#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 4.91 0.25 0.55 -4.77 -1.26 -4.87 116.67 111.48 1dgg s ASP 6 Ca 0.00 1.56 -0.04 0.00 -3.30 0.00 0.00 52.55 50.77 1dgg s ASP 6 Cb 0.00 -2.36 0.40 0.00 -1.09 0.00 0.00 42.92 39.87 1dgg s ASP 6 CO 0.00 -1.74 1.83 -0.65 0.70 0.00 0.00 175.17 175.31 1dgg h PRO 7 N -0.92 0.86 -0.09 2.11 0.11 -1.97 -2.40 132.00 129.70 1dgg h PRO 7 Ca -0.45 -0.05 0.03 0.00 0.11 0.00 0.00 66.00 65.64 1dgg h PRO 7 Cb 1.23 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 1dgg h PRO 7 CO 0.56 0.57 -0.07 0.00 -0.21 0.00 0.00 178.00 178.85 1dgg h ALA 8 N 1.45 0.01 -0.68 -0.75 0.00 -1.93 -2.57 119.26 114.80 1dgg h ALA 8 Ca 0.41 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.41 1dgg h ALA 8 Cb 0.32 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 1dgg h ALA 8 CO -0.23 -0.53 0.39 0.77 0.00 0.00 0.00 179.25 179.65 1dgg h SER 9 N -0.08 0.59 -0.01 0.00 0.02 -1.85 -2.45 113.55 109.78 1dgg h SER 9 Ca 0.06 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1dgg h SER 9 Cb 0.17 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.62 1dgg h SER 9 CO -0.15 0.39 0.00 0.47 -1.14 0.00 0.00 176.83 176.40 1dgg n ASP 10 N -4.76 0.49 -0.13 3.07 8.00 -0.94 -4.43 116.55 117.85 1dgg n ASP 10 Ca 0.08 -2.00 -0.10 0.00 0.71 0.00 0.00 54.79 53.48 1dgg n ASP 10 Cb 0.16 -0.23 -0.05 0.00 -0.02 0.00 0.00 41.12 40.98 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 0.04 -0.32 -0.51 -1.24 -0.00 -1.20 0.12 115.11 112.00 1dgg h GLN 11 Ca 0.00 0.02 -0.07 0.00 -0.00 0.00 0.00 58.65 58.60 1dgg h GLN 11 Cb 0.24 0.07 -0.02 0.00 0.00 0.00 0.00 27.48 27.77 1dgg h GLN 11 CO 0.00 -0.21 0.05 0.52 0.00 0.00 0.00 178.83 179.19 1dgg h MET 12 N -0.33 0.86 -0.33 1.69 2.86 -1.86 -2.04 114.93 115.78 1dgg h MET 12 Ca 0.13 -0.25 0.05 0.00 -2.06 0.00 0.00 59.70 57.58 1dgg h MET 12 Cb 0.59 -0.09 -0.05 0.00 0.06 0.00 0.00 31.60 32.11 1dgg h MET 12 CO -0.58 0.87 0.03 1.96 1.06 0.00 0.00 176.91 180.25 1dgg h GLN 13 N 0.74 0.13 -0.50 1.72 1.08 -1.64 -0.19 115.11 116.45 1dgg h GLN 13 Ca 0.15 -0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.29 1dgg h GLN 13 Cb 0.45 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.83 1dgg h GLN 13 CO 0.02 0.09 0.11 0.45 -0.95 0.00 0.00 178.83 178.54 1dgg h HIS 14 N 0.13 0.78 -0.68 2.96 3.86 -0.71 -1.29 115.15 120.20 1dgg h HIS 14 Ca 0.16 -0.07 -0.05 0.00 -1.16 0.00 0.00 60.37 59.25 1dgg h HIS 14 Cb 0.20 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 28.42 1dgg h HIS 14 CO -0.21 0.67 0.23 2.35 0.86 0.00 0.00 177.93 181.83 1dgg h TRP 15 N 0.73 1.07 -0.05 2.45 7.01 -0.52 -2.11 115.95 124.53 1dgg h TRP 15 Ca 0.16 -0.10 -0.00 0.00 2.11 0.00 0.00 58.89 61.06 1dgg h TRP 15 Cb 0.29 -0.31 -0.00 0.00 -2.10 0.00 0.00 29.16 27.04 1dgg h TRP 15 CO 0.02 0.85 0.03 -0.22 -2.79 0.00 0.00 178.44 176.32 1dgg h LYS 16 N 0.98 0.08 -0.57 2.65 3.64 -0.59 -2.94 116.57 119.82 1dgg h LYS 16 Ca 0.22 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.60 1dgg h LYS 16 Cb 0.26 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.04 1dgg h LYS 16 CO -0.01 0.16 0.38 0.93 -2.27 0.00 0.00 179.45 178.64 1dgg h GLU 17 N -0.03 0.75 0.00 1.90 5.08 -1.07 -0.53 114.58 120.68 1dgg h GLU 17 Ca 0.02 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1dgg h GLU 17 Cb 0.11 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1dgg h GLU 17 CO -0.00 0.50 0.00 1.04 -1.00 0.00 0.00 179.01 179.54 1dgg n GLN 18 N -4.45 0.16 0.02 2.33 6.02 -0.81 -0.09 117.38 120.57 1dgg n GLN 18 Ca 0.05 0.43 0.12 0.00 -0.01 0.00 0.00 57.00 57.60 1dgg n GLN 18 Cb 0.05 -1.83 0.26 0.00 1.02 0.00 0.00 30.24 29.74 1dgg n GLN 18 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1dgg n ARG 19 N -2.13 0.11 0.00 -1.09 5.12 -0.22 -4.98 116.66 113.48 1dgg n ARG 19 Ca 0.02 0.03 0.00 0.00 -1.93 0.00 0.00 57.85 55.97 1dgg n ARG 19 Cb 0.19 -1.57 0.00 0.00 -1.16 0.00 0.00 32.46 29.92 1dgg n ARG 19 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1dgg n ALA 20 N -1.63 0.00 -2.55 7.54 0.00 0.88 -2.51 120.51 122.24 1dgg n ALA 20 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.07 1dgg n ALA 20 Cb 0.38 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.83 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 8.36 5.63 -3.46 0.00 0.00 -1.26 -4.95 120.51 124.83 1dgg n ALA 21 Ca 0.00 -4.49 -0.13 0.00 0.00 0.00 0.00 53.44 48.82 1dgg n ALA 21 Cb 0.00 -2.63 -0.13 0.00 0.00 0.00 0.00 19.45 16.69 1dgg n ALA 21 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1dgg s GLN 22 N -1.57 0.18 0.45 0.00 -2.07 -1.05 -5.14 119.66 110.47 1dgg s GLN 22 Ca 0.39 0.37 -0.24 0.00 -1.82 0.00 0.00 55.36 54.06 1dgg s GLN 22 Cb 0.11 -0.04 -0.09 0.00 -1.09 0.00 0.00 33.01 31.89 1dgg s GLN 22 CO 0.01 -0.11 1.16 1.17 -1.32 0.00 0.00 175.29 176.20 1dgg n LYS 23 N 3.70 1.61 -1.98 9.60 3.00 -1.26 -4.95 118.16 127.88 1dgg n LYS 23 Ca -0.20 0.58 -0.35 0.00 -0.00 0.00 0.00 58.31 58.34 1dgg n LYS 23 Cb 0.55 -2.27 0.03 0.00 0.00 0.00 0.00 35.03 33.34 1dgg n LYS 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1dgg s ALA 24 N -1.27 2.54 0.93 3.14 0.00 -1.26 -5.01 121.76 120.84 1dgg s ALA 24 Ca 0.64 0.80 -0.11 0.00 0.00 0.00 0.00 51.96 53.29 1dgg s ALA 24 Cb -0.50 -3.38 0.15 0.00 0.00 0.00 0.00 23.12 19.38 1dgg s ALA 24 CO 0.56 -1.11 1.10 -0.51 0.00 0.00 0.00 175.76 175.80 1dgg s ASP 25 N -1.97 2.98 0.12 0.00 -0.00 -1.26 -4.96 116.67 111.59 1dgg s ASP 25 Ca 0.73 1.82 -0.30 0.00 -0.00 0.00 0.00 52.55 54.80 1dgg s ASP 25 Cb -0.25 -2.41 -0.06 0.00 -0.00 0.00 0.00 42.92 40.19 1dgg s ASP 25 CO 0.34 -3.00 1.06 -0.69 -0.00 0.00 0.00 175.17 172.88 1dgg s VAL 26 N -2.73 4.18 -0.16 -1.27 1.01 -1.26 -5.00 120.40 115.18 1dgg s VAL 26 Ca 0.65 1.78 -0.29 0.00 0.00 0.00 0.00 61.98 64.12 1dgg s VAL 26 Cb -0.21 -4.14 -0.01 0.00 0.00 0.00 0.00 36.38 32.02 1dgg s VAL 26 CO 0.59 0.26 1.11 -0.22 0.00 0.00 0.00 175.10 176.83 1dgg s LEU 27 N 0.07 4.18 0.37 3.92 2.96 -1.26 -4.99 118.68 123.93 1dgg s LEU 27 Ca 0.50 1.56 0.04 0.00 -0.22 0.00 0.00 54.13 56.01 1dgg s LEU 27 Cb -0.27 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 42.83 1dgg s LEU 27 CO 0.32 -0.62 0.08 0.42 -1.32 0.00 0.00 176.35 175.22 1dgg s THR 28 N 2.82 0.97 0.95 3.68 -4.23 -1.26 -0.28 115.64 118.29 1dgg s THR 28 Ca 0.50 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 58.86 1dgg s THR 28 Cb -0.19 -2.59 0.22 0.00 1.34 0.00 0.00 72.50 71.28 1dgg s THR 28 CO 0.14 0.00 1.29 0.35 -0.54 0.00 0.00 174.62 175.86 1dgg n THR 29 N -0.81 0.00 0.17 3.99 -2.24 0.46 -4.86 114.28 110.99 1dgg n THR 29 Ca -0.05 -1.04 0.04 0.00 -2.27 0.00 0.00 64.05 60.73 1dgg n THR 29 Cb 0.66 -1.44 0.45 0.00 -2.10 0.00 0.00 70.33 67.90 1dgg n THR 29 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1dgg h GLY 30 N -1.62 0.15 -0.75 3.38 0.00 -1.92 -1.56 103.07 100.74 1dgg h GLY 30 Ca -0.42 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 46.83 1dgg h GLY 30 CO 0.31 0.08 0.00 0.00 0.00 0.00 0.00 176.54 176.93 1dgg n ALA 31 N -2.50 2.51 -1.01 3.60 0.00 -1.26 -4.89 120.51 116.96 1dgg n ALA 31 Ca -0.01 -0.33 -0.00 0.00 0.00 0.00 0.00 53.44 53.09 1dgg n ALA 31 Cb 0.24 -0.99 -0.00 0.00 0.00 0.00 0.00 19.45 18.70 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 0.73 0.47 3.67 0.00 0.00 -0.59 -5.02 105.19 104.46 1dgg n GLY 32 Ca 0.06 -0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.20 6.97 0.31 1.61 0.02 -1.26 -4.72 114.94 115.67 1dgg s ASN 33 Ca 0.00 1.19 -0.28 0.00 -1.02 0.00 0.00 52.86 52.74 1dgg s ASN 33 Cb 0.00 -2.45 -0.13 0.00 0.02 0.00 0.00 41.25 38.69 1dgg s ASN 33 CO 0.00 -0.38 1.22 -2.65 0.02 0.00 0.00 177.10 175.31 1dgg n PRO 34 N 5.12 1.88 -3.95 -0.60 -0.02 -1.26 -0.40 135.00 135.76 1dgg n PRO 34 Ca 0.04 0.66 -0.35 0.00 -2.02 0.00 0.00 63.50 61.83 1dgg n PRO 34 Cb 0.49 -2.19 -0.11 0.00 -0.02 0.00 0.00 33.50 31.68 1dgg n PRO 34 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1dgg s VAL 35 N -0.94 4.67 0.01 -1.45 1.01 0.62 -4.83 120.40 119.49 1dgg s VAL 35 Ca 0.58 -0.07 0.11 0.00 0.00 0.00 0.00 61.98 62.60 1dgg s VAL 35 Cb -0.62 -3.13 -0.14 0.00 0.00 0.00 0.00 36.38 32.50 1dgg s VAL 35 CO 0.60 0.42 1.20 1.23 0.00 0.00 0.00 175.10 178.56 1dgg h GLY 36 N 7.12 0.00 -6.00 4.51 0.00 -1.94 -3.45 103.07 103.31 1dgg h GLY 36 Ca -0.37 0.00 0.10 0.00 0.00 0.00 0.00 47.33 47.06 1dgg h GLY 36 CO 0.66 0.00 -0.24 -0.35 0.00 0.00 0.00 176.54 176.61 1dgg s ASP 37 N -6.49 -1.32 -0.30 0.19 3.68 -1.26 -5.02 116.67 106.16 1dgg s ASP 37 Ca 0.01 0.80 0.10 0.00 2.13 0.00 0.00 52.55 55.59 1dgg s ASP 37 Cb 0.09 2.10 0.59 0.00 -1.45 0.00 0.00 42.92 44.24 1dgg s ASP 37 CO 0.80 -0.25 1.60 1.17 0.13 0.00 0.00 175.17 178.62 1dgg n LYS 38 N 5.43 2.51 0.00 4.34 4.81 -1.26 -4.43 118.16 129.56 1dgg n LYS 38 Ca -0.01 -3.06 0.02 0.00 -0.87 0.00 0.00 58.31 54.38 1dgg n LYS 38 Cb 0.51 -1.96 -0.02 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 -0.81 0.19 -3.91 3.14 4.77 -1.26 -5.02 117.00 114.10 1dgg n LEU 39 Ca 0.36 -0.51 -0.11 0.00 -0.03 0.00 0.00 56.01 55.73 1dgg n LEU 39 Cb 1.18 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 42.15 1dgg n LEU 39 CO 0.30 0.05 -0.31 0.20 -1.33 0.00 0.00 177.39 176.29 1dgg s ASN 40 N -1.34 0.08 0.44 -1.43 -0.87 -1.26 -5.17 114.94 105.40 1dgg s ASN 40 Ca 0.01 -0.20 0.03 0.00 -1.57 0.00 0.00 52.86 51.13 1dgg s ASN 40 Cb 0.03 0.11 0.01 0.00 -0.02 0.00 0.00 41.25 41.37 1dgg s ASN 40 CO 0.15 -0.18 0.64 0.68 -2.57 0.00 0.00 177.10 175.81 1dgg s VAL 41 N -0.80 3.59 -0.16 1.60 -7.23 -1.26 -4.98 120.40 111.15 1dgg s VAL 41 Ca -0.09 -0.71 -0.24 0.00 -1.81 0.00 0.00 61.98 59.13 1dgg s VAL 41 Cb -0.05 -3.29 -0.02 0.00 0.56 0.00 0.00 36.38 33.57 1dgg s VAL 41 CO -0.00 -0.17 0.79 -0.63 -0.31 0.00 0.00 175.10 174.77 1dgg s ILE 42 N -2.49 4.92 0.09 -0.62 1.01 -1.26 -5.04 121.20 117.81 1dgg s ILE 42 Ca 0.50 1.54 0.03 0.00 0.00 0.00 0.00 60.65 62.73 1dgg s ILE 42 Cb -0.10 -4.10 -0.04 0.00 0.01 0.00 0.00 42.46 38.24 1dgg s ILE 42 CO 0.36 0.06 -0.09 0.42 0.00 0.00 0.00 174.94 175.69 1dgg s THR 43 N 1.99 0.81 -0.68 2.92 -4.23 -1.26 -2.14 115.64 113.05 1dgg s THR 43 Ca 0.37 -1.66 -0.22 0.00 -1.18 0.00 0.00 61.69 59.00 1dgg s THR 43 Cb -0.17 -1.36 0.08 0.00 1.34 0.00 0.00 72.50 72.40 1dgg s THR 43 CO 0.13 -0.63 0.94 0.54 -0.54 0.00 0.00 174.62 175.05 1dgg s VAL 44 N -2.67 4.44 0.00 2.29 0.11 -0.96 -4.80 120.40 118.81 1dgg s VAL 44 Ca 0.05 -0.59 0.00 0.00 -2.93 0.00 0.00 61.98 58.51 1dgg s VAL 44 Cb -0.01 -4.66 0.00 0.00 -1.53 0.00 0.00 36.38 30.17 1dgg s VAL 44 CO -0.01 -1.41 0.00 0.61 -3.33 0.00 0.00 175.10 170.95 1dgg n GLY 45 N 5.34 -0.36 0.40 6.54 0.00 -1.26 -2.96 105.19 112.89 1dgg n GLY 45 Ca -0.02 -1.54 0.22 0.00 0.00 0.00 0.00 46.02 44.68 1dgg n GLY 45 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dgg h PRO 46 N 0.00 0.00 0.00 1.61 0.13 -2.01 -1.91 132.00 129.83 1dgg h PRO 46 Ca 0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 1dgg h PRO 46 Cb 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.10 1dgg h PRO 46 CO 0.00 0.00 -0.50 0.54 -0.23 0.00 0.00 178.00 177.81 1dgg n ARG 47 N -4.15 1.42 -2.45 0.86 1.74 -1.26 -5.05 116.66 107.76 1dgg n ARG 47 Ca 0.10 -3.12 -0.17 0.00 -0.77 0.00 0.00 57.85 53.89 1dgg n ARG 47 Cb 0.66 -1.47 0.07 0.00 -1.02 0.00 0.00 32.46 30.71 1dgg n ARG 47 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1dgg n GLY 48 N -1.00 1.44 3.81 -0.13 0.00 -0.72 -5.04 105.19 103.55 1dgg n GLY 48 Ca 0.18 -2.13 -0.30 0.00 0.00 0.00 0.00 46.02 43.76 1dgg n GLY 48 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1dgg s PRO 49 N -4.33 2.00 0.17 1.61 0.02 -1.26 -4.51 135.00 128.69 1dgg s PRO 49 Ca 0.51 0.56 -0.27 0.00 0.02 0.00 0.00 61.00 61.82 1dgg s PRO 49 Cb -0.04 -1.91 -0.08 0.00 0.02 0.00 0.00 34.50 32.49 1dgg s PRO 49 CO 0.33 -1.66 0.85 -1.17 -0.33 0.00 0.00 177.00 175.02 1dgg s LEU 50 N -5.78 4.58 0.02 -5.54 2.96 -1.26 -2.28 118.68 111.39 1dgg s LEU 50 Ca 0.61 1.73 -0.03 0.00 -0.22 0.00 0.00 54.13 56.22 1dgg s LEU 50 Cb -0.14 -3.42 -0.04 0.00 0.50 0.00 0.00 46.19 43.08 1dgg s LEU 50 CO 0.54 0.13 0.23 -0.76 -1.32 0.00 0.00 176.35 175.17 1dgg s LEU 51 N -0.87 4.36 0.46 -0.68 1.02 -0.91 -4.99 118.68 117.07 1dgg s LEU 51 Ca 0.39 0.40 0.24 0.00 0.02 0.00 0.00 54.13 55.19 1dgg s LEU 51 Cb -0.24 -2.77 1.12 0.00 0.02 0.00 0.00 46.19 44.32 1dgg s LEU 51 CO 0.28 0.22 1.93 0.58 0.02 0.00 0.00 176.35 179.38 1dgg h VAL 52 N 2.64 0.66 0.00 -1.59 2.07 -1.97 -2.52 116.25 115.54 1dgg h VAL 52 Ca -0.48 -0.91 0.00 0.00 0.82 0.00 0.00 66.70 66.12 1dgg h VAL 52 Cb 1.18 1.59 0.00 0.00 -1.52 0.00 0.00 31.29 32.54 1dgg h VAL 52 CO 0.70 0.20 0.00 0.00 0.02 0.00 0.00 177.57 178.50 1dgg n GLN 53 N -3.58 0.57 -2.69 1.57 10.64 -1.26 -4.00 117.38 118.63 1dgg n GLN 53 Ca -0.01 0.00 -0.43 0.00 -1.83 0.00 0.00 57.00 54.73 1dgg n GLN 53 Cb 0.35 -1.38 0.00 0.00 -0.86 0.00 0.00 30.24 28.35 1dgg n GLN 53 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 1dgg n ASP 54 N -0.88 5.11 0.17 2.61 4.64 -0.95 -4.73 116.55 122.51 1dgg n ASP 54 Ca 0.10 -3.01 0.02 0.00 -1.38 0.00 0.00 54.79 50.53 1dgg n ASP 54 Cb 0.05 -1.56 0.29 0.00 -1.04 0.00 0.00 41.12 38.85 1dgg n ASP 54 CO 0.00 0.00 0.00 0.58 -0.82 0.00 0.00 177.20 176.96 1dgg h VAL 55 N 4.43 1.24 -0.78 5.18 2.07 -1.88 -2.94 116.25 123.57 1dgg h VAL 55 Ca 0.36 -1.66 0.03 0.00 0.82 0.00 0.00 66.70 66.25 1dgg h VAL 55 Cb 0.79 1.92 -0.05 0.00 -1.52 0.00 0.00 31.29 32.43 1dgg h VAL 55 CO 1.40 0.46 0.50 0.58 0.02 0.00 0.00 177.57 180.53 1dgg h VAL 56 N 0.00 1.12 0.34 2.57 2.07 -1.94 0.22 116.25 120.63 1dgg h VAL 56 Ca -0.00 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 1dgg h VAL 56 Cb 0.88 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1dgg h VAL 56 CO 0.06 0.18 -0.16 0.15 0.02 0.00 0.00 177.57 177.82 1dgg h PHE 57 N 0.98 -0.42 -0.21 1.57 3.57 -1.92 -2.63 116.94 117.87 1dgg h PHE 57 Ca 0.31 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.83 1dgg h PHE 57 Cb 0.01 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 1dgg h PHE 57 CO -0.03 -0.11 0.03 1.15 -2.23 0.00 0.00 178.31 177.12 1dgg h THR 58 N -0.76 0.89 -0.48 4.41 2.02 -1.40 0.31 112.91 117.90 1dgg h THR 58 Ca -0.05 -0.04 0.09 0.00 0.77 0.00 0.00 66.41 67.19 1dgg h THR 58 Cb 0.51 0.77 -0.08 0.00 -1.74 0.00 0.00 68.15 67.61 1dgg h THR 58 CO 0.08 0.02 -0.00 -0.78 0.37 0.00 0.00 175.52 175.20 1dgg h ASP 59 N 0.11 -0.21 -0.04 4.18 1.82 -1.00 0.76 116.42 122.04 1dgg h ASP 59 Ca 0.10 0.12 -0.03 0.00 -0.39 0.00 0.00 57.03 56.82 1dgg h ASP 59 Cb 0.10 0.21 0.00 0.00 0.68 0.00 0.00 39.33 40.32 1dgg h ASP 59 CO -0.14 -0.07 -0.10 -0.08 -1.61 0.00 0.00 179.24 177.24 1dgg h GLU 60 N 0.11 0.13 -0.64 0.28 4.81 -1.15 -2.94 114.58 115.18 1dgg h GLU 60 Ca 0.24 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1dgg h GLU 60 Cb 0.36 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.73 1dgg h GLU 60 CO -0.41 0.71 0.39 1.98 -0.73 0.00 0.00 179.01 180.95 1dgg h MET 61 N -0.42 0.87 -0.90 1.92 4.05 -0.02 -0.89 114.93 119.54 1dgg h MET 61 Ca -0.00 -0.08 0.02 0.00 -0.28 0.00 0.00 59.70 59.36 1dgg h MET 61 Cb 0.72 -0.18 -0.05 0.00 -0.80 0.00 0.00 31.60 31.29 1dgg h MET 61 CO 0.02 0.62 0.59 0.00 0.23 0.00 0.00 176.91 178.37 1dgg h ALA 62 N 1.20 1.16 -0.33 0.39 0.00 0.46 0.24 119.26 122.38 1dgg h ALA 62 Ca 0.23 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 1dgg h ALA 62 Cb -0.03 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 1dgg h ALA 62 CO -0.04 0.50 -0.19 1.25 0.00 0.00 0.00 179.25 180.77 1dgg h HIS 63 N 1.19 0.84 -0.93 0.00 6.17 -1.28 -2.62 115.15 118.51 1dgg h HIS 63 Ca 0.34 -0.22 0.08 0.00 0.71 0.00 0.00 60.37 61.29 1dgg h HIS 63 Cb -0.08 -0.19 -0.07 0.00 2.52 0.00 0.00 27.41 29.59 1dgg h HIS 63 CO -0.01 0.94 0.58 0.35 0.71 0.00 0.00 177.93 180.50 1dgg h PHE 64 N 0.49 1.07 0.00 5.26 3.57 -0.48 0.70 116.94 127.55 1dgg h PHE 64 Ca 0.07 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1dgg h PHE 64 Cb 0.74 -0.34 0.00 0.00 2.79 0.00 0.00 35.95 39.14 1dgg h PHE 64 CO 0.06 0.51 0.00 -0.25 -2.23 0.00 0.00 178.31 176.40 1dgg n ASP 65 N -4.60 0.06 -0.04 0.41 10.43 0.80 -2.73 116.55 120.88 1dgg n ASP 65 Ca 0.15 0.52 0.05 0.00 2.57 0.00 0.00 54.79 58.08 1dgg n ASP 65 Cb 0.23 -0.53 0.06 0.00 1.84 0.00 0.00 41.12 42.73 1dgg n ASP 65 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1dgg n ARG 66 N -1.57 2.14 -0.03 -1.24 1.74 0.21 -4.81 116.66 113.10 1dgg n ARG 66 Ca 0.02 -1.98 0.02 0.00 -0.77 0.00 0.00 57.85 55.14 1dgg n ARG 66 Cb 0.11 -1.22 0.34 0.00 -1.02 0.00 0.00 32.46 30.67 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 0.00 0.59 -6.48 5.56 5.08 -1.27 -3.44 114.58 114.61 1dgg h GLU 67 Ca 0.00 -0.08 -0.53 0.00 -1.00 0.00 0.00 59.36 57.75 1dgg h GLU 67 Cb 0.75 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 1dgg h GLU 67 CO 0.00 0.49 0.13 1.03 -1.00 0.00 0.00 179.01 179.66 1dgg s ARG 68 N -5.30 4.46 0.23 2.33 1.81 -1.26 -5.09 118.95 116.14 1dgg s ARG 68 Ca -0.08 1.04 0.10 0.00 -1.72 0.00 0.00 55.73 55.07 1dgg s ARG 68 Cb 0.17 -3.20 -0.05 0.00 -0.45 0.00 0.00 34.95 31.42 1dgg s ARG 68 CO 0.75 0.56 -0.18 0.96 -0.68 0.00 0.00 175.30 176.71 1dgg s ILE 69 N -1.20 2.11 0.34 1.52 -4.36 -1.26 -5.10 121.20 113.25 1dgg s ILE 69 Ca 0.36 -2.25 -0.29 0.00 -0.26 0.00 0.00 60.65 58.21 1dgg s ILE 69 Cb -0.22 -2.14 -0.12 0.00 1.25 0.00 0.00 42.46 41.24 1dgg s ILE 69 CO 0.24 -0.45 1.47 -2.65 0.24 0.00 0.00 174.94 173.79 1dgg n PRO 70 N -0.36 2.52 -1.64 0.37 -0.02 -1.26 -4.97 135.00 129.63 1dgg n PRO 70 Ca -0.08 0.89 -0.30 0.00 -2.02 0.00 0.00 63.50 61.99 1dgg n PRO 70 Cb 0.59 -2.59 0.09 0.00 -0.02 0.00 0.00 33.50 31.58 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 -1.54 1.97 0.36 -0.52 -1.05 -1.26 -4.94 118.70 111.71 1dgg s GLU 71 Ca 0.57 0.46 -0.28 0.00 -0.15 0.00 0.00 54.97 55.57 1dgg s GLU 71 Cb -0.51 -1.92 -0.11 0.00 -0.44 0.00 0.00 34.13 31.14 1dgg s GLU 71 CO 0.59 -1.66 1.50 0.54 0.95 0.00 0.00 175.26 177.18 1dgg n ARG 72 N -3.43 2.65 0.20 -4.83 1.74 -1.26 -4.83 116.66 106.90 1dgg n ARG 72 Ca 0.07 0.93 0.15 0.00 -0.77 0.00 0.00 57.85 58.23 1dgg n ARG 72 Cb 0.58 -2.67 0.77 0.00 -1.02 0.00 0.00 32.46 30.11 1dgg n ARG 72 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 1dgg h VAL 73 N 3.02 0.68 -3.78 1.55 3.04 -1.98 -3.37 116.25 115.41 1dgg h VAL 73 Ca -0.50 0.00 -0.11 0.00 -1.01 0.00 0.00 66.70 65.08 1dgg h VAL 73 Cb 1.24 0.90 -0.16 0.00 -2.01 0.00 0.00 31.29 31.25 1dgg h VAL 73 CO 0.67 0.00 -0.46 0.68 -1.01 0.00 0.00 177.57 177.45 1dgg s VAL 74 N -4.83 0.14 -1.47 1.51 -7.23 -1.26 -4.87 120.40 102.40 1dgg s VAL 74 Ca -0.05 -1.13 0.00 0.00 -1.81 0.00 0.00 61.98 58.99 1dgg s VAL 74 Cb 0.17 -1.08 0.00 0.00 0.56 0.00 0.00 36.38 36.03 1dgg s VAL 74 CO 0.62 -0.63 0.00 1.41 -0.31 0.00 0.00 175.10 176.19 1dgg n HIS 75 N 0.47 -0.75 -0.04 2.82 -0.00 -0.35 -4.90 115.22 112.47 1dgg n HIS 75 Ca -0.17 0.00 0.03 0.00 -0.00 0.00 0.00 57.72 57.57 1dgg n HIS 75 Cb 0.60 -3.37 0.37 0.00 -0.00 0.00 0.00 29.99 27.59 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 0.75 1.61 -2.47 -1.41 0.00 -1.73 -3.41 119.26 112.60 1dgg h ALA 76 Ca -0.40 -0.06 -0.62 0.00 0.00 0.00 0.00 54.91 53.83 1dgg h ALA 76 Cb 1.28 -0.19 -0.13 0.00 0.00 0.00 0.00 17.79 18.76 1dgg h ALA 76 CO 0.47 0.34 0.07 0.21 0.00 0.00 0.00 179.25 180.34 1dgg s LYS 77 N -5.48 3.92 0.25 0.00 2.47 -1.25 -4.55 119.74 115.09 1dgg s LYS 77 Ca -0.09 0.25 -0.14 0.00 -1.56 0.00 0.00 55.97 54.43 1dgg s LYS 77 Cb 0.17 -3.71 0.05 0.00 -1.46 0.00 0.00 37.83 32.88 1dgg s LYS 77 CO 0.75 -0.51 0.69 0.41 0.16 0.00 0.00 175.35 176.84 1dgg n GLY 78 N 4.46 1.03 3.05 5.54 0.00 -1.26 -1.96 105.19 116.05 1dgg n GLY 78 Ca -0.02 -1.16 -0.08 0.00 0.00 0.00 0.00 46.02 44.75 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 -1.83 0.36 0.16 4.61 0.00 -0.09 -4.92 121.76 120.05 1dgg s ALA 79 Ca 0.14 -0.96 0.03 0.00 0.00 0.00 0.00 51.96 51.18 1dgg s ALA 79 Cb -0.03 0.22 -0.05 0.00 0.00 0.00 0.00 23.12 23.26 1dgg s ALA 79 CO 0.07 -0.28 -0.05 0.20 0.00 0.00 0.00 175.76 175.70 1dgg s GLY 80 N -2.32 1.16 0.24 0.00 0.00 -1.26 -0.03 107.32 105.11 1dgg s GLY 80 Ca -0.02 -1.55 -0.20 0.00 0.00 0.00 0.00 44.72 42.94 1dgg s GLY 80 CO -0.06 -1.58 0.65 0.00 0.00 0.00 0.00 173.10 172.11 1dgg s ALA 81 N -3.45 -1.19 0.12 3.20 0.00 -0.72 -4.54 121.76 115.18 1dgg s ALA 81 Ca 0.20 -0.17 0.04 0.00 0.00 0.00 0.00 51.96 52.03 1dgg s ALA 81 Cb 0.04 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 24.00 1dgg s ALA 81 CO 0.02 -0.94 -0.10 -0.06 0.00 0.00 0.00 175.76 174.68 1dgg s PHE 82 N -3.88 1.18 0.00 0.00 0.40 0.17 -1.40 117.98 114.44 1dgg s PHE 82 Ca 0.09 -0.70 0.00 0.00 -0.60 0.00 0.00 56.93 55.72 1dgg s PHE 82 Cb -0.04 -0.62 0.00 0.00 0.51 0.00 0.00 43.02 42.87 1dgg s PHE 82 CO 0.01 0.04 0.00 0.41 0.70 0.00 0.00 175.22 176.39 1dgg n GLY 83 N 0.20 0.95 3.49 4.36 0.00 -0.83 -0.32 105.19 113.03 1dgg n GLY 83 Ca -0.13 0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.98 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 1.40 0.03 -0.09 1.61 -0.85 0.02 -1.58 117.35 117.90 1dgg s TYR 84 Ca 0.00 -0.39 0.05 0.00 -0.52 0.00 0.00 57.07 56.21 1dgg s TYR 84 Cb 0.00 0.28 -0.00 0.00 0.38 0.00 0.00 41.96 42.61 1dgg s TYR 84 CO 0.00 -0.88 -0.24 0.12 -1.52 0.00 0.00 175.55 173.03 1dgg s PHE 85 N -3.90 2.53 -0.07 -3.49 5.36 0.15 -1.15 117.98 117.40 1dgg s PHE 85 Ca 0.12 -0.95 0.05 0.00 -0.96 0.00 0.00 56.93 55.19 1dgg s PHE 85 Cb -0.00 -1.68 -0.00 0.00 -0.34 0.00 0.00 43.02 41.00 1dgg s PHE 85 CO -0.01 -0.36 -0.22 -2.00 -1.46 0.00 0.00 175.22 171.17 1dgg s GLU 86 N 0.19 2.51 -0.18 10.12 2.12 -0.62 -0.51 118.70 132.34 1dgg s GLU 86 Ca -0.14 -0.81 -0.27 0.00 0.36 0.00 0.00 54.97 54.11 1dgg s GLU 86 Cb -0.17 -2.04 -0.01 0.00 0.26 0.00 0.00 34.13 32.18 1dgg s GLU 86 CO 0.07 0.26 0.92 0.08 -0.54 0.00 0.00 175.26 176.06 1dgg s VAL 87 N 0.11 4.81 -0.04 3.70 1.01 -0.55 -0.72 120.40 128.72 1dgg s VAL 87 Ca -0.10 1.81 0.16 0.00 0.00 0.00 0.00 61.98 63.85 1dgg s VAL 87 Cb -0.15 -4.22 -0.24 0.00 0.00 0.00 0.00 36.38 31.77 1dgg s VAL 87 CO 0.05 -0.04 0.31 0.35 0.00 0.00 0.00 175.10 175.77 1dgg n THR 88 N 4.89 0.15 -4.28 3.92 -2.24 0.12 0.68 114.28 117.52 1dgg n THR 88 Ca 0.07 -0.41 -0.15 0.00 -2.27 0.00 0.00 64.05 61.30 1dgg n THR 88 Cb 0.48 0.02 -0.10 0.00 -2.10 0.00 0.00 70.33 68.63 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 -3.00 1.38 -0.34 4.78 3.76 -0.16 -4.85 115.29 116.86 1dgg s HIS 89 Ca -0.06 -0.91 -0.15 0.00 -0.15 0.00 0.00 55.06 53.79 1dgg s HIS 89 Cb 0.09 -0.78 -0.01 0.00 1.11 0.00 0.00 32.58 32.99 1dgg s HIS 89 CO 0.66 -0.06 0.35 0.34 -0.85 0.00 0.00 174.74 175.18 1dgg s ASP 90 N -3.23 6.17 -0.09 1.40 -1.08 -1.26 -4.69 116.67 113.88 1dgg s ASP 90 Ca 0.24 -0.23 0.13 0.00 -0.52 0.00 0.00 52.55 52.18 1dgg s ASP 90 Cb 0.05 -2.19 0.21 0.00 -1.46 0.00 0.00 42.92 39.53 1dgg s ASP 90 CO 0.05 -0.32 1.11 2.30 0.52 0.00 0.00 175.17 178.83 1dgg n ILE 91 N 5.23 1.32 0.27 4.11 -5.35 -1.26 -4.75 119.36 118.93 1dgg n ILE 91 Ca -0.09 -1.61 0.18 0.00 -0.27 0.00 0.00 62.75 60.96 1dgg n ILE 91 Cb 0.49 -0.01 0.96 0.00 -1.74 0.00 0.00 39.64 39.35 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 2.18 0.00 0.00 7.28 1.35 -1.85 0.17 112.91 122.04 1dgg h THR 92 Ca -0.00 -0.01 -0.01 0.00 -0.55 0.00 0.00 66.41 65.84 1dgg h THR 92 Cb 1.13 0.80 -0.00 0.00 -1.73 0.00 0.00 68.15 68.35 1dgg h THR 92 CO 0.00 0.00 -0.05 0.07 -0.25 0.00 0.00 175.52 175.29 1dgg h LYS 93 N 0.00 0.00 0.00 4.72 2.10 -2.00 -3.23 116.57 118.16 1dgg h LYS 93 Ca 0.00 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 58.33 1dgg h LYS 93 Cb 0.01 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 31.29 1dgg h LYS 93 CO 0.00 0.05 -2.15 0.66 -2.00 0.00 0.00 179.45 176.01 1dgg n TYR 94 N -3.28 0.00 -4.32 0.07 0.53 0.55 -4.77 117.16 105.94 1dgg n TYR 94 Ca -0.01 0.00 -0.20 0.00 -1.02 0.00 0.00 57.90 56.67 1dgg n TYR 94 Cb 0.23 -0.77 -0.16 0.00 -1.03 0.00 0.00 39.34 37.61 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 -6.18 1.13 0.00 7.72 0.15 -0.82 -2.83 113.70 112.87 1dgg s SER 95 Ca -0.28 -0.17 0.21 0.00 0.70 0.00 0.00 55.95 56.41 1dgg s SER 95 Cb 0.08 -0.40 0.85 0.00 -1.71 0.00 0.00 66.02 64.84 1dgg s SER 95 CO 0.44 0.02 1.60 2.29 1.20 0.00 0.00 173.24 178.80 1dgg n LYS 96 N 3.57 1.61 -1.67 5.44 2.85 0.31 -4.17 118.16 126.10 1dgg n LYS 96 Ca -0.21 -0.91 -0.47 0.00 -1.05 0.00 0.00 58.31 55.67 1dgg n LYS 96 Cb 0.53 -1.39 -0.04 0.00 -0.65 0.00 0.00 35.03 33.47 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 0.13 1.06 -0.32 0.58 0.00 -1.22 -4.82 120.51 115.92 1dgg n ALA 97 Ca 0.16 0.38 0.30 0.00 0.00 0.00 0.00 53.44 54.28 1dgg n ALA 97 Cb 0.29 -2.40 0.64 0.00 0.00 0.00 0.00 19.45 17.98 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 7.22 0.17 -0.03 0.00 1.57 -1.93 0.25 116.57 123.83 1dgg h LYS 98 Ca -0.46 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.31 1dgg h LYS 98 Cb 1.26 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.54 1dgg h LYS 98 CO 0.91 0.11 0.03 -0.24 -0.57 0.00 0.00 179.45 179.69 1dgg h VAL 99 N 0.17 0.49 -0.01 0.50 3.04 -1.94 -2.20 116.25 116.30 1dgg h VAL 99 Ca 0.58 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.27 1dgg h VAL 99 Cb 1.93 0.97 0.00 0.00 -2.01 0.00 0.00 31.29 32.18 1dgg h VAL 99 CO -0.15 0.00 -0.09 0.49 -1.01 0.00 0.00 177.57 176.82 1dgg n PHE 100 N -3.79 0.00 -0.34 3.17 3.72 0.86 -4.81 117.46 116.26 1dgg n PHE 100 Ca -0.02 0.00 0.33 0.00 -0.05 0.00 0.00 57.45 57.70 1dgg n PHE 100 Cb 0.12 0.00 0.60 0.00 -0.94 0.00 0.00 39.48 39.26 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 1.89 0.01 -2.98 -1.08 4.11 -1.12 -3.42 114.58 112.00 1dgg h GLU 101 Ca 0.00 -0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.29 1dgg h GLU 101 Cb 0.45 -0.00 -0.24 0.00 0.50 0.00 0.00 28.75 29.46 1dgg h GLU 101 CO 0.00 0.01 -0.32 -3.38 0.07 0.00 0.00 179.01 175.38 1dgg s HIS 102 N -5.50 -0.30 0.32 2.06 -3.43 -1.26 -4.97 115.29 102.22 1dgg s HIS 102 Ca -0.09 0.70 -0.29 0.00 -0.80 0.00 0.00 55.06 54.58 1dgg s HIS 102 Cb 0.34 0.11 -0.12 0.00 -1.43 0.00 0.00 32.58 31.48 1dgg s HIS 102 CO 0.79 -0.23 1.50 -0.89 -2.00 0.00 0.00 174.74 173.90 1dgg n ILE 103 N 2.47 1.48 0.00 -5.38 5.41 -1.26 -1.66 119.36 120.41 1dgg n ILE 103 Ca -0.15 -0.37 0.00 0.00 1.00 0.00 0.00 62.75 63.23 1dgg n ILE 103 Cb 0.57 -1.86 0.00 0.00 -0.71 0.00 0.00 39.64 37.65 1dgg n ILE 103 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1dgg n GLY 104 N 1.40 1.31 3.73 7.39 0.00 0.21 -4.98 105.19 114.26 1dgg n GLY 104 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.73 4.30 -0.13 1.61 2.20 -0.67 -4.70 119.74 121.62 1dgg s LYS 105 Ca 0.00 2.21 0.00 0.00 -0.36 0.00 0.00 55.97 57.82 1dgg s LYS 105 Cb 0.00 -3.16 -0.01 0.00 -1.51 0.00 0.00 37.83 33.14 1dgg s LYS 105 CO 0.00 -0.42 -0.14 0.15 -0.36 0.00 0.00 175.35 174.58 1dgg s LYS 106 N 0.25 3.35 -0.08 4.03 1.02 -1.26 -1.47 119.74 125.57 1dgg s LYS 106 Ca 0.62 -0.70 0.03 0.00 0.02 0.00 0.00 55.97 55.94 1dgg s LYS 106 Cb -0.40 -2.62 0.01 0.00 -0.52 0.00 0.00 37.83 34.30 1dgg s LYS 106 CO 0.37 0.19 -0.18 0.99 -0.92 0.00 0.00 175.35 175.81 1dgg s THR 107 N 0.40 1.57 0.37 2.17 2.01 0.34 -4.94 115.64 117.56 1dgg s THR 107 Ca -0.11 -0.73 -0.28 0.00 0.31 0.00 0.00 61.69 60.89 1dgg s THR 107 Cb -0.16 -1.39 -0.10 0.00 0.01 0.00 0.00 72.50 70.86 1dgg s THR 107 CO 0.05 0.45 1.39 -2.84 -0.69 0.00 0.00 174.62 172.98 1dgg s PRO 108 N 0.56 4.13 0.10 4.92 0.02 -1.26 0.31 135.00 143.79 1dgg s PRO 108 Ca -0.16 2.36 0.03 0.00 0.02 0.00 0.00 61.00 63.26 1dgg s PRO 108 Cb -0.17 -2.94 -0.04 0.00 0.02 0.00 0.00 34.50 31.37 1dgg s PRO 108 CO 0.05 -0.43 -0.09 0.96 -0.33 0.00 0.00 177.00 177.17 1dgg s ILE 109 N -1.16 0.87 -0.01 2.83 -4.36 -0.61 -1.64 121.20 117.11 1dgg s ILE 109 Ca 0.53 -1.79 0.04 0.00 -0.26 0.00 0.00 60.65 59.17 1dgg s ILE 109 Cb -0.42 -1.52 -0.01 0.00 1.25 0.00 0.00 42.46 41.76 1dgg s ILE 109 CO 0.57 -0.70 -0.14 0.00 0.24 0.00 0.00 174.94 174.91 1dgg s ALA 110 N -2.96 1.20 0.04 2.27 0.00 -0.21 -1.96 121.76 120.14 1dgg s ALA 110 Ca 0.09 -0.61 0.02 0.00 0.00 0.00 0.00 51.96 51.46 1dgg s ALA 110 Cb 0.01 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.78 1dgg s ALA 110 CO -0.02 0.28 -0.07 0.08 0.00 0.00 0.00 175.76 176.03 1dgg s VAL 111 N -0.28 0.52 -0.03 0.00 1.01 -0.50 0.35 120.40 121.47 1dgg s VAL 111 Ca 0.04 -1.00 -0.01 0.00 0.00 0.00 0.00 61.98 61.02 1dgg s VAL 111 Cb -0.06 -0.57 0.03 0.00 0.00 0.00 0.00 36.38 35.77 1dgg s VAL 111 CO -0.00 -0.34 0.04 -0.60 0.00 0.00 0.00 175.10 174.19 1dgg s ARG 112 N -1.45 0.01 0.14 2.72 3.52 -0.89 -1.76 118.95 121.24 1dgg s ARG 112 Ca -0.09 0.25 0.03 0.00 -0.13 0.00 0.00 55.73 55.78 1dgg s ARG 112 Cb -0.09 -0.40 -0.04 0.00 -1.56 0.00 0.00 34.95 32.86 1dgg s ARG 112 CO 0.00 -0.23 0.24 -0.06 -0.81 0.00 0.00 175.30 174.44 1dgg s PHE 113 N 1.52 3.40 -0.03 5.12 0.40 0.96 -2.23 117.98 127.11 1dgg s PHE 113 Ca -0.03 0.09 -0.30 0.00 -0.60 0.00 0.00 56.93 56.09 1dgg s PHE 113 Cb -0.13 -1.63 0.11 0.00 0.51 0.00 0.00 43.02 41.88 1dgg s PHE 113 CO -0.03 0.52 1.11 -1.54 0.70 0.00 0.00 175.22 175.98 1dgg s SER 114 N -3.13 -0.17 0.00 1.36 1.04 -0.83 -0.91 113.70 111.05 1dgg s SER 114 Ca 0.34 -0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.64 1dgg s SER 114 Cb -0.11 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.29 1dgg s SER 114 CO 0.27 -0.48 0.00 0.35 0.98 0.00 0.00 173.24 174.36 1dgg n THR 115 N -0.32 0.00 0.08 2.02 -2.24 -0.83 0.54 114.28 113.53 1dgg n THR 115 Ca -0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1dgg n THR 115 Cb 0.61 -1.24 0.00 0.00 -2.10 0.00 0.00 70.33 67.60 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 0.00 0.51 0.05 2.28 0.31 -1.26 -3.91 118.33 116.32 1dgg n VAL 116 Ca 0.00 0.17 -0.18 0.00 -0.01 0.00 0.00 64.34 64.32 1dgg n VAL 116 Cb 0.00 -1.05 -0.09 0.00 -0.91 0.00 0.00 33.84 31.79 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 0.00 0.19 -2.85 3.52 0.00 -1.93 -0.92 119.26 117.27 1dgg h ALA 117 Ca 0.00 -0.71 -0.53 0.00 0.00 0.00 0.00 54.91 53.67 1dgg h ALA 117 Cb 0.10 0.04 0.11 0.00 0.00 0.00 0.00 17.79 18.04 1dgg h ALA 117 CO 0.00 0.73 0.49 0.20 0.00 0.00 0.00 179.25 180.67 1dgg s GLY 118 N -4.34 2.77 0.76 0.00 0.00 -1.26 -4.92 107.32 100.33 1dgg s GLY 118 Ca -0.09 1.05 -0.10 0.00 0.00 0.00 0.00 44.72 45.58 1dgg s GLY 118 CO 0.91 1.47 1.03 1.18 0.00 0.00 0.00 173.10 177.68 1dgg n GLU 119 N -1.38 -0.80 -2.02 2.90 4.71 -1.26 -3.97 120.64 118.82 1dgg n GLU 119 Ca 0.12 -1.85 -0.42 0.00 -0.01 0.00 0.00 57.16 55.01 1dgg n GLU 119 Cb 0.49 -0.98 -0.03 0.00 -1.01 0.00 0.00 31.44 29.91 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 -4.86 6.67 0.00 1.62 0.01 -1.26 -1.60 113.70 114.28 1dgg s SER 120 Ca 0.60 2.59 0.00 0.00 1.31 0.00 0.00 55.95 60.45 1dgg s SER 120 Cb -0.02 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.60 1dgg s SER 120 CO 0.42 -0.72 0.00 0.61 0.41 0.00 0.00 173.24 173.96 1dgg n GLY 121 N 2.85 2.18 3.45 3.44 0.00 -1.26 -5.03 105.19 110.82 1dgg n GLY 121 Ca 0.09 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 1dgg n GLY 121 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1dgg n SER 122 N 0.10 -1.57 -4.80 1.61 3.41 -0.63 -4.97 113.62 106.77 1dgg n SER 122 Ca 0.00 0.02 -0.35 0.00 -0.26 0.00 0.00 58.87 58.28 1dgg n SER 122 Cb 0.00 -1.22 -0.07 0.00 -0.26 0.00 0.00 64.21 62.67 1dgg n SER 122 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1dgg s ALA 123 N -2.40 3.13 -0.03 7.33 0.00 -1.26 -4.81 121.76 123.71 1dgg s ALA 123 Ca 0.64 0.47 -0.23 0.00 0.00 0.00 0.00 51.96 52.84 1dgg s ALA 123 Cb -0.21 -3.17 -0.23 0.00 0.00 0.00 0.00 23.12 19.51 1dgg s ALA 123 CO 0.64 0.14 1.06 -0.44 0.00 0.00 0.00 175.76 177.17 1dgg h ASP 124 N 2.59 0.32 0.00 0.00 3.32 -1.14 -3.39 116.42 118.13 1dgg h ASP 124 Ca -0.48 -0.76 -0.64 0.00 0.02 0.00 0.00 57.03 55.17 1dgg h ASP 124 Cb 1.19 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1dgg h ASP 124 CO 0.63 1.04 3.12 0.35 -1.72 0.00 0.00 179.24 182.67 1dgg n THR 125 N -4.42 3.27 -4.17 0.35 -2.24 -1.26 -4.87 114.28 100.94 1dgg n THR 125 Ca -0.10 -2.43 -0.14 0.00 -2.27 0.00 0.00 64.05 59.11 1dgg n THR 125 Cb 0.55 -2.50 -0.11 0.00 -2.10 0.00 0.00 70.33 66.18 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 3.26 0.90 0.16 2.28 -7.23 -1.26 -4.42 120.40 114.09 1dgg s VAL 126 Ca 0.54 -1.61 -0.31 0.00 -1.81 0.00 0.00 61.98 58.79 1dgg s VAL 126 Cb 0.15 -1.32 -0.09 0.00 0.56 0.00 0.00 36.38 35.68 1dgg s VAL 126 CO -0.04 -0.56 1.43 -0.60 -0.31 0.00 0.00 175.10 175.03 1dgg s ARG 127 N -2.75 4.29 0.00 4.82 3.52 -1.26 -4.69 118.95 122.88 1dgg s ARG 127 Ca 0.05 2.18 0.00 0.00 -0.13 0.00 0.00 55.73 57.83 1dgg s ARG 127 Cb -0.03 -3.20 0.00 0.00 -1.56 0.00 0.00 34.95 30.16 1dgg s ARG 127 CO -0.00 -0.46 0.00 -3.47 -0.81 0.00 0.00 175.30 170.56 1dgg n ASP 128 N 3.57 0.00 -4.11 -2.12 4.64 -1.15 -5.03 116.55 112.34 1dgg n ASP 128 Ca 0.11 0.00 -0.29 0.00 -1.38 0.00 0.00 54.79 53.22 1dgg n ASP 128 Cb 0.41 0.00 0.23 0.00 -1.04 0.00 0.00 41.12 40.72 1dgg n ASP 128 CO 0.00 0.00 0.00 -2.84 -0.82 0.00 0.00 177.20 173.54 1dgg s PRO 129 N -2.00 -0.84 -0.09 -0.67 0.02 -1.26 -4.75 135.00 125.40 1dgg s PRO 129 Ca 0.00 0.18 0.00 0.00 0.02 0.00 0.00 61.00 61.20 1dgg s PRO 129 Cb 0.00 -1.62 0.02 0.00 0.02 0.00 0.00 34.50 32.92 1dgg s PRO 129 CO 0.00 -3.51 -0.06 1.03 -0.33 0.00 0.00 177.00 174.12 1dgg s ARG 130 N -5.17 1.28 0.33 5.54 1.81 -1.26 -4.10 118.95 117.38 1dgg s ARG 130 Ca 0.69 -0.19 -0.27 0.00 -1.72 0.00 0.00 55.73 54.24 1dgg s ARG 130 Cb -0.14 -1.33 -0.09 0.00 -0.45 0.00 0.00 34.95 32.94 1dgg s ARG 130 CO 0.57 -0.20 1.13 0.20 -0.68 0.00 0.00 175.30 176.32 1dgg s GLY 131 N 1.46 2.96 -0.44 -3.53 0.00 0.19 -1.05 107.32 106.92 1dgg s GLY 131 Ca -0.01 0.92 0.06 0.00 0.00 0.00 0.00 44.72 45.69 1dgg s GLY 131 CO -0.04 1.48 0.52 0.33 0.00 0.00 0.00 173.10 175.38 1dgg n PHE 132 N 0.66 -1.64 -3.44 1.90 -0.00 0.19 -1.97 117.46 113.17 1dgg n PHE 132 Ca 0.01 -2.82 -0.38 0.00 -0.00 0.00 0.00 57.45 54.27 1dgg n PHE 132 Cb 0.46 0.50 -0.06 0.00 -0.00 0.00 0.00 39.48 40.37 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 -0.02 3.62 -0.11 3.13 0.00 -0.95 -2.48 121.76 124.95 1dgg s ALA 133 Ca 0.33 -0.22 0.02 0.00 0.00 0.00 0.00 51.96 52.09 1dgg s ALA 133 Cb 0.08 -2.48 0.01 0.00 0.00 0.00 0.00 23.12 20.74 1dgg s ALA 133 CO -0.15 0.31 -0.16 0.08 0.00 0.00 0.00 175.76 175.83 1dgg s VAL 134 N -0.46 1.59 -0.26 0.00 1.01 -0.52 -2.10 120.40 119.67 1dgg s VAL 134 Ca 0.24 -0.70 -0.07 0.00 0.00 0.00 0.00 61.98 61.45 1dgg s VAL 134 Cb -0.16 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 34.76 1dgg s VAL 134 CO 0.12 0.46 0.06 -0.75 0.00 0.00 0.00 175.10 174.99 1dgg s LYS 135 N 0.96 3.48 -0.26 2.72 2.20 0.16 -0.70 119.74 128.29 1dgg s LYS 135 Ca -0.07 -0.59 -0.10 0.00 -0.36 0.00 0.00 55.97 54.85 1dgg s LYS 135 Cb -0.15 -3.31 -0.05 0.00 -1.51 0.00 0.00 37.83 32.81 1dgg s LYS 135 CO -0.02 -0.26 0.16 -0.06 -0.36 0.00 0.00 175.35 174.82 1dgg s PHE 136 N 1.57 3.24 -1.20 4.03 0.40 0.68 -1.04 117.98 125.66 1dgg s PHE 136 Ca 0.05 0.10 -0.12 0.00 -0.60 0.00 0.00 56.93 56.36 1dgg s PHE 136 Cb -0.16 -2.32 0.19 0.00 0.51 0.00 0.00 43.02 41.25 1dgg s PHE 136 CO 0.03 -0.09 1.43 0.66 0.70 0.00 0.00 175.22 177.95 1dgg n TYR 137 N 4.72 4.78 -2.25 0.36 4.01 -0.65 -1.01 117.16 127.11 1dgg n TYR 137 Ca -0.15 -3.37 -0.27 0.00 -0.16 0.00 0.00 57.90 53.95 1dgg n TYR 137 Cb 0.52 -2.08 0.05 0.00 -0.31 0.00 0.00 39.34 37.52 1dgg n TYR 137 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1dgg s THR 138 N 0.95 3.01 0.23 -0.72 -4.23 -0.55 -4.58 115.64 109.76 1dgg s THR 138 Ca 0.41 -0.07 0.32 0.00 -1.18 0.00 0.00 61.69 61.16 1dgg s THR 138 Cb -0.03 -3.25 0.35 0.00 1.34 0.00 0.00 72.50 70.91 1dgg s THR 138 CO -0.01 -0.27 2.01 -0.33 -0.54 0.00 0.00 174.62 175.48 1dgg h GLU 139 N -0.42 0.00 -1.01 3.99 3.07 -1.95 -1.98 114.58 116.27 1dgg h GLU 139 Ca -0.45 0.00 -0.49 0.00 -0.50 0.00 0.00 59.36 57.92 1dgg h GLU 139 Cb 1.28 0.00 -0.28 0.00 -0.84 0.00 0.00 28.75 28.92 1dgg h GLU 139 CO 0.61 0.07 0.62 -0.25 -1.40 0.00 0.00 179.01 178.66 1dgg n ASP 140 N -3.26 4.12 0.00 1.42 10.43 -1.26 -4.57 116.55 123.44 1dgg n ASP 140 Ca -0.00 -3.48 0.00 0.00 2.57 0.00 0.00 54.79 53.88 1dgg n ASP 140 Cb 0.29 -0.83 0.00 0.00 1.84 0.00 0.00 41.12 42.43 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 -0.95 -2.56 3.81 0.44 0.00 -0.74 -4.64 105.19 100.54 1dgg n GLY 141 Ca 0.55 -1.87 -0.37 0.00 0.00 0.00 0.00 46.02 44.32 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 -2.69 7.12 -0.21 1.61 0.01 -1.26 -1.48 114.94 118.04 1dgg s ASN 142 Ca 0.00 1.42 0.02 0.00 -0.71 0.00 0.00 52.86 53.59 1dgg s ASN 142 Cb 0.00 -2.42 0.04 0.00 0.41 0.00 0.00 41.25 39.28 1dgg s ASN 142 CO 0.00 0.12 -0.13 0.86 -1.51 0.00 0.00 177.10 176.44 1dgg s TRP 143 N -1.36 2.81 -0.30 2.20 -0.00 -0.18 -4.15 118.94 117.96 1dgg s TRP 143 Ca 0.38 -1.86 -0.10 0.00 -0.00 0.00 0.00 56.10 54.53 1dgg s TRP 143 Cb -0.19 -1.82 -0.02 0.00 -0.00 0.00 0.00 33.47 31.44 1dgg s TRP 143 CO 0.22 -0.81 0.16 -0.51 -0.00 0.00 0.00 176.95 176.00 1dgg s ASP 144 N 1.26 5.62 -0.79 5.86 -0.00 -0.19 -0.23 116.67 128.20 1dgg s ASP 144 Ca -0.02 -0.38 -0.09 0.00 -0.00 0.00 0.00 52.55 52.06 1dgg s ASP 144 Cb -0.17 -2.03 0.21 0.00 -0.00 0.00 0.00 42.92 40.93 1dgg s ASP 144 CO -0.09 -0.15 0.69 -0.22 -0.00 0.00 0.00 175.17 175.40 1dgg s LEU 145 N 1.65 6.10 -1.12 1.23 2.96 0.12 -4.54 118.68 125.09 1dgg s LEU 145 Ca 0.05 -2.93 -0.19 0.00 -0.22 0.00 0.00 54.13 50.85 1dgg s LEU 145 Cb -0.17 -2.06 0.09 0.00 0.50 0.00 0.00 46.19 44.55 1dgg s LEU 145 CO 0.07 -0.44 1.48 -0.69 -1.32 0.00 0.00 176.35 175.45 1dgg s VAL 146 N -0.19 4.32 0.57 1.68 1.01 -1.26 -1.44 120.40 125.09 1dgg s VAL 146 Ca 0.20 -1.58 0.07 0.00 0.00 0.00 0.00 61.98 60.66 1dgg s VAL 146 Cb -0.13 -5.03 0.06 0.00 0.00 0.00 0.00 36.38 31.28 1dgg s VAL 146 CO -0.07 -1.83 0.56 -0.83 0.00 0.00 0.00 175.10 172.93 1dgg s GLY 147 N 4.14 2.13 0.35 4.51 0.00 -1.04 -4.93 107.32 112.48 1dgg s GLY 147 Ca 0.45 -1.58 0.04 0.00 0.00 0.00 0.00 44.72 43.63 1dgg s GLY 147 CO -0.03 -1.86 0.07 -1.31 0.00 0.00 0.00 173.10 169.98 1dgg s ASN 148 N -4.45 2.51 -0.06 1.64 0.01 -0.53 0.57 114.94 114.63 1dgg s ASN 148 Ca 0.44 -1.46 0.04 0.00 -0.71 0.00 0.00 52.86 51.17 1dgg s ASN 148 Cb -0.04 0.08 0.21 0.00 0.41 0.00 0.00 41.25 41.92 1dgg s ASN 148 CO 0.28 -0.70 0.83 -0.46 -1.51 0.00 0.00 177.10 175.54 1dgg n ASN 149 N -0.85 2.20 -3.91 -1.22 6.94 -0.21 -0.17 115.26 118.03 1dgg n ASN 149 Ca -0.04 -2.24 -0.12 0.00 -0.02 0.00 0.00 54.58 52.17 1dgg n ASN 149 Cb 0.66 -0.54 -0.13 0.00 -2.36 0.00 0.00 39.78 37.41 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 -1.46 0.11 -0.75 5.53 -1.32 -1.26 -4.69 115.64 111.81 1dgg s THR 150 Ca 0.14 -0.26 0.25 0.00 -1.21 0.00 0.00 61.69 60.62 1dgg s THR 150 Cb 0.11 -0.14 0.26 0.00 -1.51 0.00 0.00 72.50 71.21 1dgg s THR 150 CO 0.04 -0.09 1.77 -0.81 -2.21 0.00 0.00 174.62 173.32 1dgg n PRO 151 N 2.71 0.18 -4.19 7.08 -0.04 -1.26 -4.57 135.00 134.91 1dgg n PRO 151 Ca -0.15 0.22 -0.24 0.00 -0.04 0.00 0.00 63.50 63.29 1dgg n PRO 151 Cb 0.59 -1.74 -0.06 0.00 -0.04 0.00 0.00 33.50 32.24 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 -2.05 0.00 -4.07 0.52 -5.35 -1.26 -4.43 119.36 102.72 1dgg n ILE 152 Ca 0.05 -2.10 -0.10 0.00 -0.27 0.00 0.00 62.75 60.33 1dgg n ILE 152 Cb 0.35 0.66 -0.09 0.00 -1.74 0.00 0.00 39.64 38.82 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 -2.82 0.67 0.34 4.28 2.19 -0.66 -4.98 117.98 117.01 1dgg s PHE 153 Ca 0.13 -1.03 0.05 0.00 0.33 0.00 0.00 56.93 56.41 1dgg s PHE 153 Cb 0.01 -0.29 0.63 0.00 -1.31 0.00 0.00 43.02 42.06 1dgg s PHE 153 CO 0.09 -0.62 1.89 0.74 1.83 0.00 0.00 175.22 179.15 1dgg h PHE 154 N 2.71 0.53 -3.04 10.12 -1.00 -1.89 -3.39 116.94 120.97 1dgg h PHE 154 Ca -0.33 -0.05 -0.42 0.00 2.81 0.00 0.00 57.97 59.98 1dgg h PHE 154 Cb 1.21 -0.16 -0.14 0.00 3.61 0.00 0.00 35.95 40.48 1dgg h PHE 154 CO 0.41 0.51 -0.67 0.96 -1.61 0.00 0.00 178.31 177.91 1dgg s ILE 155 N -5.00 1.31 -0.41 -0.55 -4.36 -1.26 -2.34 121.20 108.59 1dgg s ILE 155 Ca -0.08 -2.08 0.04 0.00 -0.26 0.00 0.00 60.65 58.28 1dgg s ILE 155 Cb 0.16 -2.34 0.07 0.00 1.25 0.00 0.00 42.46 41.60 1dgg s ILE 155 CO 0.76 -0.36 0.86 -2.11 0.24 0.00 0.00 174.94 174.33 1dgg n ARG 156 N -0.47 1.27 -3.97 0.37 1.85 -1.26 -4.61 116.66 109.85 1dgg n ARG 156 Ca -0.06 -1.22 -0.20 0.00 -1.00 0.00 0.00 57.85 55.37 1dgg n ARG 156 Cb 0.63 -1.08 -0.17 0.00 -1.05 0.00 0.00 32.46 30.79 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 -0.67 0.99 0.57 2.89 3.68 -1.26 -4.24 116.67 118.64 1dgg s ASP 157 Ca 0.06 -0.08 0.27 0.00 2.13 0.00 0.00 52.55 54.93 1dgg s ASP 157 Cb 0.04 -0.37 1.64 0.00 -1.45 0.00 0.00 42.92 42.77 1dgg s ASP 157 CO 0.05 -0.11 2.15 1.55 0.13 0.00 0.00 175.17 178.94 1dgg h PRO 158 N 7.57 0.00 0.00 4.34 0.13 -1.88 -2.39 132.00 139.78 1dgg h PRO 158 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1dgg h PRO 158 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1dgg h PRO 158 CO 0.40 0.00 0.00 1.51 -0.23 0.00 0.00 178.00 179.68 1dgg n ILE 159 N -3.97 0.93 0.83 -3.56 3.06 -1.26 -1.57 119.36 113.82 1dgg n ILE 159 Ca -0.00 0.23 0.09 0.00 -2.50 0.00 0.00 62.75 60.57 1dgg n ILE 159 Cb 0.22 -1.00 -0.12 0.00 0.54 0.00 0.00 39.64 39.29 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 -1.43 0.84 0.06 9.51 4.32 -0.90 -4.58 117.00 124.81 1dgg n LEU 160 Ca 0.04 -0.45 -0.11 0.00 -0.02 0.00 0.00 56.01 55.47 1dgg n LEU 160 Cb 0.14 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 41.90 1dgg n LEU 160 CO 0.12 0.21 0.74 0.15 -1.22 0.00 0.00 177.39 177.39 1dgg h PHE 161 N 0.00 -0.48 -0.87 -1.77 3.04 -1.41 0.25 116.94 115.70 1dgg h PHE 161 Ca 0.00 0.02 0.11 0.00 3.98 0.00 0.00 57.97 62.08 1dgg h PHE 161 Cb 0.51 0.21 -0.08 0.00 2.56 0.00 0.00 35.95 39.15 1dgg h PHE 161 CO 0.00 -0.26 0.50 -1.35 -2.02 0.00 0.00 178.31 175.17 1dgg h PRO 162 N -0.30 0.77 -0.25 6.41 0.11 -1.81 0.55 132.00 137.47 1dgg h PRO 162 Ca 0.05 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.09 1dgg h PRO 162 Cb 0.37 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.30 1dgg h PRO 162 CO -0.17 0.51 0.04 0.77 -0.21 0.00 0.00 178.00 178.95 1dgg h SER 163 N 0.79 0.39 -0.41 -2.05 0.02 -1.72 -1.01 113.55 109.57 1dgg h SER 163 Ca 0.43 -0.26 0.03 0.00 -0.84 0.00 0.00 61.79 61.16 1dgg h SER 163 Cb 0.46 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.86 1dgg h SER 163 CO -0.28 0.55 0.21 0.15 -1.14 0.00 0.00 176.83 176.32 1dgg h PHE 164 N 0.22 0.38 -0.92 3.45 -0.00 0.17 0.01 116.94 120.25 1dgg h PHE 164 Ca 0.08 0.02 -0.01 0.00 -0.00 0.00 0.00 57.97 58.06 1dgg h PHE 164 Cb 0.32 -0.11 -0.04 0.00 -0.00 0.00 0.00 35.95 36.11 1dgg h PHE 164 CO 0.02 0.20 0.55 0.82 -0.00 0.00 0.00 178.31 179.90 1dgg h ILE 165 N 0.42 1.25 -0.26 1.41 1.08 -0.75 -1.72 117.51 118.95 1dgg h ILE 165 Ca 0.17 -0.56 -0.02 0.00 -0.39 0.00 0.00 64.86 64.07 1dgg h ILE 165 Cb 0.08 -0.05 -0.01 0.00 -3.07 0.00 0.00 36.82 33.77 1dgg h ILE 165 CO -0.12 0.27 0.10 0.45 -0.69 0.00 0.00 178.15 178.16 1dgg h HIS 166 N 1.27 0.40 -0.03 1.37 3.86 -0.44 -1.63 115.15 119.95 1dgg h HIS 166 Ca 0.33 -0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.52 1dgg h HIS 166 Cb -0.05 -0.12 -0.00 0.00 1.06 0.00 0.00 27.41 28.30 1dgg h HIS 166 CO 0.01 0.41 0.03 0.66 0.86 0.00 0.00 177.93 179.89 1dgg h SER 167 N 0.27 0.00 1.52 2.45 4.64 -0.58 -1.72 113.55 120.13 1dgg h SER 167 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1dgg h SER 167 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1dgg h SER 167 CO -0.01 0.00 -0.36 1.56 -0.87 0.00 0.00 176.83 177.15 1dgg h GLN 168 N 0.00 0.00 0.00 4.77 1.08 -0.68 -3.05 115.11 117.23 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 0.07 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.50 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 -2.76 3.59 -3.14 1.46 5.02 -0.65 -4.93 118.16 116.75 1dgg n LYS 169 Ca 0.03 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 56.00 1dgg n LYS 169 Cb 0.51 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.47 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 4.05 3.95 0.22 1.97 0.52 -1.26 -4.11 118.95 124.30 1dgg s ARG 170 Ca 0.00 0.60 -0.31 0.00 -0.52 0.00 0.00 55.73 55.51 1dgg s ARG 170 Cb 0.00 -2.45 -0.10 0.00 0.52 0.00 0.00 34.95 32.92 1dgg s ARG 170 CO 0.00 0.15 1.50 1.21 0.02 0.00 0.00 175.30 178.18 1dgg s ASN 171 N -2.38 6.61 0.63 0.23 3.84 -0.14 -4.84 114.94 118.89 1dgg s ASN 171 Ca 0.53 2.67 0.34 0.00 0.21 0.00 0.00 52.86 56.61 1dgg s ASN 171 Cb -0.10 -2.61 1.94 0.00 -0.55 0.00 0.00 41.25 39.93 1dgg s ASN 171 CO 0.19 -0.76 2.19 1.55 -2.79 0.00 0.00 177.10 177.48 1dgg h PRO 172 N 5.65 0.00 0.00 0.43 0.13 -1.96 0.13 132.00 136.38 1dgg h PRO 172 Ca -0.45 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.31 1dgg h PRO 172 Cb 1.21 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.28 1dgg h PRO 172 CO 0.83 0.00 -2.29 0.94 -0.23 0.00 0.00 178.00 177.24 1dgg n GLN 173 N -3.43 0.51 0.08 0.86 7.27 -1.26 -4.70 117.38 116.72 1dgg n GLN 173 Ca -0.01 0.19 0.04 0.00 0.07 0.00 0.00 57.00 57.28 1dgg n GLN 173 Cb 0.21 -1.37 -0.03 0.00 2.41 0.00 0.00 30.24 31.45 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 -0.55 0.44 -1.40 1.69 1.35 -1.96 -3.48 112.91 109.00 1dgg h THR 174 Ca -0.56 -1.77 -0.24 0.00 -0.55 0.00 0.00 66.41 63.29 1dgg h THR 174 Cb 1.60 1.99 -0.03 0.00 -1.73 0.00 0.00 68.15 69.98 1dgg h THR 174 CO -0.26 0.25 -0.28 1.57 -0.25 0.00 0.00 175.52 176.54 1dgg n HIS 175 N -2.92 -0.42 -4.31 4.73 -0.00 0.44 -4.94 115.22 107.81 1dgg n HIS 175 Ca -0.05 0.00 -0.28 0.00 0.46 0.00 0.00 57.72 57.86 1dgg n HIS 175 Cb 0.74 -2.56 -0.10 0.00 -0.12 0.00 0.00 29.99 27.95 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 -3.22 2.83 0.47 0.27 1.43 -1.26 -4.70 118.68 114.50 1dgg s LEU 176 Ca 0.00 -0.60 -0.24 0.00 -1.03 0.00 0.00 54.13 52.26 1dgg s LEU 176 Cb 0.00 -1.57 -0.07 0.00 0.03 0.00 0.00 46.19 44.57 1dgg s LEU 176 CO 0.00 0.13 1.40 -0.54 0.23 0.00 0.00 176.35 177.57 1dgg s LYS 177 N -2.58 3.55 -0.26 1.70 1.02 -1.26 -0.97 119.74 120.95 1dgg s LYS 177 Ca 0.22 2.36 -0.01 0.00 0.02 0.00 0.00 55.97 58.56 1dgg s LYS 177 Cb -0.09 -2.55 0.08 0.00 -0.52 0.00 0.00 37.83 34.74 1dgg s LYS 177 CO 0.13 -0.90 0.05 0.34 -0.92 0.00 0.00 175.35 174.05 1dgg s ASP 178 N -0.64 3.67 0.61 2.83 -1.08 -1.26 -4.85 116.67 115.95 1dgg s ASP 178 Ca 0.64 -1.32 0.41 0.00 -0.52 0.00 0.00 52.55 51.76 1dgg s ASP 178 Cb -0.43 -0.85 2.15 0.00 -1.46 0.00 0.00 42.92 42.33 1dgg s ASP 178 CO 0.54 -0.35 2.24 1.55 0.52 0.00 0.00 175.17 179.67 1dgg h PRO 179 N 8.10 0.00 -0.18 4.34 0.13 -1.92 -0.92 132.00 141.55 1dgg h PRO 179 Ca -0.15 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.79 1dgg h PRO 179 Cb 1.06 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.19 1dgg h PRO 179 CO 0.42 0.00 -0.64 -0.44 -0.23 0.00 0.00 178.00 177.11 1dgg h ASP 180 N 0.00 0.76 -0.09 1.44 3.45 -1.94 -1.93 116.42 118.12 1dgg h ASP 180 Ca 0.00 -0.45 -0.03 0.00 0.43 0.00 0.00 57.03 56.98 1dgg h ASP 180 Cb 0.07 -0.22 -0.00 0.00 -0.56 0.00 0.00 39.33 38.61 1dgg h ASP 180 CO 0.00 1.21 -0.05 0.24 -1.57 0.00 0.00 179.24 179.07 1dgg h MET 181 N 0.49 0.20 0.19 3.56 2.86 -1.48 0.53 114.93 121.28 1dgg h MET 181 Ca -0.01 -0.09 0.01 0.00 -2.06 0.00 0.00 59.70 57.55 1dgg h MET 181 Cb 1.23 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.86 1dgg h MET 181 CO 0.13 0.57 -0.30 0.28 1.06 0.00 0.00 176.91 178.64 1dgg h VAL 182 N -0.18 0.35 0.00 -2.22 2.07 -1.27 -2.50 116.25 112.51 1dgg h VAL 182 Ca 0.02 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.47 1dgg h VAL 182 Cb 0.51 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1dgg h VAL 182 CO 0.01 0.00 -0.33 -0.50 0.02 0.00 0.00 177.57 176.77 1dgg h TRP 183 N -0.57 0.00 -0.27 1.57 4.06 -1.41 -2.29 115.95 117.04 1dgg h TRP 183 Ca 0.01 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.89 1dgg h TRP 183 Cb 0.57 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.72 1dgg h TRP 183 CO -0.24 0.32 -0.10 0.22 -3.56 0.00 0.00 178.44 175.08 1dgg h ASP 184 N 0.00 0.56 -0.11 -3.49 3.58 -0.83 0.12 116.42 116.25 1dgg h ASP 184 Ca -0.00 -0.39 -0.01 0.00 0.42 0.00 0.00 57.03 57.04 1dgg h ASP 184 Cb 1.25 -0.15 -0.00 0.00 1.72 0.00 0.00 39.33 42.14 1dgg h ASP 184 CO 0.04 0.82 0.01 0.15 -2.88 0.00 0.00 179.24 177.39 1dgg h PHE 185 N 0.29 0.20 -0.28 0.28 3.04 -1.45 -1.48 116.94 117.54 1dgg h PHE 185 Ca 0.06 -0.03 -0.02 0.00 3.98 0.00 0.00 57.97 61.96 1dgg h PHE 185 Cb 0.60 -0.05 -0.01 0.00 2.56 0.00 0.00 35.95 39.05 1dgg h PHE 185 CO 0.06 0.40 0.08 -1.49 -2.02 0.00 0.00 178.31 175.34 1dgg h TRP 186 N -0.07 0.46 -0.03 0.41 6.55 -1.38 -0.41 115.95 121.48 1dgg h TRP 186 Ca 0.03 -0.05 -0.04 0.00 0.95 0.00 0.00 58.89 59.78 1dgg h TRP 186 Cb 0.32 -0.13 -0.01 0.00 -0.86 0.00 0.00 29.16 28.48 1dgg h TRP 186 CO 0.02 0.50 -0.19 0.66 -1.05 0.00 0.00 178.44 178.38 1dgg h SER 187 N 0.29 0.04 1.57 -3.49 4.64 -0.78 -1.80 113.55 114.02 1dgg h SER 187 Ca 0.09 -0.01 -0.06 0.00 -0.47 0.00 0.00 61.79 61.34 1dgg h SER 187 Cb 0.26 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 1dgg h SER 187 CO -0.00 0.24 -0.31 -0.07 -0.87 0.00 0.00 176.83 175.82 1dgg h LEU 188 N 0.04 0.00 -6.92 5.97 3.38 -0.98 -3.38 115.31 113.42 1dgg h LEU 188 Ca 0.01 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 1dgg h LEU 188 Cb 0.37 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.71 1dgg h LEU 188 CO 0.03 0.31 -0.65 0.54 0.09 0.00 0.00 178.44 178.75 1dgg n ARG 189 N -3.21 1.52 0.00 1.13 5.12 -0.19 -4.96 116.66 116.07 1dgg n ARG 189 Ca 0.02 -4.23 0.00 0.00 -1.93 0.00 0.00 57.85 51.71 1dgg n ARG 189 Cb 0.63 -2.16 0.01 0.00 -1.16 0.00 0.00 32.46 29.77 1dgg n ARG 189 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 1dgg n PRO 190 N 2.11 0.00 0.22 5.56 -0.04 -1.19 -2.18 135.00 139.48 1dgg n PRO 190 Ca 0.22 0.31 0.15 0.00 -0.04 0.00 0.00 63.50 64.15 1dgg n PRO 190 Cb 0.38 -1.50 0.61 0.00 -0.04 0.00 0.00 33.50 32.95 1dgg n PRO 190 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1dgg h GLU 191 N 0.00 0.00 0.00 0.54 9.09 -1.86 -2.01 114.58 120.34 1dgg h GLU 191 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1dgg h GLU 191 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1dgg h GLU 191 CO 0.00 0.00 0.00 -1.13 0.05 0.00 0.00 179.01 177.93 1dgg n SER 192 N -2.73 0.25 -0.30 3.06 3.41 -0.93 -3.90 113.62 112.47 1dgg n SER 192 Ca 0.01 0.54 0.11 0.00 -0.26 0.00 0.00 58.87 59.27 1dgg n SER 192 Cb 0.27 -0.60 0.28 0.00 -0.26 0.00 0.00 64.21 63.90 1dgg n SER 192 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1dgg h LEU 193 N 0.00 0.38 0.74 1.04 3.38 -1.59 0.24 115.31 119.50 1dgg h LEU 193 Ca 0.00 0.13 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 1dgg h LEU 193 Cb 0.45 0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.31 1dgg h LEU 193 CO 0.00 0.06 -0.36 -0.74 0.09 0.00 0.00 178.44 177.50 1dgg h HIS 194 N 0.46 -0.92 0.00 1.13 2.76 -1.81 -1.22 115.15 115.55 1dgg h HIS 194 Ca 0.52 -0.02 -0.09 0.00 -2.20 0.00 0.00 60.37 58.58 1dgg h HIS 194 Cb 0.92 0.30 -0.01 0.00 1.55 0.00 0.00 27.41 30.17 1dgg h HIS 194 CO -0.13 -0.56 -0.42 0.37 -1.30 0.00 0.00 177.93 175.89 1dgg h GLN 195 N -1.03 0.00 -0.32 5.26 5.75 -1.71 -2.47 115.11 120.59 1dgg h GLN 195 Ca -0.10 0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 58.30 1dgg h GLN 195 Cb 0.77 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.31 1dgg h GLN 195 CO 0.17 0.42 -0.23 0.28 -2.65 0.00 0.00 178.83 176.82 1dgg h VAL 196 N 0.00 1.27 -0.24 2.39 2.07 -0.42 0.94 116.25 122.26 1dgg h VAL 196 Ca -0.00 -1.29 -0.13 0.00 0.82 0.00 0.00 66.70 66.10 1dgg h VAL 196 Cb 0.77 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.81 1dgg h VAL 196 CO 0.05 0.42 -0.40 0.28 0.02 0.00 0.00 177.57 177.95 1dgg h SER 197 N 0.54 0.60 -0.21 0.57 0.02 -0.86 -2.10 113.55 112.11 1dgg h SER 197 Ca 0.08 -0.26 -0.19 0.00 -0.84 0.00 0.00 61.79 60.58 1dgg h SER 197 Cb 0.69 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.06 1dgg h SER 197 CO 0.05 0.93 -0.58 0.15 -1.14 0.00 0.00 176.83 176.24 1dgg h PHE 198 N 0.47 1.03 -0.62 3.45 3.04 -1.07 -3.04 116.94 120.19 1dgg h PHE 198 Ca 0.04 -0.38 -0.02 0.00 3.98 0.00 0.00 57.97 61.59 1dgg h PHE 198 Cb 0.90 -0.19 -0.03 0.00 2.56 0.00 0.00 35.95 39.19 1dgg h PHE 198 CO 0.04 1.20 0.30 1.25 -2.02 0.00 0.00 178.31 179.08 1dgg h LEU 199 N 0.62 0.82 -1.02 0.59 5.85 -0.64 -2.70 115.31 118.82 1dgg h LEU 199 Ca 0.00 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.60 1dgg h LEU 199 Cb 1.18 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.00 1dgg h LEU 199 CO 0.12 0.72 0.00 0.49 -0.34 0.00 0.00 178.44 179.43 1dgg n PHE 200 N -4.50 0.37 -2.60 1.25 3.01 -0.81 -3.70 117.46 110.49 1dgg n PHE 200 Ca 0.04 -0.18 -0.20 0.00 1.01 0.00 0.00 57.45 58.12 1dgg n PHE 200 Cb 0.12 -0.01 0.10 0.00 -0.01 0.00 0.00 39.48 39.68 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 0.28 1.23 -0.25 4.37 3.41 -1.02 -4.17 113.62 117.46 1dgg n SER 201 Ca 0.09 -2.02 0.13 0.00 -0.26 0.00 0.00 58.87 56.81 1dgg n SER 201 Cb 0.24 -0.55 0.40 0.00 -0.26 0.00 0.00 64.21 64.04 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 0.60 0.00 4.04 3.32 -1.89 -1.56 116.42 120.45 1dgg h ASP 202 Ca -0.29 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.80 1dgg h ASP 202 Cb 1.07 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.54 1dgg h ASP 202 CO 0.31 0.30 0.00 0.54 -1.72 0.00 0.00 179.24 178.67 1dgg n ARG 203 N -4.55 0.67 0.22 3.56 1.74 -1.26 -3.39 116.66 113.64 1dgg n ARG 203 Ca 0.17 0.00 0.07 0.00 -0.77 0.00 0.00 57.85 57.32 1dgg n ARG 203 Cb 0.50 -1.35 0.51 0.00 -1.02 0.00 0.00 32.46 31.10 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 3.52 0.00 -6.93 -0.13 0.00 -1.36 -3.35 103.07 94.83 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 -0.75 -0.42 0.00 0.00 0.00 176.54 175.37 1dgg s ILE 205 N -4.17 1.39 0.60 2.60 1.01 -1.22 -2.94 121.20 118.47 1dgg s ILE 205 Ca -0.03 -2.67 -0.18 0.00 0.00 0.00 0.00 60.65 57.77 1dgg s ILE 205 Cb 0.14 -1.96 -0.03 0.00 0.01 0.00 0.00 42.46 40.61 1dgg s ILE 205 CO 0.66 -0.94 1.17 -2.84 0.00 0.00 0.00 174.94 173.00 1dgg s PRO 206 N 0.21 2.96 -1.29 2.79 0.02 -1.26 -0.96 135.00 137.48 1dgg s PRO 206 Ca 0.20 1.70 -0.17 0.00 0.02 0.00 0.00 61.00 62.75 1dgg s PRO 206 Cb -0.20 -1.94 0.09 0.00 0.02 0.00 0.00 34.50 32.47 1dgg s PRO 206 CO -0.03 -1.18 1.70 -3.47 -0.33 0.00 0.00 177.00 173.69 1dgg n ASP 207 N -1.74 4.95 0.00 2.53 4.64 0.38 -4.50 116.55 122.81 1dgg n ASP 207 Ca 0.13 -2.93 0.00 0.00 -1.38 0.00 0.00 54.79 50.61 1dgg n ASP 207 Cb 0.50 -1.71 0.00 0.00 -1.04 0.00 0.00 41.12 38.88 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 5.06 -2.44 0.08 0.27 0.00 -1.26 -4.17 105.19 102.71 1dgg n GLY 208 Ca 0.47 -1.60 -0.09 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 0.06 0.00 1.61 3.86 -1.88 -3.34 115.15 115.46 1dgg h HIS 209 Ca 0.00 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.17 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 1.05 0.00 0.00 0.86 0.00 0.00 177.93 179.84 1dgg h ARG 210 N 0.01 0.00 -0.85 2.45 3.08 -1.96 -3.17 114.38 113.94 1dgg h ARG 210 Ca -0.16 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.33 1dgg h ARG 210 Cb 1.91 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 31.66 1dgg h ARG 210 CO 0.11 0.00 0.31 0.72 -1.07 0.00 0.00 179.97 180.04 1dgg n HIS 211 N -2.89 2.80 -4.06 3.04 8.25 -1.25 -4.44 115.22 116.66 1dgg n HIS 211 Ca 0.00 -2.49 -0.08 0.00 -0.26 0.00 0.00 57.72 54.89 1dgg n HIS 211 Cb 0.24 -0.99 -0.09 0.00 1.12 0.00 0.00 29.99 30.26 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 -3.62 0.78 0.58 -0.41 0.23 -1.20 -2.24 119.30 113.42 1dgg s MET 212 Ca 0.58 -1.24 -0.03 0.00 -1.03 0.00 0.00 55.69 53.97 1dgg s MET 212 Cb 0.47 0.25 0.03 0.00 -1.53 0.00 0.00 34.83 34.05 1dgg s MET 212 CO 0.02 -0.20 0.85 -0.80 -2.03 0.00 0.00 175.02 172.85 1dgg s ASN 213 N -2.95 5.32 0.07 -1.18 0.01 -1.26 -4.15 114.94 110.79 1dgg s ASN 213 Ca 0.13 0.33 0.07 0.00 -0.71 0.00 0.00 52.86 52.67 1dgg s ASN 213 Cb 0.07 -1.24 -0.03 0.00 0.41 0.00 0.00 41.25 40.46 1dgg s ASN 213 CO -0.06 -1.17 -0.18 -0.83 -1.51 0.00 0.00 177.10 173.35 1dgg s GLY 214 N -4.39 1.02 -0.12 0.66 0.00 -0.10 -4.04 107.32 100.35 1dgg s GLY 214 Ca 0.56 -1.06 -0.13 0.00 0.00 0.00 0.00 44.72 44.09 1dgg s GLY 214 CO 0.42 -1.05 0.35 -0.19 0.00 0.00 0.00 173.10 172.62 1dgg s TYR 215 N -1.07 -0.37 -0.50 1.90 2.02 0.76 -1.36 117.35 118.72 1dgg s TYR 215 Ca 0.03 0.90 0.26 0.00 -0.37 0.00 0.00 57.07 57.89 1dgg s TYR 215 Cb -0.09 0.13 0.85 0.00 -0.40 0.00 0.00 41.96 42.44 1dgg s TYR 215 CO 0.03 -0.21 1.76 0.78 -1.57 0.00 0.00 175.55 176.34 1dgg h GLY 216 N 5.42 0.00 0.00 0.71 0.00 -1.67 -1.41 103.07 106.12 1dgg h GLY 216 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1dgg h GLY 216 CO 0.29 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.27 1dgg n SER 217 N -2.52 0.00 -4.63 0.19 7.64 -1.26 -4.80 113.62 108.23 1dgg n SER 217 Ca 0.04 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.62 1dgg n SER 217 Cb 0.38 0.00 0.18 0.00 -1.01 0.00 0.00 64.21 63.76 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 1.77 -0.14 1.43 3.76 -1.26 -4.81 115.29 116.04 1dgg s HIS 218 Ca 0.00 1.46 -0.20 0.00 -0.15 0.00 0.00 55.06 56.17 1dgg s HIS 218 Cb 0.00 -3.20 -0.04 0.00 1.11 0.00 0.00 32.58 30.45 1dgg s HIS 218 CO 0.00 -2.98 0.57 0.99 -0.85 0.00 0.00 174.74 172.47 1dgg s THR 219 N -2.68 5.11 0.51 1.30 2.01 -1.26 -4.54 115.64 116.09 1dgg s THR 219 Ca 0.66 1.12 0.05 0.00 0.31 0.00 0.00 61.69 63.82 1dgg s THR 219 Cb -0.22 -3.90 0.01 0.00 0.01 0.00 0.00 72.50 68.40 1dgg s THR 219 CO 0.60 0.24 0.27 -0.36 -0.69 0.00 0.00 174.62 174.68 1dgg s PHE 220 N 1.11 1.85 -0.03 4.92 0.08 0.14 -3.79 117.98 122.26 1dgg s PHE 220 Ca 0.29 -0.83 0.06 0.00 0.12 0.00 0.00 56.93 56.57 1dgg s PHE 220 Cb -0.16 -1.85 -0.01 0.00 -0.57 0.00 0.00 43.02 40.43 1dgg s PHE 220 CO 0.12 -0.20 -0.21 0.21 -0.10 0.00 0.00 175.22 175.04 1dgg s LYS 221 N -4.12 1.83 0.01 0.44 2.20 -0.30 -0.22 119.74 119.58 1dgg s LYS 221 Ca 0.28 -0.75 0.06 0.00 -0.36 0.00 0.00 55.97 55.20 1dgg s LYS 221 Cb -0.00 -1.71 -0.03 0.00 -1.51 0.00 0.00 37.83 34.58 1dgg s LYS 221 CO 0.17 0.41 -0.17 -0.51 -0.36 0.00 0.00 175.35 174.89 1dgg s LEU 222 N -0.37 2.61 -0.05 5.43 1.43 0.32 -0.24 118.68 127.80 1dgg s LEU 222 Ca 0.05 -0.37 0.02 0.00 -1.03 0.00 0.00 54.13 52.80 1dgg s LEU 222 Cb -0.09 -1.52 0.01 0.00 0.03 0.00 0.00 46.19 44.62 1dgg s LEU 222 CO 0.00 0.28 -0.10 -0.69 0.23 0.00 0.00 176.35 176.07 1dgg s VAL 223 N -0.86 0.96 0.51 -1.59 1.01 -0.09 -1.74 120.40 118.60 1dgg s VAL 223 Ca 0.14 -0.38 0.06 0.00 0.00 0.00 0.00 61.98 61.79 1dgg s VAL 223 Cb -0.10 -0.89 0.04 0.00 0.00 0.00 0.00 36.38 35.43 1dgg s VAL 223 CO 0.04 0.31 0.71 0.54 0.00 0.00 0.00 175.10 176.70 1dgg s ASN 224 N 0.65 5.33 0.42 3.32 2.20 -0.29 -0.53 114.94 126.04 1dgg s ASN 224 Ca -0.12 -0.39 0.20 0.00 -0.94 0.00 0.00 52.86 51.61 1dgg s ASN 224 Cb -0.15 -0.48 1.14 0.00 -2.00 0.00 0.00 41.25 39.77 1dgg s ASN 224 CO 0.03 -1.07 1.80 0.00 -2.94 0.00 0.00 177.10 174.91 1dgg h ALA 225 N 0.29 2.31 0.00 3.54 0.00 -1.90 0.29 119.26 123.79 1dgg h ALA 225 Ca -0.38 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1dgg h ALA 225 Cb 1.28 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1dgg h ALA 225 CO 0.46 -0.68 0.00 0.09 0.00 0.00 0.00 179.25 179.12 1dgg n ASN 226 N -4.55 0.00 0.00 0.00 5.03 -1.26 -4.84 115.26 109.63 1dgg n ASN 226 Ca 0.24 -0.92 0.00 0.00 0.87 0.00 0.00 54.58 54.77 1dgg n ASN 226 Cb 0.87 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.63 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 0.66 0.44 3.84 7.41 0.00 0.10 -5.03 105.19 112.62 1dgg n GLY 227 Ca 0.19 -0.55 -0.36 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.01 4.00 0.09 1.61 2.02 -1.25 -4.85 118.70 119.30 1dgg s GLU 228 Ca 0.00 0.51 0.07 0.00 0.02 0.00 0.00 54.97 55.56 1dgg s GLU 228 Cb 0.00 -2.98 -0.03 0.00 0.10 0.00 0.00 34.13 31.21 1dgg s GLU 228 CO 0.00 0.51 -0.17 0.00 0.02 0.00 0.00 175.26 175.62 1dgg s ALA 229 N -1.40 1.49 0.09 5.21 0.00 -1.26 -1.13 121.76 124.75 1dgg s ALA 229 Ca 0.36 -1.13 -0.02 0.00 0.00 0.00 0.00 51.96 51.17 1dgg s ALA 229 Cb -0.16 -0.17 -0.04 0.00 0.00 0.00 0.00 23.12 22.76 1dgg s ALA 229 CO 0.19 0.26 0.03 0.14 0.00 0.00 0.00 175.76 176.38 1dgg s VAL 230 N -1.25 0.16 0.13 0.00 -7.23 -0.71 -4.63 120.40 106.87 1dgg s VAL 230 Ca 0.02 -1.79 0.01 0.00 -1.81 0.00 0.00 61.98 58.42 1dgg s VAL 230 Cb -0.10 -1.72 -0.04 0.00 0.56 0.00 0.00 36.38 35.08 1dgg s VAL 230 CO 0.03 -0.74 0.27 -0.31 -0.31 0.00 0.00 175.10 174.04 1dgg s TYR 231 N -3.97 3.49 0.14 2.82 2.02 0.03 -0.52 117.35 121.36 1dgg s TYR 231 Ca 0.14 0.17 -0.12 0.00 -0.37 0.00 0.00 57.07 56.89 1dgg s TYR 231 Cb 0.07 -1.71 0.01 0.00 -0.40 0.00 0.00 41.96 39.93 1dgg s TYR 231 CO -0.05 0.53 0.32 0.00 -1.57 0.00 0.00 175.55 174.78 1dgg s LYS 233 N -3.89 2.17 -0.09 0.00 -0.14 -0.38 0.25 119.74 117.67 1dgg s LYS 233 Ca 0.09 -0.66 -0.14 0.00 -1.36 0.00 0.00 55.97 53.90 1dgg s LYS 233 Cb 0.03 -1.77 -0.05 0.00 -1.68 0.00 0.00 37.83 34.36 1dgg s LYS 233 CO -0.06 0.18 0.35 -0.06 -0.76 0.00 0.00 175.35 175.00 1dgg s PHE 234 N 0.27 3.58 -0.02 3.18 0.08 -1.26 -1.10 117.98 122.70 1dgg s PHE 234 Ca -0.11 0.78 0.01 0.00 0.12 0.00 0.00 56.93 57.73 1dgg s PHE 234 Cb -0.15 -2.32 0.01 0.00 -0.57 0.00 0.00 43.02 39.99 1dgg s PHE 234 CO 0.05 0.42 -0.05 -1.01 -0.10 0.00 0.00 175.22 174.52 1dgg s HIS 235 N -0.19 0.61 -0.36 0.36 3.76 -0.21 -1.93 115.29 117.33 1dgg s HIS 235 Ca 0.20 -0.13 -0.00 0.00 -0.15 0.00 0.00 55.06 54.98 1dgg s HIS 235 Cb -0.14 -0.48 0.12 0.00 1.11 0.00 0.00 32.58 33.19 1dgg s HIS 235 CO 0.08 -0.09 0.17 1.52 -0.85 0.00 0.00 174.74 175.58 1dgg s TYR 236 N 0.35 1.41 0.36 1.40 -0.85 -0.46 0.81 117.35 120.36 1dgg s TYR 236 Ca -0.04 -1.83 -0.26 0.00 -0.52 0.00 0.00 57.07 54.41 1dgg s TYR 236 Cb -0.08 -1.49 -0.09 0.00 0.38 0.00 0.00 41.96 40.68 1dgg s TYR 236 CO -0.00 -0.83 1.07 0.15 -1.52 0.00 0.00 175.55 174.42 1dgg s LYS 237 N 1.14 4.32 -0.05 -3.49 -0.14 -0.65 -0.92 119.74 119.96 1dgg s LYS 237 Ca 0.14 1.63 -0.30 0.00 -1.36 0.00 0.00 55.97 56.08 1dgg s LYS 237 Cb -0.21 -2.78 -0.04 0.00 -1.68 0.00 0.00 37.83 33.13 1dgg s LYS 237 CO -0.12 -0.03 1.27 -0.08 -0.76 0.00 0.00 175.35 175.63 1dgg s THR 238 N -1.47 4.09 -1.39 2.17 -1.32 -1.26 -1.12 115.64 115.34 1dgg s THR 238 Ca 0.53 1.43 0.30 0.00 -1.21 0.00 0.00 61.69 62.74 1dgg s THR 238 Cb -0.26 -3.92 0.50 0.00 -1.51 0.00 0.00 72.50 67.31 1dgg s THR 238 CO 0.33 -0.01 2.04 0.47 -2.21 0.00 0.00 174.62 175.24 1dgg n ASP 239 N 5.38 0.00 -0.48 8.08 10.43 -0.72 -2.51 116.55 136.73 1dgg n ASP 239 Ca 0.12 -0.09 0.12 0.00 2.57 0.00 0.00 54.79 57.51 1dgg n ASP 239 Cb 0.45 -0.30 0.16 0.00 1.84 0.00 0.00 41.12 43.27 1dgg n ASP 239 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1dgg n GLN 240 N -1.30 1.28 0.00 -1.24 3.00 -1.26 -4.97 117.38 112.88 1dgg n GLN 240 Ca 0.14 -0.97 0.00 0.00 -0.01 0.00 0.00 57.00 56.16 1dgg n GLN 240 Cb 0.25 -1.48 0.00 0.00 0.00 0.00 0.00 30.24 29.01 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 1.37 -2.17 3.73 1.08 0.00 -1.05 -4.91 105.19 103.25 1dgg n GLY 241 Ca 0.11 -1.33 -0.42 0.00 0.00 0.00 0.00 46.02 44.39 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 -3.27 3.03 -0.17 -0.61 -1.09 -1.26 -4.52 121.20 113.31 1dgg s ILE 242 Ca 0.00 0.78 -0.09 0.00 -2.23 0.00 0.00 60.65 59.11 1dgg s ILE 242 Cb 0.00 -3.50 0.06 0.00 -1.58 0.00 0.00 42.46 37.44 1dgg s ILE 242 CO 0.00 0.09 0.41 -0.75 -1.23 0.00 0.00 174.94 173.45 1dgg s LYS 243 N 0.56 0.38 0.29 2.79 2.20 -0.95 -5.04 119.74 119.97 1dgg s LYS 243 Ca 0.63 0.81 0.10 0.00 -0.36 0.00 0.00 55.97 57.16 1dgg s LYS 243 Cb -0.39 0.01 -0.06 0.00 -1.51 0.00 0.00 37.83 35.89 1dgg s LYS 243 CO 0.35 -0.17 -0.15 -0.80 -0.36 0.00 0.00 175.35 174.22 1dgg s ASN 244 N 1.56 3.46 0.00 1.43 0.01 -1.26 -0.47 114.94 119.66 1dgg s ASN 244 Ca -0.08 -1.10 -0.05 0.00 -0.71 0.00 0.00 52.86 50.91 1dgg s ASN 244 Cb -0.09 -0.29 -0.05 0.00 0.41 0.00 0.00 41.25 41.24 1dgg s ASN 244 CO -0.13 -0.10 0.24 -0.76 -1.51 0.00 0.00 177.10 174.85 1dgg s LEU 245 N -3.52 4.37 0.64 0.60 1.43 -0.13 -4.64 118.68 117.44 1dgg s LEU 245 Ca 0.30 0.49 -0.12 0.00 -1.03 0.00 0.00 54.13 53.77 1dgg s LEU 245 Cb -0.01 -2.65 -0.02 0.00 0.03 0.00 0.00 46.19 43.54 1dgg s LEU 245 CO 0.14 0.26 1.04 -0.94 0.23 0.00 0.00 176.35 177.08 1dgg s SER 246 N -1.77 5.78 0.27 2.29 1.04 -1.26 -4.77 113.70 115.27 1dgg s SER 246 Ca 0.27 1.59 -0.01 0.00 0.48 0.00 0.00 55.95 58.29 1dgg s SER 246 Cb -0.13 -2.49 0.51 0.00 0.10 0.00 0.00 66.02 64.00 1dgg s SER 246 CO 0.17 -1.17 1.82 0.58 0.98 0.00 0.00 173.24 175.61 1dgg h VAL 247 N -0.30 0.89 -0.18 5.02 2.07 -1.98 0.25 116.25 122.02 1dgg h VAL 247 Ca -0.45 -0.31 -0.04 0.00 0.82 0.00 0.00 66.70 66.73 1dgg h VAL 247 Cb 1.20 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 1dgg h VAL 247 CO 0.59 0.16 -0.03 -0.33 0.02 0.00 0.00 177.57 177.97 1dgg h GLU 248 N 0.89 0.34 -0.48 1.57 3.07 -2.00 -2.05 114.58 115.92 1dgg h GLU 248 Ca 0.47 -0.13 -0.11 0.00 -0.50 0.00 0.00 59.36 59.09 1dgg h GLU 248 Cb 0.48 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.35 1dgg h GLU 248 CO -0.27 0.59 -0.14 -0.44 -1.40 0.00 0.00 179.01 177.35 1dgg h ASP 249 N 0.06 0.92 -0.73 1.42 3.45 -1.76 -1.81 116.42 117.98 1dgg h ASP 249 Ca 0.05 -0.31 -0.04 0.00 0.43 0.00 0.00 57.03 57.15 1dgg h ASP 249 Cb 0.46 -0.25 -0.03 0.00 -0.56 0.00 0.00 39.33 38.95 1dgg h ASP 249 CO 0.02 1.06 0.28 0.00 -1.57 0.00 0.00 179.24 179.03 1dgg h ALA 250 N 1.01 0.94 -0.31 3.45 0.00 -0.52 -0.20 119.26 123.64 1dgg h ALA 250 Ca 0.12 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1dgg h ALA 250 Cb 0.68 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1dgg h ALA 250 CO 0.05 0.57 -0.07 0.00 0.00 0.00 0.00 179.25 179.81 1dgg h ALA 251 N 1.14 0.43 -0.23 0.00 0.00 -1.24 -0.96 119.26 118.40 1dgg h ALA 251 Ca 0.24 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1dgg h ALA 251 Cb 0.23 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1dgg h ALA 251 CO -0.02 0.25 0.14 -0.09 0.00 0.00 0.00 179.25 179.53 1dgg h ARG 252 N 0.37 0.28 -0.28 0.00 2.43 -1.14 -2.69 114.38 113.34 1dgg h ARG 252 Ca 0.08 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.17 1dgg h ARG 252 Cb 0.56 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 1dgg h ARG 252 CO 0.03 0.18 -0.11 -0.07 -1.51 0.00 0.00 179.97 178.49 1dgg h LEU 253 N 0.28 0.45 -2.43 3.80 3.38 -0.96 0.89 115.31 120.73 1dgg h LEU 253 Ca 0.09 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1dgg h LEU 253 Cb -0.01 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 1dgg h LEU 253 CO -0.04 0.60 -0.03 0.77 0.09 0.00 0.00 178.44 179.83 1dgg h SER 254 N 0.44 0.00 0.01 -0.43 4.64 -0.84 0.20 113.55 117.57 1dgg h SER 254 Ca 0.08 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.06 1dgg h SER 254 Cb 0.46 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.50 1dgg h SER 254 CO 0.03 0.03 -1.90 1.67 -0.87 0.00 0.00 176.83 175.79 1dgg n GLN 255 N -3.46 0.60 -0.10 4.77 0.00 -0.68 -4.12 117.38 114.39 1dgg n GLN 255 Ca -0.02 0.40 -0.12 0.00 -0.00 0.00 0.00 57.00 57.26 1dgg n GLN 255 Cb 0.14 -1.63 -0.04 0.00 0.00 0.00 0.00 30.24 28.71 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 -0.82 0.62 -2.07 3.69 5.08 -0.62 -3.41 114.58 117.05 1dgg h GLU 256 Ca -0.50 -0.26 -0.39 0.00 -1.00 0.00 0.00 59.36 57.20 1dgg h GLU 256 Cb 1.54 -0.02 -0.33 0.00 0.50 0.00 0.00 28.75 30.44 1dgg h GLU 256 CO -0.25 0.83 -0.70 0.34 -1.00 0.00 0.00 179.01 178.23 1dgg s ASP 257 N -6.28 1.51 0.43 1.42 2.15 0.68 -4.99 116.67 111.58 1dgg s ASP 257 Ca -0.13 -1.54 0.29 0.00 0.43 0.00 0.00 52.55 51.60 1dgg s ASP 257 Cb 0.08 0.41 1.50 0.00 -0.30 0.00 0.00 42.92 44.62 1dgg s ASP 257 CO 0.79 -0.29 1.89 -0.65 -0.17 0.00 0.00 175.17 176.75 1dgg h PRO 258 N 7.24 0.00 -0.56 4.34 0.11 -1.71 -2.00 132.00 139.41 1dgg h PRO 258 Ca 0.02 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 65.81 1dgg h PRO 258 Cb 1.05 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 31.97 1dgg h PRO 258 CO 0.23 0.00 0.07 -0.25 -0.21 0.00 0.00 178.00 177.84 1dgg n ASP 259 N -2.55 3.35 -0.18 -2.05 8.00 -1.26 -0.59 116.55 121.26 1dgg n ASP 259 Ca -0.01 -3.76 -0.00 0.00 0.71 0.00 0.00 54.79 51.72 1dgg n ASP 259 Cb 0.10 -0.68 0.09 0.00 -0.02 0.00 0.00 41.12 40.60 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 1.19 0.00 -0.88 1.24 5.03 -1.70 -0.69 116.97 121.16 1dgg h TYR 260 Ca 0.35 0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.70 1dgg h TYR 260 Cb 1.81 0.09 -0.04 0.00 1.55 0.00 0.00 36.73 40.13 1dgg h TYR 260 CO 1.17 -0.12 0.55 0.78 -1.32 0.00 0.00 178.16 179.22 1dgg h GLY 261 N 0.14 1.25 0.74 1.82 0.00 -1.87 0.47 103.07 105.62 1dgg h GLY 261 Ca 0.29 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 1dgg h GLY 261 CO -0.46 0.48 -0.10 -2.22 0.00 0.00 0.00 176.54 174.23 1dgg h ILE 262 N 1.20 0.86 0.03 2.60 2.04 -1.65 -2.50 117.51 120.09 1dgg h ILE 262 Ca 0.32 -0.52 0.03 0.00 1.00 0.00 0.00 64.86 65.68 1dgg h ILE 262 Cb -0.09 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 1dgg h ILE 262 CO -0.06 0.12 -0.24 -0.09 0.00 0.00 0.00 178.15 177.87 1dgg h ARG 263 N -0.56 -0.38 -0.30 2.37 2.43 -1.00 -0.73 114.38 116.20 1dgg h ARG 263 Ca -0.03 0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.22 1dgg h ARG 263 Cb 0.41 0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 29.97 1dgg h ARG 263 CO 0.05 -0.25 -0.43 0.22 -1.51 0.00 0.00 179.97 178.04 1dgg h ASP 264 N -0.40 -1.40 0.00 -3.80 3.58 -0.93 -0.02 116.42 113.45 1dgg h ASP 264 Ca 0.05 0.20 0.01 0.00 0.42 0.00 0.00 57.03 57.71 1dgg h ASP 264 Cb 0.47 0.60 -0.01 0.00 1.72 0.00 0.00 39.33 42.10 1dgg h ASP 264 CO -0.20 -0.39 -0.03 0.25 -2.88 0.00 0.00 179.24 175.98 1dgg h LEU 265 N -0.39 -0.10 0.48 2.28 5.85 -1.21 -1.61 115.31 120.61 1dgg h LEU 265 Ca 0.11 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1dgg h LEU 265 Cb 0.60 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 1dgg h LEU 265 CO -0.51 -0.05 -0.36 0.15 -0.34 0.00 0.00 178.44 177.33 1dgg h PHE 266 N -0.06 -0.96 -0.75 1.25 3.04 -0.73 -2.39 116.94 116.35 1dgg h PHE 266 Ca 0.01 -0.00 0.07 0.00 3.98 0.00 0.00 57.97 62.03 1dgg h PHE 266 Cb 0.08 0.35 -0.05 0.00 2.56 0.00 0.00 35.95 38.90 1dgg h PHE 266 CO -0.11 -0.53 0.49 -0.91 -2.02 0.00 0.00 178.31 175.24 1dgg h ASN 267 N -0.82 0.68 0.36 0.41 2.35 -0.98 0.10 115.58 117.68 1dgg h ASN 267 Ca -0.05 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.69 1dgg h ASN 267 Cb 0.70 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.93 1dgg h ASN 267 CO 0.01 0.43 -0.17 0.00 -1.65 0.00 0.00 177.43 176.05 1dgg h ALA 268 N 1.60 -0.49 -0.34 -0.83 0.00 -1.04 -1.35 119.26 116.81 1dgg h ALA 268 Ca 0.32 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1dgg h ALA 268 Cb 0.28 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1dgg h ALA 268 CO -0.11 -0.74 0.18 0.82 0.00 0.00 0.00 179.25 179.40 1dgg h ILE 269 N -0.55 1.14 -0.69 0.00 2.04 -1.01 0.12 117.51 118.56 1dgg h ILE 269 Ca -0.05 -0.38 0.12 0.00 1.00 0.00 0.00 64.86 65.55 1dgg h ILE 269 Cb 0.41 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 37.22 1dgg h ILE 269 CO 0.08 0.15 0.46 0.00 0.00 0.00 0.00 178.15 178.84 1dgg h ALA 270 N 1.05 2.05 -0.33 1.87 0.00 -0.68 -0.95 119.26 122.26 1dgg h ALA 270 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1dgg h ALA 270 Cb 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1dgg h ALA 270 CO -0.02 -0.22 0.00 0.25 0.00 0.00 0.00 179.25 179.26 1dgg n THR 271 N -4.48 0.43 -0.41 0.00 -2.24 -0.52 -4.92 114.28 102.14 1dgg n THR 271 Ca 0.12 -0.55 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 1dgg n THR 271 Cb 0.45 0.50 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 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 1.27 0.82 2.74 3.38 0.00 -0.36 -4.96 105.19 108.07 1dgg n GLY 272 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 3.73 -1.92 1.61 5.02 0.37 -4.96 118.16 120.01 1dgg n LYS 273 Ca 0.00 -3.32 -0.42 0.00 -2.02 0.00 0.00 58.31 52.54 1dgg n LYS 273 Cb 0.00 -2.90 -0.03 0.00 -0.02 0.00 0.00 35.03 32.08 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 0.51 1.77 0.41 2.13 4.12 -1.26 -4.15 117.35 120.89 1dgg s TYR 274 Ca 0.45 0.15 -0.23 0.00 0.02 0.00 0.00 57.07 57.45 1dgg s TYR 274 Cb 0.12 -4.01 -0.09 0.00 -1.52 0.00 0.00 41.96 36.47 1dgg s TYR 274 CO -0.03 -4.07 1.03 -1.25 0.02 0.00 0.00 175.55 171.25 1dgg s PRO 275 N 4.48 4.15 0.10 -1.71 0.04 -1.24 -4.86 135.00 135.96 1dgg s PRO 275 Ca 0.79 1.45 0.00 0.00 0.04 0.00 0.00 61.00 63.28 1dgg s PRO 275 Cb -0.34 -2.47 -0.04 0.00 0.04 0.00 0.00 34.50 31.69 1dgg s PRO 275 CO 0.33 -0.14 -0.02 -1.54 0.04 0.00 0.00 177.00 175.67 1dgg s SER 276 N -1.67 0.78 0.02 6.66 1.04 -1.26 -1.78 113.70 117.49 1dgg s SER 276 Ca 0.59 -1.08 0.02 0.00 0.48 0.00 0.00 55.95 55.97 1dgg s SER 276 Cb -0.20 0.17 -0.01 0.00 0.10 0.00 0.00 66.02 66.08 1dgg s SER 276 CO 0.25 -0.58 -0.08 0.26 0.98 0.00 0.00 173.24 174.07 1dgg s TRP 277 N -3.81 0.69 -0.30 5.02 0.51 0.14 -1.75 118.94 119.44 1dgg s TRP 277 Ca 0.15 -0.27 -0.16 0.00 -2.12 0.00 0.00 56.10 53.69 1dgg s TRP 277 Cb 0.07 -0.42 -0.02 0.00 -0.81 0.00 0.00 33.47 32.28 1dgg s TRP 277 CO -0.03 -0.03 0.43 0.99 -0.51 0.00 0.00 176.95 177.79 1dgg s THR 278 N -0.67 5.12 -0.09 2.01 2.01 -0.27 0.22 115.64 123.97 1dgg s THR 278 Ca -0.02 0.45 -0.27 0.00 0.31 0.00 0.00 61.69 62.16 1dgg s THR 278 Cb -0.06 -3.81 -0.02 0.00 0.01 0.00 0.00 72.50 68.62 1dgg s THR 278 CO 0.00 0.00 0.86 0.12 -0.69 0.00 0.00 174.62 174.91 1dgg s PHE 279 N 2.18 3.54 0.28 4.92 5.36 0.12 -1.63 117.98 132.74 1dgg s PHE 279 Ca 0.16 1.42 0.02 0.00 -0.96 0.00 0.00 56.93 57.57 1dgg s PHE 279 Cb -0.16 -3.01 -0.05 0.00 -0.34 0.00 0.00 43.02 39.46 1dgg s PHE 279 CO 0.11 -0.09 0.09 0.71 -1.46 0.00 0.00 175.22 174.58 1dgg s TYR 280 N 1.48 1.64 -0.02 10.12 2.02 0.24 -0.56 117.35 132.27 1dgg s TYR 280 Ca 0.43 -1.15 -0.08 0.00 -0.37 0.00 0.00 57.07 55.90 1dgg s TYR 280 Cb -0.18 -0.99 0.01 0.00 -0.40 0.00 0.00 41.96 40.40 1dgg s TYR 280 CO 0.19 -0.28 0.17 0.96 -1.57 0.00 0.00 175.55 175.02 1dgg s ILE 281 N -3.63 0.06 -0.12 2.71 -4.36 -0.14 -1.04 121.20 114.68 1dgg s ILE 281 Ca 0.37 -0.49 -0.02 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 -0.27 -0.04 -1.10 0.24 0.00 0.00 174.94 173.92 1dgg s GLN 282 N -0.99 3.26 -0.02 0.37 -0.21 -0.26 -0.69 119.66 121.13 1dgg s GLN 282 Ca -0.11 -0.50 0.06 0.00 0.02 0.00 0.00 55.36 54.84 1dgg s GLN 282 Cb -0.06 -2.80 -0.03 0.00 1.00 0.00 0.00 33.01 31.13 1dgg s GLN 282 CO 0.02 0.47 -0.20 0.08 -2.12 0.00 0.00 175.29 173.54 1dgg s VAL 283 N -0.26 2.61 -0.04 1.09 1.01 -1.26 -1.24 120.40 122.31 1dgg s VAL 283 Ca 0.05 -0.98 -0.01 0.00 0.00 0.00 0.00 61.98 61.03 1dgg s VAL 283 Cb -0.13 -2.00 0.03 0.00 0.00 0.00 0.00 36.38 34.29 1dgg s VAL 283 CO 0.02 0.53 0.06 -0.32 0.00 0.00 0.00 175.10 175.39 1dgg s MET 284 N -0.85 -0.05 0.87 2.72 0.00 -0.21 -4.93 119.30 116.85 1dgg s MET 284 Ca 0.12 0.32 -0.12 0.00 0.00 0.00 0.00 55.69 56.00 1dgg s MET 284 Cb -0.10 -0.38 0.11 0.00 0.00 0.00 0.00 34.83 34.46 1dgg s MET 284 CO 0.01 -0.26 1.10 0.95 0.00 0.00 0.00 175.02 176.82 1dgg s THR 285 N 1.70 2.62 0.34 10.11 -4.23 -1.26 -0.79 115.64 124.13 1dgg s THR 285 Ca -0.01 0.20 0.05 0.00 -1.18 0.00 0.00 61.69 60.75 1dgg s THR 285 Cb -0.12 -2.85 0.15 0.00 1.34 0.00 0.00 72.50 71.02 1dgg s THR 285 CO -0.03 -0.26 1.87 -0.26 -0.54 0.00 0.00 174.62 175.40 1dgg h PHE 286 N -1.38 0.49 -0.50 3.99 -1.00 -1.97 -1.92 116.94 114.65 1dgg h PHE 286 Ca -0.49 -0.05 -0.09 0.00 2.81 0.00 0.00 57.97 60.14 1dgg h PHE 286 Cb 1.29 -0.14 -0.02 0.00 3.61 0.00 0.00 35.95 40.69 1dgg h PHE 286 CO 0.40 0.51 -0.06 -0.91 -1.61 0.00 0.00 178.31 176.64 1dgg h ASN 287 N 0.45 0.87 -0.31 2.17 4.21 -1.98 -2.80 115.58 118.19 1dgg h ASN 287 Ca 0.09 -0.25 -0.10 0.00 1.21 0.00 0.00 56.30 57.26 1dgg h ASN 287 Cb 0.36 -0.23 -0.01 0.00 -1.12 0.00 0.00 38.32 37.31 1dgg h ASN 287 CO 0.01 0.96 -0.19 1.56 -1.29 0.00 0.00 177.43 178.49 1dgg h GLN 288 N 0.81 0.67 -0.41 0.81 4.20 -1.77 -2.83 115.11 116.58 1dgg h GLN 288 Ca 0.14 -0.31 0.11 0.00 0.06 0.00 0.00 58.65 58.66 1dgg h GLN 288 Cb 0.56 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 1dgg h GLN 288 CO 0.03 0.91 0.30 0.00 -0.67 0.00 0.00 178.83 179.39 1dgg h ALA 289 N 0.75 2.33 0.00 3.87 0.00 -1.25 0.34 119.26 125.30 1dgg h ALA 289 Ca 0.06 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1dgg h ALA 289 Cb 0.73 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1dgg h ALA 289 CO 0.05 -0.45 -0.44 1.49 0.00 0.00 0.00 179.25 179.90 1dgg h GLU 290 N 0.04 0.00 -0.01 0.00 4.57 -1.25 -3.20 114.58 114.74 1dgg h GLU 290 Ca 0.20 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.38 1dgg h GLU 290 Cb 0.73 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.32 1dgg h GLU 290 CO -0.01 0.44 -0.72 0.25 -1.18 0.00 0.00 179.01 177.79 1dgg n THR 291 N -3.66 0.00 -1.68 0.32 -2.24 0.98 -4.98 114.28 103.02 1dgg n THR 291 Ca -0.01 -0.14 -0.45 0.00 -2.27 0.00 0.00 64.05 61.18 1dgg n THR 291 Cb 0.53 1.10 -0.04 0.00 -2.10 0.00 0.00 70.33 69.82 1dgg n THR 291 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1dgg n PHE 292 N -0.87 2.42 0.19 4.78 -0.00 0.06 -4.86 117.46 119.18 1dgg n PHE 292 Ca 0.06 0.21 0.11 0.00 -0.00 0.00 0.00 57.45 57.83 1dgg n PHE 292 Cb 0.36 -2.58 0.59 0.00 -0.00 0.00 0.00 39.48 37.85 1dgg n PHE 292 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.76 175.41 1dgg h PRO 293 N 6.05 0.00 0.00 -7.13 0.11 -1.92 -3.43 132.00 125.68 1dgg h PRO 293 Ca -0.44 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.52 1dgg h PRO 293 Cb 1.24 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.32 1dgg h PRO 293 CO 0.90 0.00 -0.12 1.19 -0.21 0.00 0.00 178.00 179.76 1dgg n PHE 294 N -2.30 0.06 -2.77 0.65 3.72 -1.26 -5.09 117.46 110.47 1dgg n PHE 294 Ca -0.01 -0.68 -0.42 0.00 -0.05 0.00 0.00 57.45 56.28 1dgg n PHE 294 Cb 0.15 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.65 1dgg n PHE 294 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1dgg s ASN 295 N -1.67 6.97 0.30 4.37 2.47 -1.26 -4.88 114.94 121.24 1dgg s ASN 295 Ca 0.05 1.20 0.24 0.00 0.42 0.00 0.00 52.86 54.77 1dgg s ASN 295 Cb 0.00 -2.49 1.09 0.00 -1.45 0.00 0.00 41.25 38.40 1dgg s ASN 295 CO 0.03 -0.61 1.72 1.55 -3.72 0.00 0.00 177.10 176.07 1dgg h PRO 296 N 7.58 0.00 -0.68 0.43 0.13 -1.89 -2.38 132.00 135.19 1dgg h PRO 296 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1dgg h PRO 296 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1dgg h PRO 296 CO 0.93 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.89 1dgg n PHE 297 N -2.29 0.90 -2.84 1.56 3.72 -1.26 -4.74 117.46 112.51 1dgg n PHE 297 Ca 0.01 -0.48 -0.43 0.00 -0.05 0.00 0.00 57.45 56.50 1dgg n PHE 297 Cb 0.16 -0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.65 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 -1.04 6.62 0.16 4.37 3.68 -0.90 -4.47 116.67 125.09 1dgg s ASP 298 Ca 0.46 0.44 0.12 0.00 2.13 0.00 0.00 52.55 55.70 1dgg s ASP 298 Cb 0.24 -2.45 0.62 0.00 -1.45 0.00 0.00 42.92 39.88 1dgg s ASP 298 CO 0.32 -0.88 1.37 0.18 0.13 0.00 0.00 175.17 176.29 1dgg n LEU 299 N 6.79 0.29 -0.59 -1.34 4.77 -1.26 -1.41 117.00 124.26 1dgg n LEU 299 Ca 0.06 0.63 0.13 0.00 -0.03 0.00 0.00 56.01 56.79 1dgg n LEU 299 Cb 0.48 -0.65 0.42 0.00 -2.33 0.00 0.00 43.42 41.34 1dgg n LEU 299 CO 0.59 -0.68 0.81 0.35 -1.33 0.00 0.00 177.39 177.12 1dgg n THR 300 N -1.88 0.10 -4.34 -5.08 -2.24 -1.26 -1.66 114.28 97.92 1dgg n THR 300 Ca -0.00 -0.33 -0.27 0.00 -2.27 0.00 0.00 64.05 61.18 1dgg n THR 300 Cb 0.04 0.58 -0.10 0.00 -2.10 0.00 0.00 70.33 68.75 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 -1.90 1.87 0.25 -0.78 -0.14 -0.50 -4.88 119.74 113.65 1dgg s LYS 301 Ca 0.35 -1.37 0.11 0.00 -1.36 0.00 0.00 55.97 53.70 1dgg s LYS 301 Cb 0.20 -2.04 -0.05 0.00 -1.68 0.00 0.00 37.83 34.26 1dgg s LYS 301 CO 0.31 0.42 -0.15 0.14 -0.76 0.00 0.00 175.35 175.31 1dgg s VAL 302 N -1.73 2.77 -0.42 3.17 -7.23 -1.26 -4.84 120.40 110.86 1dgg s VAL 302 Ca 0.24 -2.12 -0.18 0.00 -1.81 0.00 0.00 61.98 58.11 1dgg s VAL 302 Cb -0.08 -2.43 0.02 0.00 0.56 0.00 0.00 36.38 34.45 1dgg s VAL 302 CO 0.13 -0.30 0.48 0.26 -0.31 0.00 0.00 175.10 175.36 1dgg s TRP 303 N -2.19 3.15 0.10 2.82 0.52 -1.26 -5.03 118.94 117.05 1dgg s TRP 303 Ca 0.28 -0.29 -0.35 0.00 0.02 0.00 0.00 56.10 55.76 1dgg s TRP 303 Cb -0.06 -2.98 -0.14 0.00 -1.15 0.00 0.00 33.47 29.13 1dgg s TRP 303 CO 0.15 -0.73 1.55 -2.30 0.02 0.00 0.00 176.95 175.65 1dgg n PRO 304 N 5.73 1.87 -0.16 4.98 -0.02 -1.26 -4.77 135.00 141.36 1dgg n PRO 304 Ca -0.06 0.67 0.04 0.00 -2.02 0.00 0.00 63.50 62.13 1dgg n PRO 304 Cb 0.48 -2.42 0.32 0.00 -0.02 0.00 0.00 33.50 31.86 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 5.92 0.79 -1.00 6.00 3.86 -1.97 0.33 115.15 129.08 1dgg h HIS 305 Ca -0.46 0.02 0.15 0.00 -1.16 0.00 0.00 60.37 58.92 1dgg h HIS 305 Cb 1.28 -0.26 -0.09 0.00 1.06 0.00 0.00 27.41 29.39 1dgg h HIS 305 CO 0.65 0.46 0.62 0.87 0.86 0.00 0.00 177.93 181.39 1dgg h LYS 306 N 0.82 0.88 0.00 2.45 1.57 -1.99 -1.40 116.57 118.90 1dgg h LYS 306 Ca 0.27 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.92 1dgg h LYS 306 Cb 0.06 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 1dgg h LYS 306 CO -0.07 0.58 -1.63 -0.25 -0.57 0.00 0.00 179.45 177.51 1dgg n ASP 307 N -4.67 0.43 -3.48 0.86 10.43 -0.69 -4.65 116.55 114.78 1dgg n ASP 307 Ca 0.20 0.18 -0.28 0.00 2.57 0.00 0.00 54.79 57.47 1dgg n ASP 307 Cb 0.44 1.03 -0.11 0.00 1.84 0.00 0.00 41.12 44.32 1dgg n ASP 307 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 1dgg s TYR 308 N -3.22 1.31 0.69 1.24 2.02 0.11 -5.04 117.35 114.45 1dgg s TYR 308 Ca -0.05 -2.29 -0.17 0.00 -0.37 0.00 0.00 57.07 54.20 1dgg s TYR 308 Cb 0.11 -1.15 0.01 0.00 -0.40 0.00 0.00 41.96 40.53 1dgg s TYR 308 CO 0.84 -0.80 1.23 -2.30 -1.57 0.00 0.00 175.55 172.96 1dgg n PRO 309 N 3.05 0.82 -2.60 -1.71 -0.02 -0.59 -4.17 135.00 129.79 1dgg n PRO 309 Ca 0.24 0.34 -0.42 0.00 -2.02 0.00 0.00 63.50 61.64 1dgg n PRO 309 Cb 0.44 -2.47 -0.03 0.00 -0.02 0.00 0.00 33.50 31.42 1dgg n PRO 309 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1dgg s LEU 310 N -4.49 4.25 -0.30 2.45 1.43 -1.26 -4.58 118.68 116.18 1dgg s LEU 310 Ca 0.80 1.63 -0.09 0.00 -1.03 0.00 0.00 54.13 55.43 1dgg s LEU 310 Cb -0.36 -3.56 -0.01 0.00 0.03 0.00 0.00 46.19 42.30 1dgg s LEU 310 CO 0.44 -0.52 0.14 -0.63 0.23 0.00 0.00 176.35 176.01 1dgg s ILE 311 N 2.20 4.58 0.35 -0.59 1.01 0.14 -4.89 121.20 123.99 1dgg s ILE 311 Ca 0.51 -0.36 -0.28 0.00 0.00 0.00 0.00 60.65 60.52 1dgg s ILE 311 Cb -0.20 -3.30 -0.11 0.00 0.01 0.00 0.00 42.46 38.86 1dgg s ILE 311 CO 0.19 0.12 1.44 -2.16 0.00 0.00 0.00 174.94 174.52 1dgg s PRO 312 N 1.62 4.19 0.01 2.79 0.04 -1.26 -0.96 135.00 141.43 1dgg s PRO 312 Ca 0.05 2.45 0.00 0.00 0.04 0.00 0.00 61.00 63.54 1dgg s PRO 312 Cb -0.17 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.36 1dgg s PRO 312 CO 0.06 -0.43 0.00 0.28 0.04 0.00 0.00 177.00 176.95 1dgg n VAL 313 N 0.77 0.08 -2.40 -0.36 0.31 0.27 -4.59 118.33 112.42 1dgg n VAL 313 Ca 0.01 0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1dgg n VAL 313 Cb 0.40 -1.29 0.00 0.00 -0.91 0.00 0.00 33.84 32.04 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 2.71 1.89 3.30 2.92 0.00 -1.03 0.14 105.19 115.11 1dgg n GLY 314 Ca 0.00 -0.64 -0.25 0.00 0.00 0.00 0.00 46.02 45.13 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 1.10 1.20 -0.19 1.61 -0.14 0.10 0.11 119.74 123.53 1dgg s LYS 315 Ca 0.00 -1.17 0.00 0.00 -1.36 0.00 0.00 55.97 53.44 1dgg s LYS 315 Cb 0.00 -1.48 0.02 0.00 -1.68 0.00 0.00 37.83 34.68 1dgg s LYS 315 CO 0.00 0.35 -0.18 -1.17 -0.76 0.00 0.00 175.35 173.59 1dgg s LEU 316 N -1.86 2.25 -0.09 3.17 2.96 0.13 -1.59 118.68 123.65 1dgg s LEU 316 Ca 0.08 -0.63 0.02 0.00 -0.22 0.00 0.00 54.13 53.38 1dgg s LEU 316 Cb -0.10 -1.51 0.01 0.00 0.50 0.00 0.00 46.19 45.09 1dgg s LEU 316 CO 0.04 -0.01 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.24 1dgg s VAL 317 N 1.31 1.32 -0.36 1.68 1.01 -0.30 0.27 120.40 125.33 1dgg s VAL 317 Ca 0.05 -0.56 -0.10 0.00 0.00 0.00 0.00 61.98 61.38 1dgg s VAL 317 Cb -0.13 -1.21 0.03 0.00 0.00 0.00 0.00 36.38 35.06 1dgg s VAL 317 CO -0.12 0.40 0.18 -0.76 0.00 0.00 0.00 175.10 174.80 1dgg s LEU 318 N 0.87 4.57 0.00 3.92 1.43 -0.74 -0.80 118.68 127.93 1dgg s LEU 318 Ca -0.10 -0.99 0.00 0.00 -1.03 0.00 0.00 54.13 52.01 1dgg s LEU 318 Cb -0.15 -1.98 0.00 0.00 0.03 0.00 0.00 46.19 44.09 1dgg s LEU 318 CO 0.01 -0.36 0.67 -0.46 0.23 0.00 0.00 176.35 176.44 1dgg n ASN 319 N 4.95 1.12 -3.86 2.29 6.94 0.55 -3.61 115.26 123.65 1dgg n ASN 319 Ca -0.12 -1.44 -0.19 0.00 -0.02 0.00 0.00 54.58 52.81 1dgg n ASN 319 Cb 0.46 0.00 -0.16 0.00 -2.36 0.00 0.00 39.78 37.72 1dgg n ASN 319 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 1dgg s ARG 320 N -0.44 0.61 0.59 -3.83 3.52 0.57 -4.99 118.95 114.97 1dgg s ARG 320 Ca 0.00 -0.03 -0.06 0.00 -0.13 0.00 0.00 55.73 55.51 1dgg s ARG 320 Cb 0.00 -0.69 0.00 0.00 -1.56 0.00 0.00 34.95 32.70 1dgg s ARG 320 CO 0.00 -0.11 0.91 -0.80 -0.81 0.00 0.00 175.30 174.49 1dgg s ASN 321 N 0.98 5.67 0.52 -2.12 0.01 -1.26 0.46 114.94 119.19 1dgg s ASN 321 Ca -0.10 0.79 -0.18 0.00 -0.71 0.00 0.00 52.86 52.66 1dgg s ASN 321 Cb -0.14 -1.81 -0.07 0.00 0.41 0.00 0.00 41.25 39.64 1dgg s ASN 321 CO -0.01 -1.03 1.02 -2.84 -1.51 0.00 0.00 177.10 172.73 1dgg s PRO 322 N -5.00 3.74 -0.17 -0.60 0.02 -1.26 -4.82 135.00 126.91 1dgg s PRO 322 Ca 0.54 1.20 0.11 0.00 0.02 0.00 0.00 61.00 62.86 1dgg s PRO 322 Cb -0.11 -2.10 -0.23 0.00 0.02 0.00 0.00 34.50 32.09 1dgg s PRO 322 CO 0.46 -0.46 0.17 0.28 -0.33 0.00 0.00 177.00 177.12 1dgg n VAL 323 N -1.37 1.50 -3.67 3.83 0.31 -1.26 -4.82 118.33 112.86 1dgg n VAL 323 Ca 0.08 -0.76 -0.27 0.00 -0.01 0.00 0.00 64.34 63.38 1dgg n VAL 323 Cb 0.53 -0.93 -0.17 0.00 -0.91 0.00 0.00 33.84 32.37 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 -6.01 2.72 0.14 4.52 3.84 -1.26 -5.06 114.94 113.83 1dgg s ASN 324 Ca -0.15 -0.78 -0.23 0.00 0.21 0.00 0.00 52.86 51.91 1dgg s ASN 324 Cb 0.07 -0.43 0.00 0.00 -0.55 0.00 0.00 41.25 40.35 1dgg s ASN 324 CO 0.77 -0.34 1.64 0.22 -2.79 0.00 0.00 177.10 176.61 1dgg h TYR 325 N 8.33 -0.56 -0.12 0.43 3.20 -1.97 0.39 116.97 126.67 1dgg h TYR 325 Ca -0.16 0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.78 1dgg h TYR 325 Cb 1.12 0.27 -0.04 0.00 1.54 0.00 0.00 36.73 39.63 1dgg h TYR 325 CO 0.22 -0.29 -0.10 0.35 -1.64 0.00 0.00 178.16 176.71 1dgg h PHE 326 N -0.25 -0.24 -0.48 -3.82 3.04 -1.97 0.87 116.94 114.10 1dgg h PHE 326 Ca 0.11 0.02 -0.06 0.00 3.98 0.00 0.00 57.97 62.02 1dgg h PHE 326 Cb 0.42 0.12 -0.02 0.00 2.56 0.00 0.00 35.95 39.04 1dgg h PHE 326 CO -0.34 -0.15 0.07 0.00 -2.02 0.00 0.00 178.31 175.87 1dgg h ALA 327 N 0.98 0.63 0.00 2.41 0.00 -1.93 -1.68 119.26 119.67 1dgg h ALA 327 Ca 0.08 -0.24 -0.20 0.00 0.00 0.00 0.00 54.91 54.56 1dgg h ALA 327 Cb 0.23 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1dgg h ALA 327 CO -0.19 0.37 -1.80 0.39 0.00 0.00 0.00 179.25 178.02 1dgg n GLU 328 N -4.43 0.65 -0.04 0.00 1.02 0.11 -4.38 120.64 113.57 1dgg n GLU 328 Ca 0.01 0.09 -0.09 0.00 -0.02 0.00 0.00 57.16 57.15 1dgg n GLU 328 Cb 0.26 -1.68 -0.03 0.00 -0.02 0.00 0.00 31.44 29.97 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 -2.74 0.71 -0.20 2.62 0.31 0.29 -4.31 118.33 115.01 1dgg n VAL 329 Ca -0.15 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 1dgg n VAL 329 Cb 0.89 -1.68 0.24 0.00 -0.91 0.00 0.00 33.84 32.38 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 -0.35 0.96 -0.01 5.55 4.57 -1.16 -2.51 114.58 121.63 1dgg h GLU 330 Ca -0.19 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 57.91 1dgg h GLU 330 Cb 1.02 -0.21 0.00 0.00 -0.16 0.00 0.00 28.75 29.41 1dgg h GLU 330 CO -0.12 0.66 -0.08 1.04 -1.18 0.00 0.00 179.01 179.33 1dgg n GLN 331 N -4.40 1.30 -2.19 1.92 6.02 -0.64 -4.93 117.38 114.46 1dgg n GLN 331 Ca 0.07 -0.70 -0.38 0.00 -0.01 0.00 0.00 57.00 55.98 1dgg n GLN 331 Cb 0.06 -1.49 -0.01 0.00 1.02 0.00 0.00 30.24 29.82 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 -2.18 2.93 -0.07 5.09 2.07 -0.95 -4.88 121.20 123.21 1dgg s ILE 332 Ca 0.34 0.78 -0.01 0.00 -1.41 0.00 0.00 60.65 60.35 1dgg s ILE 332 Cb 0.21 -3.43 0.03 0.00 0.13 0.00 0.00 42.46 39.39 1dgg s ILE 332 CO 0.40 0.07 -0.00 0.00 -1.91 0.00 0.00 174.94 173.50 1dgg s ALA 333 N -1.38 0.72 -0.19 1.50 0.00 -1.26 -5.04 121.76 116.12 1dgg s ALA 333 Ca 0.59 -0.14 -0.06 0.00 0.00 0.00 0.00 51.96 52.35 1dgg s ALA 333 Cb -0.33 -0.74 -0.03 0.00 0.00 0.00 0.00 23.12 22.02 1dgg s ALA 333 CO 0.42 -0.44 0.03 -0.06 0.00 0.00 0.00 175.76 175.71 1dgg s PHE 334 N 1.91 3.13 -0.21 0.00 0.08 -1.26 -4.96 117.98 116.68 1dgg s PHE 334 Ca 0.04 -0.17 0.01 0.00 0.12 0.00 0.00 56.93 56.93 1dgg s PHE 334 Cb -0.12 -2.07 0.03 0.00 -0.57 0.00 0.00 43.02 40.29 1dgg s PHE 334 CO -0.05 -0.02 -0.14 -0.51 -0.10 0.00 0.00 175.22 174.39 1dgg s ASP 335 N 0.63 3.72 0.64 1.36 -0.00 -1.26 -4.87 116.67 116.89 1dgg s ASP 335 Ca 0.01 -0.85 0.37 0.00 -0.00 0.00 0.00 52.55 52.08 1dgg s ASP 335 Cb -0.14 -1.54 2.08 0.00 -0.00 0.00 0.00 42.92 43.32 1dgg s ASP 335 CO 0.02 -0.07 2.26 -0.65 -0.00 0.00 0.00 175.17 176.73 1dgg h PRO 336 N 7.92 0.00 0.00 8.23 0.11 -1.83 0.24 132.00 146.68 1dgg h PRO 336 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1dgg h PRO 336 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1dgg h PRO 336 CO 0.58 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.24 1dgg n SER 337 N -3.37 0.00 -4.49 -2.05 3.41 -1.26 -4.35 113.62 101.51 1dgg n SER 337 Ca -0.02 -0.13 -0.43 0.00 -0.26 0.00 0.00 58.87 58.02 1dgg n SER 337 Cb 0.14 -0.25 -0.01 0.00 -0.26 0.00 0.00 64.21 63.83 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 -2.50 6.89 -0.11 4.04 0.01 0.85 -4.93 114.94 119.19 1dgg s ASN 338 Ca 0.24 -2.58 0.00 0.00 -0.71 0.00 0.00 52.86 49.81 1dgg s ASN 338 Cb 0.16 -2.45 0.02 0.00 0.41 0.00 0.00 41.25 39.39 1dgg s ASN 338 CO 0.35 -0.96 -0.10 -0.04 -1.51 0.00 0.00 177.10 174.84 1dgg s MET 339 N 2.63 1.66 0.91 -0.60 -1.94 -1.26 -1.02 119.30 119.68 1dgg s MET 339 Ca 0.44 -0.33 -0.14 0.00 -1.71 0.00 0.00 55.69 53.95 1dgg s MET 339 Cb -0.01 -1.60 0.15 0.00 2.01 0.00 0.00 34.83 35.37 1dgg s MET 339 CO -0.01 -0.19 1.21 -1.25 -0.01 0.00 0.00 175.02 174.77 1dgg s PRO 340 N 1.42 1.11 0.26 2.03 0.04 -1.26 -4.90 135.00 133.70 1dgg s PRO 340 Ca 0.00 -0.02 -0.31 0.00 0.04 0.00 0.00 61.00 60.71 1dgg s PRO 340 Cb -0.13 -1.86 -0.12 0.00 0.04 0.00 0.00 34.50 32.42 1dgg s PRO 340 CO -0.05 -2.16 1.57 -2.30 0.04 0.00 0.00 177.00 174.10 1dgg n PRO 341 N -3.68 2.53 0.00 0.56 -0.02 -1.26 -2.11 135.00 131.02 1dgg n PRO 341 Ca 0.10 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 1dgg n PRO 341 Cb 0.60 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 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 2.51 2.81 2.97 -1.23 0.00 -1.26 -3.38 105.19 107.61 1dgg n GLY 342 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.48 1.19 0.32 -0.61 1.01 -0.90 -0.92 121.20 118.82 1dgg s ILE 343 Ca 0.00 -0.43 0.04 0.00 0.00 0.00 0.00 60.65 60.26 1dgg s ILE 343 Cb 0.00 -1.14 -0.04 0.00 0.01 0.00 0.00 42.46 41.29 1dgg s ILE 343 CO 0.00 0.39 0.16 -1.61 0.00 0.00 0.00 174.94 173.87 1dgg s GLU 344 N 1.32 1.66 0.44 2.79 2.02 0.67 -4.35 118.70 123.25 1dgg s GLU 344 Ca -0.01 -1.96 -0.05 0.00 0.02 0.00 0.00 54.97 52.97 1dgg s GLU 344 Cb -0.14 -0.20 -0.04 0.00 0.10 0.00 0.00 34.13 33.85 1dgg s GLU 344 CO -0.05 -0.45 0.73 0.00 0.02 0.00 0.00 175.26 175.51 1dgg s ALA 345 N -3.52 3.46 0.43 5.21 0.00 -1.26 -1.14 121.76 124.94 1dgg s ALA 345 Ca 0.34 -0.55 0.08 0.00 0.00 0.00 0.00 51.96 51.83 1dgg s ALA 345 Cb 0.05 -2.50 -0.01 0.00 0.00 0.00 0.00 23.12 20.66 1dgg s ALA 345 CO 0.17 -0.23 0.40 -1.54 0.00 0.00 0.00 175.76 174.57 1dgg s SER 346 N -3.95 5.05 0.00 0.00 1.04 -1.25 -4.41 113.70 110.18 1dgg s SER 346 Ca 0.46 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 56.13 1dgg s SER 346 Cb -0.10 -0.49 0.00 0.00 0.10 0.00 0.00 66.02 65.53 1dgg s SER 346 CO 0.41 -0.71 0.44 -0.81 0.98 0.00 0.00 173.24 173.55 1dgg n PRO 347 N -1.60 0.79 -1.78 4.02 -0.04 -1.26 -4.65 135.00 130.48 1dgg n PRO 347 Ca 0.04 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.07 1dgg n PRO 347 Cb 0.62 -1.37 -0.03 0.00 -0.04 0.00 0.00 33.50 32.68 1dgg n PRO 347 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1dgg s ASP 348 N -0.08 6.00 0.34 3.54 -1.08 -1.26 -4.85 116.67 119.28 1dgg s ASP 348 Ca 0.00 2.01 0.12 0.00 -0.52 0.00 0.00 52.55 54.16 1dgg s ASP 348 Cb 0.00 -2.52 0.95 0.00 -1.46 0.00 0.00 42.92 39.89 1dgg s ASP 348 CO 0.00 -1.51 1.74 0.11 0.52 0.00 0.00 175.17 176.03 1dgg h LYS 349 N 12.56 0.52 -0.22 4.34 1.57 -1.81 0.58 116.57 134.10 1dgg h LYS 349 Ca -0.41 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.32 1dgg h LYS 349 Cb 1.21 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.40 1dgg h LYS 349 CO 0.97 0.34 0.06 0.52 -0.57 0.00 0.00 179.45 180.77 1dgg h MET 350 N 0.53 0.36 -0.24 3.15 2.86 -1.89 -1.36 114.93 118.33 1dgg h MET 350 Ca 0.63 -0.08 -0.02 0.00 -2.06 0.00 0.00 59.70 58.17 1dgg h MET 350 Cb 1.31 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.91 1dgg h MET 350 CO -0.42 0.47 0.08 1.25 1.06 0.00 0.00 176.91 179.35 1dgg h LEU 351 N 0.18 0.34 -0.84 1.22 5.85 -1.44 -1.96 115.31 118.66 1dgg h LEU 351 Ca 0.07 -0.19 0.18 0.00 0.84 0.00 0.00 57.88 58.78 1dgg h LEU 351 Cb 0.27 -0.09 -0.11 0.00 0.37 0.00 0.00 40.66 41.10 1dgg h LEU 351 CO 0.00 0.43 0.36 1.56 -0.34 0.00 0.00 178.44 180.45 1dgg h GLN 352 N 0.23 0.44 -0.46 1.25 1.08 -0.84 0.10 115.11 116.91 1dgg h GLN 352 Ca 0.08 -0.03 -0.14 0.00 -1.45 0.00 0.00 58.65 57.11 1dgg h GLN 352 Cb 0.21 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.53 1dgg h GLN 352 CO -0.00 0.29 -0.27 0.78 -0.95 0.00 0.00 178.83 178.68 1dgg h GLY 353 N 0.45 1.08 2.00 3.46 0.00 -0.91 -2.82 103.07 106.34 1dgg h GLY 353 Ca 0.49 -1.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.80 1dgg h GLY 353 CO -0.46 0.91 -0.10 3.21 0.00 0.00 0.00 176.54 180.10 1dgg h ARG 354 N 0.84 0.00 -1.00 4.80 3.08 -0.11 -1.85 114.38 120.14 1dgg h ARG 354 Ca 0.10 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.24 1dgg h ARG 354 Cb 0.85 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.83 1dgg h ARG 354 CO 0.08 0.10 0.64 -0.07 -1.07 0.00 0.00 179.97 179.65 1dgg h LEU 355 N 0.00 0.98 0.00 3.04 4.07 -0.85 -3.10 115.31 119.45 1dgg h LEU 355 Ca -0.00 0.03 -0.10 0.00 0.08 0.00 0.00 57.88 57.88 1dgg h LEU 355 Cb 0.28 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 41.82 1dgg h LEU 355 CO 0.01 0.58 -0.61 0.15 -1.08 0.00 0.00 178.44 177.49 1dgg h PHE 356 N 1.09 0.00 -0.53 1.13 3.57 -1.47 -3.42 116.94 117.31 1dgg h PHE 356 Ca 0.46 0.00 0.09 0.00 3.53 0.00 0.00 57.97 62.06 1dgg h PHE 356 Cb 0.32 0.00 -0.11 0.00 2.79 0.00 0.00 35.95 38.95 1dgg h PHE 356 CO -0.00 1.03 -0.35 0.00 -2.23 0.00 0.00 178.31 176.76 1dgg h ALA 357 N -0.41 -0.12 0.10 2.41 0.00 -1.30 -3.01 119.26 116.93 1dgg h ALA 357 Ca -0.16 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1dgg h ALA 357 Cb 1.00 0.79 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1dgg h ALA 357 CO -0.09 -0.71 -0.05 1.88 0.00 0.00 0.00 179.25 180.27 1dgg h TYR 358 N -0.20 -0.13 -0.57 0.00 0.05 -1.80 0.28 116.97 114.61 1dgg h TYR 358 Ca 0.21 -0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.98 1dgg h TYR 358 Cb 0.55 0.04 -0.03 0.00 1.01 0.00 0.00 36.73 38.30 1dgg h TYR 358 CO -0.62 -0.04 0.33 -1.35 -1.05 0.00 0.00 178.16 175.43 1dgg h PRO 359 N -0.18 0.78 0.19 4.88 0.11 -1.81 -1.59 132.00 134.37 1dgg h PRO 359 Ca -0.01 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 1dgg h PRO 359 Cb 0.14 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.09 1dgg h PRO 359 CO 0.02 0.56 -0.09 0.22 -0.21 0.00 0.00 178.00 178.50 1dgg h ASP 360 N 0.79 -0.21 0.52 -2.05 3.58 -1.35 -2.37 116.42 115.33 1dgg h ASP 360 Ca 0.20 -0.09 -0.04 0.00 0.42 0.00 0.00 57.03 57.53 1dgg h ASP 360 Cb -0.00 0.06 -0.01 0.00 1.72 0.00 0.00 39.33 41.10 1dgg h ASP 360 CO -0.04 -0.05 -0.17 0.00 -2.88 0.00 0.00 179.24 176.11 1dgg h THR 361 N -0.37 0.60 -0.03 2.25 1.03 -0.71 -2.82 112.91 112.86 1dgg h THR 361 Ca -0.03 -0.75 -0.20 0.00 -0.01 0.00 0.00 66.41 65.42 1dgg h THR 361 Cb 0.29 1.49 -0.00 0.00 -1.07 0.00 0.00 68.15 68.85 1dgg h THR 361 CO 0.04 0.16 -0.83 0.45 -0.01 0.00 0.00 175.52 175.33 1dgg h HIS 362 N 0.00 0.48 0.00 0.00 3.86 -1.06 -0.32 115.15 118.11 1dgg h HIS 362 Ca -0.00 -0.24 -0.02 0.00 -1.16 0.00 0.00 60.37 58.94 1dgg h HIS 362 Cb 0.47 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 28.88 1dgg h HIS 362 CO 0.00 1.03 -0.11 0.00 0.86 0.00 0.00 177.93 179.71 1dgg h ARG 363 N 0.21 0.00 0.00 2.45 3.08 -1.17 0.24 114.38 119.19 1dgg h ARG 363 Ca -0.05 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.85 1dgg h ARG 363 Cb 1.44 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.47 1dgg h ARG 363 CO 0.14 0.11 -0.91 1.25 -1.07 0.00 0.00 179.97 179.49 1dgg h HIS 364 N 0.00 0.00 -0.11 3.04 2.76 -1.51 -3.06 115.15 116.27 1dgg h HIS 364 Ca -0.00 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.16 1dgg h HIS 364 Cb 0.39 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.35 1dgg h HIS 364 CO 0.00 1.06 0.03 -0.09 -1.30 0.00 0.00 177.93 177.62 1dgg h ARG 365 N -1.00 0.18 0.00 5.26 2.43 -0.97 -3.38 114.38 116.91 1dgg h ARG 365 Ca -0.22 -0.05 -0.33 0.00 -0.81 0.00 0.00 59.98 58.57 1dgg h ARG 365 Cb 1.05 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.52 1dgg h ARG 365 CO -0.13 0.36 -2.03 1.28 -1.51 0.00 0.00 179.97 177.94 1dgg n LEU 366 N -4.86 1.94 0.00 3.80 7.99 -0.00 -4.47 117.00 121.40 1dgg n LEU 366 Ca -0.06 0.35 0.00 0.00 -0.01 0.00 0.00 56.01 56.30 1dgg n LEU 366 Cb 0.16 -0.82 0.00 0.00 -0.11 0.00 0.00 43.42 42.65 1dgg n LEU 366 CO 0.35 0.33 0.00 0.61 -1.51 0.00 0.00 177.39 177.16 1dgg n GLY 367 N 1.33 3.32 0.26 -0.72 0.00 -0.75 -4.87 105.19 103.76 1dgg n GLY 367 Ca -0.42 -1.43 0.04 0.00 0.00 0.00 0.00 46.02 44.21 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 0.29 -1.21 1.61 0.11 -1.84 -1.79 132.00 129.17 1dgg h PRO 368 Ca 0.00 -0.02 -0.47 0.00 0.11 0.00 0.00 66.00 65.63 1dgg h PRO 368 Cb 0.00 -0.07 -0.21 0.00 0.11 0.00 0.00 31.00 30.83 1dgg h PRO 368 CO 0.00 0.19 0.60 0.09 -0.21 0.00 0.00 178.00 178.67 1dgg n ASN 369 N -5.12 6.24 0.24 -2.05 3.02 -1.26 -4.63 115.26 111.70 1dgg n ASN 369 Ca 0.13 -3.36 0.16 0.00 -0.03 0.00 0.00 54.58 51.49 1dgg n ASN 369 Cb 0.42 -0.96 0.85 0.00 -0.61 0.00 0.00 39.78 39.48 1dgg n ASN 369 CO 0.00 0.00 0.00 0.10 -2.62 0.00 0.00 177.26 174.74 1dgg h TYR 370 N 1.49 0.00 0.00 3.10 -0.00 -1.65 -0.47 116.97 119.44 1dgg h TYR 370 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.18 1dgg h TYR 370 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.95 1dgg h TYR 370 CO 1.12 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 180.56 1dgg n LEU 371 N -2.66 0.00 0.13 0.10 4.77 -1.26 -2.85 117.00 115.23 1dgg n LEU 371 Ca -0.02 0.47 0.12 0.00 -0.03 0.00 0.00 56.01 56.56 1dgg n LEU 371 Cb 0.09 -0.47 0.21 0.00 -2.33 0.00 0.00 43.42 40.91 1dgg n LEU 371 CO 0.16 -0.00 0.61 0.45 -1.33 0.00 0.00 177.39 177.27 1dgg h HIS 372 N 0.00 0.00 -2.63 -1.77 3.86 -1.42 -3.23 115.15 109.96 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 0.47 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.96 1dgg h HIS 372 CO 0.00 0.00 1.05 0.42 0.86 0.00 0.00 177.93 180.26 1dgg s ILE 373 N -3.19 3.11 0.09 2.45 1.01 -1.13 -4.79 121.20 118.74 1dgg s ILE 373 Ca 0.07 0.45 -0.15 0.00 0.00 0.00 0.00 60.65 61.02 1dgg s ILE 373 Cb 0.10 -3.29 -0.00 0.00 0.01 0.00 0.00 42.46 39.27 1dgg s ILE 373 CO 0.68 -0.01 0.80 -2.65 0.00 0.00 0.00 174.94 173.76 1dgg n PRO 374 N 6.08 -0.21 0.30 2.79 -0.02 -1.26 0.33 135.00 143.02 1dgg n PRO 374 Ca 0.17 0.79 0.18 0.00 -2.02 0.00 0.00 63.50 62.61 1dgg n PRO 374 Cb 0.41 -1.16 0.97 0.00 -0.02 0.00 0.00 33.50 33.70 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 0.29 0.00 -1.45 3.04 -1.90 -1.18 116.25 115.05 1dgg h VAL 375 Ca 0.10 -0.16 0.00 0.00 -1.01 0.00 0.00 66.70 65.63 1dgg h VAL 375 Cb 0.23 1.12 0.00 0.00 -2.01 0.00 0.00 31.29 30.63 1dgg h VAL 375 CO -0.49 0.03 -0.98 0.59 -1.01 0.00 0.00 177.57 175.70 1dgg n ASN 376 N -3.45 0.75 -4.72 3.17 3.02 0.15 -4.90 115.26 109.28 1dgg n ASN 376 Ca -0.02 -0.63 -0.42 0.00 -0.03 0.00 0.00 54.58 53.48 1dgg n ASN 376 Cb 0.13 0.89 -0.03 0.00 -0.61 0.00 0.00 39.78 40.16 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 3.97 3.86 0.02 0.00 -0.04 -1.26 -4.77 135.00 136.77 1dgg n PRO 378 Ca 0.14 -2.89 0.01 0.00 -0.04 0.00 0.00 63.50 60.73 1dgg n PRO 378 Cb 0.38 -2.84 0.05 0.00 -0.04 0.00 0.00 33.50 31.05 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 3.39 0.06 -0.80 0.54 4.11 -1.26 -1.22 117.16 121.98 1dgg n TYR 379 Ca 0.63 0.03 0.08 0.00 -0.00 0.00 0.00 57.90 58.64 1dgg n TYR 379 Cb 0.28 -0.47 0.38 0.00 -0.00 0.00 0.00 39.34 39.53 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 -1.49 4.31 -4.00 -3.48 1.74 -1.26 -4.90 116.66 107.57 1dgg n ARG 380 Ca -0.00 -3.03 -0.08 0.00 -0.77 0.00 0.00 57.85 53.97 1dgg n ARG 380 Cb 0.09 -2.09 -0.09 0.00 -1.02 0.00 0.00 32.46 29.35 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 -2.39 0.23 -0.40 7.54 0.00 -0.36 -4.03 121.76 122.35 1dgg s ALA 381 Ca 0.52 -0.96 -0.11 0.00 0.00 0.00 0.00 51.96 51.41 1dgg s ALA 381 Cb 0.38 0.33 0.05 0.00 0.00 0.00 0.00 23.12 23.88 1dgg s ALA 381 CO 0.19 -0.41 0.24 0.50 0.00 0.00 0.00 175.76 176.29 1dgg s ARG 382 N -3.75 2.77 -0.37 0.00 3.52 -1.26 -4.90 118.95 114.96 1dgg s ARG 382 Ca 0.05 -1.22 -0.29 0.00 -0.13 0.00 0.00 55.73 54.14 1dgg s ARG 382 Cb 0.06 -3.80 0.01 0.00 -1.56 0.00 0.00 34.95 29.67 1dgg s ARG 382 CO -0.10 -0.81 1.23 0.08 -0.81 0.00 0.00 175.30 174.89 1dgg s VAL 383 N 1.53 4.19 -0.12 7.11 1.01 -1.26 -4.99 120.40 127.87 1dgg s VAL 383 Ca 0.02 1.29 -0.02 0.00 0.00 0.00 0.00 61.98 63.27 1dgg s VAL 383 Cb -0.21 -4.34 0.04 0.00 0.00 0.00 0.00 36.38 31.87 1dgg s VAL 383 CO 0.05 -0.68 0.03 0.00 0.00 0.00 0.00 175.10 174.51 1dgg s ALA 384 N 4.45 0.67 0.00 5.51 0.00 -1.26 -5.05 121.76 126.08 1dgg s ALA 384 Ca 0.53 -0.28 0.00 0.00 0.00 0.00 0.00 51.96 52.21 1dgg s ALA 384 Cb -0.13 -0.90 0.00 0.00 0.00 0.00 0.00 23.12 22.09 1dgg s ALA 384 CO 0.26 -0.79 0.00 0.27 0.00 0.00 0.00 175.76 175.50 1dgg n ASN 385 N 5.16 0.00 -0.53 0.00 2.04 -1.26 -4.92 115.26 115.75 1dgg n ASN 385 Ca -0.07 0.00 0.09 0.00 -0.44 0.00 0.00 54.58 54.16 1dgg n ASN 385 Cb 0.49 0.00 0.20 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 0.52 -3.19 -2.53 4.02 -1.26 -4.92 117.16 109.80 1dgg n TYR 386 Ca 0.00 -0.96 -0.39 0.00 -0.01 0.00 0.00 57.90 56.54 1dgg n TYR 386 Cb 0.00 -0.25 -0.06 0.00 -0.02 0.00 0.00 39.34 39.02 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 -2.87 4.32 0.14 -0.72 -0.21 -1.26 -4.88 119.66 114.17 1dgg s GLN 387 Ca 0.38 0.79 -0.04 0.00 0.02 0.00 0.00 55.36 56.50 1dgg s GLN 387 Cb 0.32 -3.32 -0.03 0.00 1.00 0.00 0.00 33.01 30.98 1dgg s GLN 387 CO 0.06 0.42 0.14 1.03 -2.12 0.00 0.00 175.29 174.81 1dgg s ARG 388 N -0.38 0.99 3.50 2.91 1.81 -1.26 -4.94 118.95 121.58 1dgg s ARG 388 Ca 0.32 -1.32 0.00 0.00 -1.72 0.00 0.00 55.73 53.01 1dgg s ARG 388 Cb -0.19 0.29 0.00 0.00 -0.45 0.00 0.00 34.95 34.60 1dgg s ARG 388 CO 0.18 -0.31 0.00 -0.25 -0.68 0.00 0.00 175.30 174.24 1dgg n ASP 389 N -0.12 0.00 0.00 0.23 8.00 -1.26 -5.06 116.55 118.34 1dgg n ASP 389 Ca -0.07 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.43 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 0.54 3.70 0.44 0.00 -1.26 -4.80 105.19 103.82 1dgg n GLY 390 Ca 0.00 -1.70 -0.38 0.00 0.00 0.00 0.00 46.02 43.94 1dgg n GLY 390 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1dgg n PRO 391 N 0.67 1.22 -3.81 1.61 -0.04 -1.26 -3.53 135.00 129.86 1dgg n PRO 391 Ca 0.00 0.47 -0.24 0.00 -0.04 0.00 0.00 63.50 63.69 1dgg n PRO 391 Cb 0.00 -2.45 0.01 0.00 -0.04 0.00 0.00 33.50 31.02 1dgg n PRO 391 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1dgg n MET 392 N -1.44 -4.43 -2.37 0.54 2.81 -1.26 -4.35 117.12 106.63 1dgg n MET 392 Ca 0.14 0.55 -0.39 0.00 -1.81 0.00 0.00 57.70 56.18 1dgg n MET 392 Cb 0.47 -5.00 -0.03 0.00 -0.71 0.00 0.00 33.22 27.94 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 9.23 3.06 -3.29 0.00 2.81 -1.26 -4.92 117.12 122.75 1dgg n MET 394 Ca 0.14 -1.92 -0.13 0.00 -1.81 0.00 0.00 57.70 53.97 1dgg n MET 394 Cb 0.50 -1.92 -0.04 0.00 -0.71 0.00 0.00 33.22 31.05 1dgg n MET 394 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1dgg n GLN 395 N 0.19 0.65 0.00 0.03 6.02 -1.26 -4.99 117.38 118.03 1dgg n GLN 395 Ca 0.21 -1.87 0.03 0.00 -0.01 0.00 0.00 57.00 55.36 1dgg n GLN 395 Cb 0.92 1.10 0.15 0.00 1.02 0.00 0.00 30.24 33.43 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 -1.86 0.00 -2.48 1.08 5.75 -1.26 -4.81 116.55 112.97 1dgg n ASP 396 Ca -0.02 0.33 -0.21 0.00 -0.01 0.00 0.00 54.79 54.88 1dgg n ASP 396 Cb 0.33 -0.38 0.00 0.00 -1.03 0.00 0.00 41.12 40.04 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 -1.38 -5.89 -1.69 -1.12 4.05 -1.26 -2.05 115.26 105.92 1dgg n ASN 397 Ca 0.02 -0.08 -0.16 0.00 0.45 0.00 0.00 54.58 54.82 1dgg n ASN 397 Cb 0.06 -4.86 -0.02 0.00 1.23 0.00 0.00 39.78 36.20 1dgg n ASN 397 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1dgg n GLN 398 N -3.21 -1.22 0.00 1.20 6.02 -1.26 -4.83 117.38 114.08 1dgg n GLN 398 Ca -0.21 0.79 0.00 0.00 -0.01 0.00 0.00 57.00 57.57 1dgg n GLN 398 Cb 0.67 -5.13 0.00 0.00 1.02 0.00 0.00 30.24 26.80 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 -1.02 1.73 1.65 1.08 0.00 -0.87 -2.61 105.19 105.15 1dgg n GLY 399 Ca -0.18 -0.33 0.01 0.00 0.00 0.00 0.00 46.02 45.52 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 2.88 3.77 -0.02 0.00 -1.26 -4.98 105.19 105.58 1dgg n GLY 400 Ca 0.00 -0.74 -0.41 0.00 0.00 0.00 0.00 46.02 44.87 1dgg n GLY 400 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgg s ALA 401 N -2.40 3.54 0.04 4.61 0.00 -1.07 -4.88 121.76 121.59 1dgg s ALA 401 Ca 0.43 1.39 -0.38 0.00 0.00 0.00 0.00 51.96 53.40 1dgg s ALA 401 Cb 0.33 -3.54 -0.17 0.00 0.00 0.00 0.00 23.12 19.74 1dgg s ALA 401 CO 0.12 -0.81 1.30 -2.30 0.00 0.00 0.00 175.76 174.07 1dgg n PRO 402 N 0.76 0.86 -0.78 0.00 -0.02 -1.26 -4.88 135.00 129.68 1dgg n PRO 402 Ca 0.01 0.31 0.07 0.00 -2.02 0.00 0.00 63.50 61.87 1dgg n PRO 402 Cb 0.41 -1.92 0.37 0.00 -0.02 0.00 0.00 33.50 32.33 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 2.46 5.19 -4.02 2.55 2.04 -1.26 -4.92 115.26 117.30 1dgg n ASN 403 Ca 0.19 -2.78 -0.16 0.00 -0.44 0.00 0.00 54.58 51.39 1dgg n ASN 403 Cb 0.16 -0.65 -0.14 0.00 -2.53 0.00 0.00 39.78 36.62 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 -2.48 0.68 -0.07 -2.53 -0.85 -1.26 -4.86 117.35 105.97 1dgg s TYR 404 Ca 0.49 -0.24 0.04 0.00 -0.52 0.00 0.00 57.07 56.84 1dgg s TYR 404 Cb 0.37 -0.42 0.00 0.00 0.38 0.00 0.00 41.96 42.29 1dgg s TYR 404 CO 0.16 -0.02 -0.18 -0.47 -1.52 0.00 0.00 175.55 173.52 1dgg s TYR 405 N -0.57 1.93 0.69 -3.49 5.04 -1.26 -3.81 117.35 115.88 1dgg s TYR 405 Ca -0.01 -0.70 -0.11 0.00 -2.44 0.00 0.00 57.07 53.81 1dgg s TYR 405 Cb -0.05 -1.32 0.01 0.00 0.35 0.00 0.00 41.96 40.95 1dgg s TYR 405 CO 0.00 -0.29 1.08 -1.25 -1.34 0.00 0.00 175.55 173.75 1dgg s PRO 406 N 0.35 2.87 0.10 4.97 0.04 -1.26 -5.21 135.00 136.87 1dgg s PRO 406 Ca -0.13 0.42 -0.11 0.00 0.04 0.00 0.00 61.00 61.23 1dgg s PRO 406 Cb -0.15 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 32.35 1dgg s PRO 406 CO 0.05 -1.00 0.25 0.54 0.04 0.00 0.00 177.00 176.88 1dgg s ASN 407 N -4.35 0.03 -0.31 6.66 2.20 -1.25 -5.04 114.94 112.87 1dgg s ASN 407 Ca 0.58 -0.57 0.10 0.00 -0.94 0.00 0.00 52.86 52.03 1dgg s ASN 407 Cb -0.11 0.38 0.64 0.00 -2.00 0.00 0.00 41.25 40.16 1dgg s ASN 407 CO 0.51 -0.76 1.68 -1.20 -2.94 0.00 0.00 177.10 174.39 1dgg n SER 408 N -0.11 3.95 -0.64 3.54 7.64 -1.26 -4.59 113.62 122.15 1dgg n SER 408 Ca -0.15 -3.38 0.05 0.00 1.01 0.00 0.00 58.87 56.39 1dgg n SER 408 Cb 0.63 -0.70 0.20 0.00 -1.01 0.00 0.00 64.21 63.32 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 -0.61 0.24 -1.10 1.43 3.01 -1.26 -4.99 117.46 114.18 1dgg n PHE 409 Ca 0.39 -1.42 -0.03 0.00 1.01 0.00 0.00 57.45 57.39 1dgg n PHE 409 Cb 1.27 -0.28 -0.01 0.00 -0.01 0.00 0.00 39.48 40.44 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 -1.15 0.59 3.70 1.37 0.00 -1.26 -4.87 105.19 103.57 1dgg n GLY 410 Ca 0.21 -0.28 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.90 1.23 0.44 4.61 0.00 -1.26 -4.94 121.76 119.94 1dgg s ALA 411 Ca 0.00 -0.27 -0.21 0.00 0.00 0.00 0.00 51.96 51.48 1dgg s ALA 411 Cb 0.00 -3.14 -0.13 0.00 0.00 0.00 0.00 23.12 19.86 1dgg s ALA 411 CO 0.00 -2.61 0.44 -2.30 0.00 0.00 0.00 175.76 171.29 1dgg n PRO 412 N -4.04 0.45 -4.58 0.00 -0.02 -1.26 -5.01 135.00 120.55 1dgg n PRO 412 Ca 0.06 0.17 -0.25 0.00 -2.02 0.00 0.00 63.50 61.45 1dgg n PRO 412 Cb 0.57 -1.43 -0.14 0.00 -0.02 0.00 0.00 33.50 32.48 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 -1.52 1.32 0.64 -0.52 0.41 -1.26 -5.02 118.70 112.75 1dgg s GLU 413 Ca 0.63 -0.96 -0.17 0.00 -0.41 0.00 0.00 54.97 54.06 1dgg s GLU 413 Cb -0.58 -1.45 -0.01 0.00 -1.78 0.00 0.00 34.13 30.30 1dgg s GLU 413 CO 0.59 0.37 1.22 1.14 -0.49 0.00 0.00 175.26 178.08 1dgg s GLN 414 N -1.27 2.68 -0.42 1.61 -2.07 -1.26 -5.00 119.66 113.92 1dgg s GLN 414 Ca 0.07 1.82 0.01 0.00 -1.82 0.00 0.00 55.36 55.44 1dgg s GLN 414 Cb -0.09 -1.89 0.11 0.00 -1.09 0.00 0.00 33.01 30.05 1dgg s GLN 414 CO 0.02 -1.43 0.18 -1.14 -1.32 0.00 0.00 175.29 171.60 1dgg s GLN 415 N -3.53 1.86 0.39 9.60 0.74 -1.26 -5.00 119.66 122.46 1dgg s GLN 415 Ca 0.77 -2.03 0.23 0.00 0.05 0.00 0.00 55.36 54.37 1dgg s GLN 415 Cb -0.31 -3.42 1.31 0.00 1.10 0.00 0.00 33.01 31.69 1dgg s GLN 415 CO 0.38 -1.04 1.62 -1.35 -0.55 0.00 0.00 175.29 174.35 1dgg h PRO 416 N 7.56 0.11 0.00 1.67 0.11 -2.01 0.23 132.00 139.68 1dgg h PRO 416 Ca -0.08 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 1dgg h PRO 416 Cb 1.01 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.09 1dgg h PRO 416 CO 0.63 0.07 -0.03 0.66 -0.21 0.00 0.00 178.00 179.13 1dgg h SER 417 N 0.12 0.00 -0.08 -2.05 4.64 -2.04 -1.67 113.55 112.47 1dgg h SER 417 Ca 0.81 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.13 1dgg h SER 417 Cb 2.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.32 1dgg h SER 417 CO -0.60 0.03 0.00 0.00 -0.87 0.00 0.00 176.83 175.39 1dgg n ALA 418 N -2.25 2.56 -1.78 5.18 0.00 0.81 -4.92 120.51 120.10 1dgg n ALA 418 Ca -0.03 -0.28 -0.41 0.00 0.00 0.00 0.00 53.44 52.72 1dgg n ALA 418 Cb 0.12 -1.18 -0.01 0.00 0.00 0.00 0.00 19.45 18.38 1dgg n ALA 418 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1dgg s LEU 419 N -1.49 4.37 0.91 0.00 2.96 -0.63 -4.92 118.68 119.88 1dgg s LEU 419 Ca 0.27 2.85 -0.11 0.00 -0.22 0.00 0.00 54.13 56.92 1dgg s LEU 419 Cb 0.13 -3.66 0.14 0.00 0.50 0.00 0.00 46.19 43.30 1dgg s LEU 419 CO 0.21 -0.70 1.09 -1.61 -1.32 0.00 0.00 176.35 174.02 1dgg s GLU 420 N -1.79 1.14 0.00 1.98 8.01 -1.26 -5.00 118.70 121.77 1dgg s GLU 420 Ca 0.52 1.01 -0.28 0.00 0.01 0.00 0.00 54.97 56.22 1dgg s GLU 420 Cb -0.43 -1.78 -0.04 0.00 -4.31 0.00 0.00 34.13 27.57 1dgg s GLU 420 CO 0.57 -2.38 0.90 -1.58 0.01 0.00 0.00 175.26 172.79 1dgg s HIS 421 N -2.83 3.67 -0.16 1.61 5.65 -1.26 -5.05 115.29 116.92 1dgg s HIS 421 Ca 0.64 1.60 -0.06 0.00 0.25 0.00 0.00 55.06 57.50 1dgg s HIS 421 Cb -0.19 -3.03 -0.04 0.00 -1.18 0.00 0.00 32.58 28.14 1dgg s HIS 421 CO 0.58 0.06 0.04 -1.54 -0.65 0.00 0.00 174.74 173.22 1dgg s SER 422 N 0.77 5.44 0.20 9.88 1.04 -1.26 -5.11 113.70 124.66 1dgg s SER 422 Ca 0.47 0.07 0.10 0.00 0.48 0.00 0.00 55.95 57.07 1dgg s SER 422 Cb -0.21 -1.85 -0.04 0.00 0.10 0.00 0.00 66.02 64.02 1dgg s SER 422 CO 0.26 0.22 -0.19 -0.63 0.98 0.00 0.00 173.24 173.88 1dgg s ILE 423 N 0.07 2.02 -0.25 -1.02 1.01 -1.26 -5.13 121.20 116.65 1dgg s ILE 423 Ca 0.04 -2.07 -0.06 0.00 0.00 0.00 0.00 60.65 58.56 1dgg s ILE 423 Cb -0.13 -2.01 -0.02 0.00 0.01 0.00 0.00 42.46 40.32 1dgg s ILE 423 CO 0.01 -0.34 0.05 -1.58 0.00 0.00 0.00 174.94 173.08 1dgg s GLN 424 N -3.03 3.50 0.07 2.79 -0.44 -1.26 -5.10 119.66 116.20 1dgg s GLN 424 Ca 0.20 -0.57 0.03 0.00 -2.50 0.00 0.00 55.36 52.52 1dgg s GLN 424 Cb -0.05 -3.26 -0.04 0.00 -1.64 0.00 0.00 33.01 28.02 1dgg s GLN 424 CO 0.09 -0.23 0.04 0.71 0.50 0.00 0.00 175.29 176.40 1dgg s TYR 425 N 1.57 3.11 0.16 1.67 2.02 -1.26 -5.13 117.35 119.49 1dgg s TYR 425 Ca 0.06 0.05 0.09 0.00 -0.37 0.00 0.00 57.07 56.89 1dgg s TYR 425 Cb -0.15 -1.60 -0.04 0.00 -0.40 0.00 0.00 41.96 39.77 1dgg s TYR 425 CO 0.02 0.50 -0.19 -1.12 -1.57 0.00 0.00 175.55 173.19 1dgg s SER 426 N -2.25 2.73 0.00 2.29 0.01 -1.26 -5.09 113.70 110.14 1dgg s SER 426 Ca 0.27 -0.83 0.00 0.00 1.31 0.00 0.00 55.95 56.69 1dgg s SER 426 Cb -0.12 -0.16 0.00 0.00 0.21 0.00 0.00 66.02 65.95 1dgg s SER 426 CO 0.19 -0.00 0.00 0.61 0.41 0.00 0.00 173.24 174.45 1dgg n GLY 427 N 0.42 2.88 3.82 3.44 0.00 -1.26 -5.08 105.19 109.40 1dgg n GLY 427 Ca -0.14 -2.05 -0.31 0.00 0.00 0.00 0.00 46.02 43.52 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 -2.33 2.84 -0.63 1.61 2.02 -1.26 -4.99 118.70 115.96 1dgg s GLU 428 Ca 0.00 0.90 -0.18 0.00 0.02 0.00 0.00 54.97 55.70 1dgg s GLU 428 Cb 0.00 -1.98 0.11 0.00 0.10 0.00 0.00 34.13 32.36 1dgg s GLU 428 CO 0.00 -1.15 0.73 0.08 0.02 0.00 0.00 175.26 174.94 1dgg s VAL 429 N -3.07 4.88 0.00 2.63 1.01 -1.26 -4.96 120.40 119.62 1dgg s VAL 429 Ca 0.58 -1.15 0.00 0.00 0.00 0.00 0.00 61.98 61.41 1dgg s VAL 429 Cb -0.14 -4.51 0.00 0.00 0.00 0.00 0.00 36.38 31.73 1dgg s VAL 429 CO 0.55 -1.14 0.00 -2.11 0.00 0.00 0.00 175.10 172.39 1dgg n ARG 430 N 6.16 0.00 -3.33 2.72 1.85 -1.26 -5.12 116.66 117.67 1dgg n ARG 430 Ca -0.06 0.00 -0.41 0.00 -1.00 0.00 0.00 57.85 56.38 1dgg n ARG 430 Cb 0.43 0.00 -0.09 0.00 -1.05 0.00 0.00 32.46 31.75 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 -1.95 3.55 -0.26 2.89 0.52 -1.26 -5.05 118.95 117.39 1dgg s ARG 431 Ca 0.00 -0.34 -0.11 0.00 -0.52 0.00 0.00 55.73 54.76 1dgg s ARG 431 Cb 0.00 -3.82 -0.05 0.00 0.52 0.00 0.00 34.95 31.60 1dgg s ARG 431 CO 0.00 -0.60 0.20 -0.06 0.02 0.00 0.00 175.30 174.86 1dgg s PHE 432 N 2.18 3.27 0.02 -0.53 0.08 -1.26 -5.06 117.98 116.68 1dgg s PHE 432 Ca 0.15 0.20 -0.30 0.00 0.12 0.00 0.00 56.93 57.09 1dgg s PHE 432 Cb -0.16 -2.36 -0.06 0.00 -0.57 0.00 0.00 43.02 39.87 1dgg s PHE 432 CO 0.12 -0.07 1.44 1.21 -0.10 0.00 0.00 175.22 177.82 1dgg s ASN 433 N 1.44 6.81 -0.03 1.36 2.47 -1.26 -4.90 114.94 120.83 1dgg s ASN 433 Ca 0.08 2.20 0.05 0.00 0.42 0.00 0.00 52.86 55.61 1dgg s ASN 433 Cb -0.15 -2.56 0.11 0.00 -1.45 0.00 0.00 41.25 37.20 1dgg s ASN 433 CO 0.08 -0.74 1.08 0.35 -3.72 0.00 0.00 177.10 174.15 1dgg n THR 434 N 4.59 1.20 0.02 -5.21 -2.24 -1.26 -4.69 114.28 106.69 1dgg n THR 434 Ca 0.13 -1.25 0.02 0.00 -2.27 0.00 0.00 64.05 60.68 1dgg n THR 434 Cb 0.43 0.34 0.36 0.00 -2.10 0.00 0.00 70.33 69.37 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 0.33 1.53 -0.28 6.98 0.00 -2.01 -2.84 119.26 122.97 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 0.65 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1dgg h ALA 435 CO 0.01 0.36 0.00 0.09 0.00 0.00 0.00 179.25 179.70 1dgg n ASN 436 N -4.36 2.24 -4.68 0.00 3.02 -1.26 -4.84 115.26 105.38 1dgg n ASN 436 Ca 0.02 -1.84 -0.31 0.00 -0.03 0.00 0.00 54.58 52.42 1dgg n ASN 436 Cb 0.17 -0.18 0.16 0.00 -0.61 0.00 0.00 39.78 39.32 1dgg n ASN 436 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1dgg s ASP 437 N -1.42 3.09 -0.24 6.41 -0.00 -1.07 -4.77 116.67 118.66 1dgg s ASP 437 Ca 0.33 2.14 -0.38 0.00 -0.00 0.00 0.00 52.55 54.64 1dgg s ASP 437 Cb 0.18 -2.56 -0.14 0.00 -0.00 0.00 0.00 42.92 40.40 1dgg s ASP 437 CO 0.26 -2.99 1.81 -0.67 -0.00 0.00 0.00 175.17 173.58 1dgg n ASP 438 N -4.16 2.64 -0.13 0.27 4.64 -1.26 -4.85 116.55 113.70 1dgg n ASP 438 Ca 0.11 1.01 0.04 0.00 -1.38 0.00 0.00 54.79 54.57 1dgg n ASP 438 Cb 0.52 -1.20 -0.01 0.00 -1.04 0.00 0.00 41.12 39.39 1dgg n ASP 438 CO 0.00 0.00 0.00 0.59 -0.82 0.00 0.00 177.20 176.97 1dgg n ASN 439 N 6.00 0.88 -0.01 1.67 3.02 -1.26 -4.81 115.26 120.74 1dgg n ASN 439 Ca 0.27 -0.94 -0.01 0.00 -0.03 0.00 0.00 54.58 53.86 1dgg n ASN 439 Cb 0.17 0.59 -0.01 0.00 -0.61 0.00 0.00 39.78 39.93 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 -0.51 0.11 -0.13 2.41 0.24 -1.26 -4.57 118.33 114.62 1dgg n VAL 440 Ca 0.03 -0.06 -0.07 0.00 -2.04 0.00 0.00 64.34 62.20 1dgg n VAL 440 Cb 0.15 -0.77 -0.06 0.00 -1.47 0.00 0.00 33.84 31.69 1dgg n VAL 440 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1dgg h THR 441 N 0.00 0.00 0.00 3.34 2.02 -1.94 -0.61 112.91 115.72 1dgg h THR 441 Ca -0.04 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.12 1dgg h THR 441 Cb 1.08 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.49 1dgg h THR 441 CO -0.00 0.00 -0.07 1.56 0.37 0.00 0.00 175.52 177.37 1dgg h GLN 442 N -0.16 0.00 -0.40 6.66 4.20 -1.93 -1.90 115.11 121.58 1dgg h GLN 442 Ca 0.06 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.64 1dgg h GLN 442 Cb 0.31 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 1dgg h GLN 442 CO -0.41 0.07 -0.27 0.28 -0.67 0.00 0.00 178.83 177.84 1dgg h VAL 443 N 0.00 1.27 -0.23 -0.54 2.07 -1.63 -1.11 116.25 116.08 1dgg h VAL 443 Ca -0.00 -1.42 -0.00 0.00 0.82 0.00 0.00 66.70 66.10 1dgg h VAL 443 Cb 0.13 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 1dgg h VAL 443 CO 0.01 0.48 0.13 -0.09 0.02 0.00 0.00 177.57 178.12 1dgg h ARG 444 N 0.73 0.32 -0.65 1.57 2.43 -0.34 0.23 114.38 118.67 1dgg h ARG 444 Ca 0.09 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1dgg h ARG 444 Cb 0.82 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.27 1dgg h ARG 444 CO 0.07 0.27 0.42 0.00 -1.51 0.00 0.00 179.97 179.22 1dgg h ALA 445 N 1.02 1.50 0.04 2.80 0.00 -1.31 0.11 119.26 123.42 1dgg h ALA 445 Ca 0.08 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1dgg h ALA 445 Cb 0.05 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1dgg h ALA 445 CO -0.01 0.45 -0.02 0.35 0.00 0.00 0.00 179.25 180.02 1dgg h PHE 446 N 0.89 -0.05 -0.72 0.00 3.57 -0.35 0.70 116.94 120.98 1dgg h PHE 446 Ca 0.24 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.74 1dgg h PHE 446 Cb -0.07 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 38.64 1dgg h PHE 446 CO 0.00 0.26 0.46 -0.92 -2.23 0.00 0.00 178.31 175.88 1dgg h TYR 447 N -0.35 0.93 0.01 0.41 5.03 0.03 -2.43 116.97 120.61 1dgg h TYR 447 Ca -0.00 0.01 -0.08 0.00 2.58 0.00 0.00 58.73 61.24 1dgg h TYR 447 Cb 0.32 -0.31 -0.01 0.00 1.55 0.00 0.00 36.73 38.28 1dgg h TYR 447 CO 0.03 0.60 -0.42 0.28 -1.32 0.00 0.00 178.16 177.33 1dgg h VAL 448 N 0.98 1.53 0.00 1.81 2.07 -0.80 -3.37 116.25 118.47 1dgg h VAL 448 Ca 0.26 -2.32 -0.20 0.00 0.82 0.00 0.00 66.70 65.26 1dgg h VAL 448 Cb -0.08 3.06 -0.03 0.00 -1.52 0.00 0.00 31.29 32.72 1dgg h VAL 448 CO -0.05 0.54 -1.22 0.59 0.02 0.00 0.00 177.57 177.45 1dgg n ASN 449 N -4.51 1.86 0.27 0.57 5.03 0.23 -4.41 115.26 114.31 1dgg n ASN 449 Ca -0.16 0.46 0.13 0.00 0.87 0.00 0.00 54.58 55.88 1dgg n ASN 449 Cb 0.57 -0.92 0.78 0.00 -1.02 0.00 0.00 39.78 39.18 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 -1.00 0.57 -2.67 2.41 2.07 -1.31 -3.43 116.25 112.88 1dgg h VAL 450 Ca -0.30 -0.37 -0.60 0.00 0.82 0.00 0.00 66.70 66.25 1dgg h VAL 450 Cb 1.15 1.24 -0.12 0.00 -1.52 0.00 0.00 31.29 32.04 1dgg h VAL 450 CO -0.18 0.08 -0.69 -0.76 0.02 0.00 0.00 177.57 176.04 1dgg s LEU 451 N -7.44 3.07 0.56 2.57 1.43 -0.95 -5.05 118.68 112.87 1dgg s LEU 451 Ca -0.04 -0.60 0.06 0.00 -1.03 0.00 0.00 54.13 52.52 1dgg s LEU 451 Cb 0.14 -1.68 0.05 0.00 0.03 0.00 0.00 46.19 44.72 1dgg s LEU 451 CO 0.58 0.06 0.46 0.54 0.23 0.00 0.00 176.35 178.22 1dgg s ASN 452 N -3.17 4.67 0.18 2.29 2.20 -1.26 -4.68 114.94 115.17 1dgg s ASN 452 Ca 0.28 -1.23 -0.13 0.00 -0.94 0.00 0.00 52.86 50.83 1dgg s ASN 452 Cb -0.08 0.48 0.17 0.00 -2.00 0.00 0.00 41.25 39.82 1dgg s ASN 452 CO 0.17 -1.17 1.73 -0.08 -2.94 0.00 0.00 177.10 174.81 1dgg h GLU 453 N 0.65 0.26 -0.60 3.55 4.81 -1.94 0.42 114.58 121.73 1dgg h GLU 453 Ca -0.35 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 58.86 1dgg h GLU 453 Cb 1.30 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.60 1dgg h GLU 453 CO 0.55 0.17 0.37 1.49 -0.73 0.00 0.00 179.01 180.86 1dgg h GLU 454 N 0.27 0.81 -0.19 1.92 4.81 -2.00 -2.25 114.58 117.95 1dgg h GLU 454 Ca 0.23 -0.07 -0.13 0.00 -0.13 0.00 0.00 59.36 59.27 1dgg h GLU 454 Cb 0.28 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1dgg h GLU 454 CO -0.28 0.57 -0.43 1.96 -0.73 0.00 0.00 179.01 180.10 1dgg h GLN 455 N 0.81 0.45 0.00 1.92 4.20 -1.78 -2.73 115.11 117.98 1dgg h GLN 455 Ca 0.22 -0.23 -0.04 0.00 0.06 0.00 0.00 58.65 58.65 1dgg h GLN 455 Cb -0.04 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 1dgg h GLN 455 CO -0.04 0.80 -0.21 0.00 -0.67 0.00 0.00 178.83 178.71 1dgg h ARG 456 N 0.37 0.00 0.03 1.46 3.08 -0.59 -1.57 114.38 117.16 1dgg h ARG 456 Ca 0.03 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 1dgg h ARG 456 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.96 1dgg h ARG 456 CO 0.08 0.21 -0.01 -0.22 -1.07 0.00 0.00 179.97 178.95 1dgg h LYS 457 N 0.00 -0.04 -0.74 0.04 3.64 -1.11 -2.81 116.57 115.55 1dgg h LYS 457 Ca -0.00 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 1dgg h LYS 457 Cb 0.52 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.31 1dgg h LYS 457 CO 0.03 0.51 0.32 0.00 -2.27 0.00 0.00 179.45 178.04 1dgg h ARG 458 N -0.62 1.08 0.22 1.90 3.08 -1.40 -1.92 114.38 116.72 1dgg h ARG 458 Ca -0.00 -0.18 0.01 0.00 0.07 0.00 0.00 59.98 59.88 1dgg h ARG 458 Cb 0.57 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 30.39 1dgg h ARG 458 CO 0.01 0.87 -0.44 1.25 -1.07 0.00 0.00 179.97 180.58 1dgg h LEU 459 N 1.05 -1.28 -1.21 3.04 5.85 -1.35 0.26 115.31 121.67 1dgg h LEU 459 Ca 0.25 0.13 0.07 0.00 0.84 0.00 0.00 57.88 59.18 1dgg h LEU 459 Cb 0.17 0.47 -0.06 0.00 0.37 0.00 0.00 40.66 41.60 1dgg h LEU 459 CO -0.03 -0.53 0.56 0.00 -0.34 0.00 0.00 178.44 178.10 1dgg h GLU 461 N 0.93 0.76 -0.19 0.00 5.08 -0.65 -0.20 114.58 120.32 1dgg h GLU 461 Ca 0.38 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1dgg h GLU 461 Cb 0.27 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1dgg h GLU 461 CO -0.15 0.93 0.10 -0.91 -1.00 0.00 0.00 179.01 177.98 1dgg h ASN 462 N 0.55 0.24 0.23 1.42 2.35 0.13 0.98 115.58 121.48 1dgg h ASN 462 Ca 0.09 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1dgg h ASN 462 Cb 0.68 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.00 1dgg h ASN 462 CO 0.05 0.26 -0.11 0.40 -1.65 0.00 0.00 177.43 176.38 1dgg h ILE 463 N 0.19 0.81 -0.36 2.81 2.04 -1.12 -2.86 117.51 119.02 1dgg h ILE 463 Ca 0.07 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.69 1dgg h ILE 463 Cb 0.08 0.93 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 1dgg h ILE 463 CO -0.01 0.05 0.12 0.00 0.00 0.00 0.00 178.15 178.31 1dgg h ALA 464 N 0.32 1.56 0.00 1.87 0.00 -0.97 0.68 119.26 122.72 1dgg h ALA 464 Ca -0.03 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1dgg h ALA 464 Cb 0.32 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1dgg h ALA 464 CO 0.05 0.34 -0.09 0.78 0.00 0.00 0.00 179.25 180.34 1dgg h GLY 465 N 0.68 0.00 0.00 0.00 0.00 -0.57 -1.38 103.07 101.80 1dgg h GLY 465 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 47.02 1dgg h GLY 465 CO -0.01 0.00 -2.51 1.57 0.00 0.00 0.00 176.54 175.59 1dgg n HIS 466 N -3.83 0.02 0.28 5.60 -0.00 -0.80 -4.45 115.22 112.05 1dgg n HIS 466 Ca -0.02 0.01 0.14 0.00 -0.00 0.00 0.00 57.72 57.84 1dgg n HIS 466 Cb 0.18 -1.00 0.84 0.00 -0.00 0.00 0.00 29.99 30.01 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 -0.53 0.00 -2.07 0.27 5.85 -0.88 -2.77 115.31 115.19 1dgg h LEU 467 Ca -0.64 0.00 0.10 0.00 0.84 0.00 0.00 57.88 58.18 1dgg h LEU 467 Cb 1.75 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.77 1dgg h LEU 467 CO -0.27 0.05 0.35 0.07 -0.34 0.00 0.00 178.44 178.30 1dgg h LYS 468 N 0.00 0.00 -0.01 1.25 2.10 -1.46 0.22 116.57 118.66 1dgg h LYS 468 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1dgg h LYS 468 Cb 0.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.45 1dgg h LYS 468 CO 0.01 0.00 -0.11 -0.25 -2.00 0.00 0.00 179.45 177.09 1dgg n ASP 469 N -3.87 0.86 -4.87 7.07 10.43 -1.04 -4.86 116.55 120.27 1dgg n ASP 469 Ca 0.06 -0.95 -0.31 0.00 2.57 0.00 0.00 54.79 56.16 1dgg n ASP 469 Cb 0.51 0.01 -0.04 0.00 1.84 0.00 0.00 41.12 43.45 1dgg n ASP 469 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1dgg s ALA 470 N -2.31 3.32 0.79 2.24 0.00 0.06 -4.72 121.76 121.14 1dgg s ALA 470 Ca 0.32 -0.14 -0.14 0.00 0.00 0.00 0.00 51.96 51.99 1dgg s ALA 470 Cb 0.20 -2.74 0.04 0.00 0.00 0.00 0.00 23.12 20.62 1dgg s ALA 470 CO 0.44 0.01 0.94 1.04 0.00 0.00 0.00 175.76 178.19 1dgg n GLN 471 N -1.21 0.23 -0.20 0.00 6.02 -1.26 -4.69 117.38 116.27 1dgg n GLN 471 Ca 0.03 0.14 -0.01 0.00 -0.01 0.00 0.00 57.00 57.15 1dgg n GLN 471 Cb 0.54 -2.22 0.10 0.00 1.02 0.00 0.00 30.24 29.68 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 -0.74 0.80 0.00 5.09 1.08 -1.95 -0.80 117.51 120.99 1dgg h ILE 472 Ca -0.46 -0.14 -0.00 0.00 -0.39 0.00 0.00 64.86 63.86 1dgg h ILE 472 Cb 1.31 0.34 -0.00 0.00 -3.07 0.00 0.00 36.82 35.41 1dgg h ILE 472 CO 0.44 0.08 -0.02 2.19 -0.69 0.00 0.00 178.15 180.14 1dgg h PHE 473 N 0.42 0.00 0.21 1.37 -5.15 -2.00 -1.04 116.94 110.74 1dgg h PHE 473 Ca 0.29 0.00 -0.32 0.00 -0.20 0.00 0.00 57.97 57.74 1dgg h PHE 473 Cb 0.34 0.00 0.02 0.00 0.22 0.00 0.00 35.95 36.53 1dgg h PHE 473 CO -0.16 0.02 -1.47 0.82 -2.00 0.00 0.00 178.31 175.52 1dgg h ILE 474 N 0.00 1.27 -0.70 0.88 2.04 -1.51 -2.83 117.51 116.65 1dgg h ILE 474 Ca -0.00 -2.77 -0.01 0.00 1.00 0.00 0.00 64.86 63.08 1dgg h ILE 474 Cb 0.07 2.96 -0.03 0.00 -0.74 0.00 0.00 36.82 39.08 1dgg h ILE 474 CO 0.00 0.84 0.39 1.56 0.00 0.00 0.00 178.15 180.94 1dgg h GLN 475 N 0.12 0.98 -0.31 2.37 4.20 -0.49 -0.52 115.11 121.44 1dgg h GLN 475 Ca -0.24 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 58.35 1dgg h GLN 475 Cb 2.11 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 29.68 1dgg h GLN 475 CO 0.24 0.72 0.17 0.87 -0.67 0.00 0.00 178.83 180.16 1dgg h LYS 476 N 0.96 0.44 -0.19 1.46 1.79 -1.29 0.01 116.57 119.76 1dgg h LYS 476 Ca 0.25 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.65 1dgg h LYS 476 Cb 0.03 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.58 1dgg h LYS 476 CO -0.04 0.38 0.08 -0.22 -1.08 0.00 0.00 179.45 178.58 1dgg h LYS 477 N 0.38 0.28 -0.29 3.15 1.63 -1.22 -0.27 116.57 120.24 1dgg h LYS 477 Ca 0.11 -0.05 0.03 0.00 -0.85 0.00 0.00 60.65 59.90 1dgg h LYS 477 Cb 0.08 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.62 1dgg h LYS 477 CO -0.02 0.33 0.08 0.00 -3.45 0.00 0.00 179.45 176.40 1dgg h ALA 478 N 0.94 0.32 -0.35 5.00 0.00 -0.94 -1.79 119.26 122.43 1dgg h ALA 478 Ca 0.06 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1dgg h ALA 478 Cb 0.15 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1dgg h ALA 478 CO -0.01 -0.32 0.08 0.28 0.00 0.00 0.00 179.25 179.28 1dgg h VAL 479 N 0.20 1.17 -0.74 0.00 2.07 -0.81 -1.62 116.25 116.53 1dgg h VAL 479 Ca 0.13 -0.60 -0.00 0.00 0.82 0.00 0.00 66.70 67.05 1dgg h VAL 479 Cb 0.11 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 1dgg h VAL 479 CO -0.15 0.22 0.45 0.50 0.02 0.00 0.00 177.57 178.61 1dgg h LYS 480 N 0.50 1.00 -0.31 1.57 3.64 -0.21 0.16 116.57 122.92 1dgg h LYS 480 Ca 0.12 -0.09 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 1dgg h LYS 480 Cb 0.21 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1dgg h LYS 480 CO -0.00 0.70 0.02 -0.91 -2.27 0.00 0.00 179.45 176.99 1dgg h ASN 481 N 1.00 0.51 -0.51 4.20 2.35 -0.75 -2.10 115.58 120.28 1dgg h ASN 481 Ca 0.26 -0.29 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1dgg h ASN 481 Cb -0.04 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.16 1dgg h ASN 481 CO -0.05 0.67 0.32 -0.26 -1.65 0.00 0.00 177.43 176.46 1dgg h PHE 482 N 0.33 0.67 -0.91 1.19 0.04 -0.81 -1.89 116.94 115.56 1dgg h PHE 482 Ca 0.09 0.00 0.07 0.00 2.80 0.00 0.00 57.97 60.93 1dgg h PHE 482 Cb 0.40 -0.22 -0.06 0.00 2.20 0.00 0.00 35.95 38.27 1dgg h PHE 482 CO 0.03 0.45 0.59 1.15 -0.60 0.00 0.00 178.31 179.93 1dgg h THR 483 N 0.69 1.05 -0.23 -1.55 2.02 -0.59 0.71 112.91 115.01 1dgg h THR 483 Ca 0.19 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 67.02 1dgg h THR 483 Cb -0.03 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.32 1dgg h THR 483 CO -0.04 0.19 0.15 -0.08 0.37 0.00 0.00 175.52 176.11 1dgg h GLU 484 N 1.01 0.30 -0.10 6.66 4.81 -0.63 -1.85 114.58 124.78 1dgg h GLU 484 Ca 0.39 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.53 1dgg h GLU 484 Cb 0.22 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.54 1dgg h GLU 484 CO -0.15 0.20 -0.24 0.28 -0.73 0.00 0.00 179.01 178.37 1dgg h VAL 485 N 0.31 1.39 -1.37 0.32 2.07 -0.56 -3.47 116.25 114.94 1dgg h VAL 485 Ca 0.08 -1.55 0.13 0.00 0.82 0.00 0.00 66.70 66.18 1dgg h VAL 485 Cb -0.03 2.14 -0.29 0.00 -1.52 0.00 0.00 31.29 31.59 1dgg h VAL 485 CO -0.02 0.45 0.57 -2.28 0.02 0.00 0.00 177.57 176.31 1dgg s HIS 486 N -3.91 -0.35 0.23 1.57 2.46 -0.70 -4.59 115.29 110.00 1dgg s HIS 486 Ca -0.14 0.76 -0.06 0.00 0.47 0.00 0.00 55.06 56.09 1dgg s HIS 486 Cb 0.04 0.31 0.40 0.00 -0.13 0.00 0.00 32.58 33.21 1dgg s HIS 486 CO 0.77 -0.17 1.75 -1.35 -2.47 0.00 0.00 174.74 173.26 1dgg h PRO 487 N 4.89 0.47 -0.38 2.88 0.11 -1.82 -1.76 132.00 136.39 1dgg h PRO 487 Ca -0.28 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.78 1dgg h PRO 487 Cb 1.18 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 1dgg h PRO 487 CO 0.18 0.31 0.14 0.22 -0.21 0.00 0.00 178.00 178.64 1dgg h ASP 488 N 0.49 0.49 0.62 -2.05 3.58 -1.94 -0.43 116.42 117.18 1dgg h ASP 488 Ca 0.38 -0.05 -0.03 0.00 0.42 0.00 0.00 57.03 57.75 1dgg h ASP 488 Cb 0.52 -0.13 0.01 0.00 1.72 0.00 0.00 39.33 41.45 1dgg h ASP 488 CO -0.35 0.46 -0.30 0.22 -2.88 0.00 0.00 179.24 176.39 1dgg h TYR 489 N 0.54 -0.77 -0.46 0.28 -0.00 -1.63 -1.28 116.97 113.65 1dgg h TYR 489 Ca 0.13 -0.02 -0.05 0.00 -0.00 0.00 0.00 58.73 58.80 1dgg h TYR 489 Cb 0.13 0.26 -0.02 0.00 -0.00 0.00 0.00 36.73 37.10 1dgg h TYR 489 CO 0.01 -0.43 0.09 0.78 -0.00 0.00 0.00 178.16 178.60 1dgg h GLY 490 N -1.02 0.80 1.35 1.82 0.00 -1.38 -2.81 103.07 101.83 1dgg h GLY 490 Ca -0.09 -0.52 -0.08 0.00 0.00 0.00 0.00 47.33 46.64 1dgg h GLY 490 CO 0.14 0.48 -0.06 1.48 0.00 0.00 0.00 176.54 178.58 1dgg h SER 491 N 0.61 0.76 -0.48 0.19 4.64 -1.12 -0.81 113.55 117.35 1dgg h SER 491 Ca 0.14 -0.21 -0.07 0.00 -0.47 0.00 0.00 61.79 61.18 1dgg h SER 491 Cb 0.35 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.22 1dgg h SER 491 CO 0.01 0.87 0.01 -0.74 -0.87 0.00 0.00 176.83 176.10 1dgg h HIS 492 N 0.72 0.91 -0.30 4.77 6.17 -1.21 -0.84 115.15 125.36 1dgg h HIS 492 Ca 0.13 -0.15 -0.05 0.00 0.71 0.00 0.00 60.37 61.01 1dgg h HIS 492 Cb 0.53 -0.24 -0.01 0.00 2.52 0.00 0.00 27.41 30.21 1dgg h HIS 492 CO 0.03 0.87 0.01 0.82 0.71 0.00 0.00 177.93 180.36 1dgg h ILE 493 N 0.70 1.25 -0.57 6.26 2.04 -1.31 -2.66 117.51 123.22 1dgg h ILE 493 Ca 0.14 -0.92 0.01 0.00 1.00 0.00 0.00 64.86 65.09 1dgg h ILE 493 Cb 0.50 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 37.80 1dgg h ILE 493 CO 0.02 0.30 0.37 -0.61 0.00 0.00 0.00 178.15 178.23 1dgg h GLN 494 N 0.33 0.72 -0.80 2.37 5.75 -1.04 0.48 115.11 122.92 1dgg h GLN 494 Ca 0.09 -0.04 0.11 0.00 -0.15 0.00 0.00 58.65 58.65 1dgg h GLN 494 Cb 0.42 -0.16 -0.08 0.00 1.07 0.00 0.00 27.48 28.73 1dgg h GLN 494 CO 0.01 0.48 0.43 0.00 -2.65 0.00 0.00 178.83 177.10 1dgg h ALA 495 N 1.22 1.16 -0.19 3.38 0.00 -1.00 0.45 119.26 124.28 1dgg h ALA 495 Ca 0.22 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 55.07 1dgg h ALA 495 Cb -0.05 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1dgg h ALA 495 CO -0.06 -0.00 -0.30 -0.07 0.00 0.00 0.00 179.25 178.82 1dgg h LEU 496 N 0.69 0.59 -0.61 0.00 3.38 -1.07 -3.00 115.31 115.29 1dgg h LEU 496 Ca 0.41 -0.53 0.06 0.00 0.09 0.00 0.00 57.88 57.91 1dgg h LEU 496 Cb 0.46 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 1dgg h LEU 496 CO -0.29 1.00 0.32 -0.07 0.09 0.00 0.00 178.44 179.49 1dgg h LEU 497 N 0.19 0.46 -0.65 1.67 3.38 0.10 -1.53 115.31 118.93 1dgg h LEU 497 Ca 0.02 0.03 0.13 0.00 0.09 0.00 0.00 57.88 58.15 1dgg h LEU 497 Cb 0.88 -0.05 -0.10 0.00 0.09 0.00 0.00 40.66 41.48 1dgg h LEU 497 CO 0.07 0.30 0.11 0.44 0.09 0.00 0.00 178.44 179.45 1dgg h ASP 498 N 0.60 -0.07 -0.09 -0.43 3.32 -0.06 -0.12 116.42 119.57 1dgg h ASP 498 Ca 0.28 0.13 -0.13 0.00 0.02 0.00 0.00 57.03 57.33 1dgg h ASP 498 Cb 0.19 0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 1dgg h ASP 498 CO -0.19 -0.04 -0.37 0.07 -1.72 0.00 0.00 179.24 177.00 1dgg h LYS 499 N 0.23 0.60 -0.18 3.56 2.10 -1.16 -3.09 116.57 118.62 1dgg h LYS 499 Ca 0.35 -0.29 -0.02 0.00 -2.00 0.00 0.00 60.65 58.69 1dgg h LYS 499 Cb 0.56 -0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.88 1dgg h LYS 499 CO -0.47 0.87 0.05 1.88 -2.00 0.00 0.00 179.45 179.78 1dgg h TYR 500 N 0.50 0.30 0.00 0.07 0.05 -0.61 -3.52 116.97 113.76 1dgg h TYR 500 Ca 0.05 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.80 1dgg h TYR 500 Cb 0.86 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.52 1dgg h TYR 500 CO 0.04 0.41 0.00 0.09 -1.05 0.00 0.00 178.16 177.64