#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 -2.01 -0.48 4.61 0.00 -1.26 -5.12 121.76 117.50 2h3z s ALA 3 Ca 0.00 1.71 -0.26 0.00 0.00 0.00 0.00 51.96 53.42 2h3z s ALA 3 Cb 0.00 -1.11 0.03 0.00 0.00 0.00 0.00 23.12 22.04 2h3z s ALA 3 CO 0.00 -0.26 0.95 1.03 0.00 0.00 0.00 175.76 177.48 2h3z s ARG 4 N -0.77 3.52 0.02 0.00 3.00 -1.26 -5.00 118.95 118.46 2h3z s ARG 4 Ca 0.02 0.13 -0.30 0.00 0.00 0.00 0.00 55.73 55.58 2h3z s ARG 4 Cb -0.02 -3.95 -0.06 0.00 0.00 0.00 0.00 34.95 30.92 2h3z s ARG 4 CO -0.03 -1.29 1.46 0.00 0.00 0.00 0.00 175.30 175.43 2h3z s ALA 5 N 3.88 3.60 0.00 2.13 0.00 -1.26 -5.01 121.76 125.11 2h3z s ALA 5 Ca 0.37 0.97 -0.07 0.00 0.00 0.00 0.00 51.96 53.23 2h3z s ALA 5 Cb -0.10 -3.61 -0.05 0.00 0.00 0.00 0.00 23.12 19.36 2h3z s ALA 5 CO 0.26 -0.94 0.26 -1.54 0.00 0.00 0.00 175.76 173.80 2h3z s SER 6 N 1.95 6.50 -0.17 0.00 1.04 -1.26 -5.03 113.70 116.73 2h3z s SER 6 Ca 0.66 0.56 -0.14 0.00 0.48 0.00 0.00 55.95 57.51 2h3z s SER 6 Cb -0.34 -2.09 -0.09 0.00 0.10 0.00 0.00 66.02 63.60 2h3z s SER 6 CO 0.28 0.26 -0.02 0.58 0.98 0.00 0.00 173.24 175.32 2h3z h VAL 7 N 3.09 0.36 -3.83 5.02 2.07 -1.94 -3.44 116.25 117.59 2h3z h VAL 7 Ca -0.50 -1.46 -0.68 0.00 0.82 0.00 0.00 66.70 64.87 2h3z h VAL 7 Cb 1.20 0.87 -0.23 0.00 -1.52 0.00 0.00 31.29 31.61 2h3z h VAL 7 CO 0.66 0.12 -0.75 -0.76 0.02 0.00 0.00 177.57 176.86 2h3z s LEU 8 N -8.09 2.82 0.00 2.57 1.43 -1.26 -4.52 118.68 111.63 2h3z s LEU 8 Ca -0.20 -0.19 0.00 0.00 -1.03 0.00 0.00 54.13 52.71 2h3z s LEU 8 Cb 0.04 -1.59 0.00 0.00 0.03 0.00 0.00 46.19 44.66 2h3z s LEU 8 CO 0.36 0.31 0.00 -1.54 0.23 0.00 0.00 176.35 175.72 2h3z n SER 9 N 2.53 -0.20 0.36 2.29 3.41 -1.26 -4.63 113.62 116.12 2h3z n SER 9 Ca -0.17 -0.56 -0.14 0.00 -0.26 0.00 0.00 58.87 57.73 2h3z n SER 9 Cb 0.52 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.40 2h3z n SER 9 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2h3z h GLY 10 N -0.10 -0.99 0.95 5.00 0.00 -2.00 0.43 103.07 106.36 2h3z h GLY 10 Ca 0.00 0.37 0.05 0.00 0.00 0.00 0.00 47.33 47.74 2h3z h GLY 10 CO 0.00 -0.36 0.59 -1.33 0.00 0.00 0.00 176.54 175.44 2h3z h GLY 11 N -1.13 1.29 0.97 4.60 0.00 -2.01 -2.38 103.07 104.40 2h3z h GLY 11 Ca -0.10 -0.43 -0.08 0.00 0.00 0.00 0.00 47.33 46.73 2h3z h GLY 11 CO 0.16 0.35 -0.05 0.83 0.00 0.00 0.00 176.54 177.83 2h3z h GLU 12 N 1.08 0.75 -0.64 4.80 5.08 -1.91 -2.96 114.58 120.78 2h3z h GLU 12 Ca 0.37 -0.26 0.14 0.00 -1.00 0.00 0.00 59.36 58.60 2h3z h GLU 12 Cb 0.09 -0.06 -0.11 0.00 0.50 0.00 0.00 28.75 29.17 2h3z h GLU 12 CO -0.12 0.86 0.01 1.25 -1.00 0.00 0.00 179.01 180.01 2h3z h LEU 13 N 0.58 -0.26 0.38 1.33 5.85 -0.37 0.49 115.31 123.31 2h3z h LEU 13 Ca 0.11 0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.97 2h3z h LEU 13 Cb 0.55 0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.86 2h3z h LEU 13 CO 0.03 -0.12 -0.18 0.44 -0.34 0.00 0.00 178.44 178.27 2h3z h ASP 14 N 0.13 -0.44 -0.26 1.25 5.19 -1.45 -2.39 116.42 118.45 2h3z h ASP 14 Ca 0.34 0.01 0.02 0.00 -0.62 0.00 0.00 57.03 56.78 2h3z h ASP 14 Cb 0.56 0.11 -0.01 0.00 0.18 0.00 0.00 39.33 40.17 2h3z h ASP 14 CO -0.54 -0.30 0.17 0.50 -3.12 0.00 0.00 179.24 175.95 2h3z h LYS 15 N -0.53 0.26 -0.14 3.56 3.11 -1.16 -2.32 116.57 119.34 2h3z h LYS 15 Ca -0.05 -0.02 -0.00 0.00 -2.81 0.00 0.00 60.65 57.77 2h3z h LYS 15 Cb 0.40 -0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 31.57 2h3z h LYS 15 CO 0.09 0.17 0.08 2.35 -2.81 0.00 0.00 179.45 179.33 2h3z h TRP 16 N 0.26 0.19 0.00 1.91 2.91 0.39 -1.59 115.95 120.02 2h3z h TRP 16 Ca 0.10 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.12 2h3z h TRP 16 Cb 0.09 -0.06 0.00 0.00 -0.51 0.00 0.00 29.16 28.68 2h3z h TRP 16 CO -0.00 0.19 0.00 0.39 -1.03 0.00 0.00 178.44 177.99 2h3z n GLU 17 N -4.94 0.09 0.06 2.65 1.02 -0.90 -3.39 120.64 115.23 2h3z n GLU 17 Ca -0.05 0.39 -0.03 0.00 -0.02 0.00 0.00 57.16 57.46 2h3z n GLU 17 Cb 0.07 -1.69 -0.01 0.00 -0.02 0.00 0.00 31.44 29.79 2h3z n GLU 17 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2h3z h LYS 18 N 0.00 -0.16 -6.27 3.49 1.63 -1.02 -3.33 116.57 110.90 2h3z h LYS 18 Ca 0.00 0.01 -0.63 0.00 -0.85 0.00 0.00 60.65 59.19 2h3z h LYS 18 Cb 0.23 0.04 0.12 0.00 -0.60 0.00 0.00 32.23 32.01 2h3z h LYS 18 CO 0.00 -0.11 -0.27 -0.89 -3.45 0.00 0.00 179.45 174.73 2h3z n ILE 19 N -2.98 1.88 -4.12 2.00 5.41 -1.17 -4.68 119.36 115.71 2h3z n ILE 19 Ca -0.02 -0.50 -0.24 0.00 1.00 0.00 0.00 62.75 62.99 2h3z n ILE 19 Cb 0.07 -0.52 -0.05 0.00 -0.71 0.00 0.00 39.64 38.42 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 -1.37 2.84 0.20 0.38 0.52 -1.26 -2.02 118.95 118.24 2h3z s ARG 20 Ca 0.62 -1.01 -0.07 0.00 -0.52 0.00 0.00 55.73 54.75 2h3z s ARG 20 Cb -0.74 -2.56 0.14 0.00 0.52 0.00 0.00 34.95 32.32 2h3z s ARG 20 CO 0.58 0.43 1.68 -0.07 0.02 0.00 0.00 175.30 177.95 2h3z h LEU 21 N 1.95 0.99 -9.00 2.53 3.38 -1.65 -1.51 115.31 112.00 2h3z h LEU 21 Ca -0.48 -0.26 -0.50 0.00 0.09 0.00 0.00 57.88 56.73 2h3z h LEU 21 Cb 1.22 -0.26 -0.14 0.00 0.09 0.00 0.00 40.66 41.57 2h3z h LEU 21 CO 0.61 1.03 -0.74 -0.13 0.09 0.00 0.00 178.44 179.30 2h3z s ARG 22 N -5.05 1.45 0.23 1.13 0.52 -1.26 -4.14 118.95 111.82 2h3z s ARG 22 Ca -0.11 -1.65 -0.00 0.00 -0.52 0.00 0.00 55.73 53.44 2h3z s ARG 22 Cb 0.14 -1.33 0.23 0.00 0.52 0.00 0.00 34.95 34.51 2h3z s ARG 22 CO 0.85 0.23 1.59 -1.00 0.02 0.00 0.00 175.30 176.99 2h3z h PRO 23 N 2.46 0.51 -0.33 3.54 0.13 -1.91 -3.23 132.00 133.18 2h3z h PRO 23 Ca -0.39 -0.27 -0.21 0.00 -0.87 0.00 0.00 66.00 64.27 2h3z h PRO 23 Cb 1.23 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 32.24 2h3z h PRO 23 CO 0.61 0.85 -0.31 0.41 -0.23 0.00 0.00 178.00 179.33 2h3z n GLY 24 N 0.01 5.30 2.74 1.56 0.00 -1.26 -5.02 105.19 108.50 2h3z n GLY 24 Ca -0.02 -1.55 -0.18 0.00 0.00 0.00 0.00 46.02 44.27 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 -1.05 2.72 0.00 -0.02 0.00 -1.22 -5.05 105.19 100.57 2h3z n GLY 25 Ca 0.32 -2.25 0.00 0.00 0.00 0.00 0.00 46.02 44.08 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 -1.49 1.77 -2.92 1.61 5.02 -1.26 -4.93 118.16 115.97 2h3z n LYS 26 Ca 0.00 -0.23 -0.43 0.00 -2.02 0.00 0.00 58.31 55.64 2h3z n LYS 26 Cb 0.45 -0.69 -0.05 0.00 -0.02 0.00 0.00 35.03 34.72 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 -0.32 3.64 0.63 1.97 2.20 -1.26 -5.04 119.74 121.56 2h3z s LYS 27 Ca 0.00 0.22 -0.06 0.00 -0.36 0.00 0.00 55.97 55.76 2h3z s LYS 27 Cb 0.00 -3.86 0.14 0.00 -1.51 0.00 0.00 37.83 32.60 2h3z s LYS 27 CO 0.00 -0.99 0.87 1.04 -0.36 0.00 0.00 175.35 175.91 2h3z n GLN 28 N 6.65 -0.46 -3.21 4.03 3.00 -1.26 -1.91 117.38 124.23 2h3z n GLN 28 Ca 0.04 -1.76 -0.36 0.00 -0.01 0.00 0.00 57.00 54.91 2h3z n GLN 28 Cb 0.48 -0.76 -0.06 0.00 0.00 0.00 0.00 30.24 29.90 2h3z n GLN 28 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.06 177.77 2h3z s TYR 29 N -2.70 3.66 0.18 1.08 2.02 -0.86 -4.66 117.35 116.08 2h3z s TYR 29 Ca 0.52 1.26 -0.00 0.00 -0.37 0.00 0.00 57.07 58.49 2h3z s TYR 29 Cb -0.02 -2.52 -0.04 0.00 -0.40 0.00 0.00 41.96 38.98 2h3z s TYR 29 CO 0.36 0.40 0.09 0.21 -1.57 0.00 0.00 175.55 175.04 2h3z s LYS 30 N -1.86 1.13 0.32 -0.62 2.20 -1.26 -4.00 119.74 115.65 2h3z s LYS 30 Ca 0.39 -1.58 0.08 0.00 -0.36 0.00 0.00 55.97 54.51 2h3z s LYS 30 Cb -0.17 0.12 0.83 0.00 -1.51 0.00 0.00 37.83 37.10 2h3z s LYS 30 CO 0.20 -0.30 1.76 -0.07 -0.36 0.00 0.00 175.35 176.58 2h3z h LEU 31 N 2.67 0.71 -0.60 5.43 3.38 -1.99 -1.05 115.31 123.87 2h3z h LEU 31 Ca -0.36 0.11 0.12 0.00 0.09 0.00 0.00 57.88 57.84 2h3z h LEU 31 Cb 1.23 -0.01 -0.12 0.00 0.09 0.00 0.00 40.66 41.85 2h3z h LEU 31 CO 0.57 0.19 -0.24 0.11 0.09 0.00 0.00 178.44 179.17 2h3z h LYS 32 N 0.66 -0.08 -0.42 1.13 1.57 -1.99 0.34 116.57 117.78 2h3z h LYS 32 Ca 0.61 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 59.45 2h3z h LYS 32 Cb 1.08 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.38 2h3z h LYS 32 CO -0.41 -0.06 0.28 0.45 -0.57 0.00 0.00 179.45 179.14 2h3z h HIS 33 N -0.09 0.32 0.03 -1.35 3.86 -1.60 -0.54 115.15 115.78 2h3z h HIS 33 Ca 0.27 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.49 2h3z h HIS 33 Cb 0.51 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 28.87 2h3z h HIS 33 CO -0.56 0.18 -0.01 0.82 0.86 0.00 0.00 177.93 179.21 2h3z h ILE 34 N 0.32 0.00 -1.20 2.45 2.04 -0.35 -3.13 117.51 117.65 2h3z h ILE 34 Ca 0.18 -0.06 0.34 0.00 1.00 0.00 0.00 64.86 66.33 2h3z h ILE 34 Cb 0.31 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.30 2h3z h ILE 34 CO -0.04 0.00 0.81 0.58 0.00 0.00 0.00 178.15 179.50 2h3z h VAL 35 N -0.10 0.37 0.74 1.67 2.07 -1.26 -0.88 116.25 118.87 2h3z h VAL 35 Ca -0.00 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 2h3z h VAL 35 Cb 0.03 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 29.96 2h3z h VAL 35 CO 0.01 0.03 -0.50 -0.25 0.02 0.00 0.00 177.57 176.88 2h3z h TRP 36 N 0.18 -1.34 -0.81 1.57 7.01 -1.17 -1.11 115.95 120.28 2h3z h TRP 36 Ca 0.65 -0.01 0.11 0.00 2.11 0.00 0.00 58.89 61.75 2h3z h TRP 36 Cb 2.09 0.49 -0.06 0.00 -2.10 0.00 0.00 29.16 29.58 2h3z h TRP 36 CO -0.00 -0.73 0.53 0.00 -2.79 0.00 0.00 178.44 175.45 2h3z h ALA 37 N -1.09 1.81 -0.52 2.65 0.00 -1.12 -0.41 119.26 120.58 2h3z h ALA 37 Ca -0.10 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2h3z h ALA 37 Cb 0.95 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2h3z h ALA 37 CO 0.07 0.01 0.16 1.03 0.00 0.00 0.00 179.25 180.52 2h3z h SER 38 N 0.69 0.71 0.97 0.00 0.87 -1.00 0.84 113.55 116.63 2h3z h SER 38 Ca 0.38 -0.11 -0.07 0.00 -1.23 0.00 0.00 61.79 60.77 2h3z h SER 38 Cb 0.54 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.30 2h3z h SER 38 CO -0.15 0.67 -0.31 -0.09 -0.53 0.00 0.00 176.83 176.42 2h3z h ARG 39 N 0.75 0.00 0.16 2.24 2.43 0.20 -3.12 114.38 117.04 2h3z h ARG 39 Ca 0.17 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 59.01 2h3z h ARG 39 Cb 0.22 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 2h3z h ARG 39 CO -0.01 0.31 -1.64 1.49 -1.51 0.00 0.00 179.97 178.61 2h3z h GLU 40 N 0.00 0.33 -0.78 0.20 4.81 -0.80 -3.35 114.58 114.99 2h3z h GLU 40 Ca -0.00 -0.57 0.07 0.00 -0.13 0.00 0.00 59.36 58.73 2h3z h GLU 40 Cb 0.88 0.21 -0.06 0.00 0.63 0.00 0.00 28.75 30.41 2h3z h GLU 40 CO 0.04 1.22 0.45 -0.07 -0.73 0.00 0.00 179.01 179.93 2h3z h LEU 41 N 0.09 0.68 -2.44 1.64 3.38 -0.84 0.52 115.31 118.34 2h3z h LEU 41 Ca -0.30 0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.73 2h3z h LEU 41 Cb 2.07 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 42.71 2h3z h LEU 41 CO 0.17 0.42 0.14 -0.08 0.09 0.00 0.00 178.44 179.19 2h3z h GLU 42 N 0.81 0.00 0.00 1.13 4.81 -1.42 0.26 114.58 120.17 2h3z h GLU 42 Ca 0.35 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.58 2h3z h GLU 42 Cb 0.24 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.62 2h3z h GLU 42 CO -0.20 0.00 -0.74 -0.09 -0.73 0.00 0.00 179.01 177.25 2h3z h ARG 43 N 0.00 0.00 -0.83 1.92 1.12 -1.06 -3.31 114.38 112.22 2h3z h ARG 43 Ca 0.04 0.00 -0.19 0.00 -1.11 0.00 0.00 59.98 58.71 2h3z h ARG 43 Cb 0.32 0.00 -0.12 0.00 -0.01 0.00 0.00 29.97 30.16 2h3z h ARG 43 CO -0.00 0.00 0.25 1.19 -3.11 0.00 0.00 179.97 178.30 2h3z n PHE 44 N -2.67 1.98 -1.64 2.20 3.72 0.85 -4.86 117.46 117.04 2h3z n PHE 44 Ca 0.01 -1.03 -0.20 0.00 -0.05 0.00 0.00 57.45 56.18 2h3z n PHE 44 Cb 0.53 -0.60 -0.08 0.00 -0.94 0.00 0.00 39.48 38.39 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 -0.12 -0.33 -2.97 4.37 0.00 -1.19 -4.96 120.51 115.32 2h3z n ALA 45 Ca 0.33 0.31 -0.32 0.00 0.00 0.00 0.00 53.44 53.76 2h3z n ALA 45 Cb 1.19 -1.99 -0.17 0.00 0.00 0.00 0.00 19.45 18.49 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 -2.76 2.13 0.25 0.00 1.01 -0.71 -5.04 120.40 115.28 2h3z s VAL 46 Ca 0.00 -1.02 -0.30 0.00 0.00 0.00 0.00 61.98 60.67 2h3z s VAL 46 Cb 0.00 -1.80 -0.09 0.00 0.00 0.00 0.00 36.38 34.49 2h3z s VAL 46 CO 0.00 0.56 1.18 0.20 0.00 0.00 0.00 175.10 177.04 2h3z s ASN 47 N 0.08 7.10 0.00 3.32 -0.87 -1.26 -2.43 114.94 120.88 2h3z s ASN 47 Ca -0.11 2.33 0.15 0.00 -1.57 0.00 0.00 52.86 53.66 2h3z s ASN 47 Cb -0.16 -2.62 0.77 0.00 -0.02 0.00 0.00 41.25 39.22 2h3z s ASN 47 CO 0.06 -0.31 1.40 -0.81 -2.57 0.00 0.00 177.10 174.87 2h3z n PRO 48 N 1.67 0.24 0.02 -0.60 -0.04 -1.26 -2.60 135.00 132.44 2h3z n PRO 48 Ca 0.01 0.13 0.12 0.00 -0.04 0.00 0.00 63.50 63.72 2h3z n PRO 48 Cb 0.44 -1.50 0.50 0.00 -0.04 0.00 0.00 33.50 32.90 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 -1.37 0.36 0.55 0.00 -1.26 -2.96 105.19 100.49 2h3z n GLY 49 Ca 0.08 -0.07 0.02 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.63 0.97 -0.01 0.99 4.77 -1.07 -3.20 117.00 117.82 2h3z n LEU 50 Ca 0.06 -0.49 0.09 0.00 -0.03 0.00 0.00 56.01 55.63 2h3z n LEU 50 Cb 0.29 -0.19 -0.13 0.00 -2.33 0.00 0.00 43.42 41.07 2h3z n LEU 50 CO 0.23 0.21 -0.61 0.18 -1.33 0.00 0.00 177.39 176.07 2h3z n LEU 51 N -0.06 0.12 0.16 2.23 4.77 -1.15 -1.60 117.00 121.46 2h3z n LEU 51 Ca 0.05 -0.07 0.03 0.00 -0.03 0.00 0.00 56.01 55.98 2h3z n LEU 51 Cb 0.18 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.48 2h3z n LEU 51 CO 0.04 0.03 0.55 1.05 -1.33 0.00 0.00 177.39 177.73 2h3z h GLU 52 N 0.00 0.00 -5.14 3.23 4.11 -1.77 -3.43 114.58 111.58 2h3z h GLU 52 Ca 0.00 0.00 -0.67 0.00 0.07 0.00 0.00 59.36 58.76 2h3z h GLU 52 Cb 0.73 0.00 -0.31 0.00 0.50 0.00 0.00 28.75 29.67 2h3z h GLU 52 CO 0.00 0.51 -0.80 0.95 0.07 0.00 0.00 179.01 179.73 2h3z s THR 53 N -3.41 2.64 0.46 -1.06 -4.23 -1.26 -4.94 115.64 103.85 2h3z s THR 53 Ca 0.01 -0.77 0.25 0.00 -1.18 0.00 0.00 61.69 60.00 2h3z s THR 53 Cb 0.11 -2.13 0.45 0.00 1.34 0.00 0.00 72.50 72.27 2h3z s THR 53 CO 0.72 0.51 1.81 0.77 -0.54 0.00 0.00 174.62 177.89 2h3z h SER 54 N 7.53 0.25 -0.20 3.99 4.64 -1.87 0.56 113.55 128.45 2h3z h SER 54 Ca -0.36 0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 60.96 2h3z h SER 54 Cb 1.18 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.25 2h3z h SER 54 CO 0.59 0.06 0.02 -0.33 -0.87 0.00 0.00 176.83 176.29 2h3z h GLU 55 N 0.23 0.45 0.00 4.77 3.07 -1.94 -1.87 114.58 119.29 2h3z h GLU 55 Ca 0.55 -0.08 0.00 0.00 -0.50 0.00 0.00 59.36 59.33 2h3z h GLU 55 Cb 1.71 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.55 2h3z h GLU 55 CO -0.16 0.47 -0.29 0.41 -1.40 0.00 0.00 179.01 178.04 2h3z n GLY 56 N -1.00 -1.49 0.13 -3.84 0.00 0.19 -3.54 105.19 95.64 2h3z n GLY 56 Ca 0.01 -0.17 0.03 0.00 0.00 0.00 0.00 46.02 45.89 2h3z n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h3z h ARG 58 N 0.00 0.41 -0.16 0.00 2.43 -1.53 -2.99 114.38 112.54 2h3z h ARG 58 Ca -0.06 -0.24 0.05 0.00 -0.81 0.00 0.00 59.98 58.92 2h3z h ARG 58 Cb 1.39 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.95 2h3z h ARG 58 CO 0.05 0.82 0.17 0.37 -1.51 0.00 0.00 179.97 179.87 2h3z h GLN 59 N 0.04 0.00 -0.38 0.20 4.15 -1.69 -1.06 115.11 116.37 2h3z h GLN 59 Ca 0.02 0.00 -0.11 0.00 0.77 0.00 0.00 58.65 59.32 2h3z h GLN 59 Cb 0.77 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.45 2h3z h GLN 59 CO 0.05 0.00 -0.21 0.82 -1.93 0.00 0.00 178.83 177.56 2h3z h ILE 60 N 0.00 1.28 -0.24 2.39 2.04 -1.64 -1.09 117.51 120.25 2h3z h ILE 60 Ca 0.08 -1.35 -0.12 0.00 1.00 0.00 0.00 64.86 64.47 2h3z h ILE 60 Cb 0.42 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 2h3z h ILE 60 CO -0.00 0.45 -0.34 -0.07 0.00 0.00 0.00 178.15 178.19 2h3z h LEU 61 N 0.61 0.53 -0.34 1.44 3.38 -1.22 -1.20 115.31 118.51 2h3z h LEU 61 Ca 0.08 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 2h3z h LEU 61 Cb 0.77 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 2h3z h LEU 61 CO 0.06 0.84 -0.22 1.23 0.09 0.00 0.00 178.44 180.44 2h3z h GLY 62 N 1.06 0.00 0.78 0.83 0.00 -1.36 -0.09 103.07 104.29 2h3z h GLY 62 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 2h3z h GLY 62 CO 0.07 0.00 -0.84 -1.06 0.00 0.00 0.00 176.54 174.70 2h3z n GLN 63 N -3.20 0.24 -0.10 4.80 6.02 -0.42 -4.19 117.38 120.53 2h3z n GLN 63 Ca 0.02 0.02 -0.11 0.00 -0.01 0.00 0.00 57.00 56.92 2h3z n GLN 63 Cb 0.56 -1.60 -0.13 0.00 1.02 0.00 0.00 30.24 30.10 2h3z n GLN 63 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2h3z n LEU 64 N -1.91 1.03 -0.22 1.08 4.77 -0.47 -4.32 117.00 116.95 2h3z n LEU 64 Ca 0.03 -0.04 -0.05 0.00 -0.03 0.00 0.00 56.01 55.92 2h3z n LEU 64 Cb 0.42 0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.48 2h3z n LEU 64 CO 0.38 0.59 0.26 1.67 -1.33 0.00 0.00 177.39 178.97 2h3z n GLN 65 N -2.83 -0.22 -0.04 3.23 7.27 -0.05 0.55 117.38 125.29 2h3z n GLN 65 Ca -0.33 0.80 -0.13 0.00 0.07 0.00 0.00 57.00 57.41 2h3z n GLN 65 Cb 1.03 -1.18 -0.08 0.00 2.41 0.00 0.00 30.24 32.42 2h3z n GLN 65 CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 2h3z h PRO 66 N 0.00 0.21 -0.42 3.69 0.13 -1.82 -3.07 132.00 130.72 2h3z h PRO 66 Ca 0.10 -0.11 0.12 0.00 -0.87 0.00 0.00 66.00 65.24 2h3z h PRO 66 Cb 0.23 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.35 2h3z h PRO 66 CO -0.50 0.64 0.40 0.77 -0.23 0.00 0.00 178.00 179.08 2h3z h SER 67 N -0.21 0.00 -0.42 1.44 0.02 -0.57 -0.34 113.55 113.47 2h3z h SER 67 Ca 0.01 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.94 2h3z h SER 67 Cb 0.60 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.12 2h3z h SER 67 CO 0.02 0.00 0.16 -0.07 -1.14 0.00 0.00 176.83 175.80 2h3z h LEU 68 N 0.00 0.59 -0.62 5.07 3.38 0.21 -1.98 115.31 121.95 2h3z h LEU 68 Ca 0.20 -0.17 0.11 0.00 0.09 0.00 0.00 57.88 58.11 2h3z h LEU 68 Cb 1.00 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 41.51 2h3z h LEU 68 CO -0.00 0.60 0.19 -0.61 0.09 0.00 0.00 178.44 178.70 2h3z h GLN 69 N 0.54 0.32 -0.97 1.13 4.15 -1.14 -0.82 115.11 118.31 2h3z h GLN 69 Ca 0.14 -0.02 -0.61 0.00 0.77 0.00 0.00 58.65 58.93 2h3z h GLN 69 Cb 0.20 -0.07 -0.30 0.00 0.21 0.00 0.00 27.48 27.52 2h3z h GLN 69 CO -0.01 0.21 0.72 2.41 -1.93 0.00 0.00 178.83 180.24 2h3z n THR 70 N -5.07 3.42 -4.03 2.39 -1.04 -1.11 -4.95 114.28 103.90 2h3z n THR 70 Ca 0.10 -2.61 -0.08 0.00 -2.04 0.00 0.00 64.05 59.42 2h3z n THR 70 Cb 0.32 -0.89 -0.10 0.00 -1.82 0.00 0.00 70.33 67.84 2h3z n THR 70 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2h3z s GLY 71 N -1.72 0.36 0.00 3.41 0.00 -0.31 -5.02 107.32 104.04 2h3z s GLY 71 Ca 0.61 -0.94 0.00 0.00 0.00 0.00 0.00 44.72 44.39 2h3z s GLY 71 CO 0.03 -1.04 0.00 -1.14 0.00 0.00 0.00 173.10 170.95 2h3z n SER 72 N 0.60 0.00 -0.32 1.64 3.41 -1.26 -4.87 113.62 112.82 2h3z n SER 72 Ca -0.17 -0.99 0.30 0.00 -0.26 0.00 0.00 58.87 57.75 2h3z n SER 72 Cb 0.59 0.00 0.64 0.00 -0.26 0.00 0.00 64.21 65.18 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 0.17 -1.11 4.33 5.08 -1.97 0.25 114.58 121.32 2h3z h GLU 73 Ca 0.00 -0.01 0.31 0.00 -1.00 0.00 0.00 59.36 58.66 2h3z h GLU 73 Cb 0.00 -0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.14 2h3z h GLU 73 CO 0.00 0.11 0.76 0.93 -1.00 0.00 0.00 179.01 179.81 2h3z h GLU 74 N 0.17 0.17 0.00 2.33 5.08 -2.01 0.13 114.58 120.44 2h3z h GLU 74 Ca 0.59 -0.01 -0.36 0.00 -1.00 0.00 0.00 59.36 58.58 2h3z h GLU 74 Cb 1.94 -0.04 -0.07 0.00 0.50 0.00 0.00 28.75 31.09 2h3z h GLU 74 CO -0.15 0.11 -2.30 -0.11 -1.00 0.00 0.00 179.01 175.56 2h3z n LEU 75 N -4.40 0.11 -0.01 1.33 7.94 0.83 -4.35 117.00 118.45 2h3z n LEU 75 Ca 0.26 0.05 -0.11 0.00 -1.11 0.00 0.00 56.01 55.10 2h3z n LEU 75 Cb 1.08 0.46 -0.06 0.00 0.53 0.00 0.00 43.42 45.43 2h3z n LEU 75 CO 0.33 0.48 0.87 -0.09 -1.11 0.00 0.00 177.39 177.87 2h3z h ARG 76 N 0.00 0.15 -0.82 1.96 2.43 -0.42 -2.78 114.38 114.90 2h3z h ARG 76 Ca -0.51 -0.02 0.16 0.00 -0.81 0.00 0.00 59.98 58.80 2h3z h ARG 76 Cb 2.21 -0.03 -0.10 0.00 -0.42 0.00 0.00 29.97 31.63 2h3z h ARG 76 CO 0.04 0.19 0.37 0.77 -1.51 0.00 0.00 179.97 179.82 2h3z h SER 77 N 0.07 0.38 0.46 -3.80 0.02 -1.08 -2.11 113.55 107.50 2h3z h SER 77 Ca 0.04 0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 2h3z h SER 77 Cb 0.08 0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 2h3z h SER 77 CO -0.01 0.13 -0.44 -0.07 -1.14 0.00 0.00 176.83 175.30 2h3z h LEU 78 N 0.50 -1.20 -0.83 5.07 -0.00 -1.69 -2.14 115.31 115.01 2h3z h LEU 78 Ca 0.46 0.10 0.21 0.00 -0.00 0.00 0.00 57.88 58.65 2h3z h LEU 78 Cb 0.72 0.40 -0.14 0.00 -0.00 0.00 0.00 40.66 41.64 2h3z h LEU 78 CO -0.41 -0.61 0.15 0.22 -0.00 0.00 0.00 178.44 177.79 2h3z h TYR 79 N -0.91 0.21 0.38 1.13 3.20 -1.23 0.26 116.97 120.01 2h3z h TYR 79 Ca -0.05 0.05 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 2h3z h TYR 79 Cb 0.80 0.04 -0.02 0.00 1.54 0.00 0.00 36.73 39.09 2h3z h TYR 79 CO -0.23 -0.21 -0.39 -0.91 -1.64 0.00 0.00 178.16 174.78 2h3z h ASN 80 N 0.18 -1.06 0.31 -2.11 2.35 -1.00 -0.27 115.58 113.98 2h3z h ASN 80 Ca 0.50 0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 56.33 2h3z h ASN 80 Cb 0.95 0.36 -0.00 0.00 0.05 0.00 0.00 38.32 39.68 2h3z h ASN 80 CO -0.65 -0.54 -0.20 0.74 -1.65 0.00 0.00 177.43 175.13 2h3z h THR 81 N -0.80 0.59 -0.75 2.81 2.02 -0.54 -2.76 112.91 113.48 2h3z h THR 81 Ca -0.03 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.32 2h3z h THR 81 Cb 0.71 0.59 -0.12 0.00 -1.74 0.00 0.00 68.15 67.59 2h3z h THR 81 CO -0.07 0.00 0.12 0.40 0.37 0.00 0.00 175.52 176.34 2h3z h ILE 82 N -0.49 0.43 -0.38 3.11 2.04 -0.46 0.15 117.51 121.92 2h3z h ILE 82 Ca -0.03 -0.07 0.08 0.00 1.00 0.00 0.00 64.86 65.84 2h3z h ILE 82 Cb 0.41 0.22 -0.08 0.00 -0.74 0.00 0.00 36.82 36.63 2h3z h ILE 82 CO 0.03 0.04 -0.12 0.00 0.00 0.00 0.00 178.15 178.10 2h3z h ALA 83 N 1.66 0.21 -0.03 1.87 0.00 -0.76 -0.46 119.26 121.75 2h3z h ALA 83 Ca 0.43 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.48 2h3z h ALA 83 Cb 0.76 0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 2h3z h ALA 83 CO -0.58 -0.48 -0.00 0.28 0.00 0.00 0.00 179.25 178.46 2h3z h VAL 84 N -0.04 1.28 -0.93 0.00 2.07 -0.91 -2.82 116.25 114.90 2h3z h VAL 84 Ca 0.18 -0.84 0.25 0.00 0.82 0.00 0.00 66.70 67.12 2h3z h VAL 84 Cb 0.32 1.78 -0.05 0.00 -1.52 0.00 0.00 31.29 31.82 2h3z h VAL 84 CO -0.41 0.22 0.65 0.25 0.02 0.00 0.00 177.57 178.31 2h3z h LEU 85 N -0.28 0.13 -0.10 2.57 6.46 -0.37 0.56 115.31 124.28 2h3z h LEU 85 Ca 0.01 0.02 -0.09 0.00 -0.12 0.00 0.00 57.88 57.70 2h3z h LEU 85 Cb 0.36 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.29 2h3z h LEU 85 CO 0.00 0.04 -0.28 0.22 -0.62 0.00 0.00 178.44 177.81 2h3z h TYR 86 N 0.13 0.48 0.00 1.25 3.20 -0.89 -3.06 116.97 118.07 2h3z h TYR 86 Ca 0.46 -0.19 -0.02 0.00 3.14 0.00 0.00 58.73 62.12 2h3z h TYR 86 Cb 1.62 -0.08 -0.00 0.00 1.54 0.00 0.00 36.73 39.80 2h3z h TYR 86 CO -0.00 0.89 -0.11 0.00 -1.64 0.00 0.00 178.16 177.31 2h3z h VAL 88 N 0.00 1.32 0.13 0.00 2.07 -1.10 0.31 116.25 118.99 2h3z h VAL 88 Ca -0.00 -1.81 -0.34 0.00 0.82 0.00 0.00 66.70 65.37 2h3z h VAL 88 Cb 0.33 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 2h3z h VAL 88 CO 0.01 0.56 -1.78 0.45 0.02 0.00 0.00 177.57 176.84 2h3z h HIS 89 N 0.43 0.52 0.00 1.57 -0.00 -1.33 -3.33 115.15 113.00 2h3z h HIS 89 Ca 0.01 -0.38 0.00 0.00 -0.00 0.00 0.00 60.37 60.00 2h3z h HIS 89 Cb 1.10 -0.02 0.00 0.00 -0.00 0.00 0.00 27.41 28.49 2h3z h HIS 89 CO 0.05 1.70 0.00 1.04 -0.00 0.00 0.00 177.93 180.72 2h3z n GLN 90 N -3.66 0.19 -3.04 2.45 1.13 0.14 -4.89 117.38 109.71 2h3z n GLN 90 Ca -0.29 0.08 -0.12 0.00 -1.94 0.00 0.00 57.00 54.72 2h3z n GLN 90 Cb 1.01 -1.50 0.05 0.00 0.11 0.00 0.00 30.24 29.90 2h3z n GLN 90 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 2h3z n ARG 91 N -1.38 -4.27 -3.24 -1.09 0.63 -0.55 -4.99 116.66 101.77 2h3z n ARG 91 Ca 0.09 0.46 -0.43 0.00 -0.92 0.00 0.00 57.85 57.05 2h3z n ARG 91 Cb 0.23 -4.38 -0.08 0.00 0.45 0.00 0.00 32.46 28.68 2h3z n ARG 91 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 2h3z s ILE 92 N -3.18 4.99 0.25 5.15 1.01 0.99 -5.03 121.20 125.39 2h3z s ILE 92 Ca 0.25 -0.24 -0.31 0.00 0.00 0.00 0.00 60.65 60.35 2h3z s ILE 92 Cb -0.11 -4.12 -0.13 0.00 0.01 0.00 0.00 42.46 38.11 2h3z s ILE 92 CO 0.41 -0.51 1.44 -0.67 0.00 0.00 0.00 174.94 175.60 2h3z n ASP 93 N 5.84 2.95 -3.66 3.58 -0.08 -1.26 -4.70 116.55 119.22 2h3z n ASP 93 Ca -0.06 1.14 -0.10 0.00 -1.51 0.00 0.00 54.79 54.27 2h3z n ASP 93 Cb 0.47 -1.46 -0.11 0.00 2.34 0.00 0.00 41.12 42.37 2h3z n ASP 93 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 2h3z s VAL 94 N -0.06 -0.56 0.31 5.18 -7.23 -1.26 -4.90 120.40 111.88 2h3z s VAL 94 Ca 0.67 0.20 0.38 0.00 -1.81 0.00 0.00 61.98 61.42 2h3z s VAL 94 Cb -0.62 -0.59 0.40 0.00 0.56 0.00 0.00 36.38 36.13 2h3z s VAL 94 CO 0.50 0.09 2.13 0.50 -0.31 0.00 0.00 175.10 178.00 2h3z h LYS 95 N 8.19 0.00 -1.97 4.82 1.63 -1.94 -3.45 116.57 123.85 2h3z h LYS 95 Ca -0.16 0.00 0.32 0.00 -0.85 0.00 0.00 60.65 59.97 2h3z h LYS 95 Cb 1.11 0.00 -0.08 0.00 -0.60 0.00 0.00 32.23 32.66 2h3z h LYS 95 CO 0.13 0.00 0.86 0.16 -3.45 0.00 0.00 179.45 177.14 2h3z s ASP 96 N -5.25 -0.01 0.52 4.20 1.47 -1.26 -4.47 116.67 111.86 2h3z s ASP 96 Ca -0.02 -0.22 0.34 0.00 1.18 0.00 0.00 52.55 53.83 2h3z s ASP 96 Cb 0.11 0.18 1.84 0.00 -0.34 0.00 0.00 42.92 44.70 2h3z s ASP 96 CO 0.45 -0.35 2.03 0.74 0.68 0.00 0.00 175.17 178.72 2h3z h THR 97 N 2.00 0.00 0.05 2.11 2.02 -1.43 -2.31 112.91 115.35 2h3z h THR 97 Ca -0.25 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.93 2h3z h THR 97 Cb 1.19 0.75 0.00 0.00 -1.74 0.00 0.00 68.15 68.35 2h3z h THR 97 CO 0.31 0.00 -0.02 0.50 0.37 0.00 0.00 175.52 176.68 2h3z h LYS 98 N 0.00 -0.06 0.00 6.66 3.11 -1.86 -2.76 116.57 121.66 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 0.06 0.01 0.00 0.00 -1.00 0.00 0.00 32.23 31.31 2h3z h LYS 98 CO 0.00 0.57 0.00 0.93 -2.81 0.00 0.00 179.45 178.14 2h3z h GLU 99 N -0.88 0.00 0.04 1.90 4.39 -1.81 0.30 114.58 118.51 2h3z h GLU 99 Ca -0.01 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.43 2h3z h GLU 99 Cb 0.66 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.28 2h3z h GLU 99 CO 0.01 0.00 -1.39 0.00 -1.16 0.00 0.00 179.01 176.47 2h3z h ALA 100 N 2.01 0.45 0.13 3.43 0.00 -1.51 -3.29 119.26 120.47 2h3z h ALA 100 Ca 0.00 -1.14 -0.32 0.00 0.00 0.00 0.00 54.91 53.45 2h3z h ALA 100 Cb 0.07 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2h3z h ALA 100 CO 0.00 1.31 -1.68 1.25 0.00 0.00 0.00 179.25 180.13 2h3z h LEU 101 N 0.02 0.43 -1.47 0.00 7.12 -0.90 -3.26 115.31 117.25 2h3z h LEU 101 Ca -0.17 -0.88 0.18 0.00 0.13 0.00 0.00 57.88 57.14 2h3z h LEU 101 Cb 1.92 -0.14 -0.07 0.00 -0.53 0.00 0.00 40.66 41.85 2h3z h LEU 101 CO 0.13 1.73 0.58 0.44 -0.13 0.00 0.00 178.44 181.18 2h3z h ASP 102 N -0.13 0.46 0.00 1.25 5.19 -0.63 0.13 116.42 122.68 2h3z h ASP 102 Ca -0.36 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.09 2h3z h ASP 102 Cb 1.90 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 41.37 2h3z h ASP 102 CO 0.08 0.20 0.00 0.29 -3.12 0.00 0.00 179.24 176.69 2h3z n LYS 103 N -4.52 0.00 -0.46 3.56 4.76 -1.24 -0.84 118.16 119.42 2h3z n LYS 103 Ca 0.18 0.29 0.38 0.00 -2.87 0.00 0.00 58.31 56.29 2h3z n LYS 103 Cb 0.62 -0.95 0.66 0.00 -1.84 0.00 0.00 35.03 33.53 2h3z n LYS 103 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 2h3z h ILE 104 N 0.00 0.14 0.10 -0.18 2.04 -1.58 0.22 117.51 118.24 2h3z h ILE 104 Ca 0.00 -0.03 -0.00 0.00 1.00 0.00 0.00 64.86 65.82 2h3z h ILE 104 Cb 0.00 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.13 2h3z h ILE 104 CO 0.00 0.02 -0.05 -0.08 0.00 0.00 0.00 178.15 178.04 2h3z h GLU 105 N 0.09 -0.13 -0.30 2.37 4.81 -0.84 -3.21 114.58 117.37 2h3z h GLU 105 Ca 0.81 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 60.14 2h3z h GLU 105 Cb 2.63 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 32.02 2h3z h GLU 105 CO -0.36 0.38 0.32 1.49 -0.73 0.00 0.00 179.01 180.11 2h3z h GLU 106 N -0.85 0.00 -0.53 1.92 4.81 0.13 0.38 114.58 120.45 2h3z h GLU 106 Ca -0.01 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.11 2h3z h GLU 106 Cb 0.57 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.93 2h3z h GLU 106 CO 0.02 0.00 -0.07 0.93 -0.73 0.00 0.00 179.01 179.16 2h3z h GLU 107 N 0.00 0.96 0.00 1.92 4.39 -0.96 -2.26 114.58 118.63 2h3z h GLU 107 Ca 0.14 -0.32 -0.13 0.00 0.34 0.00 0.00 59.36 59.39 2h3z h GLU 107 Cb 0.78 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.33 2h3z h GLU 107 CO -0.00 0.99 -1.48 1.04 -1.16 0.00 0.00 179.01 178.39 2h3z n GLN 108 N -4.16 0.63 0.16 2.33 6.02 0.09 -4.04 117.38 118.41 2h3z n GLN 108 Ca 0.02 0.13 0.01 0.00 -0.01 0.00 0.00 57.00 57.15 2h3z n GLN 108 Cb 0.37 -1.75 0.28 0.00 1.02 0.00 0.00 30.24 30.16 2h3z n GLN 108 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 2h3z h ASN 109 N 0.00 0.01 -0.70 1.08 4.21 -0.29 -2.42 115.58 117.47 2h3z h ASN 109 Ca -0.14 -0.00 -0.05 0.00 1.21 0.00 0.00 56.30 57.32 2h3z h ASN 109 Cb 1.44 -0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 38.61 2h3z h ASN 109 CO 0.03 0.47 0.25 0.50 -1.29 0.00 0.00 177.43 177.39 2h3z h LYS 110 N 0.01 1.07 0.00 0.81 3.64 -1.55 0.20 116.57 120.74 2h3z h LYS 110 Ca -0.00 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 2h3z h LYS 110 Cb 0.83 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 2h3z h LYS 110 CO 0.06 0.90 0.00 1.03 -2.27 0.00 0.00 179.45 179.17 2h3z h SER 111 N 1.01 0.00 0.00 4.20 0.87 -1.71 -3.05 113.55 114.88 2h3z h SER 111 Ca 0.23 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.79 2h3z h SER 111 Cb 0.26 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.22 2h3z h SER 111 CO -0.01 0.00 -0.10 0.50 -0.53 0.00 0.00 176.83 176.69 2h3z h LYS 112 N 0.00 0.00 -1.14 2.24 3.64 -0.92 -3.36 116.57 117.03 2h3z h LYS 112 Ca 0.00 0.00 0.32 0.00 -1.27 0.00 0.00 60.65 59.70 2h3z h LYS 112 Cb 0.91 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.67 2h3z h LYS 112 CO 0.00 0.00 0.79 -0.22 -2.27 0.00 0.00 179.45 177.75 2h3z h LYS 113 N -0.37 0.13 -0.21 1.90 3.11 -0.79 -0.27 116.57 120.08 2h3z h LYS 113 Ca 0.00 -0.01 0.06 0.00 -2.81 0.00 0.00 60.65 57.89 2h3z h LYS 113 Cb 0.10 -0.03 -0.06 0.00 -1.00 0.00 0.00 32.23 31.23 2h3z h LYS 113 CO 0.00 0.09 -0.23 -0.22 -2.81 0.00 0.00 179.45 176.28 2h3z h LYS 114 N 0.14 -0.25 -1.02 1.90 3.64 -1.69 0.37 116.57 119.66 2h3z h LYS 114 Ca 0.59 0.02 0.30 0.00 -1.27 0.00 0.00 60.65 60.28 2h3z h LYS 114 Cb 2.03 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 33.86 2h3z h LYS 114 CO -0.12 -0.16 0.73 0.00 -2.27 0.00 0.00 179.45 177.63 2h3z h ALA 115 N 0.77 2.96 -0.62 5.00 0.00 -1.18 0.60 119.26 126.78 2h3z h ALA 115 Ca 0.12 -0.03 -0.45 0.00 0.00 0.00 0.00 54.91 54.55 2h3z h ALA 115 Cb 0.44 0.08 -0.39 0.00 0.00 0.00 0.00 17.79 17.92 2h3z h ALA 115 CO -0.35 -1.25 -0.84 0.00 0.00 0.00 0.00 179.25 176.81 2h3z n GLN 116 N -4.24 3.11 0.08 0.00 10.64 0.21 -4.77 117.38 122.42 2h3z n GLN 116 Ca 0.22 -3.96 -0.19 0.00 -1.83 0.00 0.00 57.00 51.24 2h3z n GLN 116 Cb 1.08 -2.09 -0.10 0.00 -0.86 0.00 0.00 30.24 28.27 2h3z n GLN 116 CO 0.00 0.00 0.00 0.37 -1.83 0.00 0.00 177.06 175.60 2h3z h GLN 117 N 2.11 0.54 -1.06 2.61 4.15 0.20 -3.25 115.11 120.41 2h3z h GLN 117 Ca 0.26 -0.67 -0.43 0.00 0.77 0.00 0.00 58.65 58.57 2h3z h GLN 117 Cb 1.46 0.21 -0.23 0.00 0.21 0.00 0.00 27.48 29.13 2h3z h GLN 117 CO 0.60 1.28 0.55 0.00 -1.93 0.00 0.00 178.83 179.33 2h3z n ALA 118 N -2.62 5.14 -2.36 3.38 0.00 -1.26 -4.03 120.51 118.76 2h3z n ALA 118 Ca -0.11 -2.35 0.01 0.00 0.00 0.00 0.00 53.44 50.99 2h3z n ALA 118 Cb 0.93 -1.42 -0.01 0.00 0.00 0.00 0.00 19.45 18.96 2h3z n ALA 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h3z n ALA 119 N -0.65 2.78 -2.72 0.00 0.00 -1.23 -4.92 120.51 113.77 2h3z n ALA 119 Ca 0.47 -1.86 -0.09 0.00 0.00 0.00 0.00 53.44 51.95 2h3z n ALA 119 Cb 1.19 -0.62 0.07 0.00 0.00 0.00 0.00 19.45 20.08 2h3z n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h3z n ALA 120 N 0.33 2.11 0.31 0.00 0.00 -1.26 -4.89 120.51 117.12 2h3z n ALA 120 Ca -0.04 -2.28 0.06 0.00 0.00 0.00 0.00 53.44 51.18 2h3z n ALA 120 Cb 1.01 -0.98 -0.08 0.00 0.00 0.00 0.00 19.45 19.40 2h3z n ALA 120 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2h3z n ASP 121 N -0.22 1.27 -4.74 0.00 2.03 -1.26 -5.01 116.55 108.62 2h3z n ASP 121 Ca 0.05 -0.44 -0.35 0.00 0.52 0.00 0.00 54.79 54.57 2h3z n ASP 121 Cb 0.81 1.25 0.07 0.00 -0.72 0.00 0.00 41.12 42.53 2h3z n ASP 121 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2h3z s THR 122 N -2.45 2.38 -0.33 5.18 -4.23 -1.26 -4.98 115.64 109.96 2h3z s THR 122 Ca 0.01 0.21 0.17 0.00 -1.18 0.00 0.00 61.69 60.90 2h3z s THR 122 Cb 0.09 -2.94 0.46 0.00 1.34 0.00 0.00 72.50 71.45 2h3z s THR 122 CO 0.50 -0.08 1.01 0.61 -0.54 0.00 0.00 174.62 176.13 2h3z n GLY 123 N 0.50 2.41 3.57 3.99 0.00 -1.26 -5.01 105.19 109.38 2h3z n GLY 123 Ca 0.14 -1.52 -0.41 0.00 0.00 0.00 0.00 46.02 44.23 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 -0.24 4.67 -3.84 1.61 4.13 -1.26 -4.89 115.26 115.44 2h3z n ASN 124 Ca 0.14 -2.89 -0.12 0.00 1.68 0.00 0.00 54.58 53.40 2h3z n ASN 124 Cb 0.80 -1.75 -0.11 0.00 -1.54 0.00 0.00 39.78 37.19 2h3z n ASN 124 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2h3z s ASN 125 N 4.52 -0.07 0.00 6.41 4.22 -1.26 -5.05 114.94 123.71 2h3z s ASN 125 Ca 0.56 0.02 0.18 0.00 -2.14 0.00 0.00 52.86 51.48 2h3z s ASN 125 Cb 0.04 0.28 0.30 0.00 1.28 0.00 0.00 41.25 43.15 2h3z s ASN 125 CO 0.09 -0.27 1.11 -1.20 -2.04 0.00 0.00 177.10 174.78 2h3z n SER 126 N 1.97 0.55 -4.70 3.54 7.64 -1.26 -5.12 113.62 116.23 2h3z n SER 126 Ca -0.19 -1.97 -0.34 0.00 1.01 0.00 0.00 58.87 57.37 2h3z n SER 126 Cb 0.57 -0.19 0.12 0.00 -1.01 0.00 0.00 64.21 63.69 2h3z n SER 126 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2h3z s GLN 127 N 0.00 1.81 0.27 1.43 -0.21 -1.26 -4.97 119.66 116.73 2h3z s GLN 127 Ca 0.24 1.82 -0.29 0.00 0.02 0.00 0.00 55.36 57.15 2h3z s GLN 127 Cb 0.27 -1.79 -0.09 0.00 1.00 0.00 0.00 33.01 32.40 2h3z s GLN 127 CO -0.12 -2.10 0.98 0.08 -2.12 0.00 0.00 175.29 172.01 2h3z s VAL 128 N -2.00 3.94 0.85 1.09 1.01 -1.26 -5.05 120.40 118.98 2h3z s VAL 128 Ca 0.75 1.86 -0.14 0.00 0.00 0.00 0.00 61.98 64.45 2h3z s VAL 128 Cb -0.30 -4.15 0.21 0.00 0.00 0.00 0.00 36.38 32.14 2h3z s VAL 128 CO 0.48 0.37 0.72 -1.20 0.00 0.00 0.00 175.10 175.47 2h3z n SER 129 N 1.16 -2.00 -1.35 3.32 7.64 -1.26 -4.90 113.62 116.23 2h3z n SER 129 Ca -0.01 -0.90 0.17 0.00 1.01 0.00 0.00 58.87 59.15 2h3z n SER 129 Cb 0.47 -0.68 -0.07 0.00 -1.01 0.00 0.00 64.21 62.92 2h3z n SER 129 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2h3z n GLN 130 N -3.88 -3.00 -2.20 1.43 -0.06 -1.26 -4.89 117.38 103.52 2h3z n GLN 130 Ca 0.10 2.33 -0.01 0.00 -2.00 0.00 0.00 57.00 57.42 2h3z n GLN 130 Cb 0.40 -3.56 0.05 0.00 -4.06 0.00 0.00 30.24 23.07 2h3z n GLN 130 CO 0.00 0.00 0.00 0.27 -0.20 0.00 0.00 177.06 177.13 2h3z n ASN 131 N -4.20 0.21 0.00 1.69 6.94 -1.26 -5.24 115.26 113.40 2h3z n ASN 131 Ca -0.06 -2.07 0.00 0.00 -0.02 0.00 0.00 54.58 52.44 2h3z n ASN 131 Cb 0.63 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.06 2h3z n ASN 131 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23