#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h3z s ALA 3 N 0.00 -0.36 0.41 4.61 0.00 -1.26 -5.19 121.76 119.97 2h3z s ALA 3 Ca 0.00 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.20 2h3z s ALA 3 Cb 0.00 1.03 -0.01 0.00 0.00 0.00 0.00 23.12 24.14 2h3z s ALA 3 CO 0.00 -0.86 0.11 0.54 0.00 0.00 0.00 175.76 175.55 2h3z n ARG 4 N -0.38 0.65 0.13 0.00 1.74 -1.26 -5.07 116.66 112.47 2h3z n ARG 4 Ca -0.03 -3.33 -0.23 0.00 -0.77 0.00 0.00 57.85 53.49 2h3z n ARG 4 Cb 0.62 1.61 -0.15 0.00 -1.02 0.00 0.00 32.46 33.52 2h3z n ARG 4 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2h3z h ALA 5 N 1.56 -0.08 -2.11 7.54 0.00 -2.03 -3.47 119.26 120.68 2h3z h ALA 5 Ca -0.32 -0.84 -0.55 0.00 0.00 0.00 0.00 54.91 53.20 2h3z h ALA 5 Cb 1.17 0.13 0.22 0.00 0.00 0.00 0.00 17.79 19.31 2h3z h ALA 5 CO 0.52 0.74 -1.20 -1.13 0.00 0.00 0.00 179.25 178.18 2h3z n SER 6 N -3.70 -3.96 0.03 0.00 3.41 -1.26 -4.90 113.62 103.23 2h3z n SER 6 Ca -0.15 0.30 -0.20 0.00 -0.26 0.00 0.00 58.87 58.57 2h3z n SER 6 Cb 1.06 -0.98 -0.10 0.00 -0.26 0.00 0.00 64.21 63.93 2h3z n SER 6 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2h3z h VAL 7 N -1.09 1.29 -3.66 -3.33 2.07 -1.90 -3.45 116.25 106.18 2h3z h VAL 7 Ca -0.44 -2.21 -0.68 0.00 0.82 0.00 0.00 66.70 64.20 2h3z h VAL 7 Cb 1.31 2.37 -0.21 0.00 -1.52 0.00 0.00 31.29 33.24 2h3z h VAL 7 CO 0.30 0.68 -0.72 -0.76 0.02 0.00 0.00 177.57 177.10 2h3z s LEU 8 N -8.16 3.02 0.00 2.57 1.43 -1.26 -4.66 118.68 111.62 2h3z s LEU 8 Ca -0.10 -0.11 0.00 0.00 -1.03 0.00 0.00 54.13 52.89 2h3z s LEU 8 Cb 0.07 -1.66 0.00 0.00 0.03 0.00 0.00 46.19 44.63 2h3z s LEU 8 CO 0.91 0.31 0.00 -1.20 0.23 0.00 0.00 176.35 176.60 2h3z n SER 9 N 2.57 -0.13 0.26 2.29 7.64 -1.26 -4.63 113.62 120.35 2h3z n SER 9 Ca -0.18 -0.40 -0.12 0.00 1.01 0.00 0.00 58.87 59.18 2h3z n SER 9 Cb 0.53 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.67 2h3z n SER 9 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2h3z h GLY 10 N -0.07 -0.74 2.00 0.23 0.00 -2.00 0.36 103.07 102.85 2h3z h GLY 10 Ca 0.00 0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.59 2h3z h GLY 10 CO 0.00 -0.27 -0.05 -1.33 0.00 0.00 0.00 176.54 174.89 2h3z h GLY 11 N -1.16 0.00 1.12 4.60 0.00 -2.02 -2.50 103.07 103.11 2h3z h GLY 11 Ca -0.07 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 46.95 2h3z h GLY 11 CO 0.12 0.00 -1.34 0.83 0.00 0.00 0.00 176.54 176.15 2h3z h GLU 12 N 0.00 0.49 -0.69 4.80 5.08 -1.91 -3.28 114.58 119.06 2h3z h GLU 12 Ca -0.00 -0.83 0.13 0.00 -1.00 0.00 0.00 59.36 57.65 2h3z h GLU 12 Cb 0.13 0.31 -0.09 0.00 0.50 0.00 0.00 28.75 29.60 2h3z h GLU 12 CO 0.01 1.40 0.25 1.25 -1.00 0.00 0.00 179.01 180.92 2h3z h LEU 13 N 0.03 0.21 0.25 1.33 6.46 -0.46 0.48 115.31 123.61 2h3z h LEU 13 Ca -0.24 0.10 -0.00 0.00 -0.12 0.00 0.00 57.88 57.63 2h3z h LEU 13 Cb 2.05 0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 42.07 2h3z h LEU 13 CO 0.25 0.09 -0.20 -0.78 -0.62 0.00 0.00 178.44 177.18 2h3z h ASP 14 N 0.40 -0.52 0.28 1.25 3.58 -1.64 0.20 116.42 119.97 2h3z h ASP 14 Ca 0.37 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.87 2h3z h ASP 14 Cb 0.54 0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.76 2h3z h ASP 14 CO -0.38 -0.31 0.00 0.11 -2.88 0.00 0.00 179.24 175.78 2h3z h LYS 15 N -0.46 0.00 0.03 0.28 6.56 -1.43 -2.54 116.57 119.01 2h3z h LYS 15 Ca -0.01 0.00 -0.06 0.00 -1.06 0.00 0.00 60.65 59.52 2h3z h LYS 15 Cb 0.41 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.07 2h3z h LYS 15 CO -0.02 0.00 -0.27 2.35 -2.06 0.00 0.00 179.45 179.45 2h3z h TRP 16 N 0.00 0.12 0.00 -1.35 2.91 0.24 -3.27 115.95 114.60 2h3z h TRP 16 Ca 0.00 -0.09 0.00 0.00 1.13 0.00 0.00 58.89 59.93 2h3z h TRP 16 Cb 0.14 -0.00 0.00 0.00 -0.51 0.00 0.00 29.16 28.78 2h3z h TRP 16 CO 0.00 1.10 0.00 0.93 -1.03 0.00 0.00 178.44 179.44 2h3z h GLU 17 N -0.86 0.00 0.36 2.65 5.08 -0.65 -3.07 114.58 118.10 2h3z h GLU 17 Ca -0.06 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 2h3z h GLU 17 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 2h3z h GLU 17 CO 0.02 0.00 -0.17 0.87 -1.00 0.00 0.00 179.01 178.73 2h3z h LYS 18 N 0.00 -0.47 -6.36 2.33 1.57 -1.53 -3.30 116.57 108.80 2h3z h LYS 18 Ca 0.00 0.03 -0.61 0.00 -1.87 0.00 0.00 60.65 58.21 2h3z h LYS 18 Cb 0.14 0.11 0.14 0.00 0.08 0.00 0.00 32.23 32.69 2h3z h LYS 18 CO 0.00 -0.31 -0.29 -0.89 -0.57 0.00 0.00 179.45 177.39 2h3z n ILE 19 N -4.34 1.90 -4.33 1.86 5.41 -1.16 -4.57 119.36 114.13 2h3z n ILE 19 Ca -0.06 -0.50 -0.23 0.00 1.00 0.00 0.00 62.75 62.96 2h3z n ILE 19 Cb 0.19 -0.63 -0.08 0.00 -0.71 0.00 0.00 39.64 38.41 2h3z n ILE 19 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 2h3z s ARG 20 N -1.61 2.17 0.23 0.38 0.52 -1.26 -0.16 118.95 119.22 2h3z s ARG 20 Ca 0.63 -1.49 -0.05 0.00 -0.52 0.00 0.00 55.73 54.30 2h3z s ARG 20 Cb -0.62 -2.08 0.24 0.00 0.52 0.00 0.00 34.95 33.01 2h3z s ARG 20 CO 0.58 0.36 1.77 -0.07 0.02 0.00 0.00 175.30 177.95 2h3z h LEU 21 N 1.97 0.95 -9.12 2.53 3.38 -1.69 -1.69 115.31 111.65 2h3z h LEU 21 Ca -0.43 -0.19 -0.58 0.00 0.09 0.00 0.00 57.88 56.77 2h3z h LEU 21 Cb 1.25 -0.25 -0.15 0.00 0.09 0.00 0.00 40.66 41.60 2h3z h LEU 21 CO 0.60 0.92 -0.76 -0.13 0.09 0.00 0.00 178.44 179.16 2h3z s ARG 22 N -5.28 1.58 0.09 1.13 0.52 -1.26 -3.87 118.95 111.86 2h3z s ARG 22 Ca -0.11 -1.70 -0.16 0.00 -0.52 0.00 0.00 55.73 53.24 2h3z s ARG 22 Cb 0.15 -1.63 -0.10 0.00 0.52 0.00 0.00 34.95 33.90 2h3z s ARG 22 CO 0.83 0.30 1.41 -1.00 0.02 0.00 0.00 175.30 176.86 2h3z h PRO 23 N 2.45 0.64 -0.65 3.54 0.13 -1.89 -3.26 132.00 132.96 2h3z h PRO 23 Ca -0.40 -0.34 -0.40 0.00 -0.87 0.00 0.00 66.00 63.99 2h3z h PRO 23 Cb 1.25 0.01 -0.24 0.00 0.13 0.00 0.00 31.00 32.15 2h3z h PRO 23 CO 0.59 0.94 0.04 0.41 -0.23 0.00 0.00 178.00 179.75 2h3z n GLY 24 N 0.16 5.39 3.19 1.56 0.00 -1.26 -5.00 105.19 109.23 2h3z n GLY 24 Ca -0.04 -1.75 -0.20 0.00 0.00 0.00 0.00 46.02 44.03 2h3z n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h3z n GLY 25 N -1.00 2.57 0.00 -0.02 0.00 -1.23 -5.05 105.19 100.46 2h3z n GLY 25 Ca 0.45 -2.26 0.00 0.00 0.00 0.00 0.00 46.02 44.21 2h3z n GLY 25 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h3z n LYS 26 N -1.70 1.26 -2.98 1.61 5.02 -1.26 -4.95 118.16 115.17 2h3z n LYS 26 Ca 0.02 -0.36 -0.43 0.00 -2.02 0.00 0.00 58.31 55.53 2h3z n LYS 26 Cb 0.51 -0.86 -0.05 0.00 -0.02 0.00 0.00 35.03 34.61 2h3z n LYS 26 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2h3z s LYS 27 N -0.28 3.39 0.69 1.97 2.20 -1.26 -5.05 119.74 121.41 2h3z s LYS 27 Ca 0.00 -0.14 -0.06 0.00 -0.36 0.00 0.00 55.97 55.41 2h3z s LYS 27 Cb 0.00 -3.94 0.06 0.00 -1.51 0.00 0.00 37.83 32.44 2h3z s LYS 27 CO 0.00 -1.12 1.00 -0.65 -0.36 0.00 0.00 175.35 174.22 2h3z s GLN 28 N 3.26 2.18 0.33 4.03 -0.21 -1.26 -2.04 119.66 125.94 2h3z s GLN 28 Ca 0.29 -0.35 -0.27 0.00 0.02 0.00 0.00 55.36 55.06 2h3z s GLN 28 Cb -0.12 -2.20 -0.09 0.00 1.00 0.00 0.00 33.01 31.59 2h3z s GLN 28 CO 0.22 -1.22 1.02 0.71 -2.12 0.00 0.00 175.29 173.90 2h3z s TYR 29 N -3.21 3.54 0.21 0.91 2.02 0.77 -4.70 117.35 116.89 2h3z s TYR 29 Ca 0.60 1.73 -0.02 0.00 -0.37 0.00 0.00 57.07 59.01 2h3z s TYR 29 Cb -0.10 -3.09 -0.04 0.00 -0.40 0.00 0.00 41.96 38.33 2h3z s TYR 29 CO 0.44 -0.26 0.17 0.15 -1.57 0.00 0.00 175.55 174.48 2h3z s LYS 30 N -1.98 1.26 0.34 -0.62 1.02 -1.26 -4.04 119.74 114.46 2h3z s LYS 30 Ca 0.51 -1.62 0.09 0.00 0.02 0.00 0.00 55.97 54.97 2h3z s LYS 30 Cb -0.24 0.29 0.84 0.00 -0.52 0.00 0.00 37.83 38.20 2h3z s LYS 30 CO 0.30 -0.42 1.81 1.25 -0.92 0.00 0.00 175.35 177.37 2h3z h LEU 31 N 2.57 0.68 -0.57 3.17 5.85 -1.98 -1.66 115.31 123.36 2h3z h LEU 31 Ca -0.35 0.07 0.11 0.00 0.84 0.00 0.00 57.88 58.55 2h3z h LEU 31 Cb 1.25 -0.05 -0.11 0.00 0.37 0.00 0.00 40.66 42.12 2h3z h LEU 31 CO 0.51 0.26 -0.29 0.11 -0.34 0.00 0.00 178.44 178.69 2h3z h LYS 32 N 0.67 -0.14 -0.32 1.25 1.57 -1.99 0.40 116.57 118.01 2h3z h LYS 32 Ca 0.54 0.01 0.07 0.00 -1.87 0.00 0.00 60.65 59.40 2h3z h LYS 32 Cb 0.96 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.28 2h3z h LYS 32 CO -0.30 -0.09 0.23 0.45 -0.57 0.00 0.00 179.45 179.16 2h3z h HIS 33 N -0.14 0.11 0.04 -1.35 3.86 -1.71 0.47 115.15 116.43 2h3z h HIS 33 Ca 0.24 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.45 2h3z h HIS 33 Cb 0.53 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 28.97 2h3z h HIS 33 CO -0.59 0.06 -0.02 0.82 0.86 0.00 0.00 177.93 179.05 2h3z h ILE 34 N 0.11 0.00 -1.03 2.45 2.04 -0.27 -3.19 117.51 117.61 2h3z h ILE 34 Ca 0.15 -0.15 0.27 0.00 1.00 0.00 0.00 64.86 66.14 2h3z h ILE 34 Cb 0.45 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.46 2h3z h ILE 34 CO -0.02 0.00 0.69 0.58 0.00 0.00 0.00 178.15 179.41 2h3z h VAL 35 N -0.20 0.52 0.49 1.67 2.07 -1.17 -1.43 116.25 118.20 2h3z h VAL 35 Ca -0.01 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 2h3z h VAL 35 Cb 0.04 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.03 2h3z h VAL 35 CO 0.01 0.05 -0.44 -0.25 0.02 0.00 0.00 177.57 176.96 2h3z h TRP 36 N 0.27 -1.19 -0.56 1.57 7.01 -1.01 -2.18 115.95 119.86 2h3z h TRP 36 Ca 0.55 0.00 0.06 0.00 2.11 0.00 0.00 58.89 61.62 2h3z h TRP 36 Cb 1.64 0.46 -0.03 0.00 -2.10 0.00 0.00 29.16 29.13 2h3z h TRP 36 CO -0.00 -0.61 0.37 0.00 -2.79 0.00 0.00 178.44 175.41 2h3z h ALA 37 N -0.65 1.88 -0.08 2.65 0.00 -1.26 -0.36 119.26 121.44 2h3z h ALA 37 Ca -0.05 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.86 2h3z h ALA 37 Cb 0.80 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 2h3z h ALA 37 CO -0.03 0.03 0.07 0.77 0.00 0.00 0.00 179.25 180.08 2h3z h SER 38 N 0.50 0.00 1.22 0.00 0.02 -0.90 0.18 113.55 114.57 2h3z h SER 38 Ca 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 2h3z h SER 38 Cb 0.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.86 2h3z h SER 38 CO -0.07 0.00 -0.68 0.03 -1.14 0.00 0.00 176.83 174.97 2h3z h ARG 39 N 0.00 0.00 0.08 3.45 3.08 -0.72 -3.34 114.38 116.94 2h3z h ARG 39 Ca 0.04 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.77 2h3z h ARG 39 Cb 0.17 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.20 2h3z h ARG 39 CO -0.00 0.00 -1.72 1.49 -1.07 0.00 0.00 179.97 178.67 2h3z h GLU 40 N 0.00 0.18 -0.73 0.04 4.57 -0.66 -3.36 114.58 114.61 2h3z h GLU 40 Ca 0.00 -0.30 0.05 0.00 -1.18 0.00 0.00 59.36 57.93 2h3z h GLU 40 Cb 0.95 0.11 -0.05 0.00 -0.16 0.00 0.00 28.75 29.60 2h3z h GLU 40 CO 0.00 0.96 0.44 -0.07 -1.18 0.00 0.00 179.01 179.15 2h3z h LEU 41 N 0.05 0.68 -2.62 1.64 3.38 -0.88 0.09 115.31 117.64 2h3z h LEU 41 Ca -0.31 0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.69 2h3z h LEU 41 Cb 2.02 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 42.64 2h3z h LEU 41 CO 0.11 0.45 0.10 -0.33 0.09 0.00 0.00 178.44 178.86 2h3z h GLU 42 N 0.81 0.00 0.00 1.13 5.08 -1.60 0.21 114.58 120.22 2h3z h GLU 42 Ca 0.31 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.61 2h3z h GLU 42 Cb 0.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2h3z h GLU 42 CO -0.16 0.00 -0.58 -0.09 -1.00 0.00 0.00 179.01 177.18 2h3z h ARG 43 N 0.00 0.00 -0.71 2.33 2.43 -1.15 -3.25 114.38 114.04 2h3z h ARG 43 Ca 0.01 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.11 2h3z h ARG 43 Cb 0.21 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.72 2h3z h ARG 43 CO -0.00 0.24 0.10 1.19 -1.51 0.00 0.00 179.97 179.99 2h3z n PHE 44 N -3.05 1.92 -1.63 2.20 3.72 0.64 -4.87 117.46 116.39 2h3z n PHE 44 Ca 0.00 -0.79 -0.17 0.00 -0.05 0.00 0.00 57.45 56.45 2h3z n PHE 44 Cb 0.66 -0.52 -0.06 0.00 -0.94 0.00 0.00 39.48 38.62 2h3z n PHE 44 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2h3z n ALA 45 N 0.29 -0.29 -3.67 4.37 0.00 -1.16 -4.98 120.51 115.06 2h3z n ALA 45 Ca 0.28 0.24 -0.34 0.00 0.00 0.00 0.00 53.44 53.63 2h3z n ALA 45 Cb 1.13 -1.76 -0.15 0.00 0.00 0.00 0.00 19.45 18.67 2h3z n ALA 45 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2h3z s VAL 46 N -2.65 2.66 0.33 0.00 1.01 -0.61 -5.02 120.40 116.13 2h3z s VAL 46 Ca 0.00 -0.75 -0.29 0.00 0.00 0.00 0.00 61.98 60.94 2h3z s VAL 46 Cb 0.00 -2.15 -0.11 0.00 0.00 0.00 0.00 36.38 34.12 2h3z s VAL 46 CO 0.00 0.50 1.43 0.20 0.00 0.00 0.00 175.10 177.23 2h3z s ASN 47 N 1.14 6.54 0.00 3.32 -0.87 -1.26 -2.43 114.94 121.38 2h3z s ASN 47 Ca 0.01 2.86 0.15 0.00 -1.57 0.00 0.00 52.86 54.30 2h3z s ASN 47 Cb -0.14 -2.65 0.70 0.00 -0.02 0.00 0.00 41.25 39.14 2h3z s ASN 47 CO -0.05 -0.74 1.42 -0.81 -2.57 0.00 0.00 177.10 174.35 2h3z n PRO 48 N 1.06 0.15 0.08 -0.60 -0.04 -1.26 -2.63 135.00 131.75 2h3z n PRO 48 Ca 0.02 0.18 0.11 0.00 -0.04 0.00 0.00 63.50 63.77 2h3z n PRO 48 Cb 0.40 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.81 2h3z n PRO 48 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2h3z n GLY 49 N -0.03 -1.35 0.00 0.55 0.00 -1.26 -2.58 105.19 100.51 2h3z n GLY 49 Ca 0.06 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.22 2h3z n GLY 49 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2h3z n LEU 50 N -1.97 0.00 0.07 0.99 4.77 -1.08 -2.75 117.00 117.03 2h3z n LEU 50 Ca 0.04 0.11 0.12 0.00 -0.03 0.00 0.00 56.01 56.24 2h3z n LEU 50 Cb 0.28 -0.11 0.03 0.00 -2.33 0.00 0.00 43.42 41.29 2h3z n LEU 50 CO 0.22 -0.01 0.04 0.18 -1.33 0.00 0.00 177.39 176.49 2h3z n LEU 51 N -1.11 0.72 -1.84 2.23 4.77 -1.07 -1.54 117.00 119.17 2h3z n LEU 51 Ca 0.18 0.22 -0.16 0.00 -0.03 0.00 0.00 56.01 56.22 2h3z n LEU 51 Cb 0.14 -0.09 0.12 0.00 -2.33 0.00 0.00 43.42 41.27 2h3z n LEU 51 CO 0.18 -0.10 1.04 -1.84 -1.33 0.00 0.00 177.39 175.33 2h3z n GLU 52 N -2.38 1.87 -3.29 3.23 0.28 -1.11 -4.76 120.64 114.49 2h3z n GLU 52 Ca 0.01 -2.06 0.03 0.00 -0.16 0.00 0.00 57.16 54.98 2h3z n GLU 52 Cb 0.50 -1.81 -0.02 0.00 1.43 0.00 0.00 31.44 31.54 2h3z n GLU 52 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 177.13 176.89 2h3z s THR 53 N -2.25 -0.67 0.32 3.84 -1.32 -1.25 -5.03 115.64 109.28 2h3z s THR 53 Ca 0.39 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 60.97 2h3z s THR 53 Cb 0.33 -1.00 0.32 0.00 -1.51 0.00 0.00 72.50 70.63 2h3z s THR 53 CO 0.08 0.00 1.72 0.77 -2.21 0.00 0.00 174.62 174.98 2h3z h SER 54 N 7.86 0.66 -0.12 8.08 4.64 -1.85 0.64 113.55 133.46 2h3z h SER 54 Ca -0.18 0.14 -0.06 0.00 -0.47 0.00 0.00 61.79 61.22 2h3z h SER 54 Cb 1.14 0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 63.26 2h3z h SER 54 CO 0.09 0.08 -0.10 -0.33 -0.87 0.00 0.00 176.83 175.70 2h3z h GLU 55 N 0.56 0.44 0.00 4.77 3.07 -1.96 -2.55 114.58 118.91 2h3z h GLU 55 Ca 0.65 -0.11 -0.04 0.00 -0.50 0.00 0.00 59.36 59.36 2h3z h GLU 55 Cb 1.27 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 29.12 2h3z h GLU 55 CO -0.48 0.55 -0.48 0.78 -1.40 0.00 0.00 179.01 177.98 2h3z h GLY 56 N 0.87 0.00 2.00 -3.84 0.00 -0.06 -3.27 103.07 98.77 2h3z h GLY 56 Ca 0.08 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.37 2h3z h GLY 56 CO 0.02 0.00 -0.22 0.00 0.00 0.00 0.00 176.54 176.35 2h3z h ARG 58 N 0.00 0.82 -0.30 0.00 2.43 -1.56 -2.87 114.38 112.90 2h3z h ARG 58 Ca -0.00 -0.36 -0.01 0.00 -0.81 0.00 0.00 59.98 58.80 2h3z h ARG 58 Cb 0.86 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.37 2h3z h ARG 58 CO 0.03 0.99 0.14 1.96 -1.51 0.00 0.00 179.97 181.59 2h3z h GLN 59 N 0.71 0.42 0.64 0.20 1.08 -1.70 -0.62 115.11 115.83 2h3z h GLN 59 Ca 0.09 -0.04 -0.03 0.00 -1.45 0.00 0.00 58.65 57.21 2h3z h GLN 59 Cb 0.81 -0.09 0.01 0.00 -0.05 0.00 0.00 27.48 28.16 2h3z h GLN 59 CO 0.07 0.33 -0.31 0.82 -0.95 0.00 0.00 178.83 178.79 2h3z h ILE 60 N 0.42 0.18 -1.00 2.54 2.04 -1.60 -1.23 117.51 118.87 2h3z h ILE 60 Ca 0.11 -0.32 0.04 0.00 1.00 0.00 0.00 64.86 65.69 2h3z h ILE 60 Cb 0.05 0.24 -0.06 0.00 -0.74 0.00 0.00 36.82 36.31 2h3z h ILE 60 CO -0.02 0.02 0.65 -0.07 0.00 0.00 0.00 178.15 178.74 2h3z h LEU 61 N -1.12 1.08 -1.62 1.44 3.38 -1.45 -0.61 115.31 116.41 2h3z h LEU 61 Ca -0.09 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 2h3z h LEU 61 Cb 0.69 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 2h3z h LEU 61 CO 0.14 0.73 -0.09 1.23 0.09 0.00 0.00 178.44 180.55 2h3z h GLY 62 N 1.25 0.00 0.00 0.83 0.00 -1.10 0.64 103.07 104.68 2h3z h GLY 62 Ca 0.40 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.67 2h3z h GLY 62 CO -0.13 0.00 -0.36 1.46 0.00 0.00 0.00 176.54 177.51 2h3z h GLN 63 N 0.00 0.00 0.00 4.80 7.50 0.11 -3.35 115.11 124.17 2h3z h GLN 63 Ca -0.00 0.00 -0.07 0.00 0.50 0.00 0.00 58.65 59.07 2h3z h GLN 63 Cb 0.49 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.01 2h3z h GLN 63 CO 0.01 0.88 -0.36 -0.07 -1.50 0.00 0.00 178.83 177.79 2h3z h LEU 64 N -1.00 0.00 -0.24 1.46 3.38 -1.24 -3.28 115.31 114.39 2h3z h LEU 64 Ca -0.09 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.91 2h3z h LEU 64 Cb 0.98 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.68 2h3z h LEU 64 CO -0.06 0.36 -0.38 1.56 0.09 0.00 0.00 178.44 180.01 2h3z h GLN 65 N 0.00 -0.29 0.00 1.13 4.20 -1.00 0.45 115.11 119.60 2h3z h GLN 65 Ca -0.00 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.73 2h3z h GLN 65 Cb 0.78 0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.63 2h3z h GLN 65 CO 0.05 -0.19 0.00 -0.35 -0.67 0.00 0.00 178.83 177.67 2h3z n PRO 66 N -4.52 0.49 0.00 1.46 -0.04 -1.24 -1.75 135.00 129.40 2h3z n PRO 66 Ca -0.03 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.47 2h3z n PRO 66 Cb 0.24 -1.36 -0.01 0.00 -0.04 0.00 0.00 33.50 32.32 2h3z n PRO 66 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2h3z n SER 67 N -0.86 0.89 0.23 3.54 7.64 0.12 -4.53 113.62 120.64 2h3z n SER 67 Ca 0.09 -0.94 0.14 0.00 1.01 0.00 0.00 58.87 59.16 2h3z n SER 67 Cb 0.04 0.61 0.77 0.00 -1.01 0.00 0.00 64.21 64.61 2h3z n SER 67 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2h3z h LEU 68 N 0.66 0.00 0.16 -3.43 3.38 0.37 -1.13 115.31 115.32 2h3z h LEU 68 Ca 0.00 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.69 2h3z h LEU 68 Cb 0.25 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.01 2h3z h LEU 68 CO 0.00 0.00 -1.36 -0.61 0.09 0.00 0.00 178.44 176.56 2h3z h GLN 69 N 0.00 0.34 -1.05 1.13 -0.00 -1.80 -3.34 115.11 110.39 2h3z h GLN 69 Ca 0.00 -0.58 -0.63 0.00 -0.00 0.00 0.00 58.65 57.44 2h3z h GLN 69 Cb 0.16 0.21 -0.28 0.00 0.00 0.00 0.00 27.48 27.58 2h3z h GLN 69 CO 0.00 1.28 0.81 0.25 0.00 0.00 0.00 178.83 181.17 2h3z n THR 70 N -3.87 3.51 -3.81 2.39 -2.24 -0.46 -4.91 114.28 104.88 2h3z n THR 70 Ca -0.21 -2.70 -0.12 0.00 -2.27 0.00 0.00 64.05 58.74 2h3z n THR 70 Cb 0.95 -1.12 -0.11 0.00 -2.10 0.00 0.00 70.33 67.95 2h3z n THR 70 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2h3z s GLY 71 N -1.58 -0.13 0.00 3.38 0.00 -0.98 -5.05 107.32 102.97 2h3z s GLY 71 Ca 0.61 0.47 0.00 0.00 0.00 0.00 0.00 44.72 45.80 2h3z s GLY 71 CO 0.00 0.37 0.00 -1.14 0.00 0.00 0.00 173.10 172.33 2h3z n SER 72 N 2.58 0.00 0.18 1.64 3.41 -1.26 -4.87 113.62 115.30 2h3z n SER 72 Ca -0.15 -0.23 0.08 0.00 -0.26 0.00 0.00 58.87 58.31 2h3z n SER 72 Cb 0.58 0.00 0.59 0.00 -0.26 0.00 0.00 64.21 65.11 2h3z n SER 72 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2h3z h GLU 73 N 0.00 0.14 -0.61 4.33 4.39 -1.99 -1.49 114.58 119.35 2h3z h GLU 73 Ca 0.00 -0.01 0.18 0.00 0.34 0.00 0.00 59.36 59.87 2h3z h GLU 73 Cb 0.00 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 2h3z h GLU 73 CO 0.00 0.09 0.57 0.93 -1.16 0.00 0.00 179.01 179.44 2h3z h GLU 74 N 0.14 0.00 0.00 2.33 3.07 -2.02 0.26 114.58 118.36 2h3z h GLU 74 Ca 0.05 0.00 -0.23 0.00 -0.50 0.00 0.00 59.36 58.68 2h3z h GLU 74 Cb 0.04 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 27.90 2h3z h GLU 74 CO -0.01 0.00 -1.92 -0.11 -1.40 0.00 0.00 179.01 175.57 2h3z n LEU 75 N -3.84 0.38 0.06 1.33 7.94 -0.57 -4.31 117.00 117.99 2h3z n LEU 75 Ca 0.12 0.17 -0.12 0.00 -1.11 0.00 0.00 56.01 55.07 2h3z n LEU 75 Cb 0.80 0.24 -0.06 0.00 0.53 0.00 0.00 43.42 44.92 2h3z n LEU 75 CO 0.30 0.28 0.82 -0.09 -1.11 0.00 0.00 177.39 177.60 2h3z h ARG 76 N 0.00 -0.12 -0.56 1.96 1.12 -0.36 -1.83 114.38 114.59 2h3z h ARG 76 Ca -0.30 0.01 0.11 0.00 -1.11 0.00 0.00 59.98 58.69 2h3z h ARG 76 Cb 1.79 0.03 -0.08 0.00 -0.01 0.00 0.00 29.97 31.69 2h3z h ARG 76 CO 0.04 -0.08 0.09 0.77 -3.11 0.00 0.00 179.97 177.67 2h3z h SER 77 N -0.13 -0.07 0.37 -3.80 0.02 -1.65 -0.88 113.55 107.42 2h3z h SER 77 Ca 0.02 0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2h3z h SER 77 Cb 0.15 0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.84 2h3z h SER 77 CO -0.05 -0.02 -0.27 -0.07 -1.14 0.00 0.00 176.83 175.28 2h3z h LEU 78 N 0.21 -0.70 -0.38 5.07 -0.00 -1.67 0.82 115.31 118.65 2h3z h LEU 78 Ca 0.29 0.05 0.08 0.00 -0.00 0.00 0.00 57.88 58.30 2h3z h LEU 78 Cb 0.43 0.22 -0.08 0.00 -0.00 0.00 0.00 40.66 41.23 2h3z h LEU 78 CO -0.40 -0.41 -0.20 0.22 -0.00 0.00 0.00 178.44 177.64 2h3z h TYR 79 N -0.64 -0.50 0.90 1.13 3.20 -0.77 0.36 116.97 120.66 2h3z h TYR 79 Ca -0.03 0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.84 2h3z h TYR 79 Cb 0.55 0.28 0.00 0.00 1.54 0.00 0.00 36.73 39.10 2h3z h TYR 79 CO -0.13 -0.28 -0.49 -0.91 -1.64 0.00 0.00 178.16 174.71 2h3z h ASN 80 N -0.13 -1.20 0.04 -2.11 4.21 -0.99 -0.60 115.58 114.79 2h3z h ASN 80 Ca 0.19 0.05 0.02 0.00 1.21 0.00 0.00 56.30 57.77 2h3z h ASN 80 Cb 0.42 0.33 -0.05 0.00 -1.12 0.00 0.00 38.32 37.90 2h3z h ASN 80 CO -0.46 -0.79 -0.51 0.74 -1.29 0.00 0.00 177.43 175.12 2h3z h THR 81 N -1.28 0.03 -0.92 2.81 2.02 -0.53 -1.23 112.91 113.81 2h3z h THR 81 Ca -0.12 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.26 2h3z h THR 81 Cb 1.00 0.03 -0.12 0.00 -1.74 0.00 0.00 68.15 67.33 2h3z h THR 81 CO 0.17 0.00 0.47 0.40 0.37 0.00 0.00 175.52 176.93 2h3z h ILE 82 N -0.68 0.57 -0.65 3.11 2.04 -0.30 0.88 117.51 122.48 2h3z h ILE 82 Ca 0.02 -0.18 0.06 0.00 1.00 0.00 0.00 64.86 65.76 2h3z h ILE 82 Cb 0.72 -0.01 -0.06 0.00 -0.74 0.00 0.00 36.82 36.74 2h3z h ILE 82 CO -0.33 0.10 0.35 0.00 0.00 0.00 0.00 178.15 178.27 2h3z h ALA 83 N 1.68 0.87 -0.17 1.87 0.00 0.07 0.11 119.26 123.68 2h3z h ALA 83 Ca 0.56 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.47 2h3z h ALA 83 Cb 1.00 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2h3z h ALA 83 CO -0.46 0.01 -0.01 0.28 0.00 0.00 0.00 179.25 179.06 2h3z h VAL 84 N 0.64 1.26 0.78 0.00 2.07 -0.19 -2.49 116.25 118.33 2h3z h VAL 84 Ca 0.30 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 66.88 2h3z h VAL 84 Cb 0.21 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 2h3z h VAL 84 CO -0.20 0.27 -0.41 0.25 0.02 0.00 0.00 177.57 177.50 2h3z h LEU 85 N 0.05 -0.99 -0.75 2.57 6.46 -0.87 -1.98 115.31 119.80 2h3z h LEU 85 Ca 0.05 0.04 0.17 0.00 -0.12 0.00 0.00 57.88 58.02 2h3z h LEU 85 Cb 0.41 0.27 -0.12 0.00 -0.73 0.00 0.00 40.66 40.49 2h3z h LEU 85 CO 0.01 -0.67 0.09 0.22 -0.62 0.00 0.00 178.44 177.47 2h3z h TYR 86 N -1.09 0.10 -0.53 1.25 5.03 -0.86 0.85 116.97 121.72 2h3z h TYR 86 Ca -0.10 0.05 0.05 0.00 2.58 0.00 0.00 58.73 61.31 2h3z h TYR 86 Cb 0.85 0.07 -0.05 0.00 1.55 0.00 0.00 36.73 39.16 2h3z h TYR 86 CO -0.05 -0.18 0.26 0.00 -1.32 0.00 0.00 178.16 176.88 2h3z h VAL 88 N 0.51 0.82 -0.63 0.00 2.07 -0.07 0.22 116.25 119.17 2h3z h VAL 88 Ca 0.24 -0.16 0.01 0.00 0.82 0.00 0.00 66.70 67.61 2h3z h VAL 88 Cb 0.16 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.21 2h3z h VAL 88 CO -0.17 0.08 0.42 0.45 0.02 0.00 0.00 177.57 178.37 2h3z h HIS 89 N 0.46 0.77 -0.44 1.57 -0.00 -0.83 -1.50 115.15 115.18 2h3z h HIS 89 Ca 0.30 0.02 -0.23 0.00 -0.00 0.00 0.00 60.37 60.46 2h3z h HIS 89 Cb 0.33 -0.26 -0.14 0.00 -0.00 0.00 0.00 27.41 27.35 2h3z h HIS 89 CO -0.14 0.47 0.30 1.04 -0.00 0.00 0.00 177.93 179.60 2h3z n GLN 90 N -4.45 1.56 -2.96 2.45 1.13 -0.49 -4.82 117.38 109.81 2h3z n GLN 90 Ca 0.07 -1.33 -0.20 0.00 -1.94 0.00 0.00 57.00 53.60 2h3z n GLN 90 Cb 0.07 -1.52 0.01 0.00 0.11 0.00 0.00 30.24 28.90 2h3z n GLN 90 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2h3z n ARG 91 N -0.18 -3.40 -3.88 -1.09 1.74 -0.57 -4.94 116.66 104.35 2h3z n ARG 91 Ca 0.26 0.67 -0.36 0.00 -0.77 0.00 0.00 57.85 57.65 2h3z n ARG 91 Cb 0.98 -5.39 -0.12 0.00 -1.02 0.00 0.00 32.46 26.92 2h3z n ARG 91 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2h3z s ILE 92 N -2.93 4.47 -0.19 0.55 1.01 0.65 -5.00 121.20 119.77 2h3z s ILE 92 Ca 0.24 -0.13 -0.04 0.00 0.00 0.00 0.00 60.65 60.73 2h3z s ILE 92 Cb -0.12 -3.06 -0.02 0.00 0.01 0.00 0.00 42.46 39.27 2h3z s ILE 92 CO 0.30 0.38 -0.04 -1.81 0.00 0.00 0.00 174.94 173.77 2h3z s ASP 93 N 1.15 4.51 0.08 3.58 1.11 -1.26 -3.16 116.67 122.67 2h3z s ASP 93 Ca 0.04 -0.28 0.05 0.00 0.18 0.00 0.00 52.55 52.55 2h3z s ASP 93 Cb -0.14 -1.75 -0.04 0.00 1.07 0.00 0.00 42.92 42.05 2h3z s ASP 93 CO 0.03 0.07 -0.06 0.68 1.18 0.00 0.00 175.17 177.07 2h3z s VAL 94 N 0.96 3.62 0.24 -1.27 -7.23 -1.26 -5.01 120.40 110.45 2h3z s VAL 94 Ca 0.00 -1.07 0.31 0.00 -1.81 0.00 0.00 61.98 59.41 2h3z s VAL 94 Cb -0.15 -2.67 0.34 0.00 0.56 0.00 0.00 36.38 34.46 2h3z s VAL 94 CO 0.01 0.18 2.01 0.50 -0.31 0.00 0.00 175.10 177.49 2h3z h LYS 95 N 3.79 0.00 -1.94 4.82 3.64 -1.98 -3.43 116.57 121.47 2h3z h LYS 95 Ca -0.48 0.00 0.27 0.00 -1.27 0.00 0.00 60.65 59.17 2h3z h LYS 95 Cb 1.17 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.90 2h3z h LYS 95 CO 0.55 0.08 0.72 0.16 -2.27 0.00 0.00 179.45 178.69 2h3z s ASP 96 N -5.86 -0.06 0.38 4.20 1.47 -1.26 -4.38 116.67 111.15 2h3z s ASP 96 Ca -0.01 -0.30 0.24 0.00 1.18 0.00 0.00 52.55 53.66 2h3z s ASP 96 Cb 0.11 0.29 1.28 0.00 -0.34 0.00 0.00 42.92 44.26 2h3z s ASP 96 CO 0.56 -0.55 1.71 0.74 0.68 0.00 0.00 175.17 178.31 2h3z h THR 97 N 2.00 0.00 0.02 2.11 2.02 -1.41 -2.07 112.91 115.58 2h3z h THR 97 Ca -0.27 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 2h3z h THR 97 Cb 1.21 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 68.14 2h3z h THR 97 CO 0.30 0.00 -0.01 0.50 0.37 0.00 0.00 175.52 176.67 2h3z h LYS 98 N 0.00 -0.03 0.00 6.66 3.11 -1.87 -3.21 116.57 121.23 2h3z h LYS 98 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 2h3z h LYS 98 Cb 0.10 0.01 0.00 0.00 -1.00 0.00 0.00 32.23 31.34 2h3z h LYS 98 CO 0.00 0.69 0.00 0.93 -2.81 0.00 0.00 179.45 178.26 2h3z h GLU 99 N -0.84 0.00 -0.20 1.90 5.08 -1.77 -2.18 114.58 116.56 2h3z h GLU 99 Ca -0.00 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.18 2h3z h GLU 99 Cb 0.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 2h3z h GLU 99 CO 0.01 0.00 -0.55 0.00 -1.00 0.00 0.00 179.01 177.46 2h3z h ALA 100 N 2.02 0.34 -0.13 3.43 0.00 -1.52 -3.15 119.26 120.24 2h3z h ALA 100 Ca 0.00 -0.52 -0.08 0.00 0.00 0.00 0.00 54.91 54.31 2h3z h ALA 100 Cb 0.13 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2h3z h ALA 100 CO 0.00 0.56 -0.29 1.25 0.00 0.00 0.00 179.25 180.77 2h3z h LEU 101 N 0.45 0.25 -1.31 0.00 7.12 -1.40 -2.66 115.31 117.75 2h3z h LEU 101 Ca -0.01 -0.08 -0.03 0.00 0.13 0.00 0.00 57.88 57.89 2h3z h LEU 101 Cb 1.17 -0.07 -0.02 0.00 -0.53 0.00 0.00 40.66 41.21 2h3z h LEU 101 CO 0.12 0.54 0.11 0.44 -0.13 0.00 0.00 178.44 179.51 2h3z h ASP 102 N 0.22 0.53 0.82 1.25 3.32 -1.50 -0.58 116.42 120.48 2h3z h ASP 102 Ca 0.03 -0.07 -0.07 0.00 0.02 0.00 0.00 57.03 56.94 2h3z h ASP 102 Cb 0.63 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 2h3z h ASP 102 CO 0.05 0.52 -0.33 0.11 -1.72 0.00 0.00 179.24 177.87 2h3z h LYS 103 N 0.57 0.00 0.00 3.56 6.56 -1.44 -2.72 116.57 123.10 2h3z h LYS 103 Ca 0.13 0.00 -0.22 0.00 -1.06 0.00 0.00 60.65 59.51 2h3z h LYS 103 Cb 0.20 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 31.82 2h3z h LYS 103 CO -0.01 0.33 -1.26 0.82 -2.06 0.00 0.00 179.45 177.28 2h3z h ILE 104 N 0.00 1.07 -0.30 1.86 1.08 -1.25 -3.34 117.51 116.63 2h3z h ILE 104 Ca -0.00 -2.74 -0.17 0.00 -0.39 0.00 0.00 64.86 61.55 2h3z h ILE 104 Cb 0.83 2.49 -0.00 0.00 -3.07 0.00 0.00 36.82 37.07 2h3z h ILE 104 CO 0.04 0.61 -0.48 -0.08 -0.69 0.00 0.00 178.15 177.55 2h3z h GLU 105 N 0.00 0.86 -0.55 2.37 4.57 -0.99 -3.06 114.58 117.79 2h3z h GLU 105 Ca -0.13 -0.52 0.07 0.00 -1.18 0.00 0.00 59.36 57.59 2h3z h GLU 105 Cb 1.77 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 30.38 2h3z h GLU 105 CO 0.09 1.16 0.37 1.49 -1.18 0.00 0.00 179.01 180.93 2h3z h GLU 106 N 0.65 0.46 0.00 1.92 4.81 -1.61 0.50 114.58 121.30 2h3z h GLU 106 Ca 0.03 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 2h3z h GLU 106 Cb 1.08 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.36 2h3z h GLU 106 CO 0.11 0.30 -0.22 0.93 -0.73 0.00 0.00 179.01 179.40 2h3z h GLU 107 N 0.47 0.00 -0.01 1.92 3.07 -1.65 -1.89 114.58 116.49 2h3z h GLU 107 Ca 0.24 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.10 2h3z h GLU 107 Cb 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.26 2h3z h GLU 107 CO -0.07 0.22 -0.24 0.94 -1.40 0.00 0.00 179.01 178.47 2h3z n GLN 108 N -3.67 0.76 -0.34 2.33 7.27 0.13 -4.15 117.38 119.71 2h3z n GLN 108 Ca -0.01 -0.41 0.17 0.00 0.07 0.00 0.00 57.00 56.82 2h3z n GLN 108 Cb 0.34 -1.49 0.39 0.00 2.41 0.00 0.00 30.24 31.89 2h3z n GLN 108 CO 0.00 0.00 0.00 -0.97 0.07 0.00 0.00 177.06 176.16 2h3z h ASN 109 N 1.01 0.67 -0.26 1.69 -0.73 -0.92 -0.39 115.58 116.66 2h3z h ASN 109 Ca 0.00 0.12 0.06 0.00 1.87 0.00 0.00 56.30 58.35 2h3z h ASN 109 Cb 0.48 0.02 -0.06 0.00 0.27 0.00 0.00 38.32 39.02 2h3z h ASN 109 CO 0.00 0.13 -0.14 0.50 -0.37 0.00 0.00 177.43 177.55 2h3z h LYS 110 N 0.59 -0.11 -0.91 6.67 3.64 -1.78 -0.70 116.57 123.97 2h3z h LYS 110 Ca 0.63 0.01 0.20 0.00 -1.27 0.00 0.00 60.65 60.21 2h3z h LYS 110 Cb 1.20 0.02 -0.17 0.00 -0.41 0.00 0.00 32.23 32.88 2h3z h LYS 110 CO -0.44 -0.07 -0.16 1.03 -2.27 0.00 0.00 179.45 177.53 2h3z h SER 111 N -0.11 -0.74 -0.22 4.20 0.87 -1.36 0.26 113.55 116.45 2h3z h SER 111 Ca 0.14 0.27 -0.09 0.00 -1.23 0.00 0.00 61.79 60.88 2h3z h SER 111 Cb 0.32 0.53 -0.00 0.00 -0.44 0.00 0.00 62.40 62.81 2h3z h SER 111 CO -0.33 -0.30 -0.21 0.50 -0.53 0.00 0.00 176.83 175.97 2h3z h LYS 112 N 0.01 0.52 -0.85 2.24 3.64 -1.41 0.84 116.57 121.56 2h3z h LYS 112 Ca 0.46 -0.27 0.22 0.00 -1.27 0.00 0.00 60.65 59.79 2h3z h LYS 112 Cb 0.77 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.55 2h3z h LYS 112 CO -0.91 0.85 0.59 -0.22 -2.27 0.00 0.00 179.45 177.49 2h3z h LYS 113 N 0.21 0.18 -0.01 1.90 1.63 0.89 0.38 116.57 121.75 2h3z h LYS 113 Ca 0.04 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 2h3z h LYS 113 Cb 0.75 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.34 2h3z h LYS 113 CO 0.05 0.12 -0.74 1.17 -3.45 0.00 0.00 179.45 176.60 2h3z n LYS 114 N -4.39 0.79 -2.04 1.90 4.81 -0.05 -4.37 118.16 114.81 2h3z n LYS 114 Ca 0.18 -0.39 -0.25 0.00 -0.87 0.00 0.00 58.31 56.98 2h3z n LYS 114 Cb 0.80 -1.44 0.02 0.00 0.02 0.00 0.00 35.03 34.43 2h3z n LYS 114 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2h3z n ALA 115 N -0.89 5.06 -2.49 3.14 0.00 0.12 -4.65 120.51 120.81 2h3z n ALA 115 Ca 0.06 -3.83 -0.02 0.00 0.00 0.00 0.00 53.44 49.64 2h3z n ALA 115 Cb 0.36 -0.38 0.07 0.00 0.00 0.00 0.00 19.45 19.51 2h3z n ALA 115 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2h3z n GLN 116 N -0.69 0.86 -0.11 0.00 7.27 -0.37 -4.82 117.38 119.52 2h3z n GLN 116 Ca 0.44 -0.92 -0.12 0.00 0.07 0.00 0.00 57.00 56.47 2h3z n GLN 116 Cb 0.93 0.37 -0.03 0.00 2.41 0.00 0.00 30.24 33.92 2h3z n GLN 116 CO 0.00 0.00 0.00 -0.56 0.07 0.00 0.00 177.06 176.57 2h3z h GLN 117 N 0.63 0.71 -1.15 3.69 3.07 -1.82 -2.92 115.11 117.31 2h3z h GLN 117 Ca -0.37 -0.31 0.33 0.00 0.09 0.00 0.00 58.65 58.39 2h3z h GLN 117 Cb 1.23 -0.02 -0.06 0.00 0.08 0.00 0.00 27.48 28.71 2h3z h GLN 117 CO -0.16 0.91 0.82 0.00 0.09 0.00 0.00 178.83 180.48 2h3z h ALA 118 N 0.78 2.97 -1.45 0.06 0.00 -1.98 -3.41 119.26 116.24 2h3z h ALA 118 Ca 0.08 -0.02 -0.46 0.00 0.00 0.00 0.00 54.91 54.50 2h3z h ALA 118 Cb 0.69 0.08 0.08 0.00 0.00 0.00 0.00 17.79 18.65 2h3z h ALA 118 CO 0.05 -1.32 0.10 0.00 0.00 0.00 0.00 179.25 178.08 2h3z s ALA 119 N -5.04 3.67 -0.48 0.00 0.00 -1.10 -4.61 121.76 114.20 2h3z s ALA 119 Ca -0.06 -1.64 -0.03 0.00 0.00 0.00 0.00 51.96 50.23 2h3z s ALA 119 Cb 0.23 -2.06 0.00 0.00 0.00 0.00 0.00 23.12 21.30 2h3z s ALA 119 CO 0.80 -1.40 0.42 0.00 0.00 0.00 0.00 175.76 175.59 2h3z n ALA 120 N -2.81 -0.50 -2.80 0.00 0.00 -1.26 -4.97 120.51 108.18 2h3z n ALA 120 Ca 0.14 0.13 -0.01 0.00 0.00 0.00 0.00 53.44 53.70 2h3z n ALA 120 Cb 0.60 -2.22 0.06 0.00 0.00 0.00 0.00 19.45 17.90 2h3z n ALA 120 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2h3z n ASP 121 N -0.28 1.04 0.17 0.00 9.92 -1.26 -4.94 116.55 121.21 2h3z n ASP 121 Ca -0.01 -2.11 0.00 0.00 -0.53 0.00 0.00 54.79 52.15 2h3z n ASP 121 Cb 0.53 -0.28 0.00 0.00 -0.64 0.00 0.00 41.12 40.72 2h3z n ASP 121 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 2h3z n THR 122 N -0.71 0.00 0.00 -3.53 -2.24 -1.26 -5.19 114.28 101.35 2h3z n THR 122 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 2h3z n THR 122 Cb 0.81 -0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.92 2h3z n THR 122 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2h3z n GLY 123 N -0.57 0.91 1.35 3.38 0.00 -1.26 -5.16 105.19 103.83 2h3z n GLY 123 Ca 0.00 -2.01 0.17 0.00 0.00 0.00 0.00 46.02 44.17 2h3z n GLY 123 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2h3z n ASN 124 N 2.34 -7.70 -3.57 1.61 4.13 -1.26 -5.06 115.26 105.76 2h3z n ASN 124 Ca 0.00 1.18 -0.07 0.00 1.68 0.00 0.00 54.58 57.37 2h3z n ASN 124 Cb 0.00 -4.51 -0.02 0.00 -1.54 0.00 0.00 39.78 33.71 2h3z n ASN 124 CO 0.00 0.00 0.00 0.21 0.28 0.00 0.00 177.26 177.75 2h3z s ASN 125 N -7.07 -0.32 -0.27 6.41 2.47 -1.26 -5.10 114.94 109.79 2h3z s ASN 125 Ca 0.00 -0.11 -0.01 0.00 0.42 0.00 0.00 52.86 53.16 2h3z s ASN 125 Cb 0.00 0.42 0.13 0.00 -1.45 0.00 0.00 41.25 40.34 2h3z s ASN 125 CO 0.00 -0.71 0.28 -0.55 -3.72 0.00 0.00 177.10 172.40 2h3z s SER 126 N -2.61 1.62 -0.18 -4.21 0.15 -1.26 -5.13 113.70 102.07 2h3z s SER 126 Ca 0.07 -0.61 -0.07 0.00 0.70 0.00 0.00 55.95 56.03 2h3z s SER 126 Cb -0.01 0.48 -0.04 0.00 -1.71 0.00 0.00 66.02 64.74 2h3z s SER 126 CO -0.06 -0.37 0.06 -1.58 1.20 0.00 0.00 173.24 172.48 2h3z s GLN 127 N 2.35 3.94 -0.58 5.44 2.00 -1.26 -5.00 119.66 126.55 2h3z s GLN 127 Ca 0.09 -0.36 0.00 0.00 -2.00 0.00 0.00 55.36 53.09 2h3z s GLN 127 Cb -0.14 -3.20 0.44 0.00 0.80 0.00 0.00 33.01 30.91 2h3z s GLN 127 CO -0.28 0.24 1.80 1.33 -0.50 0.00 0.00 175.29 177.89 2h3z n VAL 128 N 3.62 3.33 -1.68 1.34 0.24 -1.26 -5.02 118.33 118.90 2h3z n VAL 128 Ca -0.17 -3.41 -0.52 0.00 -2.04 0.00 0.00 64.34 58.20 2h3z n VAL 128 Cb 0.52 -1.16 -0.06 0.00 -1.47 0.00 0.00 33.84 31.67 2h3z n VAL 128 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2h3z n SER 129 N -0.83 2.69 -2.12 -1.34 3.41 -1.26 -4.91 113.62 109.27 2h3z n SER 129 Ca 0.57 1.05 -0.04 0.00 -0.26 0.00 0.00 58.87 60.19 2h3z n SER 129 Cb 0.70 -1.26 0.02 0.00 -0.26 0.00 0.00 64.21 63.41 2h3z n SER 129 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2h3z n GLN 130 N 5.11 0.56 -3.16 4.33 7.27 -1.26 -5.05 117.38 125.18 2h3z n GLN 130 Ca 0.23 -1.14 -0.09 0.00 0.07 0.00 0.00 57.00 56.07 2h3z n GLN 130 Cb 0.21 1.45 0.01 0.00 2.41 0.00 0.00 30.24 34.31 2h3z n GLN 130 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2h3z n ASN 131 N -1.20 -7.20 0.00 1.69 4.13 -1.26 -5.24 115.26 106.18 2h3z n ASN 131 Ca -0.04 -0.08 0.00 0.00 1.68 0.00 0.00 54.58 56.15 2h3z n ASN 131 Cb 0.34 -4.48 0.00 0.00 -1.54 0.00 0.00 39.78 34.10 2h3z n ASN 131 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54