 -1.76 -2.51 115.11 116.06 1dgg h GLN 455 Ca -0.00 -0.63 -0.06 0.00 0.06 0.00 0.00 58.65 58.02 1dgg h GLN 455 Cb 0.42 0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.32 1dgg h GLN 455 CO 0.03 1.23 0.22 0.00 -0.67 0.00 0.00 178.83 179.65 1dgg h ARG 456 N 0.45 1.16 -0.08 1.46 3.08 -0.64 -0.91 114.38 118.90 1dgg h ARG 456 Ca -0.07 -0.25 0.01 0.00 0.07 0.00 0.00 59.98 59.74 1dgg h ARG 456 Cb 1.49 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.36 1dgg h ARG 456 CO 0.17 0.99 -0.00 -0.22 -1.07 0.00 0.00 179.97 179.84 1dgg h LYS 457 N 1.11 0.02 -0.60 0.04 3.64 -1.11 -1.91 116.57 117.77 1dgg h LYS 457 Ca 0.24 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.60 1dgg h LYS 457 Cb 0.32 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.11 1dgg h LYS 457 CO -0.01 0.02 0.29 0.00 -2.27 0.00 0.00 179.45 177.48 1dgg h ARG 458 N 0.02 0.85 -0.24 1.90 3.08 -1.18 -0.93 114.38 117.89 1dgg h ARG 458 Ca 0.04 -0.12 0.06 0.00 0.07 0.00 0.00 59.98 60.02 1dgg h ARG 458 Cb 0.04 -0.16 -0.06 0.00 0.08 0.00 0.00 29.97 29.88 1dgg h ARG 458 CO -0.07 0.68 -0.15 1.25 -1.07 0.00 0.00 179.97 180.62 1dgg h LEU 459 N 0.81 -0.49 -0.23 3.04 5.85 -0.90 0.19 115.31 123.58 1dgg h LEU 459 Ca 0.21 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 59.03 1dgg h LEU 459 Cb 0.11 0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 1dgg h LEU 459 CO -0.03 -0.19 0.12 0.00 -0.34 0.00 0.00 178.44 178.00 1dgg h GLU 461 N 0.25 0.94 -0.36 0.00 5.08 -0.69 0.31 114.58 120.10 1dgg h GLU 461 Ca 0.08 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 1dgg h GLU 461 Cb 0.10 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1dgg h GLU 461 CO -0.01 0.62 -0.10 -0.91 -1.00 0.00 0.00 179.01 177.62 1dgg h ASN 462 N 0.97 0.71 0.42 1.42 2.35 -0.32 0.35 115.58 121.47 1dgg h ASN 462 Ca 0.38 -0.37 -0.02 0.00 -0.55 0.00 0.00 56.30 55.74 1dgg h ASN 462 Cb 0.19 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1dgg h ASN 462 CO -0.18 0.91 -0.20 0.40 -1.65 0.00 0.00 177.43 176.71 1dgg h ILE 463 N 0.50 0.56 -0.94 2.81 2.04 -0.36 -3.09 117.51 119.02 1dgg h ILE 463 Ca 0.09 -0.36 0.06 0.00 1.00 0.00 0.00 64.86 65.65 1dgg h ILE 463 Cb 0.61 0.73 -0.06 0.00 -0.74 0.00 0.00 36.82 37.35 1dgg h ILE 463 CO 0.04 0.06 0.61 0.00 0.00 0.00 0.00 178.15 178.86 1dgg h ALA 464 N -0.30 1.46 -0.17 1.87 0.00 -0.43 0.73 119.26 122.42 1dgg h ALA 464 Ca -0.06 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.87 1dgg h ALA 464 Cb 0.53 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1dgg h ALA 464 CO 0.09 0.41 0.13 0.78 0.00 0.00 0.00 179.25 180.66 1dgg h GLY 465 N 1.10 0.00 0.10 0.00 0.00 -0.86 -0.85 103.07 102.56 1dgg h GLY 465 Ca 0.40 0.00 -0.39 0.00 0.00 0.00 0.00 47.33 47.35 1dgg h GLY 465 CO -0.15 0.00 -2.40 1.57 0.00 0.00 0.00 176.54 175.56 1dgg n HIS 466 N -4.35 0.20 0.23 5.60 -0.00 -0.66 -4.43 115.22 111.80 1dgg n HIS 466 Ca 0.01 0.04 0.06 0.00 -0.00 0.00 0.00 57.72 57.83 1dgg n HIS 466 Cb 0.26 -1.03 0.52 0.00 -0.00 0.00 0.00 29.99 29.74 1dgg n HIS 466 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 1dgg h LEU 467 N 0.01 0.00 -1.36 0.27 5.85 -0.74 -3.04 115.31 116.30 1dgg h LEU 467 Ca -0.55 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.17 1dgg h LEU 467 Cb 1.93 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.96 1dgg h LEU 467 CO -0.06 0.20 0.11 0.07 -0.34 0.00 0.00 178.44 178.42 1dgg h LYS 468 N 0.00 0.00 -0.01 1.25 5.09 -1.37 0.28 116.57 121.81 1dgg h LYS 468 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 1dgg h LYS 468 Cb 0.37 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.70 1dgg h LYS 468 CO 0.03 0.00 -0.26 -0.25 -2.09 0.00 0.00 179.45 176.88 1dgg n ASP 469 N -2.26 1.53 -4.91 7.07 9.92 -1.15 -4.90 116.55 121.84 1dgg n ASP 469 Ca -0.01 -1.24 -0.27 0.00 -0.53 0.00 0.00 54.79 52.73 1dgg n ASP 469 Cb 0.14 0.20 -0.01 0.00 -0.64 0.00 0.00 41.12 40.81 1dgg n ASP 469 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1dgg s ALA 470 N -2.38 3.47 0.77 2.24 0.00 0.09 -4.71 121.76 121.24 1dgg s ALA 470 Ca 0.25 -0.55 -0.15 0.00 0.00 0.00 0.00 51.96 51.52 1dgg s ALA 470 Cb 0.19 -2.49 0.06 0.00 0.00 0.00 0.00 23.12 20.88 1dgg s ALA 470 CO 0.49 -0.20 1.22 1.04 0.00 0.00 0.00 175.76 178.31 1dgg n GLN 471 N -1.95 0.43 -0.25 0.00 6.02 -1.26 -4.71 117.38 115.66 1dgg n GLN 471 Ca -0.00 0.22 0.01 0.00 -0.01 0.00 0.00 57.00 57.22 1dgg n GLN 471 Cb 0.55 -2.46 0.13 0.00 1.02 0.00 0.00 30.24 29.49 1dgg n GLN 471 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1dgg h ILE 472 N -0.52 0.86 -0.03 5.09 1.08 -1.96 -0.22 117.51 121.81 1dgg h ILE 472 Ca -0.48 -0.21 -0.03 0.00 -0.39 0.00 0.00 64.86 63.75 1dgg h ILE 472 Cb 1.31 0.19 -0.01 0.00 -3.07 0.00 0.00 36.82 35.25 1dgg h ILE 472 CO 0.48 0.11 -0.13 2.19 -0.69 0.00 0.00 178.15 180.11 1dgg h PHE 473 N 0.61 0.04 -0.05 1.37 -5.15 -2.00 0.23 116.94 112.00 1dgg h PHE 473 Ca 0.35 -0.00 -0.21 0.00 -0.20 0.00 0.00 57.97 57.91 1dgg h PHE 473 Cb 0.35 -0.01 0.01 0.00 0.22 0.00 0.00 35.95 36.53 1dgg h PHE 473 CO -0.10 0.18 -0.79 0.82 -2.00 0.00 0.00 178.31 176.42 1dgg h ILE 474 N 0.04 1.33 -0.76 0.88 2.04 -1.59 -2.82 117.51 116.64 1dgg h ILE 474 Ca 0.01 -2.07 0.05 0.00 1.00 0.00 0.00 64.86 63.85 1dgg h ILE 474 Cb 0.26 2.32 -0.06 0.00 -0.74 0.00 0.00 36.82 38.61 1dgg h ILE 474 CO 0.02 0.63 0.46 1.56 0.00 0.00 0.00 178.15 180.82 1dgg h GLN 475 N 0.25 0.83 0.20 2.37 4.20 -0.02 -0.69 115.11 122.25 1dgg h GLN 475 Ca -0.08 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 1dgg h GLN 475 Cb 1.45 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 29.04 1dgg h GLN 475 CO 0.16 0.55 -0.10 0.87 -0.67 0.00 0.00 178.83 179.64 1dgg h LYS 476 N 0.85 -0.26 -0.80 1.46 1.79 -0.98 0.12 116.57 118.76 1dgg h LYS 476 Ca 0.33 0.02 0.03 0.00 -2.18 0.00 0.00 60.65 58.84 1dgg h LYS 476 Cb 0.14 0.06 -0.05 0.00 -1.58 0.00 0.00 32.23 30.80 1dgg h LYS 476 CO -0.16 -0.12 0.51 -0.22 -1.08 0.00 0.00 179.45 178.39 1dgg h LYS 477 N -0.34 0.98 -0.32 3.15 1.63 -1.26 0.30 116.57 120.70 1dgg h LYS 477 Ca -0.03 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 59.71 1dgg h LYS 477 Cb 0.26 -0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 31.65 1dgg h LYS 477 CO 0.05 0.65 0.20 0.00 -3.45 0.00 0.00 179.45 176.89 1dgg h ALA 478 N 1.33 0.41 -0.25 5.00 0.00 -0.91 -1.35 119.26 123.48 1dgg h ALA 478 Ca 0.31 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.09 1dgg h ALA 478 Cb -0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1dgg h ALA 478 CO -0.10 -0.09 -0.23 0.28 0.00 0.00 0.00 179.25 179.11 1dgg h VAL 479 N 0.42 1.26 -0.79 0.00 2.07 -0.13 -2.13 116.25 116.94 1dgg h VAL 479 Ca 0.12 -1.21 -0.03 0.00 0.82 0.00 0.00 66.70 66.40 1dgg h VAL 479 Cb 0.01 1.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 1dgg h VAL 479 CO -0.02 0.39 0.39 0.50 0.02 0.00 0.00 177.57 178.84 1dgg h LYS 480 N 0.42 1.13 -0.20 1.57 3.64 0.19 0.53 116.57 123.86 1dgg h LYS 480 Ca 0.07 -0.16 -0.05 0.00 -1.27 0.00 0.00 60.65 59.24 1dgg h LYS 480 Cb 0.63 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1dgg h LYS 480 CO 0.04 0.86 -0.07 -0.91 -2.27 0.00 0.00 179.45 177.10 1dgg h ASN 481 N 1.12 0.41 -0.80 4.20 2.35 -0.88 -2.48 115.58 119.51 1dgg h ASN 481 Ca 0.27 -0.39 -0.05 0.00 -0.55 0.00 0.00 56.30 55.59 1dgg h ASN 481 Cb 0.10 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 38.32 1dgg h ASN 481 CO -0.04 0.71 0.32 -0.26 -1.65 0.00 0.00 177.43 176.51 1dgg h PHE 482 N 0.11 1.21 -0.37 1.19 0.04 -1.12 -2.09 116.94 115.91 1dgg h PHE 482 Ca 0.05 -0.09 -0.01 0.00 2.80 0.00 0.00 57.97 60.72 1dgg h PHE 482 Cb 0.55 -0.36 -0.02 0.00 2.20 0.00 0.00 35.95 38.31 1dgg h PHE 482 CO 0.06 0.92 0.19 1.15 -0.60 0.00 0.00 178.31 180.03 1dgg h THR 483 N 1.16 1.12 0.00 -1.55 2.02 -0.84 -0.31 112.91 114.51 1dgg h THR 483 Ca 0.27 -0.32 -0.06 0.00 0.77 0.00 0.00 66.41 67.07 1dgg h THR 483 Cb 0.22 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1dgg h THR 483 CO -0.02 0.14 -0.27 -0.33 0.37 0.00 0.00 175.52 175.41 1dgg h GLU 484 N 0.51 0.00 -0.03 6.66 5.08 -0.91 -2.39 114.58 123.51 1dgg h GLU 484 Ca 0.13 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.45 1dgg h GLU 484 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1dgg h GLU 484 CO -0.02 0.27 -0.16 0.28 -1.00 0.00 0.00 179.01 178.38 1dgg h VAL 485 N 0.00 1.48 -1.56 3.13 2.07 -0.77 -3.46 116.25 117.14 1dgg h VAL 485 Ca -0.00 -1.64 0.11 0.00 0.82 0.00 0.00 66.70 65.98 1dgg h VAL 485 Cb 0.74 2.46 -0.23 0.00 -1.52 0.00 0.00 31.29 32.74 1dgg h VAL 485 CO 0.03 0.45 0.14 -2.28 0.02 0.00 0.00 177.57 175.94 1dgg s HIS 486 N -3.60 -0.88 0.49 1.57 2.46 -0.58 -4.50 115.29 110.25 1dgg s HIS 486 Ca -0.16 1.62 0.29 0.00 0.47 0.00 0.00 55.06 57.28 1dgg s HIS 486 Cb 0.02 0.53 1.38 0.00 -0.13 0.00 0.00 32.58 34.38 1dgg s HIS 486 CO 0.73 -0.44 1.83 -1.00 -2.47 0.00 0.00 174.74 173.39 1dgg h PRO 487 N 7.16 0.13 0.00 2.88 0.13 -1.69 0.56 132.00 141.17 1dgg h PRO 487 Ca -0.22 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1dgg h PRO 487 Cb 1.15 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1dgg h PRO 487 CO 0.13 0.09 -0.26 -0.44 -0.23 0.00 0.00 178.00 177.28 1dgg h ASP 488 N 0.13 0.00 0.21 1.44 3.32 -1.92 -2.74 116.42 116.86 1dgg h ASP 488 Ca 0.52 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.54 1dgg h ASP 488 Cb 1.80 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.35 1dgg h ASP 488 CO -0.09 0.01 -0.10 0.22 -1.72 0.00 0.00 179.24 177.55 1dgg h TYR 489 N 0.00 -0.26 -0.55 4.55 -0.00 -1.19 -2.88 116.97 116.64 1dgg h TYR 489 Ca 0.00 -0.01 0.01 0.00 -0.00 0.00 0.00 58.73 58.73 1dgg h TYR 489 Cb 0.95 0.09 -0.03 0.00 -0.00 0.00 0.00 36.73 37.74 1dgg h TYR 489 CO 0.00 0.09 0.36 0.78 -0.00 0.00 0.00 178.16 179.39 1dgg h GLY 490 N -0.95 0.77 1.02 1.82 0.00 -1.54 -2.63 103.07 101.56 1dgg h GLY 490 Ca -0.03 -0.28 -0.04 0.00 0.00 0.00 0.00 47.33 46.98 1dgg h GLY 490 CO 0.05 0.27 0.29 1.48 0.00 0.00 0.00 176.54 178.63 1dgg h SER 491 N 0.73 0.98 -0.56 0.19 4.64 -1.62 -0.85 113.55 117.06 1dgg h SER 491 Ca 0.20 -0.17 -0.02 0.00 -0.47 0.00 0.00 61.79 61.34 1dgg h SER 491 Cb -0.07 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 61.75 1dgg h SER 491 CO -0.05 0.87 0.29 -0.74 -0.87 0.00 0.00 176.83 176.33 1dgg h HIS 492 N 1.02 0.79 -0.27 4.77 6.17 -1.34 0.28 115.15 126.56 1dgg h HIS 492 Ca 0.24 -0.03 -0.03 0.00 0.71 0.00 0.00 60.37 61.26 1dgg h HIS 492 Cb 0.20 -0.25 -0.01 0.00 2.52 0.00 0.00 27.41 29.87 1dgg h HIS 492 CO 0.01 0.59 0.04 0.82 0.71 0.00 0.00 177.93 180.10 1dgg h ILE 493 N 0.76 1.23 -0.73 6.26 2.04 -1.27 -2.54 117.51 123.26 1dgg h ILE 493 Ca 0.20 -0.81 0.03 0.00 1.00 0.00 0.00 64.86 65.28 1dgg h ILE 493 Cb 0.08 1.24 -0.04 0.00 -0.74 0.00 0.00 36.82 37.36 1dgg h ILE 493 CO -0.03 0.26 0.48 -0.61 0.00 0.00 0.00 178.15 178.25 1dgg h GLN 494 N 0.27 0.88 -0.32 2.37 5.75 -0.88 0.21 115.11 123.39 1dgg h GLN 494 Ca 0.08 -0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.51 1dgg h GLN 494 Cb 0.35 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 28.69 1dgg h GLN 494 CO 0.01 0.58 0.13 0.00 -2.65 0.00 0.00 178.83 176.90 1dgg h ALA 495 N 1.57 0.42 -0.55 3.38 0.00 -0.74 -0.52 119.26 122.82 1dgg h ALA 495 Ca 0.29 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 1dgg h ALA 495 Cb 0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1dgg h ALA 495 CO -0.08 0.02 -0.03 -0.07 0.00 0.00 0.00 179.25 179.09 1dgg h LEU 496 N 0.37 0.97 -0.95 0.00 3.38 -0.88 -2.53 115.31 115.67 1dgg h LEU 496 Ca 0.11 -0.32 0.04 0.00 0.09 0.00 0.00 57.88 57.79 1dgg h LEU 496 Cb 0.19 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.62 1dgg h LEU 496 CO -0.01 1.06 0.62 -0.07 0.09 0.00 0.00 178.44 180.13 1dgg h LEU 497 N 0.86 1.03 -0.60 1.67 3.38 -0.44 -2.36 115.31 118.86 1dgg h LEU 497 Ca 0.15 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.17 1dgg h LEU 497 Cb 0.58 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 1dgg h LEU 497 CO 0.03 0.70 0.31 0.44 0.09 0.00 0.00 178.44 180.02 1dgg h ASP 498 N 1.20 0.44 0.16 -0.43 3.32 -0.66 -1.83 116.42 118.62 1dgg h ASP 498 Ca 0.38 0.04 -0.28 0.00 0.02 0.00 0.00 57.03 57.19 1dgg h ASP 498 Cb 0.01 -0.05 0.02 0.00 0.22 0.00 0.00 39.33 39.53 1dgg h ASP 498 CO -0.12 0.29 -1.15 0.07 -1.72 0.00 0.00 179.24 176.61 1dgg h LYS 499 N 0.58 0.59 -0.46 3.56 2.10 -1.34 -3.11 116.57 118.50 1dgg h LYS 499 Ca 0.27 -0.73 0.05 0.00 -2.00 0.00 0.00 60.65 58.24 1dgg h LYS 499 Cb 0.19 0.23 -0.03 0.00 -0.90 0.00 0.00 32.23 31.72 1dgg h LYS 499 CO -0.19 1.31 0.31 1.88 -2.00 0.00 0.00 179.45 180.76 1dgg h TYR 500 N 0.29 0.42 -0.01 0.07 0.05 -1.33 -3.52 116.97 112.95 1dgg h TYR 500 Ca -0.15 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.64 1dgg h TYR 500 Cb 1.81 -0.14 0.00 0.00 1.01 0.00 0.00 36.73 39.41 1dgg h TYR 500 CO 0.10 0.24 0.00 0.09 -1.05 0.00 0.00 178.16 177.54