#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3giy s LEU 5 N 0.00 4.89 0.00 3.41 1.43 -1.26 -4.83 118.68 122.32 3giy s LEU 5 Ca 0.00 -3.46 0.10 0.00 -1.03 0.00 0.00 54.13 49.75 3giy s LEU 5 Cb 0.00 -1.72 0.04 0.00 0.03 0.00 0.00 46.19 44.54 3giy s LEU 5 CO 0.00 -0.18 0.74 0.49 0.23 0.00 0.00 176.35 177.62 3giy n PHE 6 N 2.57 0.00 -3.83 0.29 3.72 -1.26 -5.04 117.46 113.91 3giy n PHE 6 Ca 0.14 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.48 3giy n PHE 6 Cb 0.35 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.90 3giy n PHE 6 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3giy s ASN 7 N -1.14 -0.09 0.29 4.37 2.20 -1.26 -5.04 114.94 114.27 3giy s ASN 7 Ca 0.10 -0.82 -0.02 0.00 -0.94 0.00 0.00 52.86 51.18 3giy s ASN 7 Cb 0.09 0.71 0.42 0.00 -2.00 0.00 0.00 41.25 40.47 3giy s ASN 7 CO 0.20 -1.38 1.94 0.58 -2.94 0.00 0.00 177.10 175.50 3giy h VAL 8 N 2.00 1.22 -0.72 3.54 2.07 -1.95 -2.37 116.25 120.04 3giy h VAL 8 Ca -0.27 -0.45 0.00 0.00 0.82 0.00 0.00 66.70 66.80 3giy h VAL 8 Cb 1.24 0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 3giy h VAL 8 CO 0.33 0.22 0.45 -0.08 0.02 0.00 0.00 177.57 178.51 3giy h GLU 9 N 1.09 0.96 -0.48 1.57 4.57 -1.97 -1.26 114.58 119.06 3giy h GLU 9 Ca 0.29 -0.07 -0.03 0.00 -1.18 0.00 0.00 59.36 58.37 3giy h GLU 9 Cb -0.07 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 28.29 3giy h GLU 9 CO -0.06 0.65 0.19 -0.44 -1.18 0.00 0.00 179.01 178.18 3giy h ASP 10 N 0.98 0.62 0.33 1.04 3.32 -1.75 -1.47 116.42 119.50 3giy h ASP 10 Ca 0.26 -0.07 -0.19 0.00 0.02 0.00 0.00 57.03 57.05 3giy h ASP 10 Cb -0.07 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.31 3giy h ASP 10 CO -0.05 0.56 -0.80 1.88 -1.72 0.00 0.00 179.24 179.11 3giy h TYR 11 N 0.68 0.51 -0.22 4.55 -1.99 -1.19 -2.60 116.97 116.70 3giy h TYR 11 Ca 0.17 -0.24 -0.00 0.00 2.00 0.00 0.00 58.73 60.65 3giy h TYR 11 Cb 0.13 -0.07 -0.01 0.00 2.00 0.00 0.00 36.73 38.78 3giy h TYR 11 CO 0.01 1.02 0.13 -0.09 -0.00 0.00 0.00 178.16 179.23 3giy h ARG 12 N 0.23 0.30 -0.75 4.88 2.43 -0.65 0.82 114.38 121.65 3giy h ARG 12 Ca -0.04 -0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.18 3giy h ARG 12 Cb 1.39 -0.06 -0.07 0.00 -0.42 0.00 0.00 29.97 30.81 3giy h ARG 12 CO 0.13 0.24 0.41 0.87 -1.51 0.00 0.00 179.97 180.12 3giy h LYS 13 N 0.27 0.69 -0.39 0.20 1.57 -1.26 0.39 116.57 118.03 3giy h LYS 13 Ca 0.08 -0.04 -0.15 0.00 -1.87 0.00 0.00 60.65 58.67 3giy h LYS 13 Cb 0.02 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 3giy h LYS 13 CO -0.01 0.46 -0.34 1.25 -0.57 0.00 0.00 179.45 180.23 3giy h LEU 14 N 0.71 0.95 -1.12 2.94 5.85 -1.08 -2.73 115.31 120.84 3giy h LEU 14 Ca 0.36 -0.42 -0.04 0.00 0.84 0.00 0.00 57.88 58.62 3giy h LEU 14 Cb 0.31 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 3giy h LEU 14 CO -0.23 1.20 0.18 0.00 -0.34 0.00 0.00 178.44 179.24 3giy h ALA 15 N 0.85 1.30 0.00 1.25 0.00 -0.07 -1.69 119.26 120.90 3giy h ALA 15 Ca 0.07 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 3giy h ALA 15 Cb 0.92 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3giy h ALA 15 CO 0.09 0.51 -0.41 0.37 0.00 0.00 0.00 179.25 179.80 3giy h GLN 16 N 0.78 0.00 0.00 0.00 4.15 -0.78 -0.63 115.11 118.63 3giy h GLN 16 Ca 0.18 0.00 -0.16 0.00 0.77 0.00 0.00 58.65 59.44 3giy h GLN 16 Cb 0.21 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.88 3giy h GLN 16 CO -0.01 0.41 -0.75 0.87 -1.93 0.00 0.00 178.83 177.42 3giy h LYS 17 N 0.00 0.00 0.00 1.69 1.57 -1.08 -3.36 116.57 115.39 3giy h LYS 17 Ca -0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.60 3giy h LYS 17 Cb 0.82 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.09 3giy h LYS 17 CO 0.05 0.75 -1.81 0.54 -0.57 0.00 0.00 179.45 178.41 3giy n ARG 18 N -3.31 0.65 -3.34 3.15 1.74 -0.70 -4.97 116.66 109.89 3giy n ARG 18 Ca 0.01 0.05 -0.33 0.00 -0.77 0.00 0.00 57.85 56.81 3giy n ARG 18 Cb 0.83 -1.66 -0.06 0.00 -1.02 0.00 0.00 32.46 30.55 3giy n ARG 18 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3giy s LEU 19 N -5.36 4.19 0.56 0.55 1.43 -0.26 -5.05 118.68 114.74 3giy s LEU 19 Ca -0.06 1.04 -0.20 0.00 -1.03 0.00 0.00 54.13 53.88 3giy s LEU 19 Cb 0.09 -3.67 -0.05 0.00 0.03 0.00 0.00 46.19 42.60 3giy s LEU 19 CO 0.84 -0.06 1.21 -2.84 0.23 0.00 0.00 176.35 175.73 3giy s PRO 20 N -2.64 3.14 0.30 1.29 0.02 -1.26 -4.72 135.00 131.13 3giy s PRO 20 Ca 0.47 1.84 0.04 0.00 0.02 0.00 0.00 61.00 63.37 3giy s PRO 20 Cb -0.12 -2.04 0.67 0.00 0.02 0.00 0.00 34.50 33.04 3giy s PRO 20 CO 0.20 -1.07 1.80 -0.22 -0.33 0.00 0.00 177.00 177.38 3giy h LYS 21 N 1.15 0.82 -0.82 5.54 3.64 -1.97 0.24 116.57 125.17 3giy h LYS 21 Ca -0.50 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 58.79 3giy h LYS 21 Cb 1.29 -0.19 -0.04 0.00 -0.41 0.00 0.00 32.23 32.88 3giy h LYS 21 CO 0.56 0.55 0.37 1.98 -2.27 0.00 0.00 179.45 180.64 3giy h MET 22 N 0.85 1.19 -0.08 1.90 4.05 -1.97 0.52 114.93 121.39 3giy h MET 22 Ca 0.55 -0.19 -0.22 0.00 -0.28 0.00 0.00 59.70 59.56 3giy h MET 22 Cb 0.75 -0.21 0.01 0.00 -0.80 0.00 0.00 31.60 31.36 3giy h MET 22 CO -0.34 0.93 -0.81 0.28 0.23 0.00 0.00 176.91 177.20 3giy h VAL 23 N 1.18 1.30 -0.76 -5.77 2.07 -1.63 -1.94 116.25 110.71 3giy h VAL 23 Ca 0.28 -2.05 -0.00 0.00 0.82 0.00 0.00 66.70 65.74 3giy h VAL 23 Cb 0.15 2.21 -0.04 0.00 -1.52 0.00 0.00 31.29 32.09 3giy h VAL 23 CO -0.03 0.64 0.47 0.22 0.02 0.00 0.00 177.57 178.88 3giy h TYR 24 N 0.37 0.98 -0.10 1.57 3.20 -0.77 -1.71 116.97 120.52 3giy h TYR 24 Ca -0.08 0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.71 3giy h TYR 24 Cb 1.46 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 39.39 3giy h TYR 24 CO 0.10 0.65 -0.34 -0.44 -1.64 0.00 0.00 178.16 176.50 3giy h ASP 25 N 1.03 0.20 -0.54 -2.11 3.32 -0.87 0.80 116.42 118.26 3giy h ASP 25 Ca 0.27 -0.07 -0.08 0.00 0.02 0.00 0.00 57.03 57.18 3giy h ASP 25 Cb -0.06 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 3giy h ASP 25 CO -0.05 0.53 0.05 0.22 -1.72 0.00 0.00 179.24 178.27 3giy h TYR 26 N 0.17 1.02 0.04 4.55 3.20 -0.66 -0.55 116.97 124.74 3giy h TYR 26 Ca 0.02 -0.14 -0.00 0.00 3.14 0.00 0.00 58.73 61.75 3giy h TYR 26 Cb 0.68 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.67 3giy h TYR 26 CO 0.01 0.89 -0.02 1.25 -1.64 0.00 0.00 178.16 178.65 3giy h LEU 27 N 0.89 -0.05 -0.19 2.82 5.85 -0.90 -3.38 115.31 120.35 3giy h LEU 27 Ca 0.17 -0.63 -0.19 0.00 0.84 0.00 0.00 57.88 58.08 3giy h LEU 27 Cb 0.45 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 3giy h LEU 27 CO 0.02 0.70 -0.90 -0.08 -0.34 0.00 0.00 178.44 177.84 3giy h GLU 28 N -0.90 0.00 -6.97 1.25 4.57 -0.93 -3.48 114.58 108.12 3giy h GLU 28 Ca -0.01 0.00 -0.55 0.00 -1.18 0.00 0.00 59.36 57.62 3giy h GLU 28 Cb 0.67 0.00 0.18 0.00 -0.16 0.00 0.00 28.75 29.44 3giy h GLU 28 CO 0.01 0.90 0.09 0.41 -1.18 0.00 0.00 179.01 179.24 3giy n GLY 29 N 1.07 -0.49 2.44 1.92 0.00 -0.22 -5.06 105.19 104.87 3giy n GLY 29 Ca -0.00 -0.38 -0.18 0.00 0.00 0.00 0.00 46.02 45.45 3giy n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3giy n GLY 30 N 1.04 3.47 3.78 -0.02 0.00 -1.26 -4.78 105.19 107.42 3giy n GLY 30 Ca 0.13 -2.06 -0.37 0.00 0.00 0.00 0.00 46.02 43.71 3giy n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3giy s ALA 31 N -2.81 3.19 0.00 4.61 0.00 -0.42 -4.36 121.76 121.98 3giy s ALA 31 Ca 0.15 0.63 0.00 0.00 0.00 0.00 0.00 51.96 52.74 3giy s ALA 31 Cb 0.01 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.90 3giy s ALA 31 CO 0.11 0.01 0.00 0.39 0.00 0.00 0.00 175.76 176.27 3giy n GLU 32 N 0.44 0.00 0.00 0.00 1.02 0.56 -1.17 120.64 121.49 3giy n GLU 32 Ca 0.03 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.29 3giy n GLU 32 Cb 0.49 0.00 0.57 0.00 -0.02 0.00 0.00 31.44 32.48 3giy n GLU 32 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3giy n ASP 33 N 3.18 0.00 -2.46 1.62 8.00 -1.26 -4.71 116.55 120.92 3giy n ASP 33 Ca 0.00 0.27 -0.19 0.00 0.71 0.00 0.00 54.79 55.58 3giy n ASP 33 Cb 0.00 -0.41 0.02 0.00 -0.02 0.00 0.00 41.12 40.71 3giy n ASP 33 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3giy n GLU 34 N -1.41 -3.58 0.15 -1.24 1.02 -0.32 -4.87 120.64 110.40 3giy n GLU 34 Ca 0.08 0.79 0.05 0.00 -0.02 0.00 0.00 57.16 58.06 3giy n GLU 34 Cb 0.25 -5.35 0.05 0.00 -0.02 0.00 0.00 31.44 26.38 3giy n GLU 34 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 3giy h TYR 35 N -0.93 0.00 0.04 -0.32 0.05 -1.81 -3.22 116.97 110.79 3giy h TYR 35 Ca -0.44 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.33 3giy h TYR 35 Cb 1.31 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.05 3giy h TYR 35 CO 0.45 0.39 -0.02 0.78 -1.05 0.00 0.00 178.16 178.71 3giy h GLY 36 N 3.62 -0.06 1.24 3.88 0.00 -1.79 0.47 103.07 110.44 3giy h GLY 36 Ca -0.01 0.02 -0.03 0.00 0.00 0.00 0.00 47.33 47.31 3giy h GLY 36 CO 0.05 -0.02 0.27 -0.39 0.00 0.00 0.00 176.54 176.45 3giy h VAL 37 N -0.41 1.23 -0.56 4.60 -1.51 -1.80 0.12 116.25 117.92 3giy h VAL 37 Ca -0.01 -0.70 -0.06 0.00 -1.23 0.00 0.00 66.70 64.70 3giy h VAL 37 Cb 0.37 0.43 -0.02 0.00 -2.13 0.00 0.00 31.29 29.94 3giy h VAL 37 CO 0.01 0.28 0.11 0.50 -1.23 0.00 0.00 177.57 177.24 3giy h LYS 38 N 0.95 0.91 -0.67 5.19 1.63 -1.54 -2.65 116.57 120.40 3giy h LYS 38 Ca 0.23 -0.24 -0.08 0.00 -0.85 0.00 0.00 60.65 59.71 3giy h LYS 38 Cb 0.17 -0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 31.66 3giy h LYS 38 CO -0.02 0.87 0.12 1.25 -3.45 0.00 0.00 179.45 178.22 3giy h HIS 39 N 0.81 1.16 -0.72 1.91 2.76 -0.25 0.04 115.15 120.85 3giy h HIS 39 Ca 0.17 -0.16 0.11 0.00 -2.20 0.00 0.00 60.37 58.30 3giy h HIS 39 Cb 0.39 -0.32 -0.05 0.00 1.55 0.00 0.00 27.41 28.98 3giy h HIS 39 CO 0.03 0.97 0.48 -0.91 -1.30 0.00 0.00 177.93 177.19 3giy h ASN 40 N 1.01 0.49 0.00 3.26 -0.26 -0.48 0.05 115.58 119.66 3giy h ASN 40 Ca 0.20 0.02 -0.02 0.00 -0.56 0.00 0.00 56.30 55.94 3giy h ASN 40 Cb 0.42 -0.08 -0.00 0.00 -1.06 0.00 0.00 38.32 37.59 3giy h ASN 40 CO 0.01 0.28 -0.11 0.03 -1.06 0.00 0.00 177.43 176.58 3giy h ARG 41 N 0.54 0.00 -0.75 0.81 2.47 -1.11 -3.38 114.38 112.96 3giy h ARG 41 Ca 0.34 0.00 0.07 0.00 -1.26 0.00 0.00 59.98 59.13 3giy h ARG 41 Cb 0.59 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.86 3giy h ARG 41 CO -0.12 0.87 0.49 -0.44 0.56 0.00 0.00 179.97 181.34 3giy h ASP 42 N -1.00 0.67 -0.10 7.04 3.32 -0.65 -2.87 116.42 122.82 3giy h ASP 42 Ca -0.03 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.06 3giy h ASP 42 Cb 0.90 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 40.31 3giy h ASP 42 CO -0.02 0.42 0.12 1.62 -1.72 0.00 0.00 179.24 179.67 3giy h VAL 43 N 0.75 0.44 0.00 -1.35 3.04 -1.16 -0.83 116.25 117.14 3giy h VAL 43 Ca 0.33 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.02 3giy h VAL 43 Cb 0.32 0.90 0.00 0.00 -2.01 0.00 0.00 31.29 30.50 3giy h VAL 43 CO -0.12 0.00 0.00 -0.26 -1.01 0.00 0.00 177.57 176.18 3giy h PHE 44 N 0.00 0.00 0.00 3.17 0.04 -1.73 -2.33 116.94 116.09 3giy h PHE 44 Ca 0.05 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.82 3giy h PHE 44 Cb 0.29 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.44 3giy h PHE 44 CO 0.00 0.00 0.00 1.04 -0.60 0.00 0.00 178.31 178.75 3giy n GLN 45 N -3.00 0.53 0.00 1.51 1.13 -0.32 -2.79 117.38 114.44 3giy n GLN 45 Ca -0.00 0.03 0.14 0.00 -1.94 0.00 0.00 57.00 55.22 3giy n GLN 45 Cb 0.24 -1.50 0.74 0.00 0.11 0.00 0.00 30.24 29.82 3giy n GLN 45 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3giy n GLN 46 N -1.19 0.49 -4.45 -1.09 6.02 -0.88 -4.73 117.38 111.54 3giy n GLN 46 Ca 0.15 0.02 -0.20 0.00 -0.01 0.00 0.00 57.00 56.96 3giy n GLN 46 Cb 0.17 -1.50 -0.15 0.00 1.02 0.00 0.00 30.24 29.78 3giy n GLN 46 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 3giy s TRP 47 N -2.47 0.96 0.17 1.08 0.51 -1.12 0.27 118.94 118.34 3giy s TRP 47 Ca 0.30 -0.19 0.04 0.00 -2.12 0.00 0.00 56.10 54.13 3giy s TRP 47 Cb 0.19 -0.62 -0.05 0.00 -0.81 0.00 0.00 33.47 32.18 3giy s TRP 47 CO 0.41 -0.03 -0.07 1.03 -0.51 0.00 0.00 176.95 177.78 3giy s ARG 48 N -0.20 1.15 0.15 4.98 0.52 -0.48 -4.94 118.95 120.14 3giy s ARG 48 Ca 0.03 -1.53 -0.14 0.00 -0.52 0.00 0.00 55.73 53.58 3giy s ARG 48 Cb -0.05 -0.63 -0.07 0.00 0.52 0.00 0.00 34.95 34.72 3giy s ARG 48 CO -0.00 0.02 0.55 -0.06 0.02 0.00 0.00 175.30 175.83 3giy s PHE 49 N -3.35 3.59 -0.60 -0.53 0.08 -1.26 -0.46 117.98 115.45 3giy s PHE 49 Ca 0.21 1.05 0.04 0.00 0.12 0.00 0.00 56.93 58.35 3giy s PHE 49 Cb 0.03 -2.36 0.16 0.00 -0.57 0.00 0.00 43.02 40.29 3giy s PHE 49 CO 0.03 0.42 0.42 0.15 -0.10 0.00 0.00 175.22 176.14 3giy s LYS 50 N -2.02 1.98 0.56 0.44 1.02 -0.08 -4.87 119.74 116.77 3giy s LYS 50 Ca 0.38 -2.91 -0.20 0.00 0.02 0.00 0.00 55.97 53.27 3giy s LYS 50 Cb -0.15 -2.87 -0.06 0.00 -0.52 0.00 0.00 37.83 34.23 3giy s LYS 50 CO 0.19 -1.29 0.94 -2.30 -0.92 0.00 0.00 175.35 171.97 3giy n PRO 51 N 2.37 0.98 -3.61 -1.68 -0.02 -1.26 -4.67 135.00 127.09 3giy n PRO 51 Ca 0.20 0.37 -0.40 0.00 -2.02 0.00 0.00 63.50 61.65 3giy n PRO 51 Cb 0.38 -2.10 -0.11 0.00 -0.02 0.00 0.00 33.50 31.64 3giy n PRO 51 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3giy s LYS 52 N -2.53 2.73 0.79 -0.52 1.02 0.13 -4.97 119.74 116.40 3giy s LYS 52 Ca 0.72 -1.21 -0.12 0.00 0.02 0.00 0.00 55.97 55.39 3giy s LYS 52 Cb -0.45 -3.72 0.07 0.00 -0.52 0.00 0.00 37.83 33.21 3giy s LYS 52 CO 0.50 -0.78 1.14 1.03 -0.92 0.00 0.00 175.35 176.33 3giy s ARG 53 N 1.50 2.15 -1.52 1.68 1.81 -1.26 -3.94 118.95 119.37 3giy s ARG 53 Ca 0.02 0.30 -0.13 0.00 -1.72 0.00 0.00 55.73 54.19 3giy s ARG 53 Cb -0.20 -1.96 0.08 0.00 -0.45 0.00 0.00 34.95 32.42 3giy s ARG 53 CO 0.05 -1.50 0.98 1.28 -0.68 0.00 0.00 175.30 175.43 3giy n LEU 54 N -3.29 -2.56 -4.48 2.53 4.77 -1.26 -4.99 117.00 107.72 3giy n LEU 54 Ca 0.07 -0.74 -0.33 0.00 -0.03 0.00 0.00 56.01 54.98 3giy n LEU 54 Cb 0.59 -2.58 -0.13 0.00 -2.33 0.00 0.00 43.42 38.97 3giy n LEU 54 CO 0.57 0.47 -0.42 -0.69 -1.33 0.00 0.00 177.39 175.99 3giy s VAL 55 N -3.28 3.32 -0.44 4.08 1.01 -1.26 -5.07 120.40 118.76 3giy s VAL 55 Ca 0.65 -0.61 -0.28 0.00 0.00 0.00 0.00 61.98 61.74 3giy s VAL 55 Cb -0.32 -2.35 0.01 0.00 0.00 0.00 0.00 36.38 33.71 3giy s VAL 55 CO 0.80 0.57 1.48 -0.62 0.00 0.00 0.00 175.10 177.33 3giy s ASP 56 N -0.38 6.20 -0.23 3.32 2.15 -1.26 -4.83 116.67 121.64 3giy s ASP 56 Ca 0.05 0.77 0.11 0.00 0.43 0.00 0.00 52.55 53.91 3giy s ASP 56 Cb -0.12 -2.54 0.44 0.00 -0.30 0.00 0.00 42.92 40.40 3giy s ASP 56 CO 0.02 -1.56 1.30 1.33 -0.17 0.00 0.00 175.17 176.10 3giy n VAL 57 N 7.10 2.30 0.33 1.11 0.24 -1.26 -4.65 118.33 123.50 3giy n VAL 57 Ca 0.17 -2.96 0.15 0.00 -2.04 0.00 0.00 64.34 59.65 3giy n VAL 57 Cb 0.48 -0.27 0.52 0.00 -1.47 0.00 0.00 33.84 33.10 3giy n VAL 57 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 3giy h SER 58 N 0.94 0.00 -3.21 -1.34 4.64 -2.00 -3.38 113.55 109.21 3giy h SER 58 Ca 0.07 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.80 3giy h SER 58 Cb 1.23 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.92 3giy h SER 58 CO 0.14 0.00 -0.75 -0.13 -0.87 0.00 0.00 176.83 175.21 3giy s ARG 59 N -3.45 0.79 0.13 4.77 0.52 -1.26 -5.13 118.95 115.33 3giy s ARG 59 Ca 0.04 -1.18 0.06 0.00 -0.52 0.00 0.00 55.73 54.13 3giy s ARG 59 Cb 0.09 -2.09 -0.04 0.00 0.52 0.00 0.00 34.95 33.43 3giy s ARG 59 CO 0.54 -0.99 0.03 1.03 0.02 0.00 0.00 175.30 175.93 3giy s ARG 60 N 1.51 2.59 -0.05 3.54 0.52 -1.26 -4.77 118.95 121.02 3giy s ARG 60 Ca 0.10 -0.93 0.01 0.00 -0.52 0.00 0.00 55.73 54.39 3giy s ARG 60 Cb -0.18 -2.51 0.02 0.00 0.52 0.00 0.00 34.95 32.81 3giy s ARG 60 CO -0.23 0.50 -0.04 0.45 0.02 0.00 0.00 175.30 176.01 3giy s SER 61 N -2.70 1.03 0.00 0.23 0.15 0.87 -4.99 113.70 108.30 3giy s SER 61 Ca 0.28 -0.12 0.18 0.00 0.70 0.00 0.00 55.95 56.98 3giy s SER 61 Cb -0.11 -0.44 0.01 0.00 -1.71 0.00 0.00 66.02 63.77 3giy s SER 61 CO 0.20 -0.08 0.93 0.18 1.20 0.00 0.00 173.24 175.67 3giy n LEU 62 N 4.21 1.83 -4.76 3.45 4.32 -1.26 -0.94 117.00 123.85 3giy n LEU 62 Ca -0.22 -0.80 -0.39 0.00 -0.02 0.00 0.00 56.01 54.58 3giy n LEU 62 Cb 0.51 0.00 0.02 0.00 -1.62 0.00 0.00 43.42 42.33 3giy n LEU 62 CO 0.21 0.34 1.04 -1.58 -1.22 0.00 0.00 177.39 176.18 3giy s GLN 63 N -1.97 3.52 0.04 3.23 0.74 -0.97 -3.71 119.66 120.56 3giy s GLN 63 Ca 0.15 2.35 -0.27 0.00 0.05 0.00 0.00 55.36 57.64 3giy s GLN 63 Cb 0.14 -2.53 0.09 0.00 1.10 0.00 0.00 33.01 31.81 3giy s GLN 63 CO 0.41 -0.92 0.79 0.00 -0.55 0.00 0.00 175.29 175.02 3giy s ALA 64 N -1.24 -1.75 -0.10 1.58 0.00 -0.85 -4.65 121.76 114.75 3giy s ALA 64 Ca 0.64 0.88 -0.14 0.00 0.00 0.00 0.00 51.96 53.35 3giy s ALA 64 Cb -0.42 0.50 -0.05 0.00 0.00 0.00 0.00 23.12 23.15 3giy s ALA 64 CO 0.53 -0.68 0.33 -1.21 0.00 0.00 0.00 175.76 174.73 3giy s GLU 65 N -3.15 4.05 -0.20 0.00 2.02 -1.26 -1.02 118.70 119.14 3giy s GLU 65 Ca 0.03 0.22 0.01 0.00 0.02 0.00 0.00 54.97 55.24 3giy s GLU 65 Cb -0.01 -3.33 0.04 0.00 0.10 0.00 0.00 34.13 30.93 3giy s GLU 65 CO -0.09 0.45 -0.10 0.08 0.02 0.00 0.00 175.26 175.61 3giy s VAL 66 N -0.21 1.62 -1.55 2.63 1.01 0.49 -4.62 120.40 119.77 3giy s VAL 66 Ca 0.20 -0.98 -0.01 0.00 0.00 0.00 0.00 61.98 61.18 3giy s VAL 66 Cb -0.14 -1.69 0.00 0.00 0.00 0.00 0.00 36.38 34.55 3giy s VAL 66 CO 0.08 0.18 0.18 0.18 0.00 0.00 0.00 175.10 175.72 3giy n LEU 67 N 4.69 -2.11 0.00 3.92 4.77 -1.26 -1.94 117.00 125.08 3giy n LEU 67 Ca -0.15 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 3giy n LEU 67 Cb 0.47 -2.73 0.00 0.00 -2.33 0.00 0.00 43.42 38.83 3giy n LEU 67 CO 0.20 -0.06 0.00 0.61 -1.33 0.00 0.00 177.39 176.81 3giy n GLY 68 N -1.16 1.30 3.40 -0.72 0.00 -1.26 -5.03 105.19 101.71 3giy n GLY 68 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 3giy n GLY 68 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3giy s LYS 69 N -0.32 3.35 0.37 1.61 2.20 -0.82 -4.99 119.74 121.15 3giy s LYS 69 Ca 0.00 -0.66 -0.26 0.00 -0.36 0.00 0.00 55.97 54.69 3giy s LYS 69 Cb 0.00 -2.65 -0.09 0.00 -1.51 0.00 0.00 37.83 33.58 3giy s LYS 69 CO 0.00 0.26 1.11 0.50 -0.36 0.00 0.00 175.35 176.86 3giy s ARG 70 N 0.25 4.24 0.15 4.03 3.52 -1.26 -0.38 118.95 129.50 3giy s ARG 70 Ca -0.08 1.72 -0.08 0.00 -0.13 0.00 0.00 55.73 57.17 3giy s ARG 70 Cb -0.15 -2.76 -0.01 0.00 -1.56 0.00 0.00 34.95 30.47 3giy s ARG 70 CO 0.05 -0.13 0.24 1.14 -0.81 0.00 0.00 175.30 175.79 3giy s GLN 71 N -2.15 1.08 0.33 5.12 -2.07 -0.19 -4.93 119.66 116.85 3giy s GLN 71 Ca 0.54 -1.19 0.04 0.00 -1.82 0.00 0.00 55.36 52.93 3giy s GLN 71 Cb -0.28 0.35 0.65 0.00 -1.09 0.00 0.00 33.01 32.64 3giy s GLN 71 CO 0.36 -0.38 1.92 0.66 -1.32 0.00 0.00 175.29 176.53 3giy h SER 72 N 2.62 0.78 -5.01 12.60 4.64 -1.70 -2.25 113.55 125.23 3giy h SER 72 Ca -0.32 0.01 -0.05 0.00 -0.47 0.00 0.00 61.79 60.95 3giy h SER 72 Cb 1.22 -0.16 -0.16 0.00 -0.31 0.00 0.00 62.40 63.00 3giy h SER 72 CO 0.51 0.49 0.10 0.00 -0.87 0.00 0.00 176.83 177.06 3giy s MET 73 N -5.79 1.10 0.00 4.77 0.00 -1.24 -2.28 119.30 115.85 3giy s MET 73 Ca -0.11 -0.23 -0.01 0.00 0.00 0.00 0.00 55.69 55.34 3giy s MET 73 Cb 0.20 0.50 -0.07 0.00 0.00 0.00 0.00 34.83 35.47 3giy s MET 73 CO 0.79 -0.41 1.43 -2.30 0.00 0.00 0.00 175.02 174.53 3giy n PRO 74 N 0.28 0.68 -4.30 3.16 -0.02 -1.26 -4.80 135.00 128.75 3giy n PRO 74 Ca -0.18 -0.25 -0.18 0.00 -2.02 0.00 0.00 63.50 60.87 3giy n PRO 74 Cb 0.61 -1.54 -0.11 0.00 -0.02 0.00 0.00 33.50 32.45 3giy n PRO 74 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3giy s LEU 75 N 0.00 2.49 0.01 2.45 1.43 -1.26 -1.27 118.68 122.53 3giy s LEU 75 Ca 0.17 -0.93 -0.14 0.00 -1.03 0.00 0.00 54.13 52.19 3giy s LEU 75 Cb 0.08 -0.61 0.02 0.00 0.03 0.00 0.00 46.19 45.71 3giy s LEU 75 CO 0.00 -0.17 0.30 -0.76 0.23 0.00 0.00 176.35 175.96 3giy s LEU 76 N -2.94 0.89 -0.40 1.79 1.02 -0.77 -4.40 118.68 113.88 3giy s LEU 76 Ca 0.16 -0.05 -0.19 0.00 0.02 0.00 0.00 54.13 54.08 3giy s LEU 76 Cb -0.02 1.29 0.01 0.00 0.02 0.00 0.00 46.19 47.49 3giy s LEU 76 CO 0.05 -0.52 0.56 -0.63 0.02 0.00 0.00 176.35 175.83 3giy s ILE 77 N -1.87 4.94 1.02 -0.59 1.01 -0.86 -0.21 121.20 124.63 3giy s ILE 77 Ca -0.10 0.17 -0.13 0.00 0.00 0.00 0.00 60.65 60.59 3giy s ILE 77 Cb -0.03 -4.08 0.20 0.00 0.01 0.00 0.00 42.46 38.55 3giy s ILE 77 CO 0.01 -0.41 1.11 -0.83 0.00 0.00 0.00 174.94 174.82 3giy s GLY 78 N 1.86 1.57 -0.04 6.18 0.00 0.05 -1.19 107.32 115.76 3giy s GLY 78 Ca 0.20 -0.50 -0.30 0.00 0.00 0.00 0.00 44.72 44.12 3giy s GLY 78 CO 0.16 0.15 1.31 2.56 0.00 0.00 0.00 173.10 177.28 3giy s PRO 79 N -5.09 4.30 -0.00 2.90 0.04 -1.24 -4.54 135.00 131.37 3giy s PRO 79 Ca 0.66 1.82 0.00 0.00 0.04 0.00 0.00 61.00 63.53 3giy s PRO 79 Cb -0.17 -3.60 0.00 0.00 0.04 0.00 0.00 34.50 30.78 3giy s PRO 79 CO 0.57 -0.55 -0.01 0.95 0.04 0.00 0.00 177.00 178.00 3giy s THR 80 N 2.49 0.11 0.31 1.26 -4.23 -1.26 -4.93 115.64 109.39 3giy s THR 80 Ca 0.60 -0.03 -0.08 0.00 -1.18 0.00 0.00 61.69 61.00 3giy s THR 80 Cb -0.28 -0.11 -0.06 0.00 1.34 0.00 0.00 72.50 73.39 3giy s THR 80 CO 0.24 0.04 0.62 0.00 -0.54 0.00 0.00 174.62 174.98 3giy s ALA 81 N 0.11 3.52 -1.34 3.99 0.00 -1.26 -4.42 121.76 122.36 3giy s ALA 81 Ca -0.01 -0.38 -0.08 0.00 0.00 0.00 0.00 51.96 51.49 3giy s ALA 81 Cb -0.02 -2.46 0.01 0.00 0.00 0.00 0.00 23.12 20.65 3giy s ALA 81 CO -0.00 0.22 1.01 1.28 0.00 0.00 0.00 175.76 178.26 3giy n LEU 82 N -0.89 -3.19 0.27 0.00 4.77 -0.96 -4.89 117.00 112.11 3giy n LEU 82 Ca 0.00 -0.46 0.12 0.00 -0.03 0.00 0.00 56.01 55.64 3giy n LEU 82 Cb 0.54 -2.91 0.74 0.00 -2.33 0.00 0.00 43.42 39.46 3giy n LEU 82 CO 0.47 0.54 1.01 0.78 -1.33 0.00 0.00 177.39 178.86 3giy h ASN 83 N -2.31 0.00 0.44 -1.43 2.35 -1.87 -0.79 115.58 111.98 3giy h ASN 83 Ca -0.54 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.21 3giy h ASN 83 Cb 1.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.72 3giy h ASN 83 CO 0.54 0.09 0.00 0.61 -1.65 0.00 0.00 177.43 177.02 3giy n GLY 84 N -0.96 -0.97 0.13 2.83 0.00 -1.26 -1.27 105.19 103.70 3giy n GLY 84 Ca -0.02 -0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.11 3giy n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3giy h ALA 85 N 2.35 0.66 0.01 4.61 0.00 -1.52 -3.34 119.26 122.04 3giy h ALA 85 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.60 3giy h ALA 85 Cb 0.22 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 3giy h ALA 85 CO 0.00 0.00 -1.86 1.28 0.00 0.00 0.00 179.25 178.67 3giy n LEU 86 N -2.66 0.98 -3.64 0.00 4.77 -0.39 -4.98 117.00 111.09 3giy n LEU 86 Ca 0.02 0.32 -0.10 0.00 -0.03 0.00 0.00 56.01 56.22 3giy n LEU 86 Cb 0.52 0.05 -0.07 0.00 -2.33 0.00 0.00 43.42 41.59 3giy n LEU 86 CO 0.37 0.47 0.66 0.86 -1.33 0.00 0.00 177.39 178.43 3giy s TRP 87 N -2.58 -0.55 0.03 -1.77 -0.11 -0.98 -4.30 118.94 108.68 3giy s TRP 87 Ca -0.08 1.34 -0.37 0.00 1.22 0.00 0.00 56.10 58.21 3giy s TRP 87 Cb 0.08 0.34 -0.16 0.00 -1.50 0.00 0.00 33.47 32.23 3giy s TRP 87 CO 0.81 -0.27 1.48 -2.30 -4.62 0.00 0.00 176.95 172.06 3giy n PRO 88 N 2.36 1.38 -3.66 5.86 -0.02 -1.26 -0.41 135.00 139.26 3giy n PRO 88 Ca -0.13 0.50 -0.27 0.00 -2.02 0.00 0.00 63.50 61.58 3giy n PRO 88 Cb 0.56 -2.18 0.03 0.00 -0.02 0.00 0.00 33.50 31.88 3giy n PRO 88 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3giy n LYS 89 N 3.38 -5.53 -0.30 -0.52 5.02 -1.26 -4.84 118.16 114.10 3giy n LYS 89 Ca 0.20 0.66 0.09 0.00 -2.02 0.00 0.00 58.31 57.24 3giy n LYS 89 Cb 0.20 -5.55 0.26 0.00 -0.02 0.00 0.00 35.03 29.92 3giy n LYS 89 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 3giy h GLY 90 N -1.93 1.44 0.61 0.72 0.00 -0.90 -1.26 103.07 101.75 3giy h GLY 90 Ca -0.55 -0.22 0.07 0.00 0.00 0.00 0.00 47.33 46.63 3giy h GLY 90 CO 0.62 -0.12 0.32 -0.55 0.00 0.00 0.00 176.54 176.80 3giy h ASP 91 N 0.54 0.44 0.00 0.19 3.32 -1.85 -0.48 116.42 118.58 3giy h ASP 91 Ca 0.50 0.04 -0.16 0.00 0.02 0.00 0.00 57.03 57.43 3giy h ASP 91 Cb 0.81 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 3giy h ASP 91 CO -0.43 0.28 -0.54 0.25 -1.72 0.00 0.00 179.24 177.09 3giy h LEU 92 N 0.58 0.64 -0.26 1.55 5.85 -1.67 -1.53 115.31 120.47 3giy h LEU 92 Ca 0.29 -0.33 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 3giy h LEU 92 Cb 0.24 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 3giy h LEU 92 CO -0.21 1.05 0.16 0.00 -0.34 0.00 0.00 178.44 179.10 3giy h ALA 93 N 0.97 0.33 -0.20 1.25 0.00 -0.65 -0.00 119.26 120.95 3giy h ALA 93 Ca 0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3giy h ALA 93 Cb 1.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3giy h ALA 93 CO 0.10 -0.17 0.07 -0.07 0.00 0.00 0.00 179.25 179.18 3giy h LEU 94 N 0.33 0.28 -0.54 0.00 3.38 -1.07 -1.83 115.31 115.85 3giy h LEU 94 Ca 0.09 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.90 3giy h LEU 94 Cb 0.01 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 3giy h LEU 94 CO -0.02 0.39 0.33 0.00 0.09 0.00 0.00 178.44 179.23 3giy h ALA 95 N 0.90 0.70 -0.16 1.53 0.00 -1.10 -1.03 119.26 120.11 3giy h ALA 95 Ca 0.06 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 3giy h ALA 95 Cb 0.20 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3giy h ALA 95 CO -0.00 0.06 -0.38 0.00 0.00 0.00 0.00 179.25 178.92 3giy h ARG 96 N 0.66 0.34 -0.27 0.00 3.08 -0.92 -1.59 114.38 115.68 3giy h ARG 96 Ca 0.22 -0.16 -0.18 0.00 0.07 0.00 0.00 59.98 59.93 3giy h ARG 96 Cb 0.00 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 3giy h ARG 96 CO -0.09 0.68 -0.53 0.00 -1.07 0.00 0.00 179.97 178.96 3giy h ALA 97 N 1.31 0.56 -0.23 0.04 0.00 -1.02 -1.69 119.26 118.22 3giy h ALA 97 Ca 0.03 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 3giy h ALA 97 Cb 0.81 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 3giy h ALA 97 CO 0.06 0.68 0.07 0.00 0.00 0.00 0.00 179.25 180.07 3giy h ALA 98 N 0.79 0.30 -0.78 0.00 0.00 -1.03 -1.78 119.26 116.76 3giy h ALA 98 Ca 0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3giy h ALA 98 Cb 1.11 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.78 3giy h ALA 98 CO 0.11 -0.07 0.46 1.15 0.00 0.00 0.00 179.25 180.90 3giy h THR 99 N 0.21 1.22 -0.33 0.00 2.02 -1.24 0.02 112.91 114.81 3giy h THR 99 Ca 0.08 -0.50 -0.04 0.00 0.77 0.00 0.00 66.41 66.71 3giy h THR 99 Cb 0.23 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 66.78 3giy h THR 99 CO -0.00 0.24 0.05 0.11 0.37 0.00 0.00 175.52 176.29 3giy h LYS 100 N 1.06 0.49 0.00 6.66 1.57 -1.15 -1.80 116.57 123.41 3giy h LYS 100 Ca 0.28 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 3giy h LYS 100 Cb -0.02 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.21 3giy h LYS 100 CO -0.05 0.48 -0.00 0.00 -0.57 0.00 0.00 179.45 179.31 3giy h ALA 101 N 1.58 1.00 0.00 3.86 0.00 -0.54 -3.48 119.26 121.68 3giy h ALA 101 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3giy h ALA 101 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3giy h ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 3giy n GLY 102 N 1.21 0.92 3.28 0.00 0.00 -0.11 -4.63 105.19 105.85 3giy n GLY 102 Ca 0.05 -0.56 -0.15 0.00 0.00 0.00 0.00 46.02 45.35 3giy n GLY 102 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3giy s ILE 103 N -2.00 1.28 0.67 -0.61 -4.36 -0.59 -2.18 121.20 113.41 3giy s ILE 103 Ca 0.00 -2.09 -0.14 0.00 -0.26 0.00 0.00 60.65 58.16 3giy s ILE 103 Cb 0.00 -1.94 0.00 0.00 1.25 0.00 0.00 42.46 41.77 3giy s ILE 103 CO 0.00 -0.67 1.09 -2.84 0.24 0.00 0.00 174.94 172.75 3giy s PRO 104 N -3.74 2.84 -0.04 0.37 0.02 -1.26 -3.83 135.00 129.36 3giy s PRO 104 Ca 0.19 1.25 0.05 0.00 0.02 0.00 0.00 61.00 62.51 3giy s PRO 104 Cb 0.02 -1.96 -0.01 0.00 0.02 0.00 0.00 34.50 32.57 3giy s PRO 104 CO 0.03 -1.20 -0.18 0.12 -0.33 0.00 0.00 177.00 175.43 3giy s PHE 105 N -2.56 1.79 -0.22 6.54 5.36 -0.96 -2.04 117.98 125.90 3giy s PHE 105 Ca 0.64 -0.50 -0.05 0.00 -0.96 0.00 0.00 56.93 56.06 3giy s PHE 105 Cb -0.18 -1.20 -0.02 0.00 -0.34 0.00 0.00 43.02 41.28 3giy s PHE 105 CO 0.45 -0.16 0.01 0.08 -1.46 0.00 0.00 175.22 174.14 3giy s VAL 106 N -0.03 3.85 0.01 3.12 1.01 -0.33 -1.01 120.40 127.02 3giy s VAL 106 Ca -0.03 -0.33 -0.24 0.00 0.00 0.00 0.00 61.98 61.38 3giy s VAL 106 Cb -0.11 -2.77 -0.05 0.00 0.00 0.00 0.00 36.38 33.45 3giy s VAL 106 CO 0.02 0.40 0.71 -0.22 0.00 0.00 0.00 175.10 176.01 3giy s LEU 107 N 1.37 4.41 0.49 3.92 2.96 -0.16 -3.59 118.68 128.09 3giy s LEU 107 Ca 0.05 1.33 -0.17 0.00 -0.22 0.00 0.00 54.13 55.12 3giy s LEU 107 Cb -0.15 -3.13 -0.08 0.00 0.50 0.00 0.00 46.19 43.33 3giy s LEU 107 CO 0.01 0.01 0.96 -0.55 -1.32 0.00 0.00 176.35 175.46 3giy s SER 108 N 0.09 6.65 0.51 3.68 0.15 -1.26 -0.37 113.70 123.14 3giy s SER 108 Ca 0.37 1.55 0.30 0.00 0.70 0.00 0.00 55.95 58.86 3giy s SER 108 Cb -0.19 -2.50 1.19 0.00 -1.71 0.00 0.00 66.02 62.81 3giy s SER 108 CO 0.21 -0.54 1.92 0.74 1.20 0.00 0.00 173.24 176.77 3giy h THR 109 N 1.05 0.23 -0.83 6.45 2.02 -1.89 -2.77 112.91 117.17 3giy h THR 109 Ca -0.47 -0.75 -0.53 0.00 0.77 0.00 0.00 66.41 65.43 3giy h THR 109 Cb 1.18 1.61 -0.29 0.00 -1.74 0.00 0.00 68.15 68.91 3giy h THR 109 CO 0.62 0.09 0.32 0.00 0.37 0.00 0.00 175.52 176.91 3giy n ALA 110 N -2.15 5.58 -1.76 6.16 0.00 -1.26 -4.65 120.51 122.43 3giy n ALA 110 Ca 0.00 -3.38 -0.30 0.00 0.00 0.00 0.00 53.44 49.77 3giy n ALA 110 Cb 0.35 -1.24 0.08 0.00 0.00 0.00 0.00 19.45 18.65 3giy n ALA 110 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3giy s SER 111 N -2.22 4.74 0.06 0.00 1.04 -1.05 -2.25 113.70 114.02 3giy s SER 111 Ca 0.57 1.07 0.23 0.00 0.48 0.00 0.00 55.95 58.30 3giy s SER 111 Cb 0.47 -1.75 0.09 0.00 0.10 0.00 0.00 66.02 64.93 3giy s SER 111 CO 0.02 -1.79 1.07 0.59 0.98 0.00 0.00 173.24 174.12 3giy n ASN 112 N -3.28 0.62 -4.41 7.02 3.02 -1.26 -3.78 115.26 113.20 3giy n ASN 112 Ca 0.07 -0.19 -0.33 0.00 -0.03 0.00 0.00 54.58 54.11 3giy n ASN 112 Cb 0.58 0.71 -0.14 0.00 -0.61 0.00 0.00 39.78 40.32 3giy n ASN 112 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 3giy s MET 113 N -3.18 3.03 0.80 3.52 1.75 -1.26 -4.49 119.30 119.47 3giy s MET 113 Ca 0.04 -0.70 -0.11 0.00 -1.25 0.00 0.00 55.69 53.68 3giy s MET 113 Cb 0.14 -2.52 0.08 0.00 2.84 0.00 0.00 34.83 35.37 3giy s MET 113 CO 0.79 0.37 1.11 -1.54 -0.65 0.00 0.00 175.02 175.10 3giy s SER 114 N -0.07 4.14 0.18 1.11 1.04 -1.26 -4.82 113.70 114.01 3giy s SER 114 Ca -0.02 1.93 -0.15 0.00 0.48 0.00 0.00 55.95 58.19 3giy s SER 114 Cb -0.14 -2.54 0.15 0.00 0.10 0.00 0.00 66.02 63.59 3giy s SER 114 CO 0.04 -2.28 1.67 0.40 0.98 0.00 0.00 173.24 174.05 3giy h ILE 115 N -1.23 0.60 -0.49 -1.02 2.04 -1.95 -2.44 117.51 113.02 3giy h ILE 115 Ca -0.44 -0.02 -0.10 0.00 1.00 0.00 0.00 64.86 65.31 3giy h ILE 115 Cb 1.24 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 3giy h ILE 115 CO 0.49 0.01 -0.07 -0.33 0.00 0.00 0.00 178.15 178.25 3giy h GLU 116 N 0.06 0.91 -0.47 2.37 3.07 -1.92 -2.88 114.58 115.72 3giy h GLU 116 Ca 0.22 -0.33 -0.04 0.00 -0.50 0.00 0.00 59.36 58.71 3giy h GLU 116 Cb 0.34 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.17 3giy h GLU 116 CO -0.42 0.98 0.13 -0.44 -1.40 0.00 0.00 179.01 177.85 3giy h ASP 117 N 0.77 0.71 -0.70 1.42 3.32 -1.86 -1.95 116.42 118.13 3giy h ASP 117 Ca 0.13 -0.22 -0.07 0.00 0.02 0.00 0.00 57.03 56.88 3giy h ASP 117 Cb 0.61 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.95 3giy h ASP 117 CO 0.04 0.75 0.14 0.25 -1.72 0.00 0.00 179.24 178.70 3giy h LEU 118 N 0.63 1.08 -1.88 1.55 5.85 -1.48 -1.47 115.31 119.60 3giy h LEU 118 Ca 0.15 -0.24 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 3giy h LEU 118 Cb 0.31 -0.29 -0.00 0.00 0.37 0.00 0.00 40.66 41.05 3giy h LEU 118 CO -0.00 1.05 -0.13 0.00 -0.34 0.00 0.00 178.44 179.02 3giy h ALA 119 N 1.08 1.47 0.00 1.25 0.00 -1.33 0.17 119.26 121.89 3giy h ALA 119 Ca 0.22 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 3giy h ALA 119 Cb 0.41 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3giy h ALA 119 CO 0.01 0.16 -0.89 -0.09 0.00 0.00 0.00 179.25 178.44 3giy h ARG 120 N 0.00 0.00 -0.01 0.00 2.43 -0.73 -3.36 114.38 112.71 3giy h ARG 120 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3giy h ARG 120 Cb 0.29 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 3giy h ARG 120 CO 0.02 0.25 -0.54 1.04 -1.51 0.00 0.00 179.97 179.22 3giy n GLN 121 N -2.96 1.65 -3.83 0.20 6.02 -0.61 -4.94 117.38 112.92 3giy n GLN 121 Ca -0.03 -0.45 -0.16 0.00 -0.01 0.00 0.00 57.00 56.35 3giy n GLN 121 Cb 0.71 -1.28 -0.16 0.00 1.02 0.00 0.00 30.24 30.52 3giy n GLN 121 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3giy n ASP 123 N 4.22 3.28 -2.62 0.00 5.68 -1.26 -4.54 116.55 121.31 3giy n ASP 123 Ca -0.26 -3.56 -0.06 0.00 -0.50 0.00 0.00 54.79 50.41 3giy n ASP 123 Cb 0.50 -0.68 0.04 0.00 -1.14 0.00 0.00 41.12 39.83 3giy n ASP 123 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3giy n GLY 124 N -0.92 0.31 3.59 6.12 0.00 -1.26 -4.98 105.19 108.05 3giy n GLY 124 Ca 0.39 -1.91 -0.42 0.00 0.00 0.00 0.00 46.02 44.07 3giy n GLY 124 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3giy s ASP 125 N -2.09 6.41 -0.16 1.61 -1.08 -1.26 -4.99 116.67 115.11 3giy s ASP 125 Ca 0.18 0.31 -0.07 0.00 -0.52 0.00 0.00 52.55 52.45 3giy s ASP 125 Cb -0.01 -2.55 -0.04 0.00 -1.46 0.00 0.00 42.92 38.86 3giy s ASP 125 CO 0.12 -1.47 0.07 -0.76 0.52 0.00 0.00 175.17 173.64 3giy s LEU 126 N 5.13 3.88 0.20 -1.34 1.43 -1.26 -2.27 118.68 124.45 3giy s LEU 126 Ca 0.48 0.15 0.09 0.00 -1.03 0.00 0.00 54.13 53.83 3giy s LEU 126 Cb -0.09 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.13 3giy s LEU 126 CO 0.28 0.24 -0.09 0.26 0.23 0.00 0.00 176.35 177.27 3giy s TRP 127 N -0.01 2.63 -0.12 0.29 0.52 -0.18 -1.59 118.94 120.48 3giy s TRP 127 Ca 0.06 -0.23 0.02 0.00 0.02 0.00 0.00 56.10 55.97 3giy s TRP 127 Cb -0.12 -1.26 0.01 0.00 -1.15 0.00 0.00 33.47 30.96 3giy s TRP 127 CO 0.01 0.54 -0.17 0.12 0.02 0.00 0.00 176.95 177.46 3giy s PHE 128 N -1.84 2.22 -0.24 -1.98 5.36 -0.16 -0.99 117.98 120.35 3giy s PHE 128 Ca 0.26 -1.10 -0.17 0.00 -0.96 0.00 0.00 56.93 54.97 3giy s PHE 128 Cb -0.08 -1.57 -0.03 0.00 -0.34 0.00 0.00 43.02 41.00 3giy s PHE 128 CO 0.16 -0.54 0.45 -1.14 -1.46 0.00 0.00 175.22 172.68 3giy s GLN 129 N 0.99 4.09 -0.17 10.12 -0.44 0.50 -0.42 119.66 134.34 3giy s GLN 129 Ca -0.05 0.23 -0.08 0.00 -2.50 0.00 0.00 55.36 52.95 3giy s GLN 129 Cb -0.15 -3.61 -0.04 0.00 -1.64 0.00 0.00 33.01 27.56 3giy s GLN 129 CO -0.03 -0.23 0.12 -1.17 0.50 0.00 0.00 175.29 174.48 3giy s LEU 130 N 1.92 4.19 -0.10 3.68 2.96 0.31 -2.67 118.68 128.98 3giy s LEU 130 Ca 0.19 0.29 0.03 0.00 -0.22 0.00 0.00 54.13 54.42 3giy s LEU 130 Cb -0.15 -2.05 -0.01 0.00 0.50 0.00 0.00 46.19 44.47 3giy s LEU 130 CO 0.09 0.27 -0.19 -0.31 -1.32 0.00 0.00 176.35 174.88 3giy s TYR 131 N -0.17 2.64 -0.35 5.38 2.02 -1.26 -2.06 117.35 123.55 3giy s TYR 131 Ca 0.10 -0.76 -0.11 0.00 -0.37 0.00 0.00 57.07 55.94 3giy s TYR 131 Cb -0.12 -1.73 0.01 0.00 -0.40 0.00 0.00 41.96 39.73 3giy s TYR 131 CO 0.01 -0.25 0.19 0.08 -1.57 0.00 0.00 175.55 174.00 3giy s VAL 132 N 0.15 4.63 -0.18 0.71 1.01 -1.26 -4.85 120.40 120.60 3giy s VAL 132 Ca -0.10 -0.63 -0.02 0.00 0.00 0.00 0.00 61.98 61.22 3giy s VAL 132 Cb -0.16 -3.48 -0.10 0.00 0.00 0.00 0.00 36.38 32.64 3giy s VAL 132 CO 0.06 -0.09 -0.19 -0.38 0.00 0.00 0.00 175.10 174.50 3giy n ILE 133 N 5.00 1.02 -3.97 2.22 -0.00 -1.26 -0.25 119.36 122.12 3giy n ILE 133 Ca -0.13 -0.34 -0.22 0.00 -0.00 0.00 0.00 62.75 62.06 3giy n ILE 133 Cb 0.48 -1.34 -0.17 0.00 -0.00 0.00 0.00 39.64 38.60 3giy n ILE 133 CO 0.00 0.00 0.00 -2.28 -0.00 0.00 0.00 176.55 174.27 3giy s HIS 134 N -2.35 0.85 0.18 1.39 5.65 -1.26 -4.20 115.29 115.55 3giy s HIS 134 Ca -0.25 -0.28 -0.16 0.00 0.25 0.00 0.00 55.06 54.62 3giy s HIS 134 Cb 0.08 -0.82 0.13 0.00 -1.18 0.00 0.00 32.58 30.78 3giy s HIS 134 CO 0.38 -0.30 1.66 0.00 -0.65 0.00 0.00 174.74 175.83 3giy h ARG 135 N 7.82 0.02 -0.44 2.88 2.47 -1.99 0.31 114.38 125.44 3giy h ARG 135 Ca -0.29 -0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.43 3giy h ARG 135 Cb 1.14 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.43 3giy h ARG 135 CO 0.37 0.01 0.27 1.49 0.56 0.00 0.00 179.97 182.67 3giy h GLU 136 N 0.02 0.61 -0.57 0.04 4.81 -1.99 0.37 114.58 117.87 3giy h GLU 136 Ca 0.22 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.35 3giy h GLU 136 Cb 0.33 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 3giy h GLU 136 CO -0.45 0.45 0.17 0.82 -0.73 0.00 0.00 179.01 179.27 3giy h ILE 137 N 0.59 1.24 -0.48 2.32 2.04 -1.80 -1.85 117.51 119.57 3giy h ILE 137 Ca 0.16 -0.82 0.01 0.00 1.00 0.00 0.00 64.86 65.21 3giy h ILE 137 Cb 0.00 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 3giy h ILE 137 CO -0.03 0.31 0.31 0.00 0.00 0.00 0.00 178.15 178.74 3giy h ALA 138 N 1.04 0.61 -0.63 1.87 0.00 -0.04 -1.19 119.26 120.92 3giy h ALA 138 Ca 0.18 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.11 3giy h ALA 138 Cb 0.29 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 3giy h ALA 138 CO -0.00 0.04 0.42 0.37 0.00 0.00 0.00 179.25 180.07 3giy h GLN 139 N 0.63 0.71 -0.50 0.00 4.15 -0.61 -0.08 115.11 119.40 3giy h GLN 139 Ca 0.18 -0.04 -0.05 0.00 0.77 0.00 0.00 58.65 59.51 3giy h GLN 139 Cb -0.05 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 27.46 3giy h GLN 139 CO -0.05 0.47 0.13 0.78 -1.93 0.00 0.00 178.83 178.22 3giy h GLY 140 N 0.73 0.87 1.15 2.39 0.00 -0.40 -2.20 103.07 105.59 3giy h GLY 140 Ca 0.26 -0.54 -0.15 0.00 0.00 0.00 0.00 47.33 46.90 3giy h GLY 140 CO -0.07 0.50 -0.31 -0.33 0.00 0.00 0.00 176.54 176.33 3giy h MET 141 N 0.69 0.95 -0.06 4.80 2.86 -0.55 -1.71 114.93 121.92 3giy h MET 141 Ca 0.16 -0.46 0.01 0.00 -2.06 0.00 0.00 59.70 57.35 3giy h MET 141 Cb 0.33 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 3giy h MET 141 CO 0.00 1.12 -0.00 0.28 1.06 0.00 0.00 176.91 179.37 3giy h VAL 142 N 0.80 0.96 -0.35 -2.22 2.07 -0.95 0.64 116.25 117.20 3giy h VAL 142 Ca 0.08 -0.01 -0.07 0.00 0.82 0.00 0.00 66.70 67.53 3giy h VAL 142 Cb 0.90 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 3giy h VAL 142 CO 0.08 0.00 -0.08 -0.07 0.02 0.00 0.00 177.57 177.53 3giy h LEU 143 N 0.02 0.56 -0.73 2.57 -0.00 -1.40 -0.90 115.31 115.42 3giy h LEU 143 Ca 0.03 -0.14 -0.04 0.00 -0.00 0.00 0.00 57.88 57.73 3giy h LEU 143 Cb 0.03 -0.15 -0.03 0.00 -0.00 0.00 0.00 40.66 40.51 3giy h LEU 143 CO -0.05 0.68 0.31 0.50 -0.00 0.00 0.00 178.44 179.88 3giy h LYS 144 N 0.54 1.07 -0.30 1.13 1.63 -0.75 -0.27 116.57 119.62 3giy h LYS 144 Ca 0.10 -0.18 -0.14 0.00 -0.85 0.00 0.00 60.65 59.58 3giy h LYS 144 Cb 0.47 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 31.91 3giy h LYS 144 CO 0.02 0.87 -0.39 0.00 -3.45 0.00 0.00 179.45 176.50 3giy h ALA 145 N 1.15 0.75 0.01 5.00 0.00 -0.48 -2.17 119.26 123.52 3giy h ALA 145 Ca 0.24 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 3giy h ALA 145 Cb 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3giy h ALA 145 CO -0.02 0.66 -0.00 1.25 0.00 0.00 0.00 179.25 181.13 3giy h LEU 146 N 0.59 -0.01 -1.41 0.00 5.85 -0.77 -0.39 115.31 119.18 3giy h LEU 146 Ca 0.05 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.57 3giy h LEU 146 Cb 0.93 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.96 3giy h LEU 146 CO 0.08 0.17 -0.15 0.45 -0.34 0.00 0.00 178.44 178.65 3giy h HIS 147 N -0.18 0.00 -0.15 1.25 3.86 -1.04 -2.84 115.15 116.04 3giy h HIS 147 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3giy h HIS 147 Cb 0.18 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.65 3giy h HIS 147 CO -0.02 0.15 0.00 0.25 0.86 0.00 0.00 177.93 179.17 3giy n THR 148 N -3.37 0.19 -0.22 2.45 -2.24 -0.82 -4.96 114.28 105.31 3giy n THR 148 Ca -0.00 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 3giy n THR 148 Cb 0.35 0.67 0.00 0.00 -2.10 0.00 0.00 70.33 69.25 3giy n THR 148 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3giy n GLY 149 N 1.24 0.88 3.73 3.38 0.00 -1.07 -4.88 105.19 108.47 3giy n GLY 149 Ca 0.17 -0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 3giy n GLY 149 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3giy s TYR 150 N -2.00 3.23 0.07 1.61 1.51 -0.17 -4.80 117.35 116.80 3giy s TYR 150 Ca 0.00 1.14 0.07 0.00 -1.01 0.00 0.00 57.07 57.27 3giy s TYR 150 Cb 0.00 -3.64 -0.22 0.00 -0.11 0.00 0.00 41.96 37.98 3giy s TYR 150 CO 0.00 -2.08 1.11 1.79 -1.11 0.00 0.00 175.55 175.25 3giy h THR 151 N 3.84 1.47 -3.87 -0.71 1.35 -1.61 -3.43 112.91 109.95 3giy h THR 151 Ca -0.44 -3.21 -0.27 0.00 -0.55 0.00 0.00 66.41 61.94 3giy h THR 151 Cb 1.21 2.75 -0.27 0.00 -1.73 0.00 0.00 68.15 70.12 3giy h THR 151 CO 0.79 0.85 -0.74 -0.89 -0.25 0.00 0.00 175.52 175.29 3giy s THR 152 N -2.68 0.27 -0.09 6.82 2.01 -1.26 -3.91 115.64 116.81 3giy s THR 152 Ca -0.01 -0.33 -0.01 0.00 0.31 0.00 0.00 61.69 61.65 3giy s THR 152 Cb 0.09 -0.27 -0.03 0.00 0.01 0.00 0.00 72.50 72.31 3giy s THR 152 CO 0.83 -0.05 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.44 3giy s LEU 153 N -0.40 3.27 -0.16 4.42 2.96 -0.62 -0.99 118.68 127.17 3giy s LEU 153 Ca -0.02 -0.00 0.00 0.00 -0.22 0.00 0.00 54.13 53.89 3giy s LEU 153 Cb -0.03 -1.73 0.03 0.00 0.50 0.00 0.00 46.19 44.95 3giy s LEU 153 CO -0.00 0.33 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.55 3giy s VAL 154 N -0.61 1.50 -0.32 1.68 1.01 0.44 -1.30 120.40 122.80 3giy s VAL 154 Ca 0.09 -0.68 -0.18 0.00 0.00 0.00 0.00 61.98 61.22 3giy s VAL 154 Cb -0.12 -1.47 -0.01 0.00 0.00 0.00 0.00 36.38 34.78 3giy s VAL 154 CO 0.02 0.37 0.49 -0.22 0.00 0.00 0.00 175.10 175.76 3giy s LEU 155 N 1.50 4.26 -0.28 3.92 2.96 -0.14 0.12 118.68 131.02 3giy s LEU 155 Ca 0.03 0.10 -0.21 0.00 -0.22 0.00 0.00 54.13 53.84 3giy s LEU 155 Cb -0.14 -2.57 -0.01 0.00 0.50 0.00 0.00 46.19 43.97 3giy s LEU 155 CO -0.10 -0.41 0.64 -0.89 -1.32 0.00 0.00 176.35 174.28 3giy s THR 156 N 2.33 4.95 -1.79 3.68 2.01 -0.87 -0.12 115.64 125.83 3giy s THR 156 Ca 0.18 1.00 0.15 0.00 0.31 0.00 0.00 61.69 63.33 3giy s THR 156 Cb -0.16 -3.98 0.15 0.00 0.01 0.00 0.00 72.50 68.52 3giy s THR 156 CO 0.12 -0.07 1.01 0.35 -0.69 0.00 0.00 174.62 175.34 3giy n THR 157 N 5.32 0.11 -1.05 -0.82 -2.24 -0.49 -4.66 114.28 110.45 3giy n THR 157 Ca -0.00 -0.56 -0.13 0.00 -2.27 0.00 0.00 64.05 61.09 3giy n THR 157 Cb 0.49 1.22 0.25 0.00 -2.10 0.00 0.00 70.33 70.19 3giy n THR 157 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3giy n ASP 158 N 0.84 4.37 -2.51 3.42 5.68 -1.26 -4.38 116.55 122.71 3giy n ASP 158 Ca 0.09 -3.34 -0.14 0.00 -0.50 0.00 0.00 54.79 50.90 3giy n ASP 158 Cb 0.38 -0.78 0.03 0.00 -1.14 0.00 0.00 41.12 39.61 3giy n ASP 158 CO 0.00 0.00 0.00 0.52 -1.33 0.00 0.00 177.20 176.39 3giy n VAL 159 N -0.52 1.76 -0.03 2.12 0.31 -1.26 -4.82 118.33 115.89 3giy n VAL 159 Ca 0.48 -3.74 0.07 0.00 -0.01 0.00 0.00 64.34 61.13 3giy n VAL 159 Cb 1.49 -0.05 0.45 0.00 -0.91 0.00 0.00 33.84 34.81 3giy n VAL 159 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3giy h ALA 160 N 2.60 1.82 -2.57 3.52 0.00 -1.90 -3.41 119.26 119.32 3giy h ALA 160 Ca 0.10 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.78 3giy h ALA 160 Cb 1.23 -0.14 -0.17 0.00 0.00 0.00 0.00 17.79 18.71 3giy h ALA 160 CO 0.56 0.12 -0.70 0.14 0.00 0.00 0.00 179.25 179.37 3giy s VAL 161 N -5.46 0.45 0.26 0.00 -7.23 -1.26 -4.28 120.40 102.88 3giy s VAL 161 Ca -0.08 -1.54 -0.29 0.00 -1.81 0.00 0.00 61.98 58.25 3giy s VAL 161 Cb 0.18 -1.17 -0.09 0.00 0.56 0.00 0.00 36.38 35.86 3giy s VAL 161 CO 0.74 -0.73 1.13 0.20 -0.31 0.00 0.00 175.10 176.13 3giy s ASN 162 N -2.42 7.20 0.55 4.85 0.02 -1.26 -5.01 114.94 118.87 3giy s ASN 162 Ca 0.01 2.29 -0.20 0.00 -1.02 0.00 0.00 52.86 53.94 3giy s ASN 162 Cb -0.00 -2.62 -0.05 0.00 0.02 0.00 0.00 41.25 38.59 3giy s ASN 162 CO -0.04 -0.21 1.20 -0.83 0.02 0.00 0.00 177.10 177.23 3giy s GLY 163 N -0.64 2.74 -1.11 0.66 0.00 -1.26 -4.94 107.32 102.77 3giy s GLY 163 Ca 0.46 0.99 -0.17 0.00 0.00 0.00 0.00 44.72 46.01 3giy s GLY 163 CO 0.41 1.40 1.37 -0.47 0.00 0.00 0.00 173.10 175.82 3giy s TYR 164 N -1.59 3.19 -0.54 1.90 5.04 -1.26 -4.95 117.35 119.14 3giy s TYR 164 Ca 0.73 -1.71 -0.17 0.00 -2.44 0.00 0.00 57.07 53.48 3giy s TYR 164 Cb -0.30 -4.40 0.10 0.00 0.35 0.00 0.00 41.96 37.72 3giy s TYR 164 CO 0.34 -1.53 0.55 1.03 -1.34 0.00 0.00 175.55 174.60 3giy s ARG 165 N 2.60 3.02 0.56 4.97 0.52 -1.26 -0.32 118.95 129.03 3giy s ARG 165 Ca 0.41 -1.44 0.31 0.00 -0.52 0.00 0.00 55.73 54.49 3giy s ARG 165 Cb -0.02 -4.24 1.65 0.00 0.52 0.00 0.00 34.95 32.86 3giy s ARG 165 CO -0.03 -1.32 2.13 0.93 0.02 0.00 0.00 175.30 177.03 3giy h GLU 166 N 8.96 0.00 -0.49 3.54 5.08 -1.84 -2.62 114.58 127.20 3giy h GLU 166 Ca -0.29 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.06 3giy h GLU 166 Cb 1.10 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.32 3giy h GLU 166 CO 1.02 0.07 0.26 0.00 -1.00 0.00 0.00 179.01 179.36 3giy h ARG 167 N 0.00 0.69 -0.83 2.33 3.08 -1.92 -0.30 114.38 117.43 3giy h ARG 167 Ca -0.00 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 3giy h ARG 167 Cb 0.26 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.14 3giy h ARG 167 CO 0.01 0.55 0.38 -0.44 -1.07 0.00 0.00 179.97 179.40 3giy h ASP 168 N 0.65 1.11 -0.62 7.04 3.32 -1.79 -1.23 116.42 124.90 3giy h ASP 168 Ca 0.17 -0.15 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 3giy h ASP 168 Cb 0.06 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 3giy h ASP 168 CO -0.03 0.95 0.32 -0.07 -1.72 0.00 0.00 179.24 178.69 3giy h LEU 169 N 1.19 0.79 -1.01 1.55 3.38 -1.37 0.65 115.31 120.49 3giy h LEU 169 Ca 0.28 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 58.04 3giy h LEU 169 Cb 0.15 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3giy h LEU 169 CO -0.03 0.68 -0.34 0.45 0.09 0.00 0.00 178.44 179.28 3giy h HIS 170 N 0.84 0.31 -0.02 1.13 3.86 -0.71 -2.77 115.15 117.79 3giy h HIS 170 Ca 0.21 -0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.35 3giy h HIS 170 Cb 0.08 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 28.48 3giy h HIS 170 CO -0.00 0.59 -0.01 0.09 0.86 0.00 0.00 177.93 179.45 3giy n ASN 171 N -4.08 2.24 -4.04 2.45 3.02 -0.50 -4.93 115.26 109.43 3giy n ASN 171 Ca -0.01 -1.74 -0.31 0.00 -0.03 0.00 0.00 54.58 52.49 3giy n ASN 171 Cb 0.44 0.01 -0.01 0.00 -0.61 0.00 0.00 39.78 39.61 3giy n ASN 171 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3giy n ARG 172 N 0.74 -4.01 -1.67 3.52 3.00 0.20 -4.74 116.66 113.70 3giy n ARG 172 Ca 0.16 0.46 -0.54 0.00 -0.01 0.00 0.00 57.85 57.92 3giy n ARG 172 Cb 0.48 -5.10 -0.06 0.00 0.00 0.00 0.00 32.46 27.78 3giy n ARG 172 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 3giy n PHE 173 N -4.47 1.96 -4.82 -1.55 7.35 0.41 -4.97 117.46 111.37 3giy n PHE 173 Ca -0.04 0.47 -0.28 0.00 -0.76 0.00 0.00 57.45 56.84 3giy n PHE 173 Cb 0.56 -2.46 -0.17 0.00 0.35 0.00 0.00 39.48 37.76 3giy n PHE 173 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 3giy s LYS 174 N 2.66 2.24 -0.27 -4.13 1.02 -1.26 -4.99 119.74 115.01 3giy s LYS 174 Ca 0.93 -0.60 -0.40 0.00 0.02 0.00 0.00 55.97 55.92 3giy s LYS 174 Cb -0.96 -1.77 -0.16 0.00 -0.52 0.00 0.00 37.83 34.42 3giy s LYS 174 CO 0.57 0.08 1.70 -0.89 -0.92 0.00 0.00 175.35 175.89 3giy n ILE 175 N 3.73 0.26 -1.02 2.17 5.41 -1.26 -4.79 119.36 123.86 3giy n ILE 175 Ca -0.21 -0.05 -0.35 0.00 1.00 0.00 0.00 62.75 63.14 3giy n ILE 175 Cb 0.52 -1.13 -0.02 0.00 -0.71 0.00 0.00 39.64 38.30 3giy n ILE 175 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 3giy n PRO 176 N 5.05 0.00 0.01 0.38 -0.02 -1.26 -4.88 135.00 134.28 3giy n PRO 176 Ca 0.26 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.75 3giy n PRO 176 Cb 0.12 -0.73 0.32 0.00 -0.02 0.00 0.00 33.50 33.19 3giy n PRO 176 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3giy h PRO 177 N 0.70 0.51 -0.01 0.52 0.13 -2.04 -2.69 132.00 129.12 3giy h PRO 177 Ca -0.21 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 3giy h PRO 177 Cb 1.05 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.10 3giy h PRO 177 CO 0.41 0.51 -0.05 1.97 -0.23 0.00 0.00 178.00 180.61 3giy n PHE 178 N -4.31 0.00 -2.18 1.56 -1.74 -1.26 -4.90 117.46 104.62 3giy n PHE 178 Ca 0.02 0.00 -0.28 0.00 -0.56 0.00 0.00 57.45 56.63 3giy n PHE 178 Cb 0.21 -0.07 0.04 0.00 1.52 0.00 0.00 39.48 41.19 3giy n PHE 178 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 3giy s LEU 179 N -2.18 3.05 -0.11 5.98 1.43 -1.02 -5.11 118.68 120.73 3giy s LEU 179 Ca 0.37 0.84 -0.10 0.00 -1.03 0.00 0.00 54.13 54.21 3giy s LEU 179 Cb 0.21 -3.62 0.03 0.00 0.03 0.00 0.00 46.19 42.84 3giy s LEU 179 CO 0.40 -1.24 0.29 0.42 0.23 0.00 0.00 176.35 176.45 3giy s THR 180 N -3.16 -0.00 -1.18 5.49 -4.23 -1.26 -5.01 115.64 106.28 3giy s THR 180 Ca 0.56 0.01 -0.06 0.00 -1.18 0.00 0.00 61.69 61.02 3giy s THR 180 Cb -0.11 -0.41 0.24 0.00 1.34 0.00 0.00 72.50 73.56 3giy s THR 180 CO 0.47 0.00 1.74 0.18 -0.54 0.00 0.00 174.62 176.48 3giy n LEU 181 N 3.02 6.70 -0.30 4.79 4.77 -1.26 -4.02 117.00 130.70 3giy n LEU 181 Ca -0.14 -4.96 0.12 0.00 -0.03 0.00 0.00 56.01 51.01 3giy n LEU 181 Cb 0.58 -1.36 0.27 0.00 -2.33 0.00 0.00 43.42 40.58 3giy n LEU 181 CO 0.17 1.60 0.89 0.50 -1.33 0.00 0.00 177.39 179.22 3giy h LYS 182 N 5.44 0.14 0.00 3.23 1.63 -1.79 -1.74 116.57 123.48 3giy h LYS 182 Ca 0.34 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.13 3giy h LYS 182 Cb 0.58 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.18 3giy h LYS 182 CO 1.47 0.09 0.00 -0.91 -3.45 0.00 0.00 179.45 176.65 3giy h ASN 183 N 0.14 0.00 -0.37 4.20 2.35 -1.82 0.29 115.58 120.37 3giy h ASN 183 Ca 0.54 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.29 3giy h ASN 183 Cb 1.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.46 3giy h ASN 183 CO -0.72 0.00 0.00 0.49 -1.65 0.00 0.00 177.43 175.55 3giy n PHE 184 N -3.03 0.47 -2.24 1.19 3.72 -0.66 -4.97 117.46 111.94 3giy n PHE 184 Ca -0.02 -0.25 -0.38 0.00 -0.05 0.00 0.00 57.45 56.75 3giy n PHE 184 Cb 0.10 -0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.62 3giy n PHE 184 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 3giy s GLU 185 N -1.45 3.90 -1.73 -1.08 2.12 0.09 -3.34 118.70 117.22 3giy s GLU 185 Ca 0.37 1.85 0.00 0.00 0.36 0.00 0.00 54.97 57.55 3giy s GLU 185 Cb 0.22 -2.56 0.00 0.00 0.26 0.00 0.00 34.13 32.05 3giy s GLU 185 CO 0.30 -0.45 0.00 0.41 -0.54 0.00 0.00 175.26 174.98 3giy n GLY 186 N 0.56 1.07 1.53 -1.50 0.00 -1.26 -4.85 105.19 100.74 3giy n GLY 186 Ca 0.06 -0.18 -0.05 0.00 0.00 0.00 0.00 46.02 45.85 3giy n GLY 186 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3giy n ILE 187 N -2.98 2.05 -0.10 -0.61 5.41 -1.21 -4.97 119.36 116.96 3giy n ILE 187 Ca -0.18 -0.73 0.00 0.00 1.00 0.00 0.00 62.75 62.84 3giy n ILE 187 Cb 0.60 -1.35 0.00 0.00 -0.71 0.00 0.00 39.64 38.18 3giy n ILE 187 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 3giy n ASP 188 N 0.99 -0.11 0.00 4.38 5.75 -1.26 -5.04 116.55 121.25 3giy n ASP 188 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.87 3giy n ASP 188 Cb 0.55 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.64 3giy n ASP 188 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 3giy n LEU 189 N 0.00 0.00 0.00 -2.12 7.94 -1.26 -4.99 117.00 116.57 3giy n LEU 189 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3giy n LEU 189 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 3giy n LEU 189 CO 0.00 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 176.89 3giy n GLY 190 N 0.00 1.15 3.84 -3.96 0.00 -1.26 -4.93 105.19 100.03 3giy n GLY 190 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3giy n GLY 190 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3giy s LYS 191 N 0.00 4.09 -0.03 1.61 1.02 -1.26 -5.08 119.74 120.08 3giy s LYS 191 Ca 0.00 0.73 0.01 0.00 0.02 0.00 0.00 55.97 56.73 3giy s LYS 191 Cb 0.00 -2.60 0.02 0.00 -0.52 0.00 0.00 37.83 34.73 3giy s LYS 191 CO 0.00 0.25 -0.02 0.00 -0.92 0.00 0.00 175.35 174.66 3giy s MET 192 N -2.61 0.45 0.00 1.68 0.23 -1.26 -4.63 119.30 113.16 3giy s MET 192 Ca 0.50 0.01 0.00 0.00 -1.03 0.00 0.00 55.69 55.16 3giy s MET 192 Cb -0.13 -0.57 0.00 0.00 -1.53 0.00 0.00 34.83 32.61 3giy s MET 192 CO 0.19 -0.10 0.00 -0.40 -2.03 0.00 0.00 175.02 172.68 3giy n ASP 193 N 4.01 0.00 0.00 -1.18 5.75 -1.26 -5.04 116.55 118.83 3giy n ASP 193 Ca -0.26 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.52 3giy n ASP 193 Cb 0.51 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 3giy n ASP 193 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3giy n LYS 194 N -0.26 0.00 -1.28 0.11 5.02 -1.26 -3.84 118.16 116.65 3giy n LYS 194 Ca 0.00 0.33 -0.30 0.00 -2.02 0.00 0.00 58.31 56.32 3giy n LYS 194 Cb 0.00 -0.90 0.24 0.00 -0.02 0.00 0.00 35.03 34.35 3giy n LYS 194 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3giy s ALA 195 N -2.82 0.94 -0.10 7.82 0.00 -1.26 -1.50 121.76 124.84 3giy s ALA 195 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 50.85 3giy s ALA 195 Cb 0.00 -2.82 0.00 0.00 0.00 0.00 0.00 23.12 20.30 3giy s ALA 195 CO 0.00 -3.44 0.00 0.09 0.00 0.00 0.00 175.76 172.41 3giy n ASN 196 N -4.62 -5.07 0.00 0.00 3.02 -1.26 -4.28 115.26 103.05 3giy n ASN 196 Ca 0.15 0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 3giy n ASN 196 Cb 0.60 -2.65 0.00 0.00 -0.61 0.00 0.00 39.78 37.12 3giy n ASN 196 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3giy n LEU 197 N -0.11 0.00 0.08 3.41 7.94 -1.21 -4.38 117.00 122.74 3giy n LEU 197 Ca -0.01 0.00 0.05 0.00 -1.11 0.00 0.00 56.01 54.94 3giy n LEU 197 Cb 0.36 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 44.28 3giy n LEU 197 CO 0.01 0.00 -0.05 -0.33 -1.11 0.00 0.00 177.39 175.91 3giy h GLU 198 N 0.00 0.00 0.20 1.96 5.08 -1.45 -3.05 114.58 117.32 3giy h GLU 198 Ca 0.00 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.04 3giy h GLU 198 Cb 0.00 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.27 3giy h GLU 198 CO 0.00 0.19 -1.50 1.98 -1.00 0.00 0.00 179.01 178.68 3giy h MET 199 N 0.00 0.42 -0.55 2.33 4.05 -1.85 -3.10 114.93 116.23 3giy h MET 199 Ca -0.08 -0.72 -0.08 0.00 -0.28 0.00 0.00 59.70 58.54 3giy h MET 199 Cb 1.33 0.27 -0.02 0.00 -0.80 0.00 0.00 31.60 32.37 3giy h MET 199 CO 0.03 1.34 0.03 1.96 0.23 0.00 0.00 176.91 180.50 3giy h GLN 200 N 0.01 0.92 0.00 0.39 4.20 -1.80 -1.96 115.11 116.87 3giy h GLN 200 Ca -0.29 -0.25 -0.08 0.00 0.06 0.00 0.00 58.65 58.09 3giy h GLN 200 Cb 2.03 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 29.70 3giy h GLN 200 CO 0.20 0.89 -0.37 0.00 -0.67 0.00 0.00 178.83 178.87 3giy h ALA 201 N 1.17 1.10 -0.01 3.87 0.00 -1.65 -1.96 119.26 121.77 3giy h ALA 201 Ca 0.16 -0.34 -0.19 0.00 0.00 0.00 0.00 54.91 54.54 3giy h ALA 201 Cb 0.47 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3giy h ALA 201 CO 0.02 0.47 -0.83 0.00 0.00 0.00 0.00 179.25 178.91 3giy h ALA 202 N 1.63 0.56 0.00 0.00 0.00 -1.37 -3.05 119.26 117.03 3giy h ALA 202 Ca -0.00 -0.68 -0.04 0.00 0.00 0.00 0.00 54.91 54.18 3giy h ALA 202 Cb 0.81 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 3giy h ALA 202 CO 0.05 0.86 -0.19 -0.07 0.00 0.00 0.00 179.25 179.90 3giy h LEU 203 N 0.14 0.00 -2.94 0.00 3.38 -1.01 -2.97 115.31 111.91 3giy h LEU 203 Ca -0.04 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.71 3giy h LEU 203 Cb 1.43 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 42.05 3giy h LEU 203 CO 0.13 0.19 0.27 0.23 0.09 0.00 0.00 178.44 179.36 3giy n MET 204 N -3.22 2.06 -4.21 1.13 2.81 -0.77 -4.81 117.12 110.11 3giy n MET 204 Ca 0.02 -1.69 -0.19 0.00 -1.81 0.00 0.00 57.70 54.03 3giy n MET 204 Cb 0.52 -1.72 -0.16 0.00 -0.71 0.00 0.00 33.22 31.15 3giy n MET 204 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3giy s SER 205 N -0.31 0.92 0.00 7.83 0.15 -1.12 -5.02 113.70 116.14 3giy s SER 205 Ca 0.31 -0.13 0.29 0.00 0.70 0.00 0.00 55.95 57.12 3giy s SER 205 Cb 0.26 -0.35 1.67 0.00 -1.71 0.00 0.00 66.02 65.89 3giy s SER 205 CO 0.07 -0.01 2.08 0.54 1.20 0.00 0.00 173.24 177.12 3giy n ARG 206 N 3.67 1.05 -3.99 5.44 1.74 -1.26 -4.80 116.66 118.50 3giy n ARG 206 Ca -0.22 -0.07 -0.32 0.00 -0.77 0.00 0.00 57.85 56.48 3giy n ARG 206 Cb 0.53 -1.45 -0.05 0.00 -1.02 0.00 0.00 32.46 30.46 3giy n ARG 206 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3giy s GLN 207 N -2.00 3.20 0.35 5.56 1.11 -1.26 -4.87 119.66 121.75 3giy s GLN 207 Ca 0.43 -0.51 0.02 0.00 0.01 0.00 0.00 55.36 55.31 3giy s GLN 207 Cb 0.20 -2.92 0.06 0.00 -1.01 0.00 0.00 33.01 29.34 3giy s GLN 207 CO 0.33 0.61 0.48 -1.33 0.01 0.00 0.00 175.29 175.39 3giy n MET 208 N 0.61 0.48 -2.14 2.91 2.81 -1.26 -4.94 117.12 115.60 3giy n MET 208 Ca -0.09 -1.52 -0.37 0.00 -1.81 0.00 0.00 57.70 53.92 3giy n MET 208 Cb 0.52 -0.25 -0.03 0.00 -0.71 0.00 0.00 33.22 32.74 3giy n MET 208 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3giy s ASP 209 N -3.02 5.43 0.00 7.83 2.15 0.66 -4.81 116.67 124.90 3giy s ASP 209 Ca 0.33 -0.05 0.27 0.00 0.43 0.00 0.00 52.55 53.53 3giy s ASP 209 Cb -0.02 -2.54 1.46 0.00 -0.30 0.00 0.00 42.92 41.52 3giy s ASP 209 CO 0.22 -2.33 1.93 0.00 -0.17 0.00 0.00 175.17 174.81 3giy n ALA 210 N 12.34 2.40 1.01 3.66 0.00 -1.26 -3.07 120.51 135.59 3giy n ALA 210 Ca 0.22 -0.14 0.11 0.00 0.00 0.00 0.00 53.44 53.62 3giy n ALA 210 Cb 0.51 -1.43 -0.03 0.00 0.00 0.00 0.00 19.45 18.50 3giy n ALA 210 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3giy n SER 211 N -1.16 1.50 -4.57 0.00 3.41 -1.26 -4.92 113.62 106.61 3giy n SER 211 Ca 0.16 -1.23 -0.45 0.00 -0.26 0.00 0.00 58.87 57.10 3giy n SER 211 Cb 0.16 0.67 -0.04 0.00 -0.26 0.00 0.00 64.21 64.74 3giy n SER 211 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3giy n PHE 212 N -0.72 1.94 -3.52 7.33 -0.00 -1.17 -4.91 117.46 116.41 3giy n PHE 212 Ca 0.07 -0.05 0.00 0.00 -0.00 0.00 0.00 57.45 57.47 3giy n PHE 212 Cb 0.40 -2.69 0.00 0.00 -0.00 0.00 0.00 39.48 37.19 3giy n PHE 212 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.76 177.03 3giy n ASN 213 N 10.85 1.94 -0.26 -2.13 0.23 -1.26 -4.98 115.26 119.65 3giy n ASN 213 Ca 0.31 -0.55 -0.04 0.00 -0.53 0.00 0.00 54.58 53.77 3giy n ASN 213 Cb 0.39 0.00 0.07 0.00 -2.08 0.00 0.00 39.78 38.16 3giy n ASN 213 CO 0.00 0.00 0.00 -0.50 -0.93 0.00 0.00 177.26 175.83 3giy h TRP 214 N 0.53 0.91 -0.70 -2.53 4.06 -1.99 -0.31 115.95 115.92 3giy h TRP 214 Ca 0.00 0.02 -0.02 0.00 2.06 0.00 0.00 58.89 60.95 3giy h TRP 214 Cb 0.00 -0.31 -0.03 0.00 -1.00 0.00 0.00 29.16 27.82 3giy h TRP 214 CO 0.00 0.56 0.36 1.49 -3.56 0.00 0.00 178.44 177.29 3giy h GLU 215 N 0.97 0.99 -0.22 0.49 4.81 -1.97 -1.59 114.58 118.06 3giy h GLU 215 Ca 0.27 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 3giy h GLU 215 Cb -0.08 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.10 3giy h GLU 215 CO -0.07 0.76 0.07 0.00 -0.73 0.00 0.00 179.01 179.04 3giy h ALA 216 N 1.18 1.72 -0.50 2.92 0.00 -1.69 -1.94 119.26 120.95 3giy h ALA 216 Ca 0.24 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 3giy h ALA 216 Cb 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3giy h ALA 216 CO -0.04 0.23 -0.19 1.25 0.00 0.00 0.00 179.25 180.50 3giy h LEU 217 N 0.31 1.02 -0.64 0.00 5.85 -0.14 -1.89 115.31 119.82 3giy h LEU 217 Ca 0.08 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.43 3giy h LEU 217 Cb 0.09 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 3giy h LEU 217 CO -0.01 1.17 0.42 0.03 -0.34 0.00 0.00 178.44 179.71 3giy h ARG 218 N 0.87 0.84 -0.17 1.25 3.08 -0.73 0.24 114.38 119.75 3giy h ARG 218 Ca 0.12 -0.05 0.05 0.00 0.07 0.00 0.00 59.98 60.16 3giy h ARG 218 Cb 0.76 -0.19 -0.06 0.00 0.08 0.00 0.00 29.97 30.57 3giy h ARG 218 CO 0.06 0.56 -0.18 2.35 -1.07 0.00 0.00 179.97 181.70 3giy h TRP 219 N 0.86 -0.46 -0.32 3.04 7.01 -1.16 -1.13 115.95 123.79 3giy h TRP 219 Ca 0.23 0.03 -0.05 0.00 2.11 0.00 0.00 58.89 61.21 3giy h TRP 219 Cb -0.09 0.23 -0.02 0.00 -2.10 0.00 0.00 29.16 27.19 3giy h TRP 219 CO -0.03 -0.25 -0.01 1.25 -2.79 0.00 0.00 178.44 176.61 3giy h LEU 220 N -0.21 0.46 -0.86 0.65 5.85 -0.69 -2.62 115.31 117.89 3giy h LEU 220 Ca 0.11 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 3giy h LEU 220 Cb 0.37 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 3giy h LEU 220 CO -0.29 0.54 0.40 -0.09 -0.34 0.00 0.00 178.44 178.65 3giy h ARG 221 N 0.47 1.23 0.00 1.25 9.65 0.62 -1.98 114.38 125.62 3giy h ARG 221 Ca 0.10 -0.18 -0.08 0.00 -1.10 0.00 0.00 59.98 58.72 3giy h ARG 221 Cb 0.33 -0.22 -0.01 0.00 -1.39 0.00 0.00 29.97 28.68 3giy h ARG 221 CO 0.01 0.94 -0.37 -0.44 2.80 0.00 0.00 179.97 182.92 3giy h ASP 222 N 1.21 0.00 0.11 -3.80 3.32 -1.05 -3.24 116.42 112.97 3giy h ASP 222 Ca 0.29 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 57.12 3giy h ASP 222 Cb 0.13 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.68 3giy h ASP 222 CO -0.04 0.37 -0.86 0.25 -1.72 0.00 0.00 179.24 177.24 3giy h LEU 223 N 0.00 0.71 -9.07 1.55 5.85 -1.10 -3.43 115.31 109.82 3giy h LEU 223 Ca -0.00 -0.51 -0.62 0.00 0.84 0.00 0.00 57.88 57.58 3giy h LEU 223 Cb 1.13 -0.21 -0.14 0.00 0.37 0.00 0.00 40.66 41.80 3giy h LEU 223 CO 0.05 1.30 -0.46 0.86 -0.34 0.00 0.00 178.44 179.84 3giy s TRP 224 N -3.51 3.31 0.00 1.25 -0.11 -0.78 -4.97 118.94 114.13 3giy s TRP 224 Ca -0.08 0.27 0.11 0.00 1.22 0.00 0.00 56.10 57.62 3giy s TRP 224 Cb 0.09 -2.32 -0.16 0.00 -1.50 0.00 0.00 33.47 29.58 3giy s TRP 224 CO 0.88 0.03 1.11 -1.00 -4.62 0.00 0.00 176.95 173.35 3giy h PRO 225 N 7.59 0.00 0.00 5.86 0.13 -1.85 -3.46 132.00 140.28 3giy h PRO 225 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 3giy h PRO 225 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3giy h PRO 225 CO 0.65 0.70 0.00 0.72 -0.23 0.00 0.00 178.00 179.85 3giy n HIS 226 N -3.20 -0.25 -1.74 1.56 8.25 -1.26 -5.02 115.22 113.56 3giy n HIS 226 Ca -0.05 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.00 3giy n HIS 226 Cb 0.92 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 32.01 3giy n HIS 226 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3giy s LYS 227 N 1.63 4.11 -0.08 -0.41 -0.14 -1.25 -4.91 119.74 118.68 3giy s LYS 227 Ca 0.00 2.61 0.02 0.00 -1.36 0.00 0.00 55.97 57.24 3giy s LYS 227 Cb 0.00 -3.03 0.01 0.00 -1.68 0.00 0.00 37.83 33.14 3giy s LYS 227 CO 0.00 -0.68 -0.13 -1.17 -0.76 0.00 0.00 175.35 172.62 3giy s LEU 228 N -0.17 1.61 0.09 3.17 2.96 -1.26 -1.58 118.68 123.50 3giy s LEU 228 Ca 0.66 -0.34 0.09 0.00 -0.22 0.00 0.00 54.13 54.33 3giy s LEU 228 Cb -0.49 -0.91 -0.03 0.00 0.50 0.00 0.00 46.19 45.26 3giy s LEU 228 CO 0.45 0.01 -0.24 -0.76 -1.32 0.00 0.00 176.35 174.49 3giy s LEU 229 N 0.88 2.25 -0.21 -0.68 1.43 -0.42 -0.99 118.68 120.95 3giy s LEU 229 Ca -0.10 -0.66 -0.04 0.00 -1.03 0.00 0.00 54.13 52.30 3giy s LEU 229 Cb -0.15 -1.11 -0.02 0.00 0.03 0.00 0.00 46.19 44.94 3giy s LEU 229 CO 0.01 0.17 -0.02 -0.69 0.23 0.00 0.00 176.35 176.04 3giy s VAL 230 N -0.98 3.65 0.01 -1.59 1.01 -1.13 -0.96 120.40 120.41 3giy s VAL 230 Ca 0.11 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 61.69 3giy s VAL 230 Cb -0.10 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 3giy s VAL 230 CO 0.04 0.43 0.01 -0.75 0.00 0.00 0.00 175.10 174.83 3giy s LYS 231 N 1.19 2.79 0.00 2.72 2.20 0.83 -0.72 119.74 128.76 3giy s LYS 231 Ca 0.03 -0.62 0.00 0.00 -0.36 0.00 0.00 55.97 55.02 3giy s LYS 231 Cb -0.14 -2.68 0.00 0.00 -1.51 0.00 0.00 37.83 33.50 3giy s LYS 231 CO 0.00 0.62 0.00 0.41 -0.36 0.00 0.00 175.35 176.02 3giy n GLY 232 N 1.30 1.12 3.81 5.54 0.00 -0.65 -1.40 105.19 114.92 3giy n GLY 232 Ca -0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 3giy n GLY 232 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3giy s LEU 233 N 0.00 4.13 -0.03 0.99 1.43 -1.19 -4.64 118.68 119.36 3giy s LEU 233 Ca 0.00 1.61 0.25 0.00 -1.03 0.00 0.00 54.13 54.96 3giy s LEU 233 Cb 0.00 -4.18 0.43 0.00 0.03 0.00 0.00 46.19 42.48 3giy s LEU 233 CO 0.00 -0.20 1.17 0.18 0.23 0.00 0.00 176.35 177.73 3giy n LEU 234 N -0.08 1.15 -3.58 1.79 4.77 -1.26 -1.50 117.00 118.29 3giy n LEU 234 Ca 0.04 -2.19 -0.16 0.00 -0.03 0.00 0.00 56.01 53.68 3giy n LEU 234 Cb 0.52 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.55 3giy n LEU 234 CO 0.41 0.59 0.43 -0.94 -1.33 0.00 0.00 177.39 176.55 3giy s SER 235 N -2.20 -0.71 0.41 -1.43 1.04 -1.26 -4.93 113.70 104.63 3giy s SER 235 Ca 0.34 1.13 0.12 0.00 0.48 0.00 0.00 55.95 58.02 3giy s SER 235 Cb 0.38 1.06 0.88 0.00 0.10 0.00 0.00 66.02 68.45 3giy s SER 235 CO -0.15 -0.40 1.94 0.00 0.98 0.00 0.00 173.24 175.61 3giy h ALA 236 N 4.13 1.59 -0.12 5.32 0.00 -1.90 -1.79 119.26 126.48 3giy h ALA 236 Ca -0.28 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 3giy h ALA 236 Cb 1.15 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 3giy h ALA 236 CO 0.20 0.30 0.04 0.93 0.00 0.00 0.00 179.25 180.72 3giy h GLU 237 N 0.11 0.18 -0.40 0.00 3.07 -1.95 -0.14 114.58 115.44 3giy h GLU 237 Ca 0.02 -0.04 -0.13 0.00 -0.50 0.00 0.00 59.36 58.71 3giy h GLU 237 Cb 0.37 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.24 3giy h GLU 237 CO 0.02 0.31 -0.27 -0.44 -1.40 0.00 0.00 179.01 177.24 3giy h ASP 238 N 0.02 0.88 -0.51 1.42 3.32 -1.91 -1.15 116.42 118.49 3giy h ASP 238 Ca 0.04 -0.35 0.02 0.00 0.02 0.00 0.00 57.03 56.77 3giy h ASP 238 Cb 0.20 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 3giy h ASP 238 CO -0.00 1.10 0.31 0.00 -1.72 0.00 0.00 179.24 178.92 3giy h ALA 239 N 0.96 0.66 -0.63 3.45 0.00 -1.20 -0.76 119.26 121.74 3giy h ALA 239 Ca 0.09 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3giy h ALA 239 Cb 0.81 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 3giy h ALA 239 CO 0.07 0.01 0.14 0.22 0.00 0.00 0.00 179.25 179.69 3giy h ASP 240 N 0.61 0.97 -0.88 0.00 3.58 -0.85 -2.59 116.42 117.27 3giy h ASP 240 Ca 0.21 -0.24 -0.02 0.00 0.42 0.00 0.00 57.03 57.39 3giy h ASP 240 Cb 0.02 -0.26 -0.04 0.00 1.72 0.00 0.00 39.33 40.77 3giy h ASP 240 CO -0.09 0.96 0.47 -0.09 -2.88 0.00 0.00 179.24 177.61 3giy h ARG 241 N 0.93 1.23 -0.68 0.28 9.65 -0.72 -0.90 114.38 124.17 3giy h ARG 241 Ca 0.20 -0.15 -0.02 0.00 -1.10 0.00 0.00 59.98 58.91 3giy h ARG 241 Cb 0.38 -0.24 -0.03 0.00 -1.39 0.00 0.00 29.97 28.69 3giy h ARG 241 CO 0.00 0.91 0.35 0.00 2.80 0.00 0.00 179.97 184.03 3giy h ILE 243 N 0.95 1.25 0.00 0.00 1.08 -1.06 -0.79 117.51 118.94 3giy h ILE 243 Ca 0.24 -0.92 -0.04 0.00 -0.39 0.00 0.00 64.86 63.75 3giy h ILE 243 Cb 0.09 0.54 -0.01 0.00 -3.07 0.00 0.00 36.82 34.37 3giy h ILE 243 CO -0.03 0.35 -0.17 0.00 -0.69 0.00 0.00 178.15 177.61 3giy h ALA 244 N 1.17 1.51 -0.11 1.87 0.00 -0.52 -2.60 119.26 120.58 3giy h ALA 244 Ca 0.22 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3giy h ALA 244 Cb 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3giy h ALA 244 CO -0.00 0.22 0.00 0.39 0.00 0.00 0.00 179.25 179.86 3giy n GLU 245 N -4.04 1.82 0.00 0.00 -0.58 -0.38 -4.93 120.64 112.53 3giy n GLU 245 Ca -0.02 -1.22 0.00 0.00 -0.42 0.00 0.00 57.16 55.50 3giy n GLU 245 Cb 0.25 -1.44 0.00 0.00 -0.57 0.00 0.00 31.44 29.68 3giy n GLU 245 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3giy n GLY 246 N 1.20 1.91 3.74 0.62 0.00 -0.98 -4.71 105.19 106.97 3giy n GLY 246 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 3giy n GLY 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3giy n ALA 247 N -0.05 1.59 1.09 4.61 0.00 -0.36 -4.90 120.51 122.48 3giy n ALA 247 Ca 0.00 0.15 0.12 0.00 0.00 0.00 0.00 53.44 53.70 3giy n ALA 247 Cb 0.00 -2.35 0.19 0.00 0.00 0.00 0.00 19.45 17.29 3giy n ALA 247 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3giy n ASP 248 N -0.83 1.02 0.00 0.00 8.00 -0.16 -4.46 116.55 120.12 3giy n ASP 248 Ca 0.10 -0.81 0.00 0.00 0.71 0.00 0.00 54.79 54.79 3giy n ASP 248 Cb 0.44 0.37 0.00 0.00 -0.02 0.00 0.00 41.12 41.91 3giy n ASP 248 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3giy n GLY 249 N 1.43 -0.23 3.26 0.44 0.00 -1.21 -4.18 105.19 104.69 3giy n GLY 249 Ca 0.08 -1.03 -0.14 0.00 0.00 0.00 0.00 46.02 44.93 3giy n GLY 249 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3giy s VAL 250 N -2.00 0.44 -0.29 1.61 -7.23 -0.91 -2.84 120.40 109.18 3giy s VAL 250 Ca 0.00 -1.98 0.00 0.00 -1.81 0.00 0.00 61.98 58.19 3giy s VAL 250 Cb 0.00 -2.41 0.09 0.00 0.56 0.00 0.00 36.38 34.62 3giy s VAL 250 CO 0.00 -0.18 0.05 -0.63 -0.31 0.00 0.00 175.10 174.03 3giy s ILE 251 N -3.84 1.26 0.05 -0.62 1.01 0.11 -0.40 121.20 118.77 3giy s ILE 251 Ca 0.33 -1.48 -0.31 0.00 0.00 0.00 0.00 60.65 59.19 3giy s ILE 251 Cb 0.07 -1.84 -0.07 0.00 0.01 0.00 0.00 42.46 40.63 3giy s ILE 251 CO 0.09 -0.50 1.41 -0.76 0.00 0.00 0.00 174.94 175.19 3giy s LEU 252 N 1.45 4.34 -0.11 2.97 1.43 -0.09 -1.63 118.68 127.04 3giy s LEU 252 Ca 0.06 2.22 -0.30 0.00 -1.03 0.00 0.00 54.13 55.07 3giy s LEU 252 Cb -0.18 -3.57 0.10 0.00 0.03 0.00 0.00 46.19 42.57 3giy s LEU 252 CO -0.16 -0.70 0.87 -0.55 0.23 0.00 0.00 176.35 176.03 3giy s SER 253 N 1.65 -0.49 -0.20 2.29 0.15 -0.56 -2.33 113.70 114.22 3giy s SER 253 Ca 0.65 0.52 0.13 0.00 0.70 0.00 0.00 55.95 57.95 3giy s SER 253 Cb -0.34 0.40 0.40 0.00 -1.71 0.00 0.00 66.02 64.77 3giy s SER 253 CO 0.28 -0.46 1.25 -0.46 1.20 0.00 0.00 173.24 175.05 3giy n ASN 254 N 0.77 2.16 -3.34 5.45 0.23 -1.26 -3.99 115.26 115.29 3giy n ASN 254 Ca -0.14 -3.58 -0.24 0.00 -0.53 0.00 0.00 54.58 50.09 3giy n ASN 254 Cb 0.58 -0.52 0.05 0.00 -2.08 0.00 0.00 39.78 37.81 3giy n ASN 254 CO 0.00 0.00 0.00 1.57 -0.93 0.00 0.00 177.26 177.90 3giy n HIS 255 N -1.18 -2.34 -2.84 -2.53 -0.00 -1.26 -2.02 115.22 103.05 3giy n HIS 255 Ca 0.20 0.74 -0.21 0.00 -0.00 0.00 0.00 57.72 58.45 3giy n HIS 255 Cb 0.74 -4.57 0.02 0.00 -0.00 0.00 0.00 29.99 26.18 3giy n HIS 255 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3giy n GLY 256 N -1.71 -0.47 2.42 1.57 0.00 -1.26 -2.15 105.19 103.59 3giy n GLY 256 Ca -0.05 0.06 -0.16 0.00 0.00 0.00 0.00 46.02 45.88 3giy n GLY 256 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3giy n GLY 257 N -1.38 1.19 0.26 -0.02 0.00 -0.86 -4.75 105.19 99.63 3giy n GLY 257 Ca -0.14 -0.27 0.11 0.00 0.00 0.00 0.00 46.02 45.72 3giy n GLY 257 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3giy n ARG 258 N -2.54 0.66 -0.08 1.61 1.74 -0.91 -1.30 116.66 115.84 3giy n ARG 258 Ca -0.16 -0.51 -0.16 0.00 -0.77 0.00 0.00 57.85 56.24 3giy n ARG 258 Cb 0.54 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.43 3giy n ARG 258 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3giy n GLN 259 N -0.72 0.36 -3.67 5.56 1.13 -1.26 -4.20 117.38 114.58 3giy n GLN 259 Ca 0.08 0.14 -0.27 0.00 -1.94 0.00 0.00 57.00 55.01 3giy n GLN 259 Cb 0.39 -1.15 -0.17 0.00 0.11 0.00 0.00 30.24 29.43 3giy n GLN 259 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 3giy s LEU 260 N -6.67 0.82 0.34 1.08 2.96 -1.26 -4.36 118.68 111.58 3giy s LEU 260 Ca -0.23 -0.77 0.07 0.00 -0.22 0.00 0.00 54.13 52.98 3giy s LEU 260 Cb 0.08 -0.44 0.76 0.00 0.50 0.00 0.00 46.19 47.09 3giy s LEU 260 CO 0.31 -0.33 1.86 -0.78 -1.32 0.00 0.00 176.35 176.09 3giy h ASP 261 N 8.32 0.72 -0.48 3.68 3.58 -1.83 -2.46 116.42 127.95 3giy h ASP 261 Ca -0.16 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.33 3giy h ASP 261 Cb 1.13 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 42.08 3giy h ASP 261 CO 0.32 0.37 0.00 0.00 -2.88 0.00 0.00 179.24 177.05 3giy s ALA 263 N -1.91 2.52 0.83 0.00 0.00 -0.93 -5.01 121.76 117.27 3giy s ALA 263 Ca 0.40 0.65 -0.11 0.00 0.00 0.00 0.00 51.96 52.89 3giy s ALA 263 Cb 0.27 -3.34 0.09 0.00 0.00 0.00 0.00 23.12 20.14 3giy s ALA 263 CO 0.17 -1.16 1.09 0.96 0.00 0.00 0.00 175.76 176.83 3giy s ILE 264 N -2.15 2.94 0.15 0.00 -4.36 -1.26 -4.95 121.20 111.57 3giy s ILE 264 Ca 0.69 0.31 -0.24 0.00 -0.26 0.00 0.00 60.65 61.14 3giy s ILE 264 Cb -0.22 -2.94 -0.08 0.00 1.25 0.00 0.00 42.46 40.47 3giy s ILE 264 CO 0.37 -0.40 0.74 -0.55 0.24 0.00 0.00 174.94 175.35 3giy s SER 265 N -3.69 7.33 0.66 4.36 0.15 -1.26 -4.80 113.70 116.45 3giy s SER 265 Ca 0.62 1.58 0.40 0.00 0.70 0.00 0.00 55.95 59.25 3giy s SER 265 Cb -0.16 -2.48 2.21 0.00 -1.71 0.00 0.00 66.02 63.88 3giy s SER 265 CO 0.55 0.22 2.26 1.55 1.20 0.00 0.00 173.24 179.02 3giy h PRO 266 N 4.35 0.00 0.00 5.44 0.13 -1.89 0.38 132.00 140.40 3giy h PRO 266 Ca -0.47 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.63 3giy h PRO 266 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 3giy h PRO 266 CO 0.66 0.00 -0.11 0.52 -0.23 0.00 0.00 178.00 178.83 3giy h MET 267 N 0.00 0.00 0.00 0.86 2.86 -1.91 -2.15 114.93 114.59 3giy h MET 267 Ca 0.00 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 3giy h MET 267 Cb 0.17 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.83 3giy h MET 267 CO -0.00 0.11 -0.08 0.93 1.06 0.00 0.00 176.91 178.94 3giy h GLU 268 N 0.00 0.00 0.00 1.72 5.08 -1.30 -3.14 114.58 116.94 3giy h GLU 268 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3giy h GLU 268 Cb 0.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 3giy h GLU 268 CO 0.01 0.08 0.00 1.33 -1.00 0.00 0.00 179.01 179.43 3giy n VAL 269 N -3.27 0.60 0.27 3.13 0.24 -0.96 -4.84 118.33 113.50 3giy n VAL 269 Ca -0.00 -0.77 -0.17 0.00 -2.04 0.00 0.00 64.34 61.36 3giy n VAL 269 Cb 0.29 0.72 -0.08 0.00 -1.47 0.00 0.00 33.84 33.30 3giy n VAL 269 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 3giy h LEU 270 N 0.00 -1.07 -0.83 1.34 5.85 -1.35 -0.29 115.31 118.95 3giy h LEU 270 Ca 0.00 0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.84 3giy h LEU 270 Cb 0.35 0.35 -0.05 0.00 0.37 0.00 0.00 40.66 41.67 3giy h LEU 270 CO 0.00 -0.57 0.53 0.00 -0.34 0.00 0.00 178.44 178.06 3giy h ALA 271 N -0.52 1.11 -0.51 1.25 0.00 -1.81 -0.96 119.26 117.83 3giy h ALA 271 Ca -0.05 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 3giy h ALA 271 Cb 0.75 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3giy h ALA 271 CO -0.03 0.33 -0.00 0.37 0.00 0.00 0.00 179.25 179.92 3giy h GLN 272 N 1.01 0.85 -0.31 0.00 4.15 -1.86 -1.16 115.11 117.80 3giy h GLN 272 Ca 0.34 -0.24 -0.14 0.00 0.77 0.00 0.00 58.65 59.38 3giy h GLN 272 Cb 0.06 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.65 3giy h GLN 272 CO -0.13 0.86 -0.38 0.77 -1.93 0.00 0.00 178.83 178.01 3giy h SER 273 N 0.79 0.77 -0.19 -0.69 0.02 -0.53 -0.99 113.55 112.73 3giy h SER 273 Ca 0.15 -0.34 -0.02 0.00 -0.84 0.00 0.00 61.79 60.73 3giy h SER 273 Cb 0.48 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 3giy h SER 273 CO 0.02 1.07 0.03 0.58 -1.14 0.00 0.00 176.83 177.39 3giy h VAL 274 N 0.60 1.23 -0.62 2.27 2.07 -0.91 -1.06 116.25 119.82 3giy h VAL 274 Ca 0.05 -0.75 -0.07 0.00 0.82 0.00 0.00 66.70 66.75 3giy h VAL 274 Cb 0.92 1.35 -0.03 0.00 -1.52 0.00 0.00 31.29 32.02 3giy h VAL 274 CO 0.08 0.23 0.10 0.00 0.02 0.00 0.00 177.57 178.01 3giy h ALA 275 N 0.82 1.01 0.00 1.67 0.00 -1.14 -2.63 119.26 118.99 3giy h ALA 275 Ca 0.06 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 3giy h ALA 275 Cb 0.32 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3giy h ALA 275 CO 0.00 0.63 -0.00 -0.22 0.00 0.00 0.00 179.25 179.67 3giy h LYS 276 N 0.95 -0.00 -0.22 0.00 3.64 -1.13 -3.38 116.57 116.43 3giy h LYS 276 Ca 0.19 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.39 3giy h LYS 276 Cb 0.41 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 3giy h LYS 276 CO 0.01 0.91 -0.61 1.79 -2.27 0.00 0.00 179.45 179.29 3giy h THR 277 N -0.96 1.29 -0.17 1.00 1.35 -1.30 -3.47 112.91 110.66 3giy h THR 277 Ca -0.00 -1.82 -0.07 0.00 -0.55 0.00 0.00 66.41 63.96 3giy h THR 277 Cb 0.92 1.77 -0.03 0.00 -1.73 0.00 0.00 68.15 69.07 3giy h THR 277 CO 0.00 0.58 -0.07 0.61 -0.25 0.00 0.00 175.52 176.40 3giy n GLY 278 N 0.42 0.51 3.55 5.82 0.00 -0.99 -4.97 105.19 109.52 3giy n GLY 278 Ca -0.05 -0.10 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 3giy n GLY 278 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3giy s LYS 279 N -1.77 1.83 -0.01 1.61 -0.14 -1.26 -5.08 119.74 114.91 3giy s LYS 279 Ca 0.00 -1.98 -0.36 0.00 -1.36 0.00 0.00 55.97 52.28 3giy s LYS 279 Cb 0.00 -1.58 -0.14 0.00 -1.68 0.00 0.00 37.83 34.43 3giy s LYS 279 CO 0.00 0.05 1.67 -2.30 -0.76 0.00 0.00 175.35 174.01 3giy n PRO 280 N -0.82 1.82 -4.03 -1.68 -0.02 -1.26 -4.91 135.00 124.10 3giy n PRO 280 Ca -0.05 0.66 -0.32 0.00 -2.02 0.00 0.00 63.50 61.77 3giy n PRO 280 Cb 0.65 -2.42 -0.15 0.00 -0.02 0.00 0.00 33.50 31.56 3giy n PRO 280 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3giy s VAL 281 N 2.35 2.33 0.44 -1.45 1.01 -1.26 -2.13 120.40 121.69 3giy s VAL 281 Ca 0.88 -1.77 0.03 0.00 0.00 0.00 0.00 61.98 61.12 3giy s VAL 281 Cb -0.80 -2.45 0.00 0.00 0.00 0.00 0.00 36.38 33.14 3giy s VAL 281 CO 0.49 -0.18 0.63 -0.76 0.00 0.00 0.00 175.10 175.28 3giy s LEU 282 N 1.08 3.65 0.02 3.92 1.02 0.46 -0.45 118.68 128.38 3giy s LEU 282 Ca -0.04 0.02 -0.24 0.00 0.02 0.00 0.00 54.13 53.90 3giy s LEU 282 Cb -0.20 -2.94 0.05 0.00 0.02 0.00 0.00 46.19 43.13 3giy s LEU 282 CO -0.05 -0.74 0.54 -0.51 0.02 0.00 0.00 176.35 175.62 3giy s ILE 283 N -2.48 0.02 0.33 -0.59 2.07 -0.83 -0.91 121.20 118.81 3giy s ILE 283 Ca 0.50 -0.20 -0.04 0.00 -1.41 0.00 0.00 60.65 59.50 3giy s ILE 283 Cb -0.10 -0.94 0.02 0.00 0.13 0.00 0.00 42.46 41.56 3giy s ILE 283 CO 0.36 -0.11 0.50 -0.90 -1.91 0.00 0.00 174.94 172.88 3giy n ASP 284 N 0.61 -1.41 -0.30 4.50 5.68 -0.98 -1.40 116.55 123.25 3giy n ASP 284 Ca -0.19 -2.67 0.00 0.00 -0.50 0.00 0.00 54.79 51.43 3giy n ASP 284 Cb 0.59 2.55 0.00 0.00 -1.14 0.00 0.00 41.12 43.12 3giy n ASP 284 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 3giy n SER 285 N -1.63 -0.40 0.00 -1.12 7.64 -1.26 -4.59 113.62 112.26 3giy n SER 285 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.87 3giy n SER 285 Cb 0.54 -0.20 0.00 0.00 -1.01 0.00 0.00 64.21 63.54 3giy n SER 285 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3giy n GLY 286 N 0.59 0.25 3.68 0.23 0.00 -1.26 -4.87 105.19 103.81 3giy n GLY 286 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3giy n GLY 286 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3giy s PHE 287 N -2.00 2.91 0.00 1.61 0.40 -1.26 -4.62 117.98 115.02 3giy s PHE 287 Ca 0.00 0.97 0.00 0.00 -0.60 0.00 0.00 56.93 57.30 3giy s PHE 287 Cb 0.00 -3.55 0.00 0.00 0.51 0.00 0.00 43.02 39.98 3giy s PHE 287 CO 0.00 -1.94 0.00 0.54 0.70 0.00 0.00 175.22 174.52 3giy n ARG 288 N 5.76 0.25 -4.05 0.44 5.12 -1.26 -4.64 116.66 118.28 3giy n ARG 288 Ca 0.13 0.00 -0.27 0.00 -1.93 0.00 0.00 57.85 55.78 3giy n ARG 288 Cb 0.45 -0.64 -0.05 0.00 -1.16 0.00 0.00 32.46 31.06 3giy n ARG 288 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 3giy s ARG 289 N -1.27 2.99 0.53 5.56 1.81 -1.26 -4.60 118.95 122.71 3giy s ARG 289 Ca 0.00 -0.78 0.19 0.00 -1.72 0.00 0.00 55.73 53.42 3giy s ARG 289 Cb 0.00 -2.72 1.34 0.00 -0.45 0.00 0.00 34.95 33.12 3giy s ARG 289 CO 0.00 0.51 2.13 0.78 -0.68 0.00 0.00 175.30 178.04 3giy h GLY 290 N 2.58 0.00 1.62 -3.53 0.00 -1.88 -1.32 103.07 100.53 3giy h GLY 290 Ca -0.47 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 46.74 3giy h GLY 290 CO 0.65 0.00 -0.39 1.48 0.00 0.00 0.00 176.54 178.28 3giy h SER 291 N 0.00 0.45 -0.06 0.19 4.64 -1.95 -0.77 113.55 116.06 3giy h SER 291 Ca 0.04 -0.19 -0.00 0.00 -0.47 0.00 0.00 61.79 61.17 3giy h SER 291 Cb 0.17 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.13 3giy h SER 291 CO -0.00 0.80 0.03 0.44 -0.87 0.00 0.00 176.83 177.23 3giy h ASP 292 N 0.36 0.07 -0.13 4.97 3.32 -1.64 -0.73 116.42 122.64 3giy h ASP 292 Ca 0.03 -0.05 0.01 0.00 0.02 0.00 0.00 57.03 57.05 3giy h ASP 292 Cb 0.84 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.36 3giy h ASP 292 CO 0.07 0.10 0.03 0.40 -1.72 0.00 0.00 179.24 178.12 3giy h ILE 293 N 0.04 0.96 -0.43 0.35 2.04 -1.34 -2.58 117.51 116.54 3giy h ILE 293 Ca 0.02 -0.03 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 3giy h ILE 293 Cb 0.04 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 3giy h ILE 293 CO -0.00 0.02 0.16 0.58 0.00 0.00 0.00 178.15 178.91 3giy h VAL 294 N 0.09 1.17 -0.73 1.67 2.07 -0.97 -1.44 116.25 118.12 3giy h VAL 294 Ca 0.06 -0.53 -0.06 0.00 0.82 0.00 0.00 66.70 66.98 3giy h VAL 294 Cb 0.04 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 3giy h VAL 294 CO -0.07 0.21 0.20 0.11 0.02 0.00 0.00 177.57 178.04 3giy h LYS 295 N 0.61 1.15 -0.26 1.57 1.57 -0.81 -0.46 116.57 119.94 3giy h LYS 295 Ca 0.15 -0.26 -0.11 0.00 -1.87 0.00 0.00 60.65 58.56 3giy h LYS 295 Cb 0.14 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 3giy h LYS 295 CO -0.01 0.99 -0.28 0.00 -0.57 0.00 0.00 179.45 179.58 3giy h ALA 296 N 1.10 0.38 -0.92 3.86 0.00 -1.07 -2.37 119.26 120.25 3giy h ALA 296 Ca 0.23 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3giy h ALA 296 Cb 0.34 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 3giy h ALA 296 CO -0.00 0.38 0.55 -0.07 0.00 0.00 0.00 179.25 180.11 3giy h LEU 297 N 0.36 1.11 -1.57 0.00 3.38 -1.13 -1.30 115.31 116.15 3giy h LEU 297 Ca 0.04 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 3giy h LEU 297 Cb 0.84 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 3giy h LEU 297 CO 0.07 0.85 -0.23 0.00 0.09 0.00 0.00 178.44 179.22 3giy h ALA 298 N 1.30 1.40 -0.08 1.53 0.00 -0.99 -1.85 119.26 120.57 3giy h ALA 298 Ca 0.33 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3giy h ALA 298 Cb -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3giy h ALA 298 CO -0.06 0.29 0.00 1.28 0.00 0.00 0.00 179.25 180.76 3giy n LEU 299 N -3.94 0.99 0.00 0.00 4.77 -0.57 -2.06 117.00 116.20 3giy n LEU 299 Ca -0.02 -0.39 0.00 0.00 -0.03 0.00 0.00 56.01 55.57 3giy n LEU 299 Cb 0.31 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 3giy n LEU 299 CO 0.35 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 3giy n GLY 300 N 1.03 0.82 3.76 -0.72 0.00 -0.70 -4.23 105.19 105.15 3giy n GLY 300 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3giy n GLY 300 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3giy s ALA 301 N -2.00 3.60 0.07 4.61 0.00 -0.75 -4.69 121.76 122.60 3giy s ALA 301 Ca 0.00 1.39 -0.17 0.00 0.00 0.00 0.00 51.96 53.18 3giy s ALA 301 Cb 0.00 -3.56 -0.12 0.00 0.00 0.00 0.00 23.12 19.44 3giy s ALA 301 CO 0.00 -0.81 1.36 1.49 0.00 0.00 0.00 175.76 177.81 3giy h GLU 302 N 4.17 0.58 -2.88 0.00 4.57 -1.11 -3.41 114.58 116.50 3giy h GLU 302 Ca -0.48 -0.33 0.06 0.00 -1.18 0.00 0.00 59.36 57.43 3giy h GLU 302 Cb 1.22 0.03 -0.08 0.00 -0.16 0.00 0.00 28.75 29.76 3giy h GLU 302 CO 0.72 0.93 0.27 0.00 -1.18 0.00 0.00 179.01 179.75 3giy s ALA 303 N -4.22 -1.40 -0.07 2.92 0.00 -1.26 -4.84 121.76 112.89 3giy s ALA 303 Ca -0.13 0.01 0.05 0.00 0.00 0.00 0.00 51.96 51.89 3giy s ALA 303 Cb 0.07 0.81 -0.00 0.00 0.00 0.00 0.00 23.12 24.00 3giy s ALA 303 CO 0.81 -0.96 -0.22 0.08 0.00 0.00 0.00 175.76 175.47 3giy s VAL 304 N -3.76 1.86 -0.10 0.00 1.01 -0.39 -1.97 120.40 117.06 3giy s VAL 304 Ca 0.08 -0.93 -0.12 0.00 0.00 0.00 0.00 61.98 61.01 3giy s VAL 304 Cb -0.04 -1.60 -0.05 0.00 0.00 0.00 0.00 36.38 34.69 3giy s VAL 304 CO 0.01 0.52 0.27 -0.76 0.00 0.00 0.00 175.10 175.14 3giy s LEU 305 N 0.13 4.37 -0.04 3.92 1.02 -0.49 -1.85 118.68 125.74 3giy s LEU 305 Ca -0.10 0.63 -0.13 0.00 0.02 0.00 0.00 54.13 54.55 3giy s LEU 305 Cb -0.15 -2.33 -0.05 0.00 0.02 0.00 0.00 46.19 43.68 3giy s LEU 305 CO 0.05 0.28 0.34 -0.76 0.02 0.00 0.00 176.35 176.29 3giy s LEU 306 N -0.54 4.43 0.00 1.79 1.43 0.70 -4.52 118.68 121.97 3giy s LEU 306 Ca 0.18 0.82 0.00 0.00 -1.03 0.00 0.00 54.13 54.10 3giy s LEU 306 Cb -0.14 -2.46 0.00 0.00 0.03 0.00 0.00 46.19 43.62 3giy s LEU 306 CO 0.07 0.32 0.00 0.61 0.23 0.00 0.00 176.35 177.57 3giy n GLY 307 N 2.02 0.60 0.29 -3.19 0.00 -1.26 -0.77 105.19 102.88 3giy n GLY 307 Ca -0.15 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.89 3giy n GLY 307 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3giy h ARG 308 N 0.00 0.54 -0.53 1.61 3.08 -1.94 -3.11 114.38 114.03 3giy h ARG 308 Ca 0.00 -0.08 0.07 0.00 0.07 0.00 0.00 59.98 60.04 3giy h ARG 308 Cb 0.00 -0.10 -0.10 0.00 0.08 0.00 0.00 29.97 29.85 3giy h ARG 308 CO 0.00 0.47 -0.49 0.00 -1.07 0.00 0.00 179.97 178.88 3giy h ALA 309 N 1.60 -0.53 0.00 0.04 0.00 -1.90 0.56 119.26 119.03 3giy h ALA 309 Ca 0.13 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3giy h ALA 309 Cb 0.16 1.05 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3giy h ALA 309 CO -0.01 -0.93 0.00 1.79 0.00 0.00 0.00 179.25 180.10 3giy h THR 310 N -0.29 0.00 0.00 0.00 1.35 -1.89 -3.01 112.91 109.07 3giy h THR 310 Ca 0.13 -0.78 -0.11 0.00 -0.55 0.00 0.00 66.41 65.11 3giy h THR 310 Cb 0.57 1.77 -0.02 0.00 -1.73 0.00 0.00 68.15 68.75 3giy h THR 310 CO -0.66 0.00 -0.51 -0.07 -0.25 0.00 0.00 175.52 174.03 3giy h LEU 311 N 0.00 0.00 -0.82 3.87 3.38 -0.91 -1.87 115.31 118.97 3giy h LEU 311 Ca 0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 3giy h LEU 311 Cb 0.80 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.53 3giy h LEU 311 CO 0.00 0.51 -0.08 1.88 0.09 0.00 0.00 178.44 180.84 3giy h TYR 312 N 0.00 0.87 -0.45 1.13 0.05 -0.89 0.04 116.97 117.71 3giy h TYR 312 Ca -0.01 -0.15 -0.10 0.00 0.05 0.00 0.00 58.73 58.52 3giy h TYR 312 Cb 0.93 -0.23 -0.01 0.00 1.01 0.00 0.00 36.73 38.43 3giy h TYR 312 CO 0.00 0.84 -0.11 0.78 -1.05 0.00 0.00 178.16 178.63 3giy h GLY 313 N 0.98 0.95 0.86 3.88 0.00 -1.53 -1.13 103.07 107.07 3giy h GLY 313 Ca 0.13 -0.78 -0.02 0.00 0.00 0.00 0.00 47.33 46.66 3giy h GLY 313 CO 0.03 0.71 -0.15 -2.00 0.00 0.00 0.00 176.54 175.13 3giy h LEU 314 N 0.71 -0.36 -1.28 3.11 5.85 -0.97 0.15 115.31 122.52 3giy h LEU 314 Ca 0.11 -0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 3giy h LEU 314 Cb 0.65 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.76 3giy h LEU 314 CO 0.04 -0.14 -0.09 0.00 -0.34 0.00 0.00 178.44 177.91 3giy h ALA 315 N 0.07 1.41 0.05 1.25 0.00 -1.03 0.29 119.26 121.30 3giy h ALA 315 Ca -0.04 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.58 3giy h ALA 315 Cb 0.42 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.10 3giy h ALA 315 CO 0.07 0.41 -0.32 0.00 0.00 0.00 0.00 179.25 179.41 3giy h ALA 316 N 1.55 -0.03 0.00 0.00 0.00 -1.11 -3.43 119.26 116.24 3giy h ALA 316 Ca 0.07 -0.57 -0.12 0.00 0.00 0.00 0.00 54.91 54.29 3giy h ALA 316 Cb 0.38 0.04 -0.27 0.00 0.00 0.00 0.00 17.79 17.95 3giy h ALA 316 CO 0.02 0.15 -0.86 0.54 0.00 0.00 0.00 179.25 179.10 3giy n ARG 317 N -4.42 0.10 0.00 0.00 1.74 0.49 -4.93 116.66 109.64 3giy n ARG 317 Ca -0.11 -1.83 0.00 0.00 -0.77 0.00 0.00 57.85 55.14 3giy n ARG 317 Cb 0.61 -0.23 0.00 0.00 -1.02 0.00 0.00 32.46 31.81 3giy n ARG 317 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3giy n GLY 318 N 0.26 1.16 0.24 -0.13 0.00 0.10 -2.04 105.19 104.78 3giy n GLY 318 Ca 0.05 -0.59 -0.00 0.00 0.00 0.00 0.00 46.02 45.48 3giy n GLY 318 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3giy h GLU 319 N 0.00 0.45 -0.68 1.61 4.81 -1.84 -0.32 114.58 118.61 3giy h GLU 319 Ca 0.00 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3giy h GLU 319 Cb 0.00 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.24 3giy h GLU 319 CO 0.00 0.30 0.42 1.15 -0.73 0.00 0.00 179.01 180.15 3giy h THR 320 N 0.47 1.19 -0.64 0.32 2.02 -1.91 -0.62 112.91 113.74 3giy h THR 320 Ca 0.31 -0.40 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 3giy h THR 320 Cb 0.36 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 3giy h THR 320 CO -0.28 0.19 0.31 1.23 0.37 0.00 0.00 175.52 177.34 3giy h GLY 321 N 0.96 0.98 0.99 2.16 0.00 -0.49 0.02 103.07 107.69 3giy h GLY 321 Ca 0.25 -0.49 -0.05 0.00 0.00 0.00 0.00 47.33 47.04 3giy h GLY 321 CO -0.05 0.46 0.14 -2.08 0.00 0.00 0.00 176.54 175.02 3giy h VAL 322 N 0.88 1.24 -0.60 4.60 2.07 -0.56 -1.75 116.25 122.14 3giy h VAL 322 Ca 0.22 -0.86 0.04 0.00 0.82 0.00 0.00 66.70 66.93 3giy h VAL 322 Cb 0.12 0.76 -0.05 0.00 -1.52 0.00 0.00 31.29 30.60 3giy h VAL 322 CO -0.03 0.31 0.33 0.44 0.02 0.00 0.00 177.57 178.65 3giy h ASP 323 N 0.77 0.51 -0.69 0.57 3.32 -0.63 -1.34 116.42 118.92 3giy h ASP 323 Ca 0.17 0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.17 3giy h ASP 323 Cb 0.33 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.77 3giy h ASP 323 CO 0.00 0.34 0.16 -0.33 -1.72 0.00 0.00 179.24 177.69 3giy h GLU 324 N 0.64 1.12 -0.32 3.56 5.08 -0.70 0.14 114.58 124.08 3giy h GLU 324 Ca 0.26 -0.27 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 3giy h GLU 324 Cb 0.12 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 3giy h GLU 324 CO -0.15 0.99 -0.09 0.28 -1.00 0.00 0.00 179.01 179.03 3giy h VAL 325 N 1.06 1.28 -0.57 3.13 2.07 -0.99 -0.95 116.25 121.29 3giy h VAL 325 Ca 0.22 -1.16 -0.06 0.00 0.82 0.00 0.00 66.70 66.52 3giy h VAL 325 Cb 0.38 1.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 3giy h VAL 325 CO 0.00 0.37 0.12 -0.07 0.02 0.00 0.00 177.57 178.01 3giy h LEU 326 N 0.41 0.83 -0.38 2.57 3.38 -1.07 -0.09 115.31 120.96 3giy h LEU 326 Ca 0.08 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 3giy h LEU 326 Cb 0.60 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 3giy h LEU 326 CO 0.04 0.83 0.08 0.74 0.09 0.00 0.00 178.44 180.21 3giy h THR 327 N 0.85 1.23 -0.32 0.22 2.02 -0.77 -0.74 112.91 115.41 3giy h THR 327 Ca 0.18 -0.82 -0.02 0.00 0.77 0.00 0.00 66.41 66.52 3giy h THR 327 Cb 0.34 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 3giy h THR 327 CO 0.00 0.28 0.14 -0.07 0.37 0.00 0.00 175.52 176.24 3giy h LEU 328 N 0.48 0.43 -0.74 2.58 3.38 -0.85 -1.92 115.31 118.67 3giy h LEU 328 Ca 0.12 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 3giy h LEU 328 Cb 0.34 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 3giy h LEU 328 CO 0.00 0.46 0.31 -0.07 0.09 0.00 0.00 178.44 179.23 3giy h LEU 329 N 0.37 1.01 -0.32 1.67 3.38 -0.90 0.14 115.31 120.67 3giy h LEU 329 Ca 0.11 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 3giy h LEU 329 Cb 0.16 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3giy h LEU 329 CO -0.01 0.90 0.12 0.50 0.09 0.00 0.00 178.44 180.04 3giy h LYS 330 N 1.06 0.49 -0.25 1.13 3.64 -1.00 0.24 116.57 121.88 3giy h LYS 330 Ca 0.25 -0.09 -0.06 0.00 -1.27 0.00 0.00 60.65 59.47 3giy h LYS 330 Cb 0.20 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 3giy h LYS 330 CO -0.02 0.50 -0.13 0.00 -2.27 0.00 0.00 179.45 177.54 3giy h ALA 331 N 0.96 1.33 0.13 5.00 0.00 -1.16 0.11 119.26 125.62 3giy h ALA 331 Ca 0.11 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3giy h ALA 331 Cb 0.21 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3giy h ALA 331 CO -0.01 0.45 -0.06 0.22 0.00 0.00 0.00 179.25 179.86 3giy h ASP 332 N 0.38 -0.14 -0.58 0.00 1.82 -0.20 0.14 116.42 117.84 3giy h ASP 332 Ca 0.07 -0.20 0.02 0.00 -0.39 0.00 0.00 57.03 56.53 3giy h ASP 332 Cb 0.46 0.04 -0.03 0.00 0.68 0.00 0.00 39.33 40.47 3giy h ASP 332 CO 0.03 0.12 0.37 0.40 -1.61 0.00 0.00 179.24 178.54 3giy h ILE 333 N -0.41 1.11 -0.19 2.25 2.04 -0.20 -0.74 117.51 121.36 3giy h ILE 333 Ca -0.02 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.59 3giy h ILE 333 Cb 0.33 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 3giy h ILE 333 CO 0.03 0.13 0.12 -0.78 0.00 0.00 0.00 178.15 177.66 3giy h ASP 334 N 0.74 0.22 -0.69 1.72 3.58 -0.65 -0.93 116.42 120.40 3giy h ASP 334 Ca 0.22 -0.01 0.01 0.00 0.42 0.00 0.00 57.03 57.67 3giy h ASP 334 Cb -0.03 -0.05 -0.04 0.00 1.72 0.00 0.00 39.33 40.93 3giy h ASP 334 CO -0.07 0.16 0.46 -0.09 -2.88 0.00 0.00 179.24 176.81 3giy h ARG 335 N 0.25 0.90 -0.36 0.28 2.43 -0.42 -2.16 114.38 115.30 3giy h ARG 335 Ca 0.07 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.14 3giy h ARG 335 Cb -0.02 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.31 3giy h ARG 335 CO -0.01 0.59 0.07 1.15 -1.51 0.00 0.00 179.97 180.26 3giy h THR 336 N 0.92 1.23 -0.79 0.20 2.02 -0.87 -1.53 112.91 114.10 3giy h THR 336 Ca 0.26 -0.81 0.05 0.00 0.77 0.00 0.00 66.41 66.68 3giy h THR 336 Cb -0.09 1.06 -0.06 0.00 -1.74 0.00 0.00 68.15 67.33 3giy h THR 336 CO -0.06 0.28 0.48 -0.07 0.37 0.00 0.00 175.52 176.51 3giy h LEU 337 N 0.44 0.75 -0.33 2.58 3.38 -0.94 -1.58 115.31 119.62 3giy h LEU 337 Ca 0.11 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 3giy h LEU 337 Cb 0.34 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 3giy h LEU 337 CO 0.00 0.49 0.09 0.00 0.09 0.00 0.00 178.44 179.12 3giy h ALA 338 N 1.37 0.43 0.00 1.53 0.00 -1.16 0.06 119.26 121.49 3giy h ALA 338 Ca 0.34 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3giy h ALA 338 Cb 0.14 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3giy h ALA 338 CO -0.16 0.08 -0.00 1.96 0.00 0.00 0.00 179.25 181.12 3giy h GLN 339 N 0.37 0.00 -0.02 0.00 4.20 -0.81 -2.61 115.11 116.24 3giy h GLN 339 Ca 0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.81 3giy h GLN 339 Cb 0.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.05 3giy h GLN 339 CO -0.00 0.00 -0.22 0.44 -0.67 0.00 0.00 178.83 178.38 3giy n ILE 340 N -3.09 0.00 -2.32 2.54 -5.35 -0.64 -4.72 119.36 105.77 3giy n ILE 340 Ca 0.00 -0.39 -0.04 0.00 -0.27 0.00 0.00 62.75 62.05 3giy n ILE 340 Cb 0.28 1.38 0.00 0.00 -1.74 0.00 0.00 39.64 39.57 3giy n ILE 340 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3giy n GLY 341 N 1.35 0.41 2.69 3.28 0.00 -0.89 -0.69 105.19 111.33 3giy n GLY 341 Ca 0.11 -0.64 -0.28 0.00 0.00 0.00 0.00 46.02 45.22 3giy n GLY 341 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3giy h PRO 343 N 5.39 0.54 -4.85 0.00 0.13 -1.87 -3.39 132.00 127.94 3giy h PRO 343 Ca 0.19 -0.03 -0.66 0.00 -0.87 0.00 0.00 66.00 64.63 3giy h PRO 343 Cb 0.80 -0.12 -0.23 0.00 0.13 0.00 0.00 31.00 31.59 3giy h PRO 343 CO 0.60 0.36 -0.59 0.34 -0.23 0.00 0.00 178.00 178.48 3giy s ASP 344 N -5.73 5.36 0.49 1.44 -1.08 -1.26 -0.09 116.67 115.80 3giy s ASP 344 Ca -0.09 -0.40 0.22 0.00 -0.52 0.00 0.00 52.55 51.77 3giy s ASP 344 Cb 0.22 -1.96 1.28 0.00 -1.46 0.00 0.00 42.92 41.00 3giy s ASP 344 CO 0.78 -0.12 1.96 -0.29 0.52 0.00 0.00 175.17 178.01 3giy h ILE 345 N 5.63 0.74 0.00 4.11 2.10 -1.23 0.76 117.51 129.61 3giy h ILE 345 Ca -0.35 -0.05 0.00 0.00 1.08 0.00 0.00 64.86 65.54 3giy h ILE 345 Cb 1.16 0.57 0.00 0.00 -1.09 0.00 0.00 36.82 37.45 3giy h ILE 345 CO 0.60 0.03 0.00 0.35 -1.08 0.00 0.00 178.15 178.04 3giy n THR 346 N -4.41 0.04 0.90 2.19 -2.24 -1.26 -2.46 114.28 107.04 3giy n THR 346 Ca 0.12 0.01 0.12 0.00 -2.27 0.00 0.00 64.05 62.03 3giy n THR 346 Cb 0.62 -0.65 0.18 0.00 -2.10 0.00 0.00 70.33 68.38 3giy n THR 346 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3giy n SER 347 N -1.03 2.91 -4.76 3.42 7.64 0.26 -4.97 113.62 117.09 3giy n SER 347 Ca 0.16 -1.94 -0.41 0.00 1.01 0.00 0.00 58.87 57.69 3giy n SER 347 Cb 0.09 -0.06 -0.01 0.00 -1.01 0.00 0.00 64.21 63.22 3giy n SER 347 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3giy s LEU 348 N -1.87 4.35 0.20 -3.43 1.43 -1.03 -5.01 118.68 113.32 3giy s LEU 348 Ca 0.32 2.90 -0.08 0.00 -1.03 0.00 0.00 54.13 56.24 3giy s LEU 348 Cb 0.21 -3.64 -0.02 0.00 0.03 0.00 0.00 46.19 42.77 3giy s LEU 348 CO 0.31 -0.84 0.30 -0.94 0.23 0.00 0.00 176.35 175.41 3giy s SER 349 N 0.26 0.03 0.00 2.29 1.04 -1.26 -4.76 113.70 111.31 3giy s SER 349 Ca 0.59 -1.03 0.08 0.00 0.48 0.00 0.00 55.95 56.07 3giy s SER 349 Cb -0.46 0.47 0.35 0.00 0.10 0.00 0.00 66.02 66.47 3giy s SER 349 CO 0.51 -0.96 1.26 -2.65 0.98 0.00 0.00 173.24 172.38 3giy n PRO 350 N -0.28 0.00 0.27 4.02 -0.02 -0.87 -2.36 135.00 135.76 3giy n PRO 350 Ca -0.03 0.36 0.18 0.00 -2.02 0.00 0.00 63.50 61.99 3giy n PRO 350 Cb 0.63 -1.50 0.85 0.00 -0.02 0.00 0.00 33.50 33.47 3giy n PRO 350 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 3giy h ASP 351 N 0.00 0.00 0.07 2.55 3.58 -1.95 -1.31 116.42 119.35 3giy h ASP 351 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 3giy h ASP 351 Cb 0.14 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.19 3giy h ASP 351 CO 0.00 0.00 -0.07 -1.22 -2.88 0.00 0.00 179.24 175.07 3giy n TYR 352 N -2.92 0.00 -4.18 0.28 4.02 -1.00 -4.85 117.16 108.52 3giy n TYR 352 Ca -0.01 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.66 3giy n TYR 352 Cb 0.19 -0.04 -0.06 0.00 -0.02 0.00 0.00 39.34 39.41 3giy n TYR 352 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 3giy s LEU 353 N -2.15 3.48 -0.07 7.72 1.43 -0.50 -0.90 118.68 127.69 3giy s LEU 353 Ca 0.34 -0.48 -0.01 0.00 -1.03 0.00 0.00 54.13 52.95 3giy s LEU 353 Cb 0.20 -2.00 0.03 0.00 0.03 0.00 0.00 46.19 44.45 3giy s LEU 353 CO 0.39 -0.05 -0.02 -1.58 0.23 0.00 0.00 176.35 175.32 3giy s GLN 354 N -3.77 0.73 0.06 1.70 2.00 0.39 -4.77 119.66 115.99 3giy s GLN 354 Ca 0.33 0.02 -0.30 0.00 -2.00 0.00 0.00 55.36 53.40 3giy s GLN 354 Cb -0.07 -0.96 -0.05 0.00 0.80 0.00 0.00 33.01 32.73 3giy s GLN 354 CO 0.23 -0.23 1.14 -0.80 -0.50 0.00 0.00 175.29 175.12 3giy s ASN 355 N 1.61 7.16 0.00 6.67 0.01 -1.26 -1.38 114.94 127.76 3giy s ASN 355 Ca -0.00 1.94 0.15 0.00 -0.71 0.00 0.00 52.86 54.23 3giy s ASN 355 Cb -0.13 -2.58 0.12 0.00 0.41 0.00 0.00 41.25 39.07 3giy s ASN 355 CO -0.04 -0.40 0.98 -0.62 -1.51 0.00 0.00 177.10 175.51