#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cg3 h ARG 26 N 0.00 0.09 -5.27 4.33 2.43 -1.95 -3.44 114.38 110.57 3cg3 h ARG 26 Ca 0.00 -0.15 -0.63 0.00 -0.81 0.00 0.00 59.98 58.38 3cg3 h ARG 26 Cb 0.00 0.06 -0.20 0.00 -0.42 0.00 0.00 29.97 29.41 3cg3 h ARG 26 CO 0.00 1.07 -0.63 -1.21 -1.51 0.00 0.00 179.97 177.69 3cg3 s GLU 27 N -2.32 3.76 0.05 0.20 2.02 -1.26 0.14 118.70 121.29 3cg3 s GLU 27 Ca -0.20 -0.47 -0.01 0.00 0.02 0.00 0.00 54.97 54.31 3cg3 s GLU 27 Cb 0.00 -3.02 -0.04 0.00 0.10 0.00 0.00 34.13 31.17 3cg3 s GLU 27 CO 0.71 0.23 -0.02 0.00 0.02 0.00 0.00 175.26 176.20 3cg3 s ALA 28 N 0.43 0.42 -0.02 5.21 0.00 -0.20 -4.93 121.76 122.68 3cg3 s ALA 28 Ca -0.01 -1.10 0.06 0.00 0.00 0.00 0.00 51.96 50.91 3cg3 s ALA 28 Cb -0.14 0.27 -0.02 0.00 0.00 0.00 0.00 23.12 23.24 3cg3 s ALA 28 CO 0.02 -0.35 -0.20 0.50 0.00 0.00 0.00 175.76 175.72 3cg3 s ARG 29 N -3.63 1.65 -0.10 0.00 3.52 -1.26 -2.02 118.95 117.12 3cg3 s ARG 29 Ca 0.04 -0.72 0.03 0.00 -0.13 0.00 0.00 55.73 54.95 3cg3 s ARG 29 Cb 0.06 -1.59 -0.01 0.00 -1.56 0.00 0.00 34.95 31.85 3cg3 s ARG 29 CO -0.09 0.43 -0.19 -0.51 -0.81 0.00 0.00 175.30 174.12 3cg3 s LEU 30 N -0.45 2.37 -0.29 -0.88 1.43 -0.41 -4.77 118.68 115.68 3cg3 s LEU 30 Ca 0.07 -0.43 -0.08 0.00 -1.03 0.00 0.00 54.13 52.66 3cg3 s LEU 30 Cb -0.08 -1.49 -0.01 0.00 0.03 0.00 0.00 46.19 44.64 3cg3 s LEU 30 CO -0.01 0.19 0.10 -0.63 0.23 0.00 0.00 176.35 176.23 3cg3 s ILE 31 N 0.16 4.23 -0.15 -0.59 1.01 -1.26 -0.11 121.20 124.49 3cg3 s ILE 31 Ca -0.11 -0.47 0.01 0.00 0.00 0.00 0.00 60.65 60.09 3cg3 s ILE 31 Cb -0.16 -3.11 0.02 0.00 0.01 0.00 0.00 42.46 39.22 3cg3 s ILE 31 CO 0.06 0.15 -0.18 -0.63 0.00 0.00 0.00 174.94 174.34 3cg3 s ILE 32 N 1.56 1.84 -0.25 2.92 1.01 -0.82 -0.89 121.20 126.58 3cg3 s ILE 32 Ca 0.04 -0.83 -0.10 0.00 0.00 0.00 0.00 60.65 59.76 3cg3 s ILE 32 Cb -0.16 -1.67 -0.05 0.00 0.01 0.00 0.00 42.46 40.59 3cg3 s ILE 32 CO 0.04 0.51 0.16 -0.36 0.00 0.00 0.00 174.94 175.28 3cg3 s PHE 33 N 1.14 3.27 0.08 3.97 2.99 -0.50 -0.58 117.98 128.35 3cg3 s PHE 33 Ca -0.01 0.15 -0.10 0.00 0.00 0.00 0.00 56.93 56.97 3cg3 s PHE 33 Cb -0.14 -2.29 0.00 0.00 0.00 0.00 0.00 43.02 40.60 3cg3 s PHE 33 CO -0.07 -0.02 0.21 -3.38 -0.00 0.00 0.00 175.22 171.97 3cg3 s HIS 34 N 1.25 0.09 0.39 0.36 -3.43 -0.51 -1.82 115.29 111.62 3cg3 s HIS 34 Ca 0.07 -0.46 -0.25 0.00 -0.80 0.00 0.00 55.06 53.62 3cg3 s HIS 34 Cb -0.14 -0.02 -0.11 0.00 -1.43 0.00 0.00 32.58 30.88 3cg3 s HIS 34 CO 0.06 -0.53 1.08 0.00 -2.00 0.00 0.00 174.74 173.34 3cg3 n ALA 35 N 0.09 0.41 -0.07 -1.38 0.00 -0.42 -1.53 120.51 117.60 3cg3 n ALA 35 Ca -0.16 0.27 -0.00 0.00 0.00 0.00 0.00 53.44 53.55 3cg3 n ALA 35 Cb 0.62 -2.12 0.27 0.00 0.00 0.00 0.00 19.45 18.22 3cg3 n ALA 35 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3cg3 h GLY 36 N 1.79 0.75 2.00 0.00 0.00 -1.76 -2.35 103.07 103.50 3cg3 h GLY 36 Ca -0.44 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 46.50 3cg3 h GLY 36 CO 0.58 0.37 0.00 -1.14 0.00 0.00 0.00 176.54 176.35 3cg3 n SER 37 N -4.32 0.53 -0.06 0.19 3.41 -1.26 -1.64 113.62 110.47 3cg3 n SER 37 Ca 0.03 0.68 0.12 0.00 -0.26 0.00 0.00 58.87 59.44 3cg3 n SER 37 Cb 0.18 -0.77 0.29 0.00 -0.26 0.00 0.00 64.21 63.65 3cg3 n SER 37 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3cg3 n LEU 38 N -2.14 0.62 -0.21 1.04 4.77 -0.89 -4.55 117.00 115.65 3cg3 n LEU 38 Ca 0.01 -0.06 -0.06 0.00 -0.03 0.00 0.00 56.01 55.87 3cg3 n LEU 38 Cb 0.14 -0.22 -0.00 0.00 -2.33 0.00 0.00 43.42 41.01 3cg3 n LEU 38 CO 0.14 0.14 0.61 0.28 -1.33 0.00 0.00 177.39 177.24 3cg3 h SER 39 N 0.30 -1.25 0.56 -1.43 0.02 -1.39 -0.06 113.55 110.30 3cg3 h SER 39 Ca 0.00 0.23 -0.03 0.00 -0.84 0.00 0.00 61.79 61.16 3cg3 h SER 39 Cb 0.50 0.61 0.01 0.00 0.14 0.00 0.00 62.40 63.65 3cg3 h SER 39 CO 0.00 -0.31 -0.27 0.40 -1.14 0.00 0.00 176.83 175.51 3cg3 h ILE 40 N -0.17 0.37 -0.40 3.27 2.04 -1.82 -0.75 117.51 120.04 3cg3 h ILE 40 Ca 0.22 -0.27 -0.09 0.00 1.00 0.00 0.00 64.86 65.72 3cg3 h ILE 40 Cb 0.56 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 3cg3 h ILE 40 CO -0.69 0.04 -0.13 1.55 0.00 0.00 0.00 178.15 178.91 3cg3 h PRO 41 N -0.95 0.73 -0.75 2.37 0.13 -1.86 -2.80 132.00 128.88 3cg3 h PRO 41 Ca -0.08 -0.25 0.01 0.00 -0.87 0.00 0.00 66.00 64.82 3cg3 h PRO 41 Cb 0.64 -0.06 -0.04 0.00 0.13 0.00 0.00 31.00 31.67 3cg3 h PRO 41 CO 0.13 0.83 0.49 -0.07 -0.23 0.00 0.00 178.00 179.15 3cg3 h LEU 42 N 0.66 0.84 -1.44 1.56 3.38 -1.00 -0.59 115.31 118.73 3cg3 h LEU 42 Ca 0.11 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3cg3 h LEU 42 Cb 0.60 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 3cg3 h LEU 42 CO 0.04 0.61 0.35 0.77 0.09 0.00 0.00 178.44 180.29 3cg3 h SER 43 N 1.00 0.63 -0.04 -0.43 4.64 -0.88 0.69 113.55 119.16 3cg3 h SER 43 Ca 0.28 -0.02 -0.20 0.00 -0.47 0.00 0.00 61.79 61.37 3cg3 h SER 43 Cb -0.09 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 61.84 3cg3 h SER 43 CO -0.07 0.47 -0.72 1.56 -0.87 0.00 0.00 176.83 177.21 3cg3 h GLN 44 N 0.74 0.68 -0.49 4.77 4.20 -1.14 -2.34 115.11 121.52 3cg3 h GLN 44 Ca 0.20 -0.52 -0.06 0.00 0.06 0.00 0.00 58.65 58.32 3cg3 h GLN 44 Cb -0.06 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.80 3cg3 h GLN 44 CO -0.04 1.14 0.06 0.28 -0.67 0.00 0.00 178.83 179.61 3cg3 h VAL 45 N 0.48 1.25 -0.99 -0.54 2.07 -0.47 -2.36 116.25 115.68 3cg3 h VAL 45 Ca -0.03 -0.96 0.01 0.00 0.82 0.00 0.00 66.70 66.55 3cg3 h VAL 45 Cb 1.32 0.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.96 3cg3 h VAL 45 CO 0.14 0.34 0.65 -0.33 0.02 0.00 0.00 177.57 178.39 3cg3 h GLU 46 N 0.69 1.29 -0.09 1.57 5.08 -0.82 0.83 114.58 123.13 3cg3 h GLU 46 Ca 0.15 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3cg3 h GLU 46 Cb 0.42 -0.29 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 3cg3 h GLU 46 CO 0.01 0.85 0.05 0.93 -1.00 0.00 0.00 179.01 179.86 3cg3 h GLU 47 N 1.33 0.13 -0.24 2.33 5.08 -1.20 -1.53 114.58 120.49 3cg3 h GLU 47 Ca 0.37 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.64 3cg3 h GLU 47 Cb -0.13 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 3cg3 h GLU 47 CO -0.09 0.17 -0.18 0.87 -1.00 0.00 0.00 179.01 178.77 3cg3 h LYS 48 N 0.06 0.41 -0.09 2.33 1.57 -0.98 -2.72 116.57 117.16 3cg3 h LYS 48 Ca 0.03 -0.13 -0.09 0.00 -1.87 0.00 0.00 60.65 58.59 3cg3 h LYS 48 Cb 0.07 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 3cg3 h LYS 48 CO -0.01 0.59 -0.36 0.35 -0.57 0.00 0.00 179.45 179.45 3cg3 h PHE 49 N 0.38 0.22 -0.45 -1.35 3.57 -0.56 -2.01 116.94 116.74 3cg3 h PHE 49 Ca 0.07 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 3cg3 h PHE 49 Cb 0.54 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.21 3cg3 h PHE 49 CO 0.01 0.54 0.24 1.15 -2.23 0.00 0.00 178.31 178.02 3cg3 h THR 50 N 0.17 1.17 -0.26 4.41 2.02 -0.96 0.46 112.91 119.91 3cg3 h THR 50 Ca 0.02 -0.44 -0.02 0.00 0.77 0.00 0.00 66.41 66.73 3cg3 h THR 50 Cb 0.72 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 3cg3 h THR 50 CO 0.05 0.18 0.08 0.11 0.37 0.00 0.00 175.52 176.31 3cg3 h LYS 51 N 0.59 0.41 -0.49 6.66 1.57 -1.46 -2.59 116.57 121.25 3cg3 h LYS 51 Ca 0.16 -0.09 0.01 0.00 -1.87 0.00 0.00 60.65 58.85 3cg3 h LYS 51 Cb 0.07 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 3cg3 h LYS 51 CO -0.02 0.48 0.32 -0.92 -0.57 0.00 0.00 179.45 178.74 3cg3 h TYR 52 N 0.25 0.61 -1.00 -1.35 3.20 -1.06 -1.94 116.97 115.68 3cg3 h TYR 52 Ca 0.08 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.00 3cg3 h TYR 52 Cb 0.25 -0.21 -0.06 0.00 1.54 0.00 0.00 36.73 38.25 3cg3 h TYR 52 CO 0.01 0.39 0.66 0.00 -1.64 0.00 0.00 178.16 177.57 3cg3 h ALA 53 N 1.18 1.32 0.48 1.82 0.00 0.03 0.87 119.26 124.96 3cg3 h ALA 53 Ca 0.18 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3cg3 h ALA 53 Cb -0.08 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.36 3cg3 h ALA 53 CO -0.04 0.56 -0.23 0.37 0.00 0.00 0.00 179.25 179.91 3cg3 h GLN 54 N 1.27 -0.62 -0.77 0.00 5.75 -1.12 0.20 115.11 119.82 3cg3 h GLN 54 Ca 0.40 0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.93 3cg3 h GLN 54 Cb -0.01 0.14 -0.04 0.00 1.07 0.00 0.00 27.48 28.65 3cg3 h GLN 54 CO -0.12 -0.32 0.43 0.93 -2.65 0.00 0.00 178.83 177.09 3cg3 h GLU 55 N -1.00 1.06 0.00 1.69 5.08 -1.23 -0.26 114.58 119.93 3cg3 h GLU 55 Ca -0.07 -0.11 -0.28 0.00 -1.00 0.00 0.00 59.36 57.90 3cg3 h GLU 55 Cb 0.59 -0.21 -0.05 0.00 0.50 0.00 0.00 28.75 29.58 3cg3 h GLU 55 CO 0.11 0.77 -2.05 1.17 -1.00 0.00 0.00 179.01 178.01 3cg3 n LYS 56 N -4.36 1.41 0.00 2.33 4.81 0.29 -4.63 118.16 118.01 3cg3 n LYS 56 Ca 0.08 0.00 0.07 0.00 -0.87 0.00 0.00 58.31 57.59 3cg3 n LYS 56 Cb 0.09 -1.39 -0.06 0.00 0.02 0.00 0.00 35.03 33.70 3cg3 n LYS 56 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 3cg3 n LEU 57 N -2.61 0.91 -2.14 3.14 4.77 0.17 -4.99 117.00 116.24 3cg3 n LEU 57 Ca -0.26 -0.57 -0.18 0.00 -0.03 0.00 0.00 56.01 54.97 3cg3 n LEU 57 Cb 0.98 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 42.07 3cg3 n LEU 57 CO 0.31 0.20 -0.21 0.61 -1.33 0.00 0.00 177.39 176.97 3cg3 n GLY 58 N 1.27 -0.38 3.25 -0.72 0.00 0.48 -4.94 105.19 104.15 3cg3 n GLY 58 Ca 0.04 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 3cg3 n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3cg3 s VAL 59 N -2.93 1.94 -0.47 1.61 1.01 -0.78 -4.71 120.40 116.08 3cg3 s VAL 59 Ca 0.03 -1.01 -0.22 0.00 0.00 0.00 0.00 61.98 60.78 3cg3 s VAL 59 Cb -0.01 -1.64 0.03 0.00 0.00 0.00 0.00 36.38 34.76 3cg3 s VAL 59 CO 0.04 0.54 0.74 -0.75 0.00 0.00 0.00 175.10 175.67 3cg3 s LYS 60 N -0.22 3.31 -0.07 2.72 2.20 0.38 -2.77 119.74 125.29 3cg3 s LYS 60 Ca -0.01 -0.33 -0.02 0.00 -0.36 0.00 0.00 55.97 55.25 3cg3 s LYS 60 Cb -0.13 -3.98 -0.03 0.00 -1.51 0.00 0.00 37.83 32.17 3cg3 s LYS 60 CO 0.03 -1.16 0.03 0.08 -0.36 0.00 0.00 175.35 173.96 3cg3 s VAL 61 N 3.15 4.49 0.05 4.02 1.01 -1.26 -1.03 120.40 130.83 3cg3 s VAL 61 Ca 0.25 -0.26 0.04 0.00 0.00 0.00 0.00 61.98 62.02 3cg3 s VAL 61 Cb -0.14 -2.93 -0.03 0.00 0.00 0.00 0.00 36.38 33.28 3cg3 s VAL 61 CO 0.19 0.55 -0.12 0.42 0.00 0.00 0.00 175.10 176.14 3cg3 s THR 62 N -0.97 0.89 -0.08 3.92 -4.23 -0.85 -4.90 115.64 109.41 3cg3 s THR 62 Ca 0.15 -1.13 0.00 0.00 -1.18 0.00 0.00 61.69 59.54 3cg3 s THR 62 Cb -0.12 -0.87 -0.03 0.00 1.34 0.00 0.00 72.50 72.83 3cg3 s THR 62 CO 0.05 -0.23 -0.08 -0.36 -0.54 0.00 0.00 174.62 173.47 3cg3 s PHE 63 N -1.19 2.92 -0.82 3.99 0.40 -1.26 -1.29 117.98 120.72 3cg3 s PHE 63 Ca -0.04 -0.10 -0.01 0.00 -0.60 0.00 0.00 56.93 56.19 3cg3 s PHE 63 Cb -0.09 -1.75 0.20 0.00 0.51 0.00 0.00 43.02 41.89 3cg3 s PHE 63 CO 0.01 0.22 0.68 -1.14 0.70 0.00 0.00 175.22 175.69 3cg3 s GLN 64 N -0.53 3.03 -0.06 0.44 0.74 0.84 -4.93 119.66 119.18 3cg3 s GLN 64 Ca 0.08 -3.18 -0.18 0.00 0.05 0.00 0.00 55.36 52.13 3cg3 s GLN 64 Cb -0.12 -3.83 -0.05 0.00 1.10 0.00 0.00 33.01 30.11 3cg3 s GLN 64 CO 0.02 -1.25 0.48 0.34 -0.55 0.00 0.00 175.29 174.33 3cg3 s ASP 65 N -0.25 6.78 -0.20 6.67 -1.08 -1.26 -1.95 116.67 125.38 3cg3 s ASP 65 Ca 0.25 0.93 -0.01 0.00 -0.52 0.00 0.00 52.55 53.20 3cg3 s ASP 65 Cb -0.09 -2.29 0.06 0.00 -1.46 0.00 0.00 42.92 39.14 3cg3 s ASP 65 CO -0.12 0.12 -0.00 -1.61 0.52 0.00 0.00 175.17 174.08 3cg3 s GLU 66 N -0.05 1.04 -0.00 4.34 2.02 0.25 -4.96 118.70 121.34 3cg3 s GLU 66 Ca 0.26 -0.62 -0.17 0.00 0.02 0.00 0.00 54.97 54.46 3cg3 s GLU 66 Cb -0.16 -2.26 -0.06 0.00 0.10 0.00 0.00 34.13 31.75 3cg3 s GLU 66 CO 0.13 -0.61 0.48 0.00 0.02 0.00 0.00 175.26 175.28 3cg3 s ALA 67 N 1.68 3.60 0.24 5.21 0.00 -1.26 -1.42 121.76 129.82 3cg3 s ALA 67 Ca -0.03 -0.12 -0.21 0.00 0.00 0.00 0.00 51.96 51.61 3cg3 s ALA 67 Cb -0.18 -2.54 0.06 0.00 0.00 0.00 0.00 23.12 20.46 3cg3 s ALA 67 CO -0.07 0.33 0.92 -1.54 0.00 0.00 0.00 175.76 175.39 3cg3 s SER 68 N -0.65 -0.07 0.59 0.00 1.04 -0.58 -4.91 113.70 109.11 3cg3 s SER 68 Ca 0.26 -0.74 -0.20 0.00 0.48 0.00 0.00 55.95 55.76 3cg3 s SER 68 Cb -0.17 0.62 -0.03 0.00 0.10 0.00 0.00 66.02 66.53 3cg3 s SER 68 CO 0.15 -1.21 1.30 -0.83 0.98 0.00 0.00 173.24 173.63 3cg3 s GLY 69 N -3.15 2.85 0.41 7.32 0.00 -1.26 -2.06 107.32 111.44 3cg3 s GLY 69 Ca 0.17 1.21 0.07 0.00 0.00 0.00 0.00 44.72 46.17 3cg3 s GLY 69 CO 0.06 1.67 2.06 1.76 0.00 0.00 0.00 173.10 178.65 3cg3 h SER 70 N 1.06 0.46 -0.46 1.64 0.02 -1.84 -1.41 113.55 113.02 3cg3 h SER 70 Ca -0.51 -0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 60.37 3cg3 h SER 70 Cb 1.31 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.72 3cg3 h SER 70 CO 0.55 0.33 0.06 0.58 -1.14 0.00 0.00 176.83 177.21 3cg3 h VAL 71 N 0.55 1.25 -0.53 2.27 2.07 -1.60 -1.69 116.25 118.57 3cg3 h VAL 71 Ca 0.16 -0.94 -0.06 0.00 0.82 0.00 0.00 66.70 66.68 3cg3 h VAL 71 Cb -0.04 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 3cg3 h VAL 71 CO -0.03 0.33 0.10 0.50 0.02 0.00 0.00 177.57 178.48 3cg3 h LYS 72 N 0.63 0.83 -0.49 1.57 3.64 -1.16 -0.78 116.57 120.81 3cg3 h LYS 72 Ca 0.14 -0.18 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 3cg3 h LYS 72 Cb 0.41 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 3cg3 h LYS 72 CO 0.01 0.77 0.27 0.00 -2.27 0.00 0.00 179.45 178.24 3cg3 h ALA 73 N 1.31 0.63 -0.29 5.00 0.00 -0.92 -0.72 119.26 124.28 3cg3 h ALA 73 Ca 0.17 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3cg3 h ALA 73 Cb 0.34 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3cg3 h ALA 73 CO 0.00 0.14 -0.09 0.28 0.00 0.00 0.00 179.25 179.59 3cg3 h VAL 74 N 0.65 1.29 -0.06 0.00 2.07 -1.05 -3.02 116.25 116.13 3cg3 h VAL 74 Ca 0.17 -1.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.54 3cg3 h VAL 74 Cb 0.04 1.43 -0.00 0.00 -1.52 0.00 0.00 31.29 31.24 3cg3 h VAL 74 CO -0.03 0.36 -0.03 0.03 0.02 0.00 0.00 177.57 177.93 3cg3 h ARG 75 N 0.32 0.08 -0.51 1.57 3.08 -0.91 -0.91 114.38 117.11 3cg3 h ARG 75 Ca 0.07 -0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.15 3cg3 h ARG 75 Cb 0.58 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.59 3cg3 h ARG 75 CO 0.03 0.12 0.34 0.87 -1.07 0.00 0.00 179.97 180.26 3cg3 h LYS 76 N 0.08 0.55 0.00 0.04 1.57 -1.00 0.27 116.57 118.08 3cg3 h LYS 76 Ca 0.02 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.67 3cg3 h LYS 76 Cb 0.11 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 3cg3 h LYS 76 CO 0.00 0.37 -0.51 0.28 -0.57 0.00 0.00 179.45 179.02 3cg3 h VAL 77 N 0.57 1.39 0.04 0.50 2.07 -1.32 0.11 116.25 119.61 3cg3 h VAL 77 Ca 0.21 -2.24 -0.23 0.00 0.82 0.00 0.00 66.70 65.26 3cg3 h VAL 77 Cb 0.11 2.82 -0.01 0.00 -1.52 0.00 0.00 31.29 32.70 3cg3 h VAL 77 CO -0.05 0.47 -1.03 0.71 0.02 0.00 0.00 177.57 177.69 3cg3 h THR 78 N -1.00 1.55 0.00 2.57 1.35 -1.09 -3.10 112.91 113.19 3cg3 h THR 78 Ca -0.14 -2.96 -0.22 0.00 -0.55 0.00 0.00 66.41 62.55 3cg3 h THR 78 Cb 1.10 2.71 -0.04 0.00 -1.73 0.00 0.00 68.15 70.19 3cg3 h THR 78 CO -0.09 0.86 -1.83 0.47 -0.25 0.00 0.00 175.52 174.69 3cg3 n ASP 79 N -3.55 2.78 -0.47 5.36 8.00 0.85 -4.54 116.55 124.99 3cg3 n ASP 79 Ca -0.04 -0.07 0.13 0.00 0.71 0.00 0.00 54.79 55.52 3cg3 n ASP 79 Cb 0.91 -0.10 0.41 0.00 -0.02 0.00 0.00 41.12 42.31 3cg3 n ASP 79 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3cg3 n LEU 80 N -2.86 1.56 -3.24 0.64 4.77 -0.70 -4.95 117.00 112.22 3cg3 n LEU 80 Ca -0.25 -0.50 -0.22 0.00 -0.03 0.00 0.00 56.01 55.00 3cg3 n LEU 80 Cb 0.79 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.85 3cg3 n LEU 80 CO 0.16 0.27 -0.03 0.29 -1.33 0.00 0.00 177.39 176.74 3cg3 n LYS 81 N 0.06 -3.67 -2.20 3.23 4.76 -1.05 -4.94 118.16 114.35 3cg3 n LYS 81 Ca 0.16 0.57 -0.32 0.00 -2.87 0.00 0.00 58.31 55.85 3cg3 n LYS 81 Cb 0.39 -5.31 -0.01 0.00 -1.84 0.00 0.00 35.03 28.25 3cg3 n LYS 81 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 3cg3 s LYS 82 N -5.89 3.65 0.11 1.97 1.02 0.34 -4.98 119.74 115.95 3cg3 s LYS 82 Ca 0.36 1.04 -0.28 0.00 0.02 0.00 0.00 55.97 57.10 3cg3 s LYS 82 Cb -0.18 -2.09 -0.06 0.00 -0.52 0.00 0.00 37.83 34.98 3cg3 s LYS 82 CO 0.44 -0.52 0.90 0.50 -0.92 0.00 0.00 175.35 175.75 3cg3 s ARG 83 N -4.17 4.65 0.14 1.68 3.52 -1.26 -4.54 118.95 118.97 3cg3 s ARG 83 Ca 0.60 1.34 -0.24 0.00 -0.13 0.00 0.00 55.73 57.31 3cg3 s ARG 83 Cb -0.12 -3.36 0.07 0.00 -1.56 0.00 0.00 34.95 29.98 3cg3 s ARG 83 CO 0.36 0.27 0.62 0.00 -0.81 0.00 0.00 175.30 175.73 3cg3 s ALA 84 N -0.15 -1.62 -0.24 6.12 0.00 -1.26 -4.99 121.76 119.62 3cg3 s ALA 84 Ca 0.44 0.56 -0.06 0.00 0.00 0.00 0.00 51.96 52.90 3cg3 s ALA 84 Cb -0.23 0.82 -0.12 0.00 0.00 0.00 0.00 23.12 23.58 3cg3 s ALA 84 CO 0.28 -0.74 -0.27 -0.25 0.00 0.00 0.00 175.76 174.78 3cg3 n ASP 85 N -0.29 1.94 -4.09 0.00 8.00 -0.07 -4.22 116.55 117.81 3cg3 n ASP 85 Ca -0.17 0.12 -0.22 0.00 0.71 0.00 0.00 54.79 55.24 3cg3 n ASP 85 Cb 0.64 -0.57 -0.15 0.00 -0.02 0.00 0.00 41.12 41.02 3cg3 n ASP 85 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3cg3 s ILE 86 N -2.45 1.04 -0.12 0.53 1.01 -0.90 -0.96 121.20 119.34 3cg3 s ILE 86 Ca -0.33 -0.58 0.01 0.00 0.00 0.00 0.00 60.65 59.76 3cg3 s ILE 86 Cb 0.11 -0.87 0.02 0.00 0.01 0.00 0.00 42.46 41.73 3cg3 s ILE 86 CO 0.47 0.28 -0.14 -0.69 0.00 0.00 0.00 174.94 174.86 3cg3 s VAL 87 N -0.33 1.48 -0.12 2.92 1.01 -0.81 -1.41 120.40 123.14 3cg3 s VAL 87 Ca 0.05 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.44 3cg3 s VAL 87 Cb -0.05 -1.37 0.01 0.00 0.00 0.00 0.00 36.38 34.97 3cg3 s VAL 87 CO -0.00 0.44 -0.19 0.00 0.00 0.00 0.00 175.10 175.35 3cg3 s ALA 88 N 1.16 1.95 0.22 5.51 0.00 -0.76 -1.73 121.76 128.11 3cg3 s ALA 88 Ca -0.03 -0.89 0.11 0.00 0.00 0.00 0.00 51.96 51.14 3cg3 s ALA 88 Cb -0.14 -0.89 -0.05 0.00 0.00 0.00 0.00 23.12 22.04 3cg3 s ALA 88 CO -0.04 -0.02 -0.20 0.14 0.00 0.00 0.00 175.76 175.64 3cg3 s VAL 89 N 0.85 2.21 -1.25 0.00 -7.23 0.40 -1.30 120.40 114.07 3cg3 s VAL 89 Ca -0.08 -2.16 0.28 0.00 -1.81 0.00 0.00 61.98 58.20 3cg3 s VAL 89 Cb -0.15 -2.12 0.26 0.00 0.56 0.00 0.00 36.38 34.93 3cg3 s VAL 89 CO -0.01 -0.32 1.76 0.00 -0.31 0.00 0.00 175.10 176.23 3cg3 n ALA 90 N -0.12 2.84 -3.57 1.32 0.00 -1.26 -0.99 120.51 118.73 3cg3 n ALA 90 Ca -0.09 -0.23 -0.28 0.00 0.00 0.00 0.00 53.44 52.83 3cg3 n ALA 90 Cb 0.58 -1.32 -0.15 0.00 0.00 0.00 0.00 19.45 18.56 3cg3 n ALA 90 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3cg3 s ASP 91 N -2.80 3.32 0.55 0.00 -1.08 -1.25 -4.02 116.67 111.40 3cg3 s ASP 91 Ca 0.19 -1.17 0.30 0.00 -0.52 0.00 0.00 52.55 51.35 3cg3 s ASP 91 Cb 0.19 -0.37 1.46 0.00 -1.46 0.00 0.00 42.92 42.75 3cg3 s ASP 91 CO 0.56 -0.42 1.91 0.10 0.52 0.00 0.00 175.17 177.84 3cg3 h TYR 92 N 8.39 0.00 -0.97 -5.34 -0.00 -1.43 -2.34 116.97 115.28 3cg3 h TYR 92 Ca -0.19 0.00 0.30 0.00 0.00 0.00 0.00 58.73 58.85 3cg3 h TYR 92 Cb 1.04 0.00 -0.15 0.00 0.00 0.00 0.00 36.73 37.62 3cg3 h TYR 92 CO 0.27 0.00 0.47 1.15 -0.00 0.00 0.00 178.16 180.04 3cg3 h THR 93 N 0.00 0.27 -0.49 -0.90 2.02 -1.95 -1.16 112.91 110.71 3cg3 h THR 93 Ca 0.35 -0.09 0.09 0.00 0.77 0.00 0.00 66.41 67.53 3cg3 h THR 93 Cb 1.48 -0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 67.85 3cg3 h THR 93 CO -0.00 0.05 0.33 -0.07 0.37 0.00 0.00 175.52 176.20 3cg3 h LEU 94 N 0.26 0.24 0.54 2.58 3.38 -1.84 -2.00 115.31 118.48 3cg3 h LEU 94 Ca 0.69 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.64 3cg3 h LEU 94 Cb 1.55 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 42.26 3cg3 h LEU 94 CO -0.64 0.15 -0.26 0.40 0.09 0.00 0.00 178.44 178.18 3cg3 h ILE 95 N 0.27 0.00 0.00 1.22 2.04 -1.43 -1.03 117.51 118.58 3cg3 h ILE 95 Ca 0.22 -0.46 -0.05 0.00 1.00 0.00 0.00 64.86 65.57 3cg3 h ILE 95 Cb 0.53 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.60 3cg3 h ILE 95 CO -0.05 0.00 -0.23 1.55 0.00 0.00 0.00 178.15 179.42 3cg3 h PRO 96 N -1.18 0.00 -0.24 2.37 0.13 -1.69 0.12 132.00 131.51 3cg3 h PRO 96 Ca -0.07 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.94 3cg3 h PRO 96 Cb 0.55 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.67 3cg3 h PRO 96 CO 0.12 0.23 -0.34 0.37 -0.23 0.00 0.00 178.00 178.15 3cg3 h GLN 97 N 0.00 0.52 0.00 0.86 4.15 -1.36 -3.38 115.11 115.91 3cg3 h GLN 97 Ca -0.00 -0.24 0.00 0.00 0.77 0.00 0.00 58.65 59.18 3cg3 h GLN 97 Cb 0.43 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.11 3cg3 h GLN 97 CO 0.03 0.80 -0.55 1.28 -1.93 0.00 0.00 178.83 178.45 3cg3 n LEU 98 N -4.06 0.00 -0.00 -2.39 4.77 -0.39 -4.87 117.00 110.06 3cg3 n LEU 98 Ca -0.01 -0.13 0.05 0.00 -0.03 0.00 0.00 56.01 55.89 3cg3 n LEU 98 Cb 0.47 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.50 3cg3 n LEU 98 CO 0.44 0.00 -0.25 0.23 -1.33 0.00 0.00 177.39 176.48 3cg3 n MET 99 N -1.08 2.42 -4.14 3.23 2.81 0.40 -4.93 117.12 115.84 3cg3 n MET 99 Ca 0.00 -0.04 -0.35 0.00 -1.81 0.00 0.00 57.70 55.50 3cg3 n MET 99 Cb 0.00 -1.07 -0.09 0.00 -0.71 0.00 0.00 33.22 31.35 3cg3 n MET 99 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3cg3 s ILE 100 N -2.23 4.77 -1.97 2.02 1.01 -1.17 -0.35 121.20 123.28 3cg3 s ILE 100 Ca 0.01 -0.06 0.25 0.00 0.00 0.00 0.00 60.65 60.85 3cg3 s ILE 100 Cb 0.07 -3.07 0.20 0.00 0.01 0.00 0.00 42.46 39.67 3cg3 s ILE 100 CO 0.41 0.57 1.41 -0.81 0.00 0.00 0.00 174.94 176.52 3cg3 n PRO 101 N 2.46 1.10 -0.13 2.79 -0.04 -1.26 -4.93 135.00 134.99 3cg3 n PRO 101 Ca -0.18 -0.77 0.05 0.00 -0.04 0.00 0.00 63.50 62.56 3cg3 n PRO 101 Cb 0.54 -1.48 0.37 0.00 -0.04 0.00 0.00 33.50 32.88 3cg3 n PRO 101 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 3cg3 h ASN 102 N 1.87 0.62 0.00 3.54 -0.26 -1.93 -3.30 115.58 116.12 3cg3 h ASN 102 Ca 0.00 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.73 3cg3 h ASN 102 Cb 0.61 -0.14 0.00 0.00 -1.06 0.00 0.00 38.32 37.73 3cg3 h ASN 102 CO 0.00 0.42 -1.43 -1.22 -1.06 0.00 0.00 177.43 174.14 3cg3 n TYR 103 N -4.47 0.00 -3.60 1.19 4.02 0.52 -4.93 117.16 109.90 3cg3 n TYR 103 Ca 0.08 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.88 3cg3 n TYR 103 Cb 0.16 -0.22 -0.02 0.00 -0.02 0.00 0.00 39.34 39.24 3cg3 n TYR 103 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 176.86 175.77 3cg3 s THR 104 N -2.66 0.00 -0.04 -0.72 -1.32 -1.03 -0.42 115.64 109.45 3cg3 s THR 104 Ca -0.03 -0.38 0.05 0.00 -1.21 0.00 0.00 61.69 60.12 3cg3 s THR 104 Cb 0.06 -1.42 0.08 0.00 -1.51 0.00 0.00 72.50 69.72 3cg3 s THR 104 CO 0.40 0.00 0.95 -0.90 -2.21 0.00 0.00 174.62 172.86 3cg3 n ASP 105 N -0.39 1.44 -3.66 8.08 5.68 -1.26 -4.29 116.55 122.14 3cg3 n ASP 105 Ca -0.11 -2.12 -0.10 0.00 -0.50 0.00 0.00 54.79 51.97 3cg3 n ASP 105 Cb 0.62 -0.15 -0.02 0.00 -1.14 0.00 0.00 41.12 40.43 3cg3 n ASP 105 CO 0.00 0.00 0.00 0.72 -1.33 0.00 0.00 177.20 176.59 3cg3 s PHE 106 N -1.20 -0.30 0.08 2.11 -0.12 -1.26 -1.18 117.98 116.11 3cg3 s PHE 106 Ca 0.09 -0.04 -0.24 0.00 -0.05 0.00 0.00 56.93 56.70 3cg3 s PHE 106 Cb 0.08 0.57 0.06 0.00 -0.63 0.00 0.00 43.02 43.10 3cg3 s PHE 106 CO 0.01 -1.01 0.57 1.52 -0.05 0.00 0.00 175.22 176.26 3cg3 s TYR 107 N -3.85 -0.49 -0.08 3.49 -0.85 -0.83 -4.72 117.35 110.03 3cg3 s TYR 107 Ca 0.07 0.47 0.03 0.00 -0.52 0.00 0.00 57.07 57.12 3cg3 s TYR 107 Cb -0.03 0.43 0.01 0.00 0.38 0.00 0.00 41.96 42.75 3cg3 s TYR 107 CO -0.03 -0.73 -0.15 0.08 -1.52 0.00 0.00 175.55 173.20 3cg3 s VAL 108 N -2.88 1.38 -0.17 -3.49 1.01 -0.19 -1.15 120.40 114.91 3cg3 s VAL 108 Ca -0.03 -0.62 -0.20 0.00 0.00 0.00 0.00 61.98 61.13 3cg3 s VAL 108 Cb -0.00 -1.24 -0.03 0.00 0.00 0.00 0.00 36.38 35.11 3cg3 s VAL 108 CO -0.05 0.41 0.58 -0.76 0.00 0.00 0.00 175.10 175.28 3cg3 s LEU 109 N 0.61 4.18 0.00 3.92 1.02 0.11 -1.28 118.68 127.24 3cg3 s LEU 109 Ca -0.15 0.82 0.00 0.00 0.02 0.00 0.00 54.13 54.81 3cg3 s LEU 109 Cb -0.16 -2.82 0.00 0.00 0.02 0.00 0.00 46.19 43.22 3cg3 s LEU 109 CO 0.05 -0.19 0.00 2.22 0.02 0.00 0.00 176.35 178.45 3cg3 n PHE 110 N 4.65 0.00 -3.87 0.29 1.16 -0.58 -1.26 117.46 117.85 3cg3 n PHE 110 Ca -0.03 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.46 3cg3 n PHE 110 Cb 0.50 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 38.34 3cg3 n PHE 110 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3cg3 s ALA 111 N -0.23 -0.76 0.19 1.98 0.00 -1.26 -1.02 121.76 120.67 3cg3 s ALA 111 Ca 0.00 -0.49 0.03 0.00 0.00 0.00 0.00 51.96 51.49 3cg3 s ALA 111 Cb 0.00 0.93 -0.01 0.00 0.00 0.00 0.00 23.12 24.04 3cg3 s ALA 111 CO 0.00 -0.89 0.10 -2.37 0.00 0.00 0.00 175.76 172.59 3cg3 n THR 112 N -0.39 0.00 -3.86 0.00 5.66 -1.26 -0.47 114.28 113.96 3cg3 n THR 112 Ca -0.05 -1.21 -0.01 0.00 -3.05 0.00 0.00 64.05 59.73 3cg3 n THR 112 Cb 0.61 0.50 0.01 0.00 -1.55 0.00 0.00 70.33 69.90 3cg3 n THR 112 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 3cg3 n ASN 113 N -1.99 -1.16 -3.78 1.09 2.85 -1.23 -4.85 115.26 106.19 3cg3 n ASN 113 Ca -0.00 -1.50 -0.11 0.00 -0.11 0.00 0.00 54.58 52.86 3cg3 n ASN 113 Cb 0.31 1.86 -0.07 0.00 1.24 0.00 0.00 39.78 43.12 3cg3 n ASN 113 CO 0.00 0.00 0.00 -1.83 -2.11 0.00 0.00 177.26 173.32 3cg3 s GLU 114 N -2.03 0.81 -0.08 1.20 -1.05 -1.26 -4.16 118.70 112.13 3cg3 s GLU 114 Ca 0.20 -0.61 -0.17 0.00 -0.15 0.00 0.00 54.97 54.23 3cg3 s GLU 114 Cb -0.02 0.35 -0.05 0.00 -0.44 0.00 0.00 34.13 33.97 3cg3 s GLU 114 CO 0.02 -0.26 0.46 0.42 0.95 0.00 0.00 175.26 176.85 3cg3 s ILE 115 N -2.83 5.12 0.35 1.83 -1.09 -0.43 -1.24 121.20 122.91 3cg3 s ILE 115 Ca -0.03 0.93 0.03 0.00 -2.23 0.00 0.00 60.65 59.35 3cg3 s ILE 115 Cb 0.00 -3.79 -0.04 0.00 -1.58 0.00 0.00 42.46 37.05 3cg3 s ILE 115 CO -0.05 0.41 0.09 0.68 -1.23 0.00 0.00 174.94 174.84 3cg3 s VAL 116 N 0.08 0.83 -0.22 2.92 -7.23 -0.18 -4.36 120.40 112.24 3cg3 s VAL 116 Ca 0.25 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.38 3cg3 s VAL 116 Cb -0.16 -2.58 -0.01 0.00 0.56 0.00 0.00 36.38 34.19 3cg3 s VAL 116 CO 0.11 0.00 -0.03 -0.63 -0.31 0.00 0.00 175.10 174.24 3cg3 s ILE 117 N -3.34 3.45 0.19 -0.62 1.01 -0.99 -1.98 121.20 118.92 3cg3 s ILE 117 Ca 0.31 -0.47 0.07 0.00 0.00 0.00 0.00 60.65 60.56 3cg3 s ILE 117 Cb 0.06 -2.58 -0.04 0.00 0.01 0.00 0.00 42.46 39.91 3cg3 s ILE 117 CO 0.15 0.41 0.08 0.00 0.00 0.00 0.00 174.94 175.57 3cg3 s ALA 118 N 1.49 3.39 0.05 9.38 0.00 -0.23 -1.24 121.76 134.60 3cg3 s ALA 118 Ca 0.06 -1.33 -0.07 0.00 0.00 0.00 0.00 51.96 50.61 3cg3 s ALA 118 Cb -0.14 -1.16 0.02 0.00 0.00 0.00 0.00 23.12 21.84 3cg3 s ALA 118 CO -0.03 0.45 0.33 1.97 0.00 0.00 0.00 175.76 178.48 3cg3 n PHE 119 N -0.39 -0.72 -4.36 0.00 1.16 0.34 -1.50 117.46 112.00 3cg3 n PHE 119 Ca -0.09 -0.37 -0.20 0.00 -1.87 0.00 0.00 57.45 54.92 3cg3 n PHE 119 Cb 0.56 0.18 -0.09 0.00 -1.61 0.00 0.00 39.48 38.52 3cg3 n PHE 119 CO 0.00 0.00 0.00 0.95 -1.87 0.00 0.00 176.76 175.84 3cg3 s THR 120 N -2.37 0.28 -0.26 1.97 -4.23 -1.26 -0.20 115.64 109.57 3cg3 s THR 120 Ca 0.07 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.83 3cg3 s THR 120 Cb -0.01 -2.47 0.25 0.00 1.34 0.00 0.00 72.50 71.61 3cg3 s THR 120 CO 0.01 0.00 1.73 -0.55 -0.54 0.00 0.00 174.62 175.27 3cg3 h ASN 121 N 2.11 0.00 1.25 3.99 -0.00 -1.98 -1.83 115.58 119.12 3cg3 h ASN 121 Ca -0.31 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 55.99 3cg3 h ASN 121 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.57 3cg3 h ASN 121 CO 0.48 0.00 -0.46 0.11 -0.00 0.00 0.00 177.43 177.57 3cg3 h LYS 122 N 0.00 0.00 -6.86 4.14 1.57 -1.95 -3.46 116.57 110.01 3cg3 h LYS 122 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 3cg3 h LYS 122 Cb 0.17 0.00 0.07 0.00 0.08 0.00 0.00 32.23 32.55 3cg3 h LYS 122 CO 0.00 0.00 0.70 -1.12 -0.57 0.00 0.00 179.45 178.46 3cg3 s SER 123 N -4.94 6.66 0.20 0.86 0.01 -0.69 -4.92 113.70 110.88 3cg3 s SER 123 Ca 0.06 2.75 -0.32 0.00 1.31 0.00 0.00 55.95 59.75 3cg3 s SER 123 Cb 0.11 -2.65 -0.13 0.00 0.21 0.00 0.00 66.02 63.56 3cg3 s SER 123 CO 0.70 -0.64 1.66 1.17 0.41 0.00 0.00 173.24 176.54 3cg3 n LYS 124 N 1.12 2.57 -1.64 12.44 4.81 -1.26 -1.52 118.16 134.68 3cg3 n LYS 124 Ca 0.02 0.93 -0.15 0.00 -0.87 0.00 0.00 58.31 58.24 3cg3 n LYS 124 Cb 0.41 -2.74 -0.05 0.00 0.02 0.00 0.00 35.03 32.67 3cg3 n LYS 124 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3cg3 n TYR 125 N 3.63 -0.17 -0.20 5.64 0.53 -1.26 -4.92 117.16 120.40 3cg3 n TYR 125 Ca 0.16 0.00 -0.02 0.00 -1.02 0.00 0.00 57.90 57.01 3cg3 n TYR 125 Cb 0.33 -2.70 0.08 0.00 -1.03 0.00 0.00 39.34 36.02 3cg3 n TYR 125 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 3cg3 h ALA 126 N 0.17 0.79 -0.72 -0.72 0.00 -1.58 0.25 119.26 117.45 3cg3 h ALA 126 Ca -0.31 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 3cg3 h ALA 126 Cb 1.03 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 3cg3 h ALA 126 CO 0.43 -0.05 0.36 0.22 0.00 0.00 0.00 179.25 180.21 3cg3 h ASP 127 N 0.56 0.94 -0.64 0.00 1.82 -1.91 -0.98 116.42 116.22 3cg3 h ASP 127 Ca 0.27 -0.13 -0.06 0.00 -0.39 0.00 0.00 57.03 56.73 3cg3 h ASP 127 Cb 0.21 -0.24 -0.03 0.00 0.68 0.00 0.00 39.33 39.95 3cg3 h ASP 127 CO -0.20 0.80 0.17 -0.08 -1.61 0.00 0.00 179.24 178.32 3cg3 h GLU 128 N 1.01 1.01 -0.46 0.28 4.81 -1.78 -1.57 114.58 117.87 3cg3 h GLU 128 Ca 0.25 -0.23 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 3cg3 h GLU 128 Cb 0.10 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 3cg3 h GLU 128 CO -0.03 0.90 0.25 1.98 -0.73 0.00 0.00 179.01 181.38 3cg3 h MET 129 N 0.93 0.65 -0.60 1.92 4.05 -0.55 -0.26 114.93 121.07 3cg3 h MET 129 Ca 0.20 -0.08 -0.04 0.00 -0.28 0.00 0.00 59.70 59.50 3cg3 h MET 129 Cb 0.33 -0.13 -0.03 0.00 -0.80 0.00 0.00 31.60 30.98 3cg3 h MET 129 CO -0.00 0.52 0.20 -0.07 0.23 0.00 0.00 176.91 177.79 3cg3 h LEU 130 N 0.61 0.83 -0.20 3.39 3.38 -1.00 -2.53 115.31 119.79 3cg3 h LEU 130 Ca 0.16 -0.13 -0.15 0.00 0.09 0.00 0.00 57.88 57.85 3cg3 h LEU 130 Cb 0.06 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 3cg3 h LEU 130 CO -0.03 0.77 -0.72 0.11 0.09 0.00 0.00 178.44 178.67 3cg3 h LYS 131 N 0.88 0.00 -2.09 1.13 1.57 -0.93 -3.37 116.57 113.76 3cg3 h LYS 131 Ca 0.20 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.45 3cg3 h LYS 131 Cb 0.23 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.13 3cg3 h LYS 131 CO -0.01 0.72 -0.99 0.09 -0.57 0.00 0.00 179.45 178.69 3cg3 n ASN 132 N -3.38 1.97 0.11 0.86 3.02 -0.14 -4.95 115.26 112.75 3cg3 n ASN 132 Ca 0.01 -3.19 0.19 0.00 -0.03 0.00 0.00 54.58 51.56 3cg3 n ASN 132 Cb 0.78 -0.61 0.76 0.00 -0.61 0.00 0.00 39.78 40.11 3cg3 n ASN 132 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3cg3 h PRO 133 N 3.21 0.00 0.00 3.52 0.13 -1.64 -0.78 132.00 136.44 3cg3 h PRO 133 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3cg3 h PRO 133 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 3cg3 h PRO 133 CO 0.61 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.13 3cg3 n ASP 134 N -3.87 0.16 -1.42 1.44 8.00 -1.26 -2.37 116.55 117.24 3cg3 n ASP 134 Ca 0.06 0.53 0.00 0.00 0.71 0.00 0.00 54.79 56.10 3cg3 n ASP 134 Cb 0.52 -0.57 0.27 0.00 -0.02 0.00 0.00 41.12 41.32 3cg3 n ASP 134 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3cg3 n LYS 135 N -1.67 3.12 -0.35 -1.24 4.76 -0.30 -4.68 118.16 117.79 3cg3 n LYS 135 Ca 0.04 -3.02 0.14 0.00 -2.87 0.00 0.00 58.31 52.59 3cg3 n LYS 135 Cb 0.22 -2.01 0.33 0.00 -1.84 0.00 0.00 35.03 31.73 3cg3 n LYS 135 CO 0.00 0.00 0.00 0.11 -1.37 0.00 0.00 177.40 176.14 3cg3 h TRP 136 N 2.08 1.04 0.00 2.13 5.08 -1.60 -0.92 115.95 123.77 3cg3 h TRP 136 Ca 0.15 0.03 0.00 0.00 1.08 0.00 0.00 58.89 60.15 3cg3 h TRP 136 Cb 1.86 -0.31 0.00 0.00 -3.00 0.00 0.00 29.16 27.72 3cg3 h TRP 136 CO 0.94 0.19 0.00 0.10 -1.28 0.00 0.00 178.44 178.39 3cg3 h TYR 137 N 0.71 0.00 0.23 0.12 -0.00 -1.87 -1.73 116.97 114.43 3cg3 h TYR 137 Ca 0.59 0.00 -0.33 0.00 0.00 0.00 0.00 58.73 58.99 3cg3 h TYR 137 Cb 0.97 0.00 0.04 0.00 0.00 0.00 0.00 36.73 37.74 3cg3 h TYR 137 CO -0.01 0.00 -1.44 0.93 -0.00 0.00 0.00 178.16 177.64 3cg3 h GLU 138 N 0.00 0.56 -0.48 0.10 5.08 -1.54 -2.73 114.58 115.58 3cg3 h GLU 138 Ca 0.00 -0.92 -0.11 0.00 -1.00 0.00 0.00 59.36 57.33 3cg3 h GLU 138 Cb 0.54 0.33 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 3cg3 h GLU 138 CO 0.00 1.44 -0.13 0.82 -1.00 0.00 0.00 179.01 180.14 3cg3 h ILE 139 N 0.17 1.27 0.00 3.13 2.04 -1.30 -2.59 117.51 120.24 3cg3 h ILE 139 Ca -0.25 -1.26 0.00 0.00 1.00 0.00 0.00 64.86 64.35 3cg3 h ILE 139 Cb 2.12 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 39.30 3cg3 h ILE 139 CO 0.27 0.44 0.00 -0.07 0.00 0.00 0.00 178.15 178.79 3cg3 h LEU 140 N 0.78 0.00 0.00 1.44 3.38 -1.38 -2.31 115.31 117.22 3cg3 h LEU 140 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3cg3 h LEU 140 Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 3cg3 h LEU 140 CO 0.05 0.00 -0.23 -1.20 0.09 0.00 0.00 178.44 177.15 3cg3 n SER 141 N -2.56 0.26 -4.74 -0.43 7.64 -0.99 -4.88 113.62 107.92 3cg3 n SER 141 Ca 0.01 0.17 -0.41 0.00 1.01 0.00 0.00 58.87 59.65 3cg3 n SER 141 Cb 0.26 -0.17 -0.03 0.00 -1.01 0.00 0.00 64.21 63.26 3cg3 n SER 141 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3cg3 s ARG 142 N -3.01 4.42 0.51 1.43 0.52 -0.87 -4.93 118.95 117.02 3cg3 s ARG 142 Ca 0.12 2.03 0.20 0.00 -0.52 0.00 0.00 55.73 57.56 3cg3 s ARG 142 Cb 0.18 -3.19 1.31 0.00 0.52 0.00 0.00 34.95 33.77 3cg3 s ARG 142 CO 0.61 -0.19 2.10 -1.00 0.02 0.00 0.00 175.30 176.84 3cg3 h PRO 143 N 5.06 0.00 -0.09 3.54 0.13 -1.89 -2.44 132.00 136.31 3cg3 h PRO 143 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3cg3 h PRO 143 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 3cg3 h PRO 143 CO 0.75 0.09 0.00 -0.40 -0.23 0.00 0.00 178.00 178.21 3cg3 n ASP 144 N -4.16 1.04 -4.68 1.44 5.75 -1.26 -4.84 116.55 109.84 3cg3 n ASP 144 Ca -0.03 -1.56 -0.35 0.00 -0.01 0.00 0.00 54.79 52.85 3cg3 n ASP 144 Cb 0.17 -0.06 -0.09 0.00 -1.03 0.00 0.00 41.12 40.11 3cg3 n ASP 144 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3cg3 s VAL 145 N -1.89 4.49 -0.02 2.12 1.01 -0.92 -5.03 120.40 120.17 3cg3 s VAL 145 Ca 0.32 -0.17 0.01 0.00 0.00 0.00 0.00 61.98 62.15 3cg3 s VAL 145 Cb 0.17 -2.93 -0.03 0.00 0.00 0.00 0.00 36.38 33.58 3cg3 s VAL 145 CO 0.26 0.57 -0.03 -0.94 0.00 0.00 0.00 175.10 174.97 3cg3 s SER 146 N -0.57 4.94 0.08 3.32 1.04 -1.26 -4.85 113.70 116.39 3cg3 s SER 146 Ca 0.10 -0.03 -0.09 0.00 0.48 0.00 0.00 55.95 56.41 3cg3 s SER 146 Cb -0.12 -1.26 -0.00 0.00 0.10 0.00 0.00 66.02 64.74 3cg3 s SER 146 CO 0.02 0.30 0.19 0.72 0.98 0.00 0.00 173.24 175.45 3cg3 s PHE 147 N -1.00 0.13 0.14 5.02 -0.12 -0.84 -2.24 117.98 119.08 3cg3 s PHE 147 Ca 0.17 -0.52 -0.02 0.00 -0.05 0.00 0.00 56.93 56.51 3cg3 s PHE 147 Cb -0.11 -0.06 -0.03 0.00 -0.63 0.00 0.00 43.02 42.19 3cg3 s PHE 147 CO 0.07 -0.52 0.10 0.20 -0.05 0.00 0.00 175.22 175.03 3cg3 s GLY 148 N -2.68 0.94 0.11 1.99 0.00 -0.18 -1.24 107.32 106.26 3cg3 s GLY 148 Ca 0.03 -1.39 -0.21 0.00 0.00 0.00 0.00 44.72 43.14 3cg3 s GLY 148 CO -0.09 -1.28 0.53 -0.11 0.00 0.00 0.00 173.10 172.15 3cg3 s PHE 149 N -4.05 -0.42 0.75 1.90 -0.12 -0.98 -1.99 117.98 113.07 3cg3 s PHE 149 Ca 0.24 0.30 -0.11 0.00 -0.05 0.00 0.00 56.93 57.31 3cg3 s PHE 149 Cb 0.07 0.41 0.05 0.00 -0.63 0.00 0.00 43.02 42.91 3cg3 s PHE 149 CO 0.02 -0.74 1.13 -1.54 -0.05 0.00 0.00 175.22 174.05 3cg3 s SER 150 N -2.44 4.99 -0.15 1.98 1.04 -1.26 -3.60 113.70 114.26 3cg3 s SER 150 Ca -0.01 0.93 -0.29 0.00 0.48 0.00 0.00 55.95 57.06 3cg3 s SER 150 Cb -0.00 -1.58 -0.04 0.00 0.10 0.00 0.00 66.02 64.49 3cg3 s SER 150 CO -0.08 -1.60 1.76 -0.62 0.98 0.00 0.00 173.24 173.68 3cg3 s ASP 151 N -4.47 6.30 0.49 7.02 -1.08 -0.37 -4.20 116.67 120.37 3cg3 s ASP 151 Ca 0.60 1.92 0.19 0.00 -0.52 0.00 0.00 52.55 54.74 3cg3 s ASP 151 Cb -0.11 -2.53 1.24 0.00 -1.46 0.00 0.00 42.92 40.06 3cg3 s ASP 151 CO 0.50 -1.28 2.02 -0.65 0.52 0.00 0.00 175.17 176.28 3cg3 h PRO 152 N 11.15 0.14 0.00 4.34 0.11 -1.80 0.22 132.00 146.15 3cg3 h PRO 152 Ca -0.38 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.72 3cg3 h PRO 152 Cb 1.18 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3cg3 h PRO 152 CO 0.98 0.09 0.00 -0.91 -0.21 0.00 0.00 178.00 177.95 3cg3 h ASN 153 N 0.14 0.00 0.00 -2.05 2.35 -1.92 -3.33 115.58 110.78 3cg3 h ASN 153 Ca 0.21 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.94 3cg3 h ASN 153 Cb 0.65 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.01 3cg3 h ASN 153 CO -0.03 0.00 -1.14 0.00 -1.65 0.00 0.00 177.43 174.62 3cg3 n GLN 154 N -2.49 1.87 -3.86 0.81 6.02 -0.31 -4.61 117.38 114.81 3cg3 n GLN 154 Ca 0.02 -0.01 -0.19 0.00 -0.01 0.00 0.00 57.00 56.81 3cg3 n GLN 154 Cb 0.29 -1.06 -0.17 0.00 1.02 0.00 0.00 30.24 30.32 3cg3 n GLN 154 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3cg3 s ASP 155 N -2.79 0.80 0.42 1.08 2.15 -0.09 -1.53 116.67 116.70 3cg3 s ASP 155 Ca -0.01 -0.02 0.12 0.00 0.43 0.00 0.00 52.55 53.06 3cg3 s ASP 155 Cb 0.01 -0.26 0.95 0.00 -0.30 0.00 0.00 42.92 43.32 3cg3 s ASP 155 CO 0.10 -0.14 1.98 -0.65 -0.17 0.00 0.00 175.17 176.29 3cg3 h PRO 156 N 7.66 0.48 -0.92 4.34 0.11 -1.87 0.12 132.00 141.93 3cg3 h PRO 156 Ca -0.33 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.78 3cg3 h PRO 156 Cb 1.13 -0.11 -0.05 0.00 0.11 0.00 0.00 31.00 32.08 3cg3 h PRO 156 CO 0.38 0.32 0.61 0.00 -0.21 0.00 0.00 178.00 179.09 3cg3 h GLY 158 N 1.20 0.28 2.00 0.00 0.00 -1.17 -0.37 103.07 105.01 3cg3 h GLY 158 Ca 0.35 -0.25 -0.09 0.00 0.00 0.00 0.00 47.33 47.34 3cg3 h GLY 158 CO -0.09 0.23 -0.42 0.10 0.00 0.00 0.00 176.54 176.35 3cg3 h TYR 159 N -0.07 0.00 -0.28 5.60 -0.00 -1.01 -2.54 116.97 118.67 3cg3 h TYR 159 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 58.73 58.62 3cg3 h TYR 159 Cb 0.50 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.22 3cg3 h TYR 159 CO 0.06 0.42 -0.39 0.00 -0.00 0.00 0.00 178.16 178.26 3cg3 h ARG 160 N 0.00 0.65 -0.53 0.10 3.08 -0.28 -1.45 114.38 115.96 3cg3 h ARG 160 Ca -0.00 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.72 3cg3 h ARG 160 Cb 0.83 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.85 3cg3 h ARG 160 CO 0.05 0.93 0.34 0.77 -1.07 0.00 0.00 179.97 181.00 3cg3 h SER 161 N 0.54 0.61 -0.44 7.04 0.02 -0.66 0.50 113.55 121.16 3cg3 h SER 161 Ca 0.05 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 3cg3 h SER 161 Cb 0.91 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.27 3cg3 h SER 161 CO 0.08 0.45 0.11 0.58 -1.14 0.00 0.00 176.83 176.91 3cg3 h VAL 162 N 0.71 1.23 -0.41 2.27 2.07 -1.40 -2.07 116.25 118.66 3cg3 h VAL 162 Ca 0.19 -0.81 -0.06 0.00 0.82 0.00 0.00 66.70 66.84 3cg3 h VAL 162 Cb -0.07 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 3cg3 h VAL 162 CO -0.04 0.29 0.01 0.24 0.02 0.00 0.00 177.57 178.09 3cg3 h MET 163 N 0.58 0.65 -0.73 1.57 2.07 -0.60 -2.09 114.93 116.39 3cg3 h MET 163 Ca 0.14 -0.15 -0.03 0.00 -2.07 0.00 0.00 59.70 57.59 3cg3 h MET 163 Cb 0.32 -0.09 -0.03 0.00 -1.87 0.00 0.00 31.60 29.93 3cg3 h MET 163 CO 0.00 0.66 0.32 0.28 1.07 0.00 0.00 176.91 179.24 3cg3 h VAL 164 N 0.61 1.24 -0.02 -2.22 2.07 0.35 0.23 116.25 118.51 3cg3 h VAL 164 Ca 0.13 -0.71 -0.10 0.00 0.82 0.00 0.00 66.70 66.83 3cg3 h VAL 164 Cb 0.37 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 3cg3 h VAL 164 CO 0.01 0.30 -0.48 0.24 0.02 0.00 0.00 177.57 177.66 3cg3 h MET 165 N 1.04 0.05 -0.18 1.57 2.86 -0.92 0.81 114.93 120.16 3cg3 h MET 165 Ca 0.25 -0.02 -0.10 0.00 -2.06 0.00 0.00 59.70 57.76 3cg3 h MET 165 Cb 0.15 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.81 3cg3 h MET 165 CO -0.03 0.52 -0.28 -0.22 1.06 0.00 0.00 176.91 177.96 3cg3 h LYS 166 N 0.04 0.51 -0.25 1.72 1.63 -0.72 -1.89 116.57 117.61 3cg3 h LYS 166 Ca -0.00 -0.31 -0.04 0.00 -0.85 0.00 0.00 60.65 59.46 3cg3 h LYS 166 Cb 0.86 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.50 3cg3 h LYS 166 CO 0.06 0.90 -0.01 -0.07 -3.45 0.00 0.00 179.45 176.88 3cg3 h LEU 167 N 0.16 0.34 -0.63 5.20 3.38 -0.74 -1.61 115.31 121.42 3cg3 h LEU 167 Ca 0.02 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 3cg3 h LEU 167 Cb 0.86 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 3cg3 h LEU 167 CO 0.06 0.41 0.15 0.00 0.09 0.00 0.00 178.44 179.16 3cg3 h ALA 168 N 1.63 0.83 -0.47 1.53 0.00 -0.66 0.29 119.26 122.43 3cg3 h ALA 168 Ca 0.08 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3cg3 h ALA 168 Cb 0.27 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3cg3 h ALA 168 CO 0.01 0.55 0.30 1.49 0.00 0.00 0.00 179.25 181.60 3cg3 h GLU 169 N 0.93 0.62 -0.45 0.00 4.81 -0.48 0.35 114.58 120.36 3cg3 h GLU 169 Ca 0.20 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.25 3cg3 h GLU 169 Cb 0.37 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 3cg3 h GLU 169 CO 0.00 0.41 -0.26 -0.07 -0.73 0.00 0.00 179.01 178.37 3cg3 h LEU 170 N 0.63 0.98 0.11 1.64 3.38 -0.98 -1.56 115.31 119.51 3cg3 h LEU 170 Ca 0.17 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 3cg3 h LEU 170 Cb -0.06 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.42 3cg3 h LEU 170 CO -0.04 1.18 -0.05 0.22 0.09 0.00 0.00 178.44 179.84 3cg3 h TYR 171 N 0.81 -0.13 0.00 1.13 3.20 -0.13 -3.33 116.97 118.52 3cg3 h TYR 171 Ca 0.10 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 3cg3 h TYR 171 Cb 0.83 0.04 -0.00 0.00 1.54 0.00 0.00 36.73 39.14 3cg3 h TYR 171 CO 0.05 0.34 -0.21 1.88 -1.64 0.00 0.00 178.16 178.58 3cg3 h TYR 172 N -0.70 0.00 -0.59 -3.82 -1.99 -1.05 -3.48 116.97 105.34 3cg3 h TYR 172 Ca -0.01 0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.61 3cg3 h TYR 172 Cb 0.53 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.25 3cg3 h TYR 172 CO 0.09 0.04 -0.13 0.41 -0.00 0.00 0.00 178.16 178.58 3cg3 n GLY 173 N 1.12 0.38 3.28 3.88 0.00 -0.59 -5.04 105.19 108.22 3cg3 n GLY 173 Ca 0.03 -0.71 -0.25 0.00 0.00 0.00 0.00 46.02 45.09 3cg3 n GLY 173 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3cg3 s ARG 174 N -3.63 1.26 0.00 1.61 0.52 -1.22 -5.05 118.95 112.45 3cg3 s ARG 174 Ca 0.00 -1.09 -0.02 0.00 -0.52 0.00 0.00 55.73 54.10 3cg3 s ARG 174 Cb 0.00 -1.48 -0.09 0.00 0.52 0.00 0.00 34.95 33.89 3cg3 s ARG 174 CO 0.00 0.36 1.60 -0.35 0.02 0.00 0.00 175.30 176.93 3cg3 n PRO 175 N 1.39 0.71 -0.18 3.54 -0.04 -1.26 -4.30 135.00 134.86 3cg3 n PRO 175 Ca -0.18 -0.35 -0.10 0.00 -0.04 0.00 0.00 63.50 62.83 3cg3 n PRO 175 Cb 0.53 -1.67 0.01 0.00 -0.04 0.00 0.00 33.50 32.33 3cg3 n PRO 175 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 3cg3 h ILE 176 N 2.63 1.27 -0.40 0.52 2.04 -1.90 -1.26 117.51 120.40 3cg3 h ILE 176 Ca 0.07 -1.14 -0.15 0.00 1.00 0.00 0.00 64.86 64.64 3cg3 h ILE 176 Cb 0.54 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 3cg3 h ILE 176 CO 0.40 0.40 -0.32 0.15 0.00 0.00 0.00 178.15 178.79 3cg3 h PHE 177 N 0.82 1.10 -0.72 1.37 3.57 -1.81 0.10 116.94 121.36 3cg3 h PHE 177 Ca 0.15 -0.31 -0.04 0.00 3.53 0.00 0.00 57.97 61.29 3cg3 h PHE 177 Cb 0.57 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 39.04 3cg3 h PHE 177 CO 0.04 1.13 0.28 0.87 -2.23 0.00 0.00 178.31 178.39 3cg3 h LYS 178 N 0.75 1.09 -0.04 1.11 1.57 -1.90 -0.55 116.57 118.59 3cg3 h LYS 178 Ca 0.08 -0.21 -0.18 0.00 -1.87 0.00 0.00 60.65 58.47 3cg3 h LYS 178 Cb 0.90 -0.17 0.01 0.00 0.08 0.00 0.00 32.23 33.05 3cg3 h LYS 178 CO 0.08 0.90 -0.67 1.49 -0.57 0.00 0.00 179.45 180.69 3cg3 h GLU 179 N 1.04 0.53 0.00 3.15 4.57 -1.11 -1.83 114.58 120.93 3cg3 h GLU 179 Ca 0.24 -0.51 -0.14 0.00 -1.18 0.00 0.00 59.36 57.76 3cg3 h GLU 179 Cb 0.23 0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.93 3cg3 h GLU 179 CO -0.02 1.14 -1.45 1.28 -1.18 0.00 0.00 179.01 178.79 3cg3 n LEU 180 N -4.13 0.75 -0.04 1.64 4.77 0.01 -4.36 117.00 115.63 3cg3 n LEU 180 Ca -0.10 0.32 -0.09 0.00 -0.03 0.00 0.00 56.01 56.12 3cg3 n LEU 180 Cb 0.70 0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.83 3cg3 n LEU 180 CO 0.49 0.11 -0.80 0.52 -1.33 0.00 0.00 177.39 176.37 3cg3 n VAL 181 N -2.81 0.48 0.08 4.08 0.31 -0.26 -4.45 118.33 115.77 3cg3 n VAL 181 Ca -0.09 -0.13 -0.06 0.00 -0.01 0.00 0.00 64.34 64.05 3cg3 n VAL 181 Cb 0.80 -1.57 0.07 0.00 -0.91 0.00 0.00 33.84 32.23 3cg3 n VAL 181 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3cg3 h GLU 182 N -0.30 0.22 0.00 5.55 5.08 -1.45 -1.29 114.58 122.39 3cg3 h GLU 182 Ca -0.22 -0.18 -0.18 0.00 -1.00 0.00 0.00 59.36 57.78 3cg3 h GLU 182 Cb 1.20 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.46 3cg3 h GLU 182 CO -0.13 0.84 -0.85 0.87 -1.00 0.00 0.00 179.01 178.74 3cg3 h LYS 183 N 0.15 0.03 0.00 2.33 1.57 -1.53 -3.34 116.57 115.78 3cg3 h LYS 183 Ca -0.02 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3cg3 h LYS 183 Cb 1.25 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.58 3cg3 h LYS 183 CO 0.11 0.86 -1.33 0.25 -0.57 0.00 0.00 179.45 178.77 3cg3 n THR 184 N -3.56 0.35 -4.13 -0.16 -2.24 -1.20 -4.55 114.28 98.78 3cg3 n THR 184 Ca -0.01 -0.49 -0.16 0.00 -2.27 0.00 0.00 64.05 61.12 3cg3 n THR 184 Cb 0.81 -0.15 -0.05 0.00 -2.10 0.00 0.00 70.33 68.84 3cg3 n THR 184 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3cg3 s THR 185 N -3.39 0.00 -1.41 4.28 -4.23 -0.49 0.18 115.64 110.58 3cg3 s THR 185 Ca -0.02 -1.68 0.17 0.00 -1.18 0.00 0.00 61.69 58.97 3cg3 s THR 185 Cb 0.12 -2.65 0.61 0.00 1.34 0.00 0.00 72.50 71.92 3cg3 s THR 185 CO 0.83 0.00 1.50 -0.46 -0.54 0.00 0.00 174.62 175.95 3cg3 n ASN 186 N -1.59 3.99 -4.73 3.99 6.94 -0.84 -4.50 115.26 118.52 3cg3 n ASN 186 Ca 0.03 -2.29 -0.41 0.00 -0.02 0.00 0.00 54.58 51.89 3cg3 n ASN 186 Cb 0.61 -0.51 -0.04 0.00 -2.36 0.00 0.00 39.78 37.48 3cg3 n ASN 186 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3cg3 s ILE 187 N -1.64 4.05 0.27 1.53 1.01 -1.26 -4.71 121.20 120.44 3cg3 s ILE 187 Ca 0.44 1.74 0.03 0.00 0.00 0.00 0.00 60.65 62.85 3cg3 s ILE 187 Cb 0.27 -4.11 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 3cg3 s ILE 187 CO 0.23 0.28 0.18 -0.72 0.00 0.00 0.00 174.94 174.91 3cg3 s TYR 188 N -0.13 1.47 0.12 3.97 -0.85 -1.02 -4.14 117.35 116.77 3cg3 s TYR 188 Ca 0.49 -1.44 -0.02 0.00 -0.52 0.00 0.00 57.07 55.57 3cg3 s TYR 188 Cb -0.28 -0.70 -0.04 0.00 0.38 0.00 0.00 41.96 41.32 3cg3 s TYR 188 CO 0.33 -0.65 0.08 -1.54 -1.52 0.00 0.00 175.55 172.25 3cg3 s SER 189 N -3.29 0.29 -0.21 -0.18 1.04 -1.26 -0.23 113.70 109.86 3cg3 s SER 189 Ca 0.38 -1.13 -0.04 0.00 0.48 0.00 0.00 55.95 55.65 3cg3 s SER 189 Cb 0.05 0.30 0.11 0.00 0.10 0.00 0.00 66.02 66.58 3cg3 s SER 189 CO 0.18 -0.73 0.28 0.21 0.98 0.00 0.00 173.24 174.15 3cg3 s ASN 190 N -3.02 0.93 0.95 7.02 3.04 -0.36 -5.00 114.94 118.49 3cg3 s ASN 190 Ca 0.21 -0.03 0.00 0.00 0.04 0.00 0.00 52.86 53.08 3cg3 s ASN 190 Cb 0.07 0.66 0.00 0.00 -1.54 0.00 0.00 41.25 40.44 3cg3 s ASN 190 CO -0.00 -0.31 0.00 0.61 -3.04 0.00 0.00 177.10 174.36 3cg3 n GLY 191 N 5.34 1.77 1.53 1.21 0.00 -1.26 -2.15 105.19 111.63 3cg3 n GLY 191 Ca -0.05 -0.54 0.06 0.00 0.00 0.00 0.00 46.02 45.49 3cg3 n GLY 191 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3cg3 n THR 192 N 0.00 2.62 -3.83 2.61 -2.24 -1.26 -4.89 114.28 107.30 3cg3 n THR 192 Ca 0.00 -1.65 -0.36 0.00 -2.27 0.00 0.00 64.05 59.77 3cg3 n THR 192 Cb 0.00 -0.28 -0.10 0.00 -2.10 0.00 0.00 70.33 67.85 3cg3 n THR 192 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3cg3 s ARG 193 N -2.84 3.96 0.06 -0.78 0.52 -0.91 -2.49 118.95 116.47 3cg3 s ARG 193 Ca 0.50 -0.33 0.03 0.00 -0.52 0.00 0.00 55.73 55.40 3cg3 s ARG 193 Cb 0.39 -3.36 -0.04 0.00 0.52 0.00 0.00 34.95 32.46 3cg3 s ARG 193 CO 0.13 0.11 0.07 0.42 0.02 0.00 0.00 175.30 176.05 3cg3 s ILE 194 N 0.85 4.51 -0.08 1.52 1.01 -0.01 -1.22 121.20 127.78 3cg3 s ILE 194 Ca 0.05 -0.71 0.00 0.00 0.00 0.00 0.00 60.65 59.99 3cg3 s ILE 194 Cb -0.13 -3.15 0.02 0.00 0.01 0.00 0.00 42.46 39.21 3cg3 s ILE 194 CO 0.03 0.17 -0.07 -0.31 0.00 0.00 0.00 174.94 174.76 3cg3 s TYR 195 N -1.34 1.24 -0.39 3.97 1.51 0.68 -1.07 117.35 121.96 3cg3 s TYR 195 Ca 0.28 -0.52 -0.10 0.00 -1.01 0.00 0.00 57.07 55.72 3cg3 s TYR 195 Cb -0.12 -1.03 0.04 0.00 -0.11 0.00 0.00 41.96 40.74 3cg3 s TYR 195 CO 0.20 -0.37 0.22 0.00 -1.11 0.00 0.00 175.55 174.49 3cg3 s ALA 196 N 1.32 3.27 0.76 3.71 0.00 -0.59 -2.43 121.76 127.80 3cg3 s ALA 196 Ca -0.03 -1.85 -0.13 0.00 0.00 0.00 0.00 51.96 49.95 3cg3 s ALA 196 Cb -0.14 -2.60 0.05 0.00 0.00 0.00 0.00 23.12 20.43 3cg3 s ALA 196 CO -0.03 -1.47 1.13 -1.25 0.00 0.00 0.00 175.76 174.14 3cg3 s PRO 197 N 1.51 2.15 0.21 0.00 0.04 -1.26 -1.09 135.00 136.56 3cg3 s PRO 197 Ca 0.02 1.45 -0.09 0.00 0.04 0.00 0.00 61.00 62.41 3cg3 s PRO 197 Cb -0.20 -1.87 0.25 0.00 0.04 0.00 0.00 34.50 32.72 3cg3 s PRO 197 CO 0.05 -1.76 1.80 0.87 0.04 0.00 0.00 177.00 178.00 3cg3 h LYS 198 N -0.74 0.64 -4.38 4.56 1.57 -1.95 -3.35 116.57 112.92 3cg3 h LYS 198 Ca -0.45 -0.04 -0.73 0.00 -1.87 0.00 0.00 60.65 57.56 3cg3 h LYS 198 Cb 1.26 -0.14 -0.26 0.00 0.08 0.00 0.00 32.23 33.17 3cg3 h LYS 198 CO 0.50 0.42 -0.40 -1.21 -0.57 0.00 0.00 179.45 178.19 3cg3 s GLU 199 N -6.09 2.76 0.03 3.15 0.41 -1.26 -4.90 118.70 112.80 3cg3 s GLU 199 Ca -0.13 -1.43 -0.23 0.00 -0.41 0.00 0.00 54.97 52.77 3cg3 s GLU 199 Cb 0.16 -3.94 -0.05 0.00 -1.78 0.00 0.00 34.13 28.52 3cg3 s GLU 199 CO 0.76 -1.00 0.69 0.42 -0.49 0.00 0.00 175.26 175.64 3cg3 s ILE 200 N 1.51 4.80 -0.09 -1.63 1.01 -1.26 -5.01 121.20 120.54 3cg3 s ILE 200 Ca 0.03 1.47 0.04 0.00 0.00 0.00 0.00 60.65 62.19 3cg3 s ILE 200 Cb -0.24 -4.04 -0.01 0.00 0.01 0.00 0.00 42.46 38.19 3cg3 s ILE 200 CO 0.04 0.39 -0.22 -0.63 0.00 0.00 0.00 174.94 174.52 3cg3 s ILE 201 N -0.15 2.26 -0.26 2.92 1.01 -1.26 -5.02 121.20 120.69 3cg3 s ILE 201 Ca 0.35 -0.97 -0.10 0.00 0.00 0.00 0.00 60.65 59.93 3cg3 s ILE 201 Cb -0.20 -1.86 -0.05 0.00 0.01 0.00 0.00 42.46 40.37 3cg3 s ILE 201 CO 0.21 0.56 0.16 -0.63 0.00 0.00 0.00 174.94 175.24 3cg3 s ILE 202 N 0.10 5.18 -0.09 2.92 1.01 -1.26 -1.99 121.20 127.07 3cg3 s ILE 202 Ca -0.11 0.12 0.05 0.00 0.00 0.00 0.00 60.65 60.71 3cg3 s ILE 202 Cb -0.16 -3.44 -0.24 0.00 0.01 0.00 0.00 42.46 38.63 3cg3 s ILE 202 CO 0.06 0.30 0.47 0.29 0.00 0.00 0.00 174.94 176.06 3cg3 n LYS 203 N 4.76 0.69 -3.73 2.79 5.02 0.13 -4.76 118.16 123.06 3cg3 n LYS 203 Ca -0.15 0.26 -0.38 0.00 -2.02 0.00 0.00 58.31 56.02 3cg3 n LYS 203 Cb 0.52 -1.73 -0.11 0.00 -0.02 0.00 0.00 35.03 33.68 3cg3 n LYS 203 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3cg3 s ASP 204 N -6.46 5.36 0.00 4.39 -1.08 -0.95 -4.98 116.67 112.95 3cg3 s ASP 204 Ca -0.13 -1.50 0.05 0.00 -0.52 0.00 0.00 52.55 50.45 3cg3 s ASP 204 Cb 0.07 -1.88 0.32 0.00 -1.46 0.00 0.00 42.92 39.97 3cg3 s ASP 204 CO 0.79 -0.44 0.70 0.29 0.52 0.00 0.00 175.17 177.03 3cg3 n LYS 205 N 4.77 0.28 0.01 4.34 4.76 -1.26 -1.14 118.16 129.92 3cg3 n LYS 205 Ca -0.09 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.48 3cg3 n LYS 205 Cb 0.43 -1.29 0.52 0.00 -1.84 0.00 0.00 35.03 32.85 3cg3 n LYS 205 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 3cg3 n ARG 206 N -0.79 0.02 -3.56 1.97 1.85 -1.26 -4.68 116.66 110.21 3cg3 n ARG 206 Ca 0.04 0.01 -0.37 0.00 -1.00 0.00 0.00 57.85 56.53 3cg3 n ARG 206 Cb 0.02 -1.52 -0.08 0.00 -1.05 0.00 0.00 32.46 29.82 3cg3 n ARG 206 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3cg3 s VAL 207 N -3.01 5.30 -0.08 8.89 1.01 -0.29 -1.98 120.40 130.24 3cg3 s VAL 207 Ca 0.13 0.41 -0.01 0.00 0.00 0.00 0.00 61.98 62.51 3cg3 s VAL 207 Cb 0.18 -3.59 -0.03 0.00 0.00 0.00 0.00 36.38 32.94 3cg3 s VAL 207 CO 0.57 0.33 -0.03 -0.63 0.00 0.00 0.00 175.10 175.34 3cg3 s ILE 208 N 1.01 4.05 0.07 2.22 -1.09 -0.37 -4.96 121.20 122.14 3cg3 s ILE 208 Ca 0.13 -0.35 0.05 0.00 -2.23 0.00 0.00 60.65 58.25 3cg3 s ILE 208 Cb -0.14 -2.68 -0.03 0.00 -1.58 0.00 0.00 42.46 38.03 3cg3 s ILE 208 CO 0.05 0.60 -0.13 -0.04 -1.23 0.00 0.00 174.94 174.19 3cg3 s MET 209 N -0.83 0.80 0.06 2.79 -1.94 -1.26 -2.31 119.30 116.61 3cg3 s MET 209 Ca 0.13 -0.96 -0.04 0.00 -1.71 0.00 0.00 55.69 53.10 3cg3 s MET 209 Cb -0.11 -0.74 -0.02 0.00 2.01 0.00 0.00 34.83 35.97 3cg3 s MET 209 CO 0.02 0.16 0.06 1.03 -0.01 0.00 0.00 175.02 176.27 3cg3 s ARG 210 N -1.86 0.68 0.48 2.03 1.81 -1.24 -4.98 118.95 115.86 3cg3 s ARG 210 Ca -0.02 -1.06 0.18 0.00 -1.72 0.00 0.00 55.73 53.10 3cg3 s ARG 210 Cb -0.09 0.25 1.18 0.00 -0.45 0.00 0.00 34.95 35.84 3cg3 s ARG 210 CO 0.02 -0.16 2.01 -1.35 -0.68 0.00 0.00 175.30 175.14 3cg3 h PRO 211 N 3.11 0.22 -3.54 3.54 0.11 -1.94 -0.97 132.00 132.53 3cg3 h PRO 211 Ca -0.34 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 65.61 3cg3 h PRO 211 Cb 1.17 -0.05 -0.21 0.00 0.11 0.00 0.00 31.00 32.02 3cg3 h PRO 211 CO 0.60 0.14 -0.50 -1.59 -0.21 0.00 0.00 178.00 176.44 3cg3 s LYS 212 N -5.23 0.48 0.31 1.05 -2.85 -1.26 -4.31 119.74 107.93 3cg3 s LYS 212 Ca -0.06 -0.42 0.04 0.00 -1.00 0.00 0.00 55.97 54.53 3cg3 s LYS 212 Cb 0.19 0.20 0.67 0.00 -2.06 0.00 0.00 37.83 36.83 3cg3 s LYS 212 CO 0.73 -0.11 1.83 1.05 0.10 0.00 0.00 175.35 178.95 3cg3 h GLU 213 N 4.29 0.84 0.00 1.78 9.09 -1.95 -1.10 114.58 127.52 3cg3 h GLU 213 Ca -0.31 -0.05 0.00 0.00 0.05 0.00 0.00 59.36 59.05 3cg3 h GLU 213 Cb 1.19 -0.19 0.00 0.00 -1.65 0.00 0.00 28.75 28.11 3cg3 h GLU 213 CO 0.41 0.55 0.00 1.79 0.05 0.00 0.00 179.01 181.81 3cg3 h THR 214 N 0.86 0.00 0.00 -1.06 1.35 -1.97 -0.34 112.91 111.75 3cg3 h THR 214 Ca 0.51 -0.12 -0.02 0.00 -0.55 0.00 0.00 66.41 66.22 3cg3 h THR 214 Cb 0.66 0.91 -0.00 0.00 -1.73 0.00 0.00 68.15 67.99 3cg3 h THR 214 CO -0.28 0.00 -0.12 0.44 -0.25 0.00 0.00 175.52 175.31 3cg3 h ASP 215 N 0.00 0.00 1.61 5.36 3.32 -1.60 -2.99 116.42 122.12 3cg3 h ASP 215 Ca 0.00 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 3cg3 h ASP 215 Cb 0.14 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3cg3 h ASP 215 CO 0.00 0.12 -0.20 -0.07 -1.72 0.00 0.00 179.24 177.36 3cg3 h LEU 216 N 0.00 0.00 -0.25 1.55 3.38 -1.17 -3.35 115.31 115.47 3cg3 h LEU 216 Ca -0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 3cg3 h LEU 216 Cb 0.65 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 3cg3 h LEU 216 CO 0.02 0.20 0.15 0.58 0.09 0.00 0.00 178.44 179.48 3cg3 h VAL 217 N 0.00 1.04 -0.82 1.22 2.07 -1.62 -2.32 116.25 115.82 3cg3 h VAL 217 Ca -0.00 -0.11 0.05 0.00 0.82 0.00 0.00 66.70 67.46 3cg3 h VAL 217 Cb 1.06 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 31.48 3cg3 h VAL 217 CO 0.03 0.06 0.54 1.23 0.02 0.00 0.00 177.57 179.44 3cg3 h GLY 218 N 0.32 1.16 1.23 2.17 0.00 -1.76 -0.27 103.07 105.92 3cg3 h GLY 218 Ca 0.09 -0.38 -0.09 0.00 0.00 0.00 0.00 47.33 46.96 3cg3 h GLY 218 CO -0.03 0.30 -0.03 1.41 0.00 0.00 0.00 176.54 178.18 3cg3 h LEU 219 N 0.95 0.90 -0.15 3.11 3.38 -1.64 -2.14 115.31 119.72 3cg3 h LEU 219 Ca 0.34 -0.25 -0.20 0.00 0.09 0.00 0.00 57.88 57.87 3cg3 h LEU 219 Cb 0.15 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 40.67 3cg3 h LEU 219 CO -0.11 0.97 -0.68 0.58 0.09 0.00 0.00 178.44 179.29 3cg3 h VAL 220 N 0.84 1.30 -0.60 1.22 2.07 -0.85 -2.38 116.25 117.87 3cg3 h VAL 220 Ca 0.15 -1.91 -0.01 0.00 0.82 0.00 0.00 66.70 65.75 3cg3 h VAL 220 Cb 0.54 2.03 -0.03 0.00 -1.52 0.00 0.00 31.29 32.31 3cg3 h VAL 220 CO 0.03 0.60 0.32 -0.33 0.02 0.00 0.00 177.57 178.21 3cg3 h GLU 221 N 0.42 0.82 0.00 1.57 5.08 -0.97 -1.46 114.58 120.04 3cg3 h GLU 221 Ca -0.04 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 3cg3 h GLU 221 Cb 1.31 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.39 3cg3 h GLU 221 CO 0.14 0.60 0.00 0.66 -1.00 0.00 0.00 179.01 179.41 3cg3 h SER 222 N 0.83 0.00 0.00 1.42 4.64 -1.43 -3.47 113.55 115.54 3cg3 h SER 222 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 3cg3 h SER 222 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3cg3 h SER 222 CO -0.03 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.54 3cg3 n GLY 223 N 0.77 0.75 0.22 -0.77 0.00 -0.55 -4.93 105.19 100.68 3cg3 n GLY 223 Ca 0.03 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.16 3cg3 n GLY 223 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3cg3 h SER 224 N 0.00 0.00 -3.31 1.61 4.64 -1.72 -3.43 113.55 111.35 3cg3 h SER 224 Ca 0.00 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.64 3cg3 h SER 224 Cb 0.00 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 61.76 3cg3 h SER 224 CO 0.00 0.15 -0.88 -0.22 -0.87 0.00 0.00 176.83 175.02 3cg3 s LEU 225 N -6.38 2.09 -0.07 5.97 2.96 -0.93 -4.98 118.68 117.33 3cg3 s LEU 225 Ca 0.04 -0.57 -0.23 0.00 -0.22 0.00 0.00 54.13 53.15 3cg3 s LEU 225 Cb 0.08 -1.41 -0.19 0.00 0.50 0.00 0.00 46.19 45.16 3cg3 s LEU 225 CO 0.65 0.14 0.89 0.44 -1.32 0.00 0.00 176.35 177.15 3cg3 h ASP 226 N 6.87 -0.07 -4.77 3.68 3.32 -1.79 -3.38 116.42 120.28 3cg3 h ASP 226 Ca -0.23 -0.56 -0.24 0.00 0.02 0.00 0.00 57.03 56.02 3cg3 h ASP 226 Cb 1.23 0.02 -0.19 0.00 0.22 0.00 0.00 39.33 40.60 3cg3 h ASP 226 CO 0.49 0.60 -0.72 -0.31 -1.72 0.00 0.00 179.24 177.58 3cg3 s TYR 227 N -3.15 0.68 0.03 4.55 1.51 -0.95 -4.48 117.35 115.54 3cg3 s TYR 227 Ca -0.15 -0.65 0.01 0.00 -1.01 0.00 0.00 57.07 55.27 3cg3 s TYR 227 Cb -0.00 -0.41 -0.02 0.00 -0.11 0.00 0.00 41.96 41.42 3cg3 s TYR 227 CO 0.56 -0.13 -0.04 0.96 -1.11 0.00 0.00 175.55 175.79 3cg3 s ILE 228 N -2.14 0.23 -0.15 2.71 -4.36 -0.56 -1.01 121.20 115.93 3cg3 s ILE 228 Ca -0.04 -0.99 -0.18 0.00 -0.26 0.00 0.00 60.65 59.19 3cg3 s ILE 228 Cb -0.05 -0.40 -0.04 0.00 1.25 0.00 0.00 42.46 43.22 3cg3 s ILE 228 CO -0.02 -0.48 0.46 -0.36 0.24 0.00 0.00 174.94 174.78 3cg3 s PHE 229 N -1.52 3.47 0.19 1.37 0.40 -0.84 -1.07 117.98 119.97 3cg3 s PHE 229 Ca -0.14 0.81 -0.24 0.00 -0.60 0.00 0.00 56.93 56.77 3cg3 s PHE 229 Cb -0.09 -2.55 0.05 0.00 0.51 0.00 0.00 43.02 40.93 3cg3 s PHE 229 CO -0.01 0.10 0.80 -1.50 0.70 0.00 0.00 175.22 175.32 3cg3 s ILE 230 N 0.88 0.00 0.45 0.64 2.07 -0.84 -4.76 121.20 119.64 3cg3 s ILE 230 Ca 0.24 -0.62 -0.23 0.00 -1.41 0.00 0.00 60.65 58.62 3cg3 s ILE 230 Cb -0.15 -1.73 -0.07 0.00 0.13 0.00 0.00 42.46 40.63 3cg3 s ILE 230 CO 0.09 0.00 1.19 -0.31 -1.91 0.00 0.00 174.94 174.01 3cg3 s TYR 231 N -3.59 2.86 0.26 3.50 1.51 -1.26 -1.01 117.35 119.63 3cg3 s TYR 231 Ca 0.09 1.52 -0.03 0.00 -1.01 0.00 0.00 57.07 57.63 3cg3 s TYR 231 Cb -0.03 -3.44 0.37 0.00 -0.11 0.00 0.00 41.96 38.75 3cg3 s TYR 231 CO 0.01 -1.63 1.90 -0.22 -1.11 0.00 0.00 175.55 174.49 3cg3 h LYS 232 N 2.16 1.20 -0.69 -0.62 3.64 -1.51 -1.90 116.57 118.85 3cg3 h LYS 232 Ca -0.49 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 58.77 3cg3 h LYS 232 Cb 1.25 -0.27 -0.03 0.00 -0.41 0.00 0.00 32.23 32.77 3cg3 h LYS 232 CO 0.61 0.79 0.27 0.66 -2.27 0.00 0.00 179.45 179.51 3cg3 h SER 233 N 1.23 0.94 -0.26 4.20 4.64 -1.84 -1.20 113.55 121.27 3cg3 h SER 233 Ca 0.41 -0.14 -0.18 0.00 -0.47 0.00 0.00 61.79 61.42 3cg3 h SER 233 Cb 0.06 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 61.91 3cg3 h SER 233 CO -0.14 0.84 -0.51 0.58 -0.87 0.00 0.00 176.83 176.72 3cg3 h VAL 234 N 1.00 1.28 -0.69 0.95 2.07 -1.72 -0.91 116.25 118.23 3cg3 h VAL 234 Ca 0.23 -1.70 -0.06 0.00 0.82 0.00 0.00 66.70 65.99 3cg3 h VAL 234 Cb 0.20 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 3cg3 h VAL 234 CO -0.02 0.55 0.19 0.00 0.02 0.00 0.00 177.57 178.32 3cg3 h ALA 235 N 0.75 0.90 -0.17 1.67 0.00 -1.07 -1.71 119.26 119.64 3cg3 h ALA 235 Ca 0.02 -0.23 -0.17 0.00 0.00 0.00 0.00 54.91 54.54 3cg3 h ALA 235 Cb 1.11 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 3cg3 h ALA 235 CO 0.11 0.60 -0.59 0.87 0.00 0.00 0.00 179.25 180.25 3cg3 h LYS 236 N 1.02 0.56 -0.38 0.00 1.57 -1.16 0.29 116.57 118.46 3cg3 h LYS 236 Ca 0.22 -0.37 -0.05 0.00 -1.87 0.00 0.00 60.65 58.58 3cg3 h LYS 236 Cb 0.33 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 3cg3 h LYS 236 CO -0.00 0.99 0.04 1.96 -0.57 0.00 0.00 179.45 181.86 3cg3 h GLN 237 N 0.42 0.59 -0.62 3.15 4.20 -0.88 -2.45 115.11 119.52 3cg3 h GLN 237 Ca -0.00 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.59 3cg3 h GLN 237 Cb 1.14 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.84 3cg3 h GLN 237 CO 0.11 0.58 0.00 0.72 -0.67 0.00 0.00 178.83 179.57 3cg3 n HIS 238 N -4.29 0.89 -3.93 2.96 8.25 -0.67 -4.95 115.22 113.49 3cg3 n HIS 238 Ca 0.02 -0.42 -0.29 0.00 -0.26 0.00 0.00 57.72 56.76 3cg3 n HIS 238 Cb 0.23 -0.04 0.02 0.00 1.12 0.00 0.00 29.99 31.32 3cg3 n HIS 238 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3cg3 n HIS 239 N 1.23 -2.11 -3.00 4.41 8.25 -0.79 -4.98 115.22 118.23 3cg3 n HIS 239 Ca 0.21 0.87 -0.28 0.00 -0.26 0.00 0.00 57.72 58.26 3cg3 n HIS 239 Cb 0.56 -3.88 -0.02 0.00 1.12 0.00 0.00 29.99 27.77 3cg3 n HIS 239 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3cg3 s LEU 240 N -7.16 3.86 0.55 2.41 1.43 0.02 -5.03 118.68 114.75 3cg3 s LEU 240 Ca 0.52 0.85 -0.15 0.00 -1.03 0.00 0.00 54.13 54.32 3cg3 s LEU 240 Cb -0.26 -3.73 -0.07 0.00 0.03 0.00 0.00 46.19 42.16 3cg3 s LEU 240 CO 0.85 -0.38 1.00 -0.44 0.23 0.00 0.00 176.35 177.61 3cg3 s SER 241 N -3.58 6.45 0.08 2.29 0.01 0.72 -4.72 113.70 114.96 3cg3 s SER 241 Ca 0.46 1.56 -0.26 0.00 1.31 0.00 0.00 55.95 59.02 3cg3 s SER 241 Cb -0.10 -2.50 0.08 0.00 0.21 0.00 0.00 66.02 63.71 3cg3 s SER 241 CO 0.36 -0.71 0.82 -0.72 0.41 0.00 0.00 173.24 173.40 3cg3 s TYR 242 N -2.73 -0.35 0.04 2.43 -0.85 -1.26 -0.50 117.35 114.13 3cg3 s TYR 242 Ca 0.58 0.15 0.07 0.00 -0.52 0.00 0.00 57.07 57.36 3cg3 s TYR 242 Cb -0.11 0.57 -0.02 0.00 0.38 0.00 0.00 41.96 42.78 3cg3 s TYR 242 CO 0.37 -0.70 -0.19 0.96 -1.52 0.00 0.00 175.55 174.46 3cg3 s ILE 243 N -3.35 1.55 0.41 -3.49 -4.36 -0.37 -4.98 121.20 106.62 3cg3 s ILE 243 Ca 0.05 -1.16 -0.07 0.00 -0.26 0.00 0.00 60.65 59.21 3cg3 s ILE 243 Cb -0.01 -1.36 -0.05 0.00 1.25 0.00 0.00 42.46 42.29 3cg3 s ILE 243 CO -0.07 0.16 0.74 0.42 0.24 0.00 0.00 174.94 176.43 3cg3 s THR 244 N -0.81 4.88 0.30 8.37 -4.23 -1.26 -2.33 115.64 120.55 3cg3 s THR 244 Ca 0.06 0.35 0.08 0.00 -1.18 0.00 0.00 61.69 60.99 3cg3 s THR 244 Cb -0.09 -3.79 -0.03 0.00 1.34 0.00 0.00 72.50 69.93 3cg3 s THR 244 CO 0.02 -0.62 0.22 -0.76 -0.54 0.00 0.00 174.62 172.94 3cg3 s LEU 245 N -4.15 3.60 0.53 4.79 1.43 -1.26 -4.94 118.68 118.67 3cg3 s LEU 245 Ca 0.48 -0.46 -0.21 0.00 -1.03 0.00 0.00 54.13 52.91 3cg3 s LEU 245 Cb -0.10 -2.16 -0.07 0.00 0.03 0.00 0.00 46.19 43.89 3cg3 s LEU 245 CO 0.36 -0.21 1.07 -2.65 0.23 0.00 0.00 176.35 175.15 3cg3 n PRO 246 N -1.24 1.25 0.28 1.29 -0.02 -1.26 -4.70 135.00 130.60 3cg3 n PRO 246 Ca -0.04 0.46 0.13 0.00 -2.02 0.00 0.00 63.50 62.03 3cg3 n PRO 246 Cb 0.59 -2.22 0.80 0.00 -0.02 0.00 0.00 33.50 32.65 3cg3 n PRO 246 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3cg3 h ASP 247 N 1.07 0.00 0.74 2.55 3.32 -1.98 -1.02 116.42 121.10 3cg3 h ASP 247 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 3cg3 h ASP 247 Cb 1.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.89 3cg3 h ASP 247 CO 0.54 0.08 0.00 0.44 -1.72 0.00 0.00 179.24 178.58 3cg3 h ASP 248 N 0.00 0.00 0.00 6.45 3.32 -1.98 -3.30 116.42 120.91 3cg3 h ASP 248 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3cg3 h ASP 248 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 3cg3 h ASP 248 CO 0.01 0.00 -0.10 2.30 -1.72 0.00 0.00 179.24 179.72 3cg3 n ILE 249 N -2.51 0.00 1.72 0.35 -5.35 -0.69 -4.77 119.36 108.11 3cg3 n ILE 249 Ca 0.01 -0.29 0.15 0.00 -0.27 0.00 0.00 62.75 62.35 3cg3 n ILE 249 Cb 0.23 0.90 0.78 0.00 -1.74 0.00 0.00 39.64 39.81 3cg3 n ILE 249 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 3cg3 n ASN 250 N -0.74 0.39 -0.74 7.28 0.23 -0.47 -4.70 115.26 116.51 3cg3 n ASN 250 Ca 0.00 -0.92 -0.10 0.00 -0.53 0.00 0.00 54.58 53.03 3cg3 n ASN 250 Cb 0.00 -0.04 -0.04 0.00 -2.08 0.00 0.00 39.78 37.61 3cg3 n ASN 250 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 3cg3 n LEU 251 N -0.79 -0.49 -0.51 -4.53 4.77 -1.26 -1.31 117.00 112.88 3cg3 n LEU 251 Ca 0.20 0.24 0.07 0.00 -0.03 0.00 0.00 56.01 56.49 3cg3 n LEU 251 Cb 0.21 -2.02 0.05 0.00 -2.33 0.00 0.00 43.42 39.33 3cg3 n LEU 251 CO 0.19 -0.72 0.42 0.61 -1.33 0.00 0.00 177.39 176.57 3cg3 n GLY 252 N -0.95 -0.03 3.40 -0.72 0.00 -1.26 -0.80 105.19 104.82 3cg3 n GLY 252 Ca -0.10 -0.40 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 3cg3 n GLY 252 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3cg3 s ASP 253 N -1.30 5.90 0.61 1.61 -1.08 -1.26 -4.93 116.67 116.21 3cg3 s ASP 253 Ca 0.15 -1.03 0.37 0.00 -0.52 0.00 0.00 52.55 51.52 3cg3 s ASP 253 Cb 0.12 -2.08 1.94 0.00 -1.46 0.00 0.00 42.92 41.44 3cg3 s ASP 253 CO 0.21 -0.44 2.22 -0.26 0.52 0.00 0.00 175.17 177.42 3cg3 h PHE 254 N 8.53 0.00 0.00 -5.34 -1.00 -1.96 -1.80 116.94 115.37 3cg3 h PHE 254 Ca -0.26 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.52 3cg3 h PHE 254 Cb 1.11 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.67 3cg3 h PHE 254 CO 0.57 0.02 0.00 -1.71 -1.61 0.00 0.00 178.31 175.59 3cg3 n ASN 255 N -3.27 0.00 -1.41 2.17 5.15 -1.26 -3.35 115.26 113.29 3cg3 n ASN 255 Ca -0.02 0.06 0.08 0.00 -0.60 0.00 0.00 54.58 54.10 3cg3 n ASN 255 Cb 0.16 -0.35 0.33 0.00 -0.53 0.00 0.00 39.78 39.39 3cg3 n ASN 255 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3cg3 n LYS 256 N -1.35 3.83 -0.33 1.20 4.76 -0.68 -4.65 118.16 120.93 3cg3 n LYS 256 Ca 0.12 -2.90 0.05 0.00 -2.87 0.00 0.00 58.31 52.71 3cg3 n LYS 256 Cb 0.27 -1.95 0.21 0.00 -1.84 0.00 0.00 35.03 31.71 3cg3 n LYS 256 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3cg3 h ALA 257 N 3.23 1.37 -0.73 7.82 0.00 -1.70 0.22 119.26 129.47 3cg3 h ALA 257 Ca 0.00 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3cg3 h ALA 257 Cb 1.57 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 19.14 3cg3 h ALA 257 CO 0.30 0.19 0.29 -0.44 0.00 0.00 0.00 179.25 179.58 3cg3 h ASP 258 N 0.92 0.99 -0.07 0.00 3.32 -1.90 0.49 116.42 120.17 3cg3 h ASP 258 Ca 0.45 -0.14 -0.07 0.00 0.02 0.00 0.00 57.03 57.29 3cg3 h ASP 258 Cb 0.42 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.72 3cg3 h ASP 258 CO -0.25 0.88 -0.23 0.15 -1.72 0.00 0.00 179.24 178.07 3cg3 h PHE 259 N 1.05 0.37 -0.34 4.55 3.57 -1.69 -3.23 116.94 121.23 3cg3 h PHE 259 Ca 0.24 -0.15 0.04 0.00 3.53 0.00 0.00 57.97 61.64 3cg3 h PHE 259 Cb 0.20 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 38.84 3cg3 h PHE 259 CO 0.02 0.85 0.10 1.88 -2.23 0.00 0.00 178.31 178.93 3cg3 h TYR 260 N -0.22 0.18 0.00 0.41 0.05 -0.89 -2.76 116.97 113.74 3cg3 h TYR 260 Ca -0.01 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.79 3cg3 h TYR 260 Cb 0.85 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.56 3cg3 h TYR 260 CO 0.12 0.07 0.03 0.41 -1.05 0.00 0.00 178.16 177.74 3cg3 n GLY 261 N -1.21 -0.45 0.16 3.88 0.00 0.15 -1.46 105.19 106.26 3cg3 n GLY 261 Ca 0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.16 3cg3 n GLY 261 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3cg3 h ARG 262 N 0.00 0.00 -5.97 1.61 2.47 -1.51 -3.44 114.38 107.54 3cg3 h ARG 262 Ca 0.00 0.00 -0.67 0.00 -1.26 0.00 0.00 59.98 58.05 3cg3 h ARG 262 Cb 0.05 0.00 -0.13 0.00 -1.65 0.00 0.00 29.97 28.24 3cg3 h ARG 262 CO 0.00 0.00 -0.61 0.08 0.56 0.00 0.00 179.97 180.00 3cg3 s VAL 263 N -3.23 4.45 0.17 2.04 1.01 -0.53 -4.74 120.40 119.58 3cg3 s VAL 263 Ca 0.08 -0.27 -0.06 0.00 0.00 0.00 0.00 61.98 61.72 3cg3 s VAL 263 Cb 0.10 -2.91 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 3cg3 s VAL 263 CO 0.57 0.55 0.23 -0.94 0.00 0.00 0.00 175.10 175.51 3cg3 s SER 264 N -1.08 0.10 -0.00 3.32 1.04 -1.04 -1.10 113.70 114.93 3cg3 s SER 264 Ca 0.15 -1.04 0.00 0.00 0.48 0.00 0.00 55.95 55.55 3cg3 s SER 264 Cb -0.11 0.42 0.00 0.00 0.10 0.00 0.00 66.02 66.42 3cg3 s SER 264 CO 0.05 -0.88 -0.00 -0.51 0.98 0.00 0.00 173.24 172.87 3cg3 s ILE 265 N -4.02 0.06 -0.23 -1.02 2.07 -0.42 -0.83 121.20 116.81 3cg3 s ILE 265 Ca 0.23 -0.00 -0.06 0.00 -1.41 0.00 0.00 60.65 59.40 3cg3 s ILE 265 Cb 0.04 -0.08 -0.02 0.00 0.13 0.00 0.00 42.46 42.53 3cg3 s ILE 265 CO 0.04 0.04 0.04 -0.89 -1.91 0.00 0.00 174.94 172.25 3cg3 s THR 266 N 0.16 4.07 -0.02 4.00 2.01 -0.23 -0.85 115.64 124.77 3cg3 s THR 266 Ca -0.01 -0.26 -0.21 0.00 0.31 0.00 0.00 61.69 61.52 3cg3 s THR 266 Cb -0.03 -2.88 -0.05 0.00 0.01 0.00 0.00 72.50 69.55 3cg3 s THR 266 CO -0.00 0.37 0.62 -0.76 -0.69 0.00 0.00 174.62 174.16 3cg3 s LEU 267 N 1.46 4.39 0.28 4.42 1.43 -0.68 -1.54 118.68 128.46 3cg3 s LEU 267 Ca 0.05 1.17 0.03 0.00 -1.03 0.00 0.00 54.13 54.35 3cg3 s LEU 267 Cb -0.15 -2.96 0.43 0.00 0.03 0.00 0.00 46.19 43.54 3cg3 s LEU 267 CO 0.02 0.05 1.73 1.23 0.23 0.00 0.00 176.35 179.61 3cg3 h GLY 268 N 5.88 0.50 1.32 -3.19 0.00 -1.36 0.24 103.07 106.47 3cg3 h GLY 268 Ca -0.44 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 46.46 3cg3 h GLY 268 CO 0.71 0.37 0.33 1.48 0.00 0.00 0.00 176.54 179.43 3cg3 h SER 269 N 0.41 0.80 0.00 0.19 4.64 -1.84 -3.28 113.55 114.47 3cg3 h SER 269 Ca 0.06 -0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 61.29 3cg3 h SER 269 Cb 0.66 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 62.54 3cg3 h SER 269 CO 0.05 0.67 -1.43 0.35 -0.87 0.00 0.00 176.83 175.59 3cg3 n THR 270 N -4.36 0.07 -0.99 2.95 -2.24 -1.20 -4.99 114.28 103.51 3cg3 n THR 270 Ca 0.06 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 3cg3 n THR 270 Cb 0.12 0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.51 3cg3 n THR 270 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3cg3 n GLY 271 N 2.04 0.96 3.90 3.38 0.00 0.84 -5.01 105.19 111.30 3cg3 n GLY 271 Ca -0.03 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.78 3cg3 n GLY 271 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cg3 s LYS 272 N -0.02 3.05 -0.09 1.61 1.02 -1.24 -4.81 119.74 119.26 3cg3 s LYS 272 Ca 0.00 -1.02 -0.04 0.00 0.02 0.00 0.00 55.97 54.93 3cg3 s LYS 272 Cb 0.00 -2.67 -0.04 0.00 -0.52 0.00 0.00 37.83 34.60 3cg3 s LYS 272 CO 0.00 0.28 0.08 0.99 -0.92 0.00 0.00 175.35 175.79 3cg3 s THR 273 N -2.14 4.97 -0.08 2.17 2.01 -1.26 -1.68 115.64 119.63 3cg3 s THR 273 Ca 0.37 -0.05 0.02 0.00 0.31 0.00 0.00 61.69 62.34 3cg3 s THR 273 Cb -0.08 -3.16 0.01 0.00 0.01 0.00 0.00 72.50 69.29 3cg3 s THR 273 CO 0.27 0.57 -0.13 -0.63 -0.69 0.00 0.00 174.62 174.02 3cg3 s ILE 274 N -1.01 1.23 0.37 1.82 1.01 -0.03 -4.97 121.20 119.63 3cg3 s ILE 274 Ca 0.16 -0.51 -0.18 0.00 0.00 0.00 0.00 60.65 60.11 3cg3 s ILE 274 Cb -0.12 -1.13 -0.10 0.00 0.01 0.00 0.00 42.46 41.12 3cg3 s ILE 274 CO 0.05 0.38 0.84 -0.54 0.00 0.00 0.00 174.94 175.67 3cg3 s LYS 275 N 0.80 4.12 0.35 2.79 1.02 -1.26 -1.30 119.74 126.25 3cg3 s LYS 275 Ca -0.12 0.90 -0.28 0.00 0.02 0.00 0.00 55.97 56.49 3cg3 s LYS 275 Cb -0.15 -2.31 -0.09 0.00 -0.52 0.00 0.00 37.83 34.75 3cg3 s LYS 275 CO 0.02 0.07 1.21 0.00 -0.92 0.00 0.00 175.35 175.72 3cg3 s ALA 276 N -2.07 3.34 0.20 5.17 0.00 -0.26 -4.95 121.76 123.19 3cg3 s ALA 276 Ca 0.58 1.07 -0.23 0.00 0.00 0.00 0.00 51.96 53.38 3cg3 s ALA 276 Cb -0.10 -3.41 0.05 0.00 0.00 0.00 0.00 23.12 19.66 3cg3 s ALA 276 CO 0.15 -0.49 0.76 -1.59 0.00 0.00 0.00 175.76 174.60 3cg3 s LYS 277 N -1.90 1.46 0.24 0.00 -2.85 -1.26 -2.73 119.74 112.70 3cg3 s LYS 277 Ca 0.51 -0.74 -0.31 0.00 -1.00 0.00 0.00 55.97 54.43 3cg3 s LYS 277 Cb -0.35 0.54 -0.14 0.00 -2.06 0.00 0.00 37.83 35.83 3cg3 s LYS 277 CO 0.45 -0.66 1.31 -2.30 0.10 0.00 0.00 175.35 174.25 3cg3 n PRO 278 N -0.43 1.82 -2.14 1.78 -0.02 -1.26 -4.85 135.00 129.90 3cg3 n PRO 278 Ca -0.08 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 61.62 3cg3 n PRO 278 Cb 0.61 -2.24 -0.03 0.00 -0.02 0.00 0.00 33.50 31.83 3cg3 n PRO 278 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3cg3 s ILE 279 N -0.29 3.75 -0.04 4.25 1.01 0.02 -5.00 121.20 124.91 3cg3 s ILE 279 Ca 0.67 0.96 -0.02 0.00 0.00 0.00 0.00 60.65 62.27 3cg3 s ILE 279 Cb -0.68 -3.62 0.03 0.00 0.01 0.00 0.00 42.46 38.20 3cg3 s ILE 279 CO 0.52 -0.07 0.07 -0.69 0.00 0.00 0.00 174.94 174.78 3cg3 s VAL 280 N 3.60 -0.10 0.41 2.92 1.01 -1.26 -3.55 120.40 123.42 3cg3 s VAL 280 Ca 0.67 0.31 -0.21 0.00 0.00 0.00 0.00 61.98 62.75 3cg3 s VAL 280 Cb -0.30 -0.16 -0.11 0.00 0.00 0.00 0.00 36.38 35.81 3cg3 s VAL 280 CO 0.25 0.13 0.94 -0.31 0.00 0.00 0.00 175.10 176.11 3cg3 s TYR 281 N 1.67 3.38 0.13 5.22 1.51 0.38 -1.30 117.35 128.32 3cg3 s TYR 281 Ca -0.02 1.61 0.05 0.00 -1.01 0.00 0.00 57.07 57.71 3cg3 s TYR 281 Cb -0.12 -2.84 -0.04 0.00 -0.11 0.00 0.00 41.96 38.85 3cg3 s TYR 281 CO -0.04 -0.04 -0.13 0.20 -1.11 0.00 0.00 175.55 174.43 3cg3 s GLY 282 N -2.09 1.05 0.00 0.71 0.00 -0.16 -1.53 107.32 105.30 3cg3 s GLY 282 Ca 0.60 -1.32 -0.10 0.00 0.00 0.00 0.00 44.72 43.90 3cg3 s GLY 282 CO 0.15 -1.39 0.19 -1.50 0.00 0.00 0.00 173.10 170.55 3cg3 s ILE 283 N -2.41 0.08 0.15 0.90 2.07 -0.40 -0.46 121.20 121.14 3cg3 s ILE 283 Ca 0.10 -0.65 -0.16 0.00 -1.41 0.00 0.00 60.65 58.53 3cg3 s ILE 283 Cb -0.03 -0.52 0.03 0.00 0.13 0.00 0.00 42.46 42.07 3cg3 s ILE 283 CO 0.02 -0.36 0.44 0.28 -1.91 0.00 0.00 174.94 173.42 3cg3 s THR 284 N -1.46 0.05 -0.11 4.00 -1.32 -0.71 -1.02 115.64 115.07 3cg3 s THR 284 Ca -0.14 -0.65 0.00 0.00 -1.21 0.00 0.00 61.69 59.69 3cg3 s THR 284 Cb -0.06 -1.33 -0.02 0.00 -1.51 0.00 0.00 72.50 69.58 3cg3 s THR 284 CO 0.02 -0.23 -0.11 -0.69 -2.21 0.00 0.00 174.62 171.39 3cg3 s VAL 285 N -3.83 3.23 0.58 5.08 1.01 -1.26 -1.93 120.40 123.28 3cg3 s VAL 285 Ca 0.06 -0.61 -0.18 0.00 0.00 0.00 0.00 61.98 61.24 3cg3 s VAL 285 Cb 0.01 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 3cg3 s VAL 285 CO -0.08 0.54 1.11 -0.76 0.00 0.00 0.00 175.10 175.90 3cg3 s LEU 286 N 0.07 3.62 0.24 3.92 1.43 -0.14 -4.77 118.68 123.05 3cg3 s LEU 286 Ca -0.04 2.08 -0.07 0.00 -1.03 0.00 0.00 54.13 55.06 3cg3 s LEU 286 Cb -0.14 -4.57 0.23 0.00 0.03 0.00 0.00 46.19 41.74 3cg3 s LEU 286 CO 0.04 -1.32 1.91 0.11 0.23 0.00 0.00 176.35 177.32 3cg3 h LYS 287 N 0.78 1.25 -0.75 1.70 1.57 -1.10 -2.63 116.57 117.39 3cg3 h LYS 287 Ca -0.49 -0.08 -0.27 0.00 -1.87 0.00 0.00 60.65 57.94 3cg3 h LYS 287 Cb 1.25 -0.28 -0.16 0.00 0.08 0.00 0.00 32.23 33.12 3cg3 h LYS 287 CO 0.56 0.84 0.32 0.09 -0.57 0.00 0.00 179.45 180.69 3cg3 n ASN 288 N -4.41 4.40 -4.66 0.86 3.02 -1.26 -4.99 115.26 108.21 3cg3 n ASN 288 Ca 0.11 -3.34 -0.46 0.00 -0.03 0.00 0.00 54.58 50.86 3cg3 n ASN 288 Cb 0.02 -0.75 -0.03 0.00 -0.61 0.00 0.00 39.78 38.41 3cg3 n ASN 288 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3cg3 n ALA 289 N -0.46 1.06 0.17 5.41 0.00 -1.00 -4.87 120.51 120.82 3cg3 n ALA 289 Ca 0.44 0.43 0.02 0.00 0.00 0.00 0.00 53.44 54.33 3cg3 n ALA 289 Cb 1.41 -2.29 0.37 0.00 0.00 0.00 0.00 19.45 18.94 3cg3 n ALA 289 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3cg3 h PRO 290 N 4.90 0.08 -2.16 0.00 0.13 -1.93 -3.22 132.00 129.80 3cg3 h PRO 290 Ca -0.45 -0.03 -0.56 0.00 -0.87 0.00 0.00 66.00 64.10 3cg3 h PRO 290 Cb 1.27 -0.01 -0.41 0.00 0.13 0.00 0.00 31.00 31.98 3cg3 h PRO 290 CO 0.81 0.37 -0.84 0.09 -0.23 0.00 0.00 178.00 178.20 3cg3 n ASN 291 N -4.16 2.91 -0.28 1.44 4.13 -1.26 -4.95 115.26 113.09 3cg3 n ASN 291 Ca -0.02 -3.36 -0.02 0.00 1.68 0.00 0.00 54.58 52.86 3cg3 n ASN 291 Cb 0.36 -0.60 0.10 0.00 -1.54 0.00 0.00 39.78 38.10 3cg3 n ASN 291 CO 0.00 0.00 0.00 -0.09 0.28 0.00 0.00 177.26 177.45 3cg3 h ARG 292 N 3.23 0.93 -0.55 3.52 2.43 -1.93 0.18 114.38 122.19 3cg3 h ARG 292 Ca 0.13 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.15 3cg3 h ARG 292 Cb 0.70 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 30.02 3cg3 h ARG 292 CO 0.69 0.62 0.00 0.93 -1.51 0.00 0.00 179.97 180.70 3cg3 h GLU 293 N 0.96 0.93 -0.25 0.20 5.08 -1.92 -0.28 114.58 119.30 3cg3 h GLU 293 Ca 0.31 -0.27 -0.16 0.00 -1.00 0.00 0.00 59.36 58.24 3cg3 h GLU 293 Cb 0.03 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3cg3 h GLU 293 CO -0.12 0.92 -0.49 1.25 -1.00 0.00 0.00 179.01 179.57 3cg3 h LEU 294 N 0.86 0.75 -1.03 1.33 5.85 -1.85 -2.24 115.31 118.98 3cg3 h LEU 294 Ca 0.16 -0.37 -0.04 0.00 0.84 0.00 0.00 57.88 58.46 3cg3 h LEU 294 Cb 0.50 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 3cg3 h LEU 294 CO 0.02 1.11 0.19 0.00 -0.34 0.00 0.00 178.44 179.42 3cg3 h ALA 295 N 0.91 1.22 -0.14 1.25 0.00 -0.26 -1.19 119.26 121.06 3cg3 h ALA 295 Ca 0.03 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 3cg3 h ALA 295 Cb 1.04 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3cg3 h ALA 295 CO 0.10 0.55 -0.46 0.82 0.00 0.00 0.00 179.25 180.26 3cg3 h ILE 296 N 0.86 1.33 -0.62 0.00 2.04 -0.87 -1.17 117.51 119.08 3cg3 h ILE 296 Ca 0.20 -1.66 -0.08 0.00 1.00 0.00 0.00 64.86 64.32 3cg3 h ILE 296 Cb 0.24 1.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.02 3cg3 h ILE 296 CO -0.01 0.50 0.07 -0.33 0.00 0.00 0.00 178.15 178.39 3cg3 h GLU 297 N 0.29 1.03 -0.66 2.37 4.39 -0.90 -0.82 114.58 120.28 3cg3 h GLU 297 Ca 0.02 -0.28 -0.08 0.00 0.34 0.00 0.00 59.36 59.36 3cg3 h GLU 297 Cb 0.93 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.43 3cg3 h GLU 297 CO 0.08 0.96 0.10 0.35 -1.16 0.00 0.00 179.01 179.34 3cg3 h PHE 298 N 0.96 1.15 -0.64 4.33 3.57 -0.81 -1.06 116.94 124.44 3cg3 h PHE 298 Ca 0.19 -0.16 -0.08 0.00 3.53 0.00 0.00 57.97 61.45 3cg3 h PHE 298 Cb 0.45 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 38.85 3cg3 h PHE 298 CO 0.03 0.97 0.08 1.25 -2.23 0.00 0.00 178.31 178.41 3cg3 h LEU 299 N 1.02 1.04 -0.72 0.59 5.85 -0.85 0.49 115.31 122.73 3cg3 h LEU 299 Ca 0.20 -0.27 -0.05 0.00 0.84 0.00 0.00 57.88 58.60 3cg3 h LEU 299 Cb 0.44 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 3cg3 h LEU 299 CO 0.01 1.05 0.25 -0.09 -0.34 0.00 0.00 178.44 179.33 3cg3 h ARG 300 N 1.00 1.09 -0.39 1.25 2.43 -0.86 -1.20 114.38 117.70 3cg3 h ARG 300 Ca 0.19 -0.22 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 3cg3 h ARG 300 Cb 0.47 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 3cg3 h ARG 300 CO 0.02 0.92 0.05 0.35 -1.51 0.00 0.00 179.97 179.80 3cg3 h PHE 301 N 1.04 0.69 -0.38 2.20 3.57 -0.86 -1.54 116.94 121.65 3cg3 h PHE 301 Ca 0.23 -0.10 -0.02 0.00 3.53 0.00 0.00 57.97 61.62 3cg3 h PHE 301 Cb 0.26 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 3cg3 h PHE 301 CO 0.02 0.69 0.18 1.25 -2.23 0.00 0.00 178.31 178.22 3cg3 h LEU 302 N 0.49 0.51 0.00 0.59 6.46 -0.63 -2.39 115.31 120.33 3cg3 h LEU 302 Ca 0.12 -0.13 0.00 0.00 -0.12 0.00 0.00 57.88 57.74 3cg3 h LEU 302 Cb 0.38 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 40.18 3cg3 h LEU 302 CO 0.01 0.50 0.00 0.18 -0.62 0.00 0.00 178.44 178.51 3cg3 n LEU 303 N -4.70 0.00 0.00 2.25 4.77 -0.48 -3.61 117.00 115.23 3cg3 n LEU 303 Ca -0.00 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 3cg3 n LEU 303 Cb 0.11 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 3cg3 n LEU 303 CO 0.36 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 3cg3 n GLY 304 N 1.31 -1.10 0.33 -0.72 0.00 -0.58 -4.75 105.19 99.68 3cg3 n GLY 304 Ca 0.12 -1.66 -0.04 0.00 0.00 0.00 0.00 46.02 44.43 3cg3 n GLY 304 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3cg3 h ASN 305 N -0.01 0.99 -0.32 1.61 2.35 -1.88 -1.55 115.58 116.78 3cg3 h ASN 305 Ca 0.00 -0.15 -0.09 0.00 -0.55 0.00 0.00 56.30 55.51 3cg3 h ASN 305 Cb 0.00 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.11 3cg3 h ASN 305 CO 0.00 0.89 -0.17 -0.33 -1.65 0.00 0.00 177.43 176.17 3cg3 h GLU 306 N 1.05 0.68 -0.52 0.81 5.08 -1.90 -1.89 114.58 117.89 3cg3 h GLU 306 Ca 0.24 -0.30 -0.09 0.00 -1.00 0.00 0.00 59.36 58.21 3cg3 h GLU 306 Cb 0.21 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 3cg3 h GLU 306 CO -0.02 0.90 -0.01 0.78 -1.00 0.00 0.00 179.01 179.66 3cg3 h GLY 307 N 0.45 1.00 1.01 -3.84 0.00 -1.51 -2.13 103.07 98.06 3cg3 h GLY 307 Ca 0.07 -0.75 -0.00 0.00 0.00 0.00 0.00 47.33 46.65 3cg3 h GLY 307 CO 0.05 0.69 0.48 -0.09 0.00 0.00 0.00 176.54 177.66 3cg3 h ARG 308 N 0.80 1.04 -0.49 4.80 2.43 -1.23 -0.83 114.38 120.90 3cg3 h ARG 308 Ca 0.15 -0.09 -0.03 0.00 -0.81 0.00 0.00 59.98 59.20 3cg3 h ARG 308 Cb 0.54 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.84 3cg3 h ARG 308 CO 0.03 0.72 0.18 -0.22 -1.51 0.00 0.00 179.97 179.17 3cg3 h LYS 309 N 1.05 0.74 -0.66 0.20 3.64 -1.17 -1.09 116.57 119.28 3cg3 h LYS 309 Ca 0.28 -0.15 -0.04 0.00 -1.27 0.00 0.00 60.65 59.47 3cg3 h LYS 309 Cb -0.06 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.62 3cg3 h LYS 309 CO -0.05 0.68 0.24 0.82 -2.27 0.00 0.00 179.45 178.87 3cg3 h ILE 310 N 0.65 1.24 -0.30 2.00 2.04 -0.95 -1.36 117.51 120.84 3cg3 h ILE 310 Ca 0.16 -0.80 -0.14 0.00 1.00 0.00 0.00 64.86 65.08 3cg3 h ILE 310 Cb 0.23 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 3cg3 h ILE 310 CO -0.01 0.31 -0.38 -0.26 0.00 0.00 0.00 178.15 177.81 3cg3 h PHE 311 N 0.95 0.82 -0.70 1.37 -1.00 -0.97 -2.36 116.94 115.04 3cg3 h PHE 311 Ca 0.22 -0.23 -0.01 0.00 2.81 0.00 0.00 57.97 60.75 3cg3 h PHE 311 Cb 0.25 -0.18 -0.03 0.00 3.61 0.00 0.00 35.95 39.60 3cg3 h PHE 311 CO 0.02 0.96 0.39 1.49 -1.61 0.00 0.00 178.31 179.56 3cg3 h GLU 312 N 0.57 0.97 0.00 1.51 4.81 -0.94 0.01 114.58 121.51 3cg3 h GLU 312 Ca 0.05 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3cg3 h GLU 312 Cb 0.91 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.10 3cg3 h GLU 312 CO 0.08 0.72 0.00 -0.44 -0.73 0.00 0.00 179.01 178.64 3cg3 h ASP 313 N 0.96 0.00 -0.45 1.04 3.32 -1.04 -1.93 116.42 118.32 3cg3 h ASP 313 Ca 0.25 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.29 3cg3 h ASP 313 Cb 0.03 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 3cg3 h ASP 313 CO -0.04 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.07 3cg3 n ASN 314 N -2.45 5.01 -2.71 6.45 4.13 -0.61 -4.95 115.26 120.13 3cg3 n ASN 314 Ca 0.01 -2.98 -0.19 0.00 1.68 0.00 0.00 54.58 53.10 3cg3 n ASN 314 Cb 0.23 -0.63 0.04 0.00 -1.54 0.00 0.00 39.78 37.88 3cg3 n ASN 314 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 3cg3 n TYR 315 N 0.16 -1.83 -3.20 3.10 4.02 -0.72 -4.74 117.16 113.94 3cg3 n TYR 315 Ca 0.26 0.52 -0.22 0.00 -0.01 0.00 0.00 57.90 58.45 3cg3 n TYR 315 Cb 1.09 -4.10 -0.07 0.00 -0.02 0.00 0.00 39.34 36.24 3cg3 n TYR 315 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79 3cg3 n GLN 316 N -3.71 0.43 -1.96 -0.72 7.27 -0.11 -4.46 117.38 114.12 3cg3 n GLN 316 Ca -0.08 -2.93 -0.39 0.00 0.07 0.00 0.00 57.00 53.67 3cg3 n GLN 316 Cb 0.60 -1.49 0.01 0.00 2.41 0.00 0.00 30.24 31.76 3cg3 n GLN 316 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 3cg3 s GLU 317 N -0.15 3.82 0.80 3.69 2.02 -1.26 -4.17 118.70 123.45 3cg3 s GLU 317 Ca 0.33 2.24 -0.10 0.00 0.02 0.00 0.00 54.97 57.46 3cg3 s GLU 317 Cb 0.09 -2.68 0.07 0.00 0.10 0.00 0.00 34.13 31.71 3cg3 s GLU 317 CO -0.16 -0.65 1.10 -0.06 0.02 0.00 0.00 175.26 175.52 3cg3 s PHE 318 N -1.25 2.41 0.63 1.61 0.40 -1.26 -4.05 117.98 116.46 3cg3 s PHE 318 Ca 0.59 1.59 -0.15 0.00 -0.60 0.00 0.00 56.93 58.37 3cg3 s PHE 318 Cb -0.40 -3.10 -0.02 0.00 0.51 0.00 0.00 43.02 40.01 3cg3 s PHE 318 CO 0.51 -1.99 1.07 -0.51 0.70 0.00 0.00 175.22 175.00 3cg3 s LEU 319 N -6.05 3.40 -0.45 -0.37 1.43 -0.18 -4.92 118.68 111.54 3cg3 s LEU 319 Ca 0.62 1.83 0.03 0.00 -1.03 0.00 0.00 54.13 55.58 3cg3 s LEU 319 Cb -0.18 -4.53 0.13 0.00 0.03 0.00 0.00 46.19 41.64 3cg3 s LEU 319 CO 0.56 -1.35 0.22 -0.44 0.23 0.00 0.00 176.35 175.57 3cg3 s SER 320 N -2.91 4.00 0.50 2.29 0.01 -1.26 -3.07 113.70 113.26 3cg3 s SER 320 Ca 0.63 -2.64 0.08 0.00 1.31 0.00 0.00 55.95 55.34 3cg3 s SER 320 Cb -0.17 -1.28 0.04 0.00 0.21 0.00 0.00 66.02 64.82 3cg3 s SER 320 CO 0.41 -0.28 0.56 -2.16 0.41 0.00 0.00 173.24 172.19 3cg3 s PRO 321 N 0.28 2.44 0.66 12.44 0.04 -1.26 -5.13 135.00 144.48 3cg3 s PRO 321 Ca 0.16 -1.64 -0.16 0.00 0.04 0.00 0.00 61.00 59.40 3cg3 s PRO 321 Cb -0.24 -2.47 0.00 0.00 0.04 0.00 0.00 34.50 31.83 3cg3 s PRO 321 CO -0.02 -0.54 1.19 -2.14 0.04 0.00 0.00 177.00 175.53 3cg3 s PRO 322 N -4.39 2.58 -0.08 0.56 0.02 -1.18 -4.79 135.00 127.73 3cg3 s PRO 322 Ca 0.51 1.72 0.02 0.00 0.02 0.00 0.00 61.00 63.27 3cg3 s PRO 322 Cb -0.05 -1.89 -0.02 0.00 0.02 0.00 0.00 34.50 32.56 3cg3 s PRO 322 CO 0.31 -1.48 -0.15 0.08 -0.33 0.00 0.00 177.00 175.43 3cg3 s VAL 323 N -1.90 2.94 0.05 3.83 1.01 -0.39 -1.18 120.40 124.76 3cg3 s VAL 323 Ca 0.74 -0.74 0.09 0.00 0.00 0.00 0.00 61.98 62.07 3cg3 s VAL 323 Cb -0.28 -2.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 3cg3 s VAL 323 CO 0.40 0.56 -0.25 0.00 0.00 0.00 0.00 175.10 175.81 3cg3 s ALA 324 N -0.26 2.32 0.13 5.51 0.00 0.70 0.05 121.76 130.21 3cg3 s ALA 324 Ca 0.01 -1.27 0.09 0.00 0.00 0.00 0.00 51.96 50.79 3cg3 s ALA 324 Cb -0.13 -0.51 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 3cg3 s ALA 324 CO 0.03 0.54 -0.21 -0.06 0.00 0.00 0.00 175.76 176.06 3cg3 s PHE 325 N -0.84 1.88 0.00 0.00 0.40 -0.30 -0.21 117.98 118.91 3cg3 s PHE 325 Ca 0.12 -0.43 0.00 0.00 -0.60 0.00 0.00 56.93 56.03 3cg3 s PHE 325 Cb -0.10 -1.00 0.00 0.00 0.51 0.00 0.00 43.02 42.43 3cg3 s PHE 325 CO 0.03 0.27 0.00 0.41 0.70 0.00 0.00 175.22 176.63 3cg3 n GLY 326 N 0.79 -0.31 3.35 4.36 0.00 -1.26 -1.96 105.19 110.17 3cg3 n GLY 326 Ca -0.17 -1.34 -0.43 0.00 0.00 0.00 0.00 46.02 44.08 3cg3 n GLY 326 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3cg3 n ASN 327 N 0.69 4.80 -4.71 1.61 5.15 -0.32 -4.95 115.26 117.53 3cg3 n ASN 327 Ca 0.00 -2.93 -0.42 0.00 -0.60 0.00 0.00 54.58 50.63 3cg3 n ASN 327 Cb 0.00 -1.68 -0.03 0.00 -0.53 0.00 0.00 39.78 37.54 3cg3 n ASN 327 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3cg3 s VAL 328 N 3.28 3.45 0.19 3.44 1.01 -1.26 -4.62 120.40 125.88 3cg3 s VAL 328 Ca 0.50 0.98 -0.33 0.00 0.00 0.00 0.00 61.98 63.13 3cg3 s VAL 328 Cb 0.05 -3.63 -0.13 0.00 0.00 0.00 0.00 36.38 32.67 3cg3 s VAL 328 CO 0.03 0.05 1.61 -2.65 0.00 0.00 0.00 175.10 174.14 3cg3 n PRO 329 N 4.50 2.35 0.25 2.72 -0.02 -1.26 -4.86 135.00 138.67 3cg3 n PRO 329 Ca 0.12 0.85 0.15 0.00 -2.02 0.00 0.00 63.50 62.59 3cg3 n PRO 329 Cb 0.43 -2.63 0.82 0.00 -0.02 0.00 0.00 33.50 32.10 3cg3 n PRO 329 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3cg3 h PRO 330 N 6.01 0.00 -0.30 0.52 0.13 -2.01 -2.28 132.00 134.07 3cg3 h PRO 330 Ca -0.44 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.75 3cg3 h PRO 330 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.35 3cg3 h PRO 330 CO 0.90 0.00 0.21 0.93 -0.23 0.00 0.00 178.00 179.80 3cg3 h GLU 331 N 0.00 0.11 -0.41 0.86 3.07 -1.97 -2.26 114.58 113.98 3cg3 h GLU 331 Ca 0.04 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.89 3cg3 h GLU 331 Cb 0.19 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 3cg3 h GLU 331 CO -0.00 0.07 0.00 0.44 -1.40 0.00 0.00 179.01 178.12 3cg3 n ILE 332 N -4.47 1.05 0.29 3.13 -5.35 -0.86 -4.69 119.36 108.45 3cg3 n ILE 332 Ca 0.04 -1.03 0.15 0.00 -0.27 0.00 0.00 62.75 61.64 3cg3 n ILE 332 Cb 0.30 0.47 0.89 0.00 -1.74 0.00 0.00 39.64 39.56 3cg3 n ILE 332 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 3cg3 h ARG 333 N 2.40 0.00 -0.00 6.28 2.43 -1.37 -1.37 114.38 122.75 3cg3 h ARG 333 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3cg3 h ARG 333 Cb 0.80 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 3cg3 h ARG 333 CO 0.01 0.02 -0.18 0.54 -1.51 0.00 0.00 179.97 178.85 3cg3 n ARG 334 N -3.78 0.63 0.00 0.20 1.74 -1.26 -3.81 116.66 110.37 3cg3 n ARG 334 Ca -0.03 -0.27 0.08 0.00 -0.77 0.00 0.00 57.85 56.87 3cg3 n ARG 334 Cb 0.11 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.02 3cg3 n ARG 334 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3cg3 n LEU 335 N -0.95 1.39 -4.19 0.55 4.77 -0.52 -5.01 117.00 113.03 3cg3 n LEU 335 Ca 0.13 -0.67 -0.11 0.00 -0.03 0.00 0.00 56.01 55.33 3cg3 n LEU 335 Cb 0.31 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.30 3cg3 n LEU 335 CO 0.25 0.28 -0.32 0.68 -1.33 0.00 0.00 177.39 176.96 3cg3 s VAL 336 N -2.25 0.39 -0.24 4.08 -7.23 -1.17 -4.28 120.40 109.70 3cg3 s VAL 336 Ca 0.12 -1.94 -0.10 0.00 -1.81 0.00 0.00 61.98 58.25 3cg3 s VAL 336 Cb 0.14 -2.03 -0.05 0.00 0.56 0.00 0.00 36.38 35.00 3cg3 s VAL 336 CO 0.54 -0.52 0.15 -0.70 -0.31 0.00 0.00 175.10 174.26 3cg3 s GLU 337 N -3.97 4.02 0.05 4.82 2.12 -0.33 -4.90 118.70 120.50 3cg3 s GLU 337 Ca 0.22 -0.30 -0.21 0.00 0.36 0.00 0.00 54.97 55.05 3cg3 s GLU 337 Cb 0.07 -3.52 -0.06 0.00 0.26 0.00 0.00 34.13 30.87 3cg3 s GLU 337 CO 0.02 0.02 0.63 0.14 -0.54 0.00 0.00 175.26 175.52 3cg3 s VAL 338 N 1.16 4.76 0.00 3.70 -7.23 -1.26 -0.21 120.40 121.31 3cg3 s VAL 338 Ca 0.07 1.33 0.00 0.00 -1.81 0.00 0.00 61.98 61.57 3cg3 s VAL 338 Cb -0.14 -3.96 0.00 0.00 0.56 0.00 0.00 36.38 32.84 3cg3 s VAL 338 CO 0.05 0.47 0.19 0.29 -0.31 0.00 0.00 175.10 175.80