#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h3z n ALA 3 N 0.00 -2.51 -2.73 4.61 0.00 -1.26 -4.16 120.51 114.45 2h3z n ALA 3 Ca 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 53.44 53.33 2h3z n ALA 3 Cb 0.00 -4.73 -0.02 0.00 0.00 0.00 0.00 19.45 14.70 2h3z n ALA 3 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2h3z n ARG 4 N -3.82 -3.57 -1.17 0.00 1.74 -1.26 -4.75 116.66 103.83 2h3z n ARG 4 Ca -0.09 2.82 -0.34 0.00 -0.77 0.00 0.00 57.85 59.47 2h3z n ARG 4 Cb 0.60 -4.68 -0.03 0.00 -1.02 0.00 0.00 32.46 27.33 2h3z n ARG 4 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2h3z n ALA 5 N 1.24 6.90 -2.70 7.54 0.00 -1.26 -4.89 120.51 127.35 2h3z n ALA 5 Ca -0.16 -3.13 -0.34 0.00 0.00 0.00 0.00 53.44 49.80 2h3z n ALA 5 Cb 0.29 -3.27 -0.09 0.00 0.00 0.00 0.00 19.45 16.39 2h3z n ALA 5 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2h3z s SER 6 N 2.44 5.29 -0.09 0.00 0.01 -1.26 -5.04 113.70 115.05 2h3z s SER 6 Ca 0.63 0.12 -0.17 0.00 1.31 0.00 0.00 55.95 57.84 2h3z s SER 6 Cb 0.17 -1.47 -0.13 0.00 0.21 0.00 0.00 66.02 64.79 2h3z s SER 6 CO -0.05 0.34 0.57 0.58 0.41 0.00 0.00 173.24 175.09 2h3z h VAL 7 N 3.88 0.80 -3.64 3.43 2.07 -1.90 -3.43 116.25 117.46 2h3z h VAL 7 Ca -0.50 -1.39 -0.67 0.00 0.82 0.00 0.00 66.70 64.96 2h3z h VAL 7 Cb 1.19 1.45 -0.24 0.00 -1.52 0.00 0.00 31.29 32.17 2h3z h VAL 7 CO 0.56 0.25 -0.75 -0.76 0.02 0.00 0.00 177.57 176.89 2h3z s LEU 8 N -8.66 2.82 0.00 2.57 1.43 -1.26 -4.58 118.68 111.00 2h3z s LEU 8 Ca -0.10 -0.22 0.00 0.00 -1.03 0.00 0.00 54.13 52.77 2h3z s LEU 8 Cb -0.01 -1.61 0.00 0.00 0.03 0.00 0.00 46.19 44.60 2h3z s LEU 8 CO 0.38 0.26 0.00 -1.54 0.23 0.00 0.00 176.35 175.68 2h3z n SER 9 N 2.88 -0.42 0.36 2.29 3.41 -1.26 -4.54 113.62 116.35 2h3z n SER 9 Ca -0.18 -0.62 -0.14 0.00 -0.26 0.00 0.00 58.87 57.67 2h3z n SER 9 Cb 0.52 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.41 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 -0.21 -0.97 1.39 5.00 0.00 -2.00 0.31 103.07 106.59 2h3z h GLY 10 Ca 0.00 0.36 0.05 0.00 0.00 0.00 0.00 47.33 47.74 2h3z h GLY 10 CO 0.00 -0.35 0.30 -1.33 0.00 0.00 0.00 176.54 175.15 2h3z h GLY 11 N -1.00 0.49 0.91 4.60 0.00 -2.01 -2.25 103.07 103.82 2h3z h GLY 11 Ca -0.10 -0.16 -0.14 0.00 0.00 0.00 0.00 47.33 46.93 2h3z h GLY 11 CO 0.16 0.13 -0.46 0.83 0.00 0.00 0.00 176.54 177.20 2h3z h GLU 12 N 0.41 0.57 -0.30 4.80 5.08 -1.89 -3.12 114.58 120.14 2h3z h GLU 12 Ca 0.19 -0.42 0.07 0.00 -1.00 0.00 0.00 59.36 58.20 2h3z h GLU 12 Cb 0.23 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.49 2h3z h GLU 12 CO -0.05 1.04 -0.14 1.25 -1.00 0.00 0.00 179.01 180.11 2h3z h LEU 13 N 0.21 -0.48 0.31 1.33 6.46 0.22 0.23 115.31 123.59 2h3z h LEU 13 Ca -0.02 0.11 -0.00 0.00 -0.12 0.00 0.00 57.88 57.86 2h3z h LEU 13 Cb 1.08 0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 41.25 2h3z h LEU 13 CO 0.10 -0.18 -0.47 0.44 -0.62 0.00 0.00 178.44 177.71 2h3z h ASP 14 N -0.10 -1.34 -0.90 1.25 3.32 -1.55 -1.65 116.42 115.44 2h3z h ASP 14 Ca 0.15 0.12 0.13 0.00 0.02 0.00 0.00 57.03 57.46 2h3z h ASP 14 Cb 0.33 0.47 -0.09 0.00 0.22 0.00 0.00 39.33 40.26 2h3z h ASP 14 CO -0.36 -0.57 0.51 0.11 -1.72 0.00 0.00 179.24 177.22 2h3z h LYS 15 N -0.82 0.75 -0.65 3.56 1.57 -1.43 -1.15 116.57 118.40 2h3z h LYS 15 Ca -0.04 -0.05 0.10 0.00 -1.87 0.00 0.00 60.65 58.80 2h3z h LYS 15 Cb 0.75 -0.17 -0.07 0.00 0.08 0.00 0.00 32.23 32.82 2h3z h LYS 15 CO -0.14 0.50 0.26 2.35 -0.57 0.00 0.00 179.45 181.85 2h3z h TRP 16 N 0.77 0.46 0.00 -1.35 2.91 0.04 0.26 115.95 119.04 2h3z h TRP 16 Ca 0.47 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.52 2h3z h TRP 16 Cb 0.57 -0.11 0.00 0.00 -0.51 0.00 0.00 29.16 29.11 2h3z h TRP 16 CO -0.05 0.12 0.00 0.93 -1.03 0.00 0.00 178.44 178.41 2h3z h GLU 17 N 0.45 0.00 0.23 2.65 5.08 -0.29 -3.14 114.58 119.56 2h3z h GLU 17 Ca 0.33 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.68 2h3z h GLU 17 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2h3z h GLU 17 CO -0.31 0.00 -0.11 -0.22 -1.00 0.00 0.00 179.01 177.37 2h3z h LYS 18 N 0.00 -0.30 -6.30 2.33 3.11 -0.29 -3.32 116.57 111.80 2h3z h LYS 18 Ca 0.00 0.02 -0.60 0.00 -2.81 0.00 0.00 60.65 57.26 2h3z h LYS 18 Cb 0.18 0.07 0.15 0.00 -1.00 0.00 0.00 32.23 31.63 2h3z h LYS 18 CO 0.00 -0.20 -0.48 -0.89 -2.81 0.00 0.00 179.45 175.07 2h3z n ILE 19 N -3.55 1.64 -4.42 2.00 5.41 -1.13 -4.55 119.36 114.76 2h3z n ILE 19 Ca -0.04 -0.50 -0.24 0.00 1.00 0.00 0.00 62.75 62.97 2h3z n ILE 19 Cb 0.12 -0.48 -0.10 0.00 -0.71 0.00 0.00 39.64 38.48 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 -1.55 1.81 0.26 0.38 0.52 -1.26 -0.08 118.95 119.04 2h3z s ARG 20 Ca 0.63 -1.64 -0.04 0.00 -0.52 0.00 0.00 55.73 54.16 2h3z s ARG 20 Cb -0.59 -1.88 0.32 0.00 0.52 0.00 0.00 34.95 33.32 2h3z s ARG 20 CO 0.58 0.35 1.83 -0.07 0.02 0.00 0.00 175.30 178.01 2h3z h LEU 21 N 2.32 0.92 -9.00 2.53 3.38 -1.72 -2.31 115.31 111.43 2h3z h LEU 21 Ca -0.42 -0.14 -0.62 0.00 0.09 0.00 0.00 57.88 56.80 2h3z h LEU 21 Cb 1.25 -0.24 -0.18 0.00 0.09 0.00 0.00 40.66 41.58 2h3z h LEU 21 CO 0.59 0.83 -0.81 -0.13 0.09 0.00 0.00 178.44 179.01 2h3z s ARG 22 N -5.43 1.47 0.10 1.13 1.81 -1.26 -3.97 118.95 112.79 2h3z s ARG 22 Ca -0.11 -1.52 -0.15 0.00 -1.72 0.00 0.00 55.73 52.23 2h3z s ARG 22 Cb 0.16 -1.70 -0.08 0.00 -0.45 0.00 0.00 34.95 32.87 2h3z s ARG 22 CO 0.81 0.36 1.42 -1.00 -0.68 0.00 0.00 175.30 176.22 2h3z h PRO 23 N 3.12 0.70 -0.64 3.54 0.13 -1.89 -3.23 132.00 133.72 2h3z h PRO 23 Ca -0.45 -0.36 -0.34 0.00 -0.87 0.00 0.00 66.00 63.98 2h3z h PRO 23 Cb 1.21 0.01 -0.20 0.00 0.13 0.00 0.00 31.00 32.15 2h3z h PRO 23 CO 0.50 0.98 0.23 0.41 -0.23 0.00 0.00 178.00 179.88 2h3z n GLY 24 N 0.15 4.81 3.28 1.56 0.00 -1.26 -4.99 105.19 108.74 2h3z n GLY 24 Ca -0.04 -1.24 -0.20 0.00 0.00 0.00 0.00 46.02 44.54 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 -1.12 2.49 0.03 -0.02 0.00 -1.22 -5.05 105.19 100.29 2h3z n GLY 25 Ca 0.45 -2.26 0.01 0.00 0.00 0.00 0.00 46.02 44.22 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 -1.77 2.29 -2.98 1.61 5.02 -1.26 -4.95 118.16 116.11 2h3z n LYS 26 Ca 0.04 -0.33 -0.42 0.00 -2.02 0.00 0.00 58.31 55.58 2h3z n LYS 26 Cb 0.53 -0.82 -0.05 0.00 -0.02 0.00 0.00 35.03 34.66 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 -0.52 3.70 0.77 1.97 2.20 -1.26 -5.05 119.74 121.55 2h3z s LYS 27 Ca 0.01 0.22 -0.06 0.00 -0.36 0.00 0.00 55.97 55.78 2h3z s LYS 27 Cb 0.01 -3.82 0.13 0.00 -1.51 0.00 0.00 37.83 32.63 2h3z s LYS 27 CO 0.03 -0.86 1.07 -0.65 -0.36 0.00 0.00 175.35 174.58 2h3z s GLN 28 N 3.05 1.57 0.28 4.03 1.11 -1.26 -2.32 119.66 126.12 2h3z s GLN 28 Ca 0.30 -0.72 -0.24 0.00 0.01 0.00 0.00 55.36 54.71 2h3z s GLN 28 Cb -0.13 -2.18 -0.09 0.00 -1.01 0.00 0.00 33.01 29.60 2h3z s GLN 28 CO 0.17 -1.61 0.87 0.71 0.01 0.00 0.00 175.29 175.44 2h3z s TYR 29 N -3.34 3.69 0.20 0.91 2.02 0.89 -4.63 117.35 117.09 2h3z s TYR 29 Ca 0.66 1.66 -0.02 0.00 -0.37 0.00 0.00 57.07 59.00 2h3z s TYR 29 Cb -0.06 -2.82 -0.04 0.00 -0.40 0.00 0.00 41.96 38.64 2h3z s TYR 29 CO 0.46 0.27 0.15 0.15 -1.57 0.00 0.00 175.55 175.01 2h3z s LYS 30 N -1.98 1.21 0.36 -0.62 1.02 -1.26 -4.08 119.74 114.40 2h3z s LYS 30 Ca 0.47 -1.60 0.13 0.00 0.02 0.00 0.00 55.97 54.99 2h3z s LYS 30 Cb -0.18 0.28 0.94 0.00 -0.52 0.00 0.00 37.83 38.34 2h3z s LYS 30 CO 0.23 -0.40 1.80 -0.07 -0.92 0.00 0.00 175.35 175.99 2h3z h LEU 31 N 2.60 0.59 -0.55 3.17 3.38 -1.98 -1.37 115.31 121.16 2h3z h LEU 31 Ca -0.35 0.08 0.11 0.00 0.09 0.00 0.00 57.88 57.80 2h3z h LEU 31 Cb 1.25 -0.03 -0.11 0.00 0.09 0.00 0.00 40.66 41.86 2h3z h LEU 31 CO 0.52 0.20 -0.25 0.11 0.09 0.00 0.00 178.44 179.11 2h3z h LYS 32 N 0.56 -0.11 -0.33 1.13 6.56 -1.99 0.28 116.57 122.68 2h3z h LYS 32 Ca 0.55 0.01 0.04 0.00 -1.06 0.00 0.00 60.65 60.18 2h3z h LYS 32 Cb 1.12 0.03 -0.02 0.00 -0.57 0.00 0.00 32.23 32.79 2h3z h LYS 32 CO -0.29 -0.07 0.22 0.45 -2.06 0.00 0.00 179.45 177.70 2h3z h HIS 33 N -0.12 0.29 0.02 -1.35 3.86 -1.66 -0.56 115.15 115.63 2h3z h HIS 33 Ca 0.25 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.46 2h3z h HIS 33 Cb 0.50 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.88 2h3z h HIS 33 CO -0.55 0.17 -0.01 0.82 0.86 0.00 0.00 177.93 179.22 2h3z h ILE 34 N 0.29 0.00 -1.18 2.45 2.04 -0.49 -3.18 117.51 117.44 2h3z h ILE 34 Ca 0.14 -0.06 0.34 0.00 1.00 0.00 0.00 64.86 66.28 2h3z h ILE 34 Cb 0.19 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.18 2h3z h ILE 34 CO -0.03 0.00 0.79 0.58 0.00 0.00 0.00 178.15 179.49 2h3z h VAL 35 N -0.09 0.38 0.45 1.67 2.07 -1.19 -0.74 116.25 118.80 2h3z h VAL 35 Ca -0.00 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 2h3z h VAL 35 Cb 0.03 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 29.94 2h3z h VAL 35 CO 0.01 0.04 -0.43 -0.25 0.02 0.00 0.00 177.57 176.95 2h3z h TRP 36 N 0.20 -1.18 -0.85 1.57 7.01 -1.19 -0.97 115.95 120.54 2h3z h TRP 36 Ca 0.65 0.01 0.18 0.00 2.11 0.00 0.00 58.89 61.83 2h3z h TRP 36 Cb 2.03 0.46 -0.06 0.00 -2.10 0.00 0.00 29.16 29.49 2h3z h TRP 36 CO -0.00 -0.59 0.56 0.00 -2.79 0.00 0.00 178.44 175.62 2h3z h ALA 37 N -0.59 2.14 0.14 2.65 0.00 -1.11 -1.65 119.26 120.83 2h3z h ALA 37 Ca -0.04 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2h3z h ALA 37 Cb 0.78 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2h3z h ALA 37 CO -0.06 -0.39 -0.06 0.77 0.00 0.00 0.00 179.25 179.51 2h3z h SER 38 N 0.44 -0.15 -0.21 0.00 0.02 -1.12 0.11 113.55 112.63 2h3z h SER 38 Ca 0.43 -0.20 0.06 0.00 -0.84 0.00 0.00 61.79 61.24 2h3z h SER 38 Cb 1.02 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.59 2h3z h SER 38 CO -0.16 0.12 0.25 -0.09 -1.14 0.00 0.00 176.83 175.81 2h3z h ARG 39 N -0.43 0.00 0.17 3.45 9.65 -0.27 -1.15 114.38 125.80 2h3z h ARG 39 Ca -0.02 0.00 -0.36 0.00 -1.10 0.00 0.00 59.98 58.50 2h3z h ARG 39 Cb 0.34 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.92 2h3z h ARG 39 CO 0.03 0.00 -1.85 1.49 2.80 0.00 0.00 179.97 182.45 2h3z h GLU 40 N 0.00 0.35 -0.81 0.20 4.57 -1.08 -3.37 114.58 114.45 2h3z h GLU 40 Ca 0.10 -0.60 0.12 0.00 -1.18 0.00 0.00 59.36 57.80 2h3z h GLU 40 Cb 0.61 0.22 -0.08 0.00 -0.16 0.00 0.00 28.75 29.34 2h3z h GLU 40 CO -0.00 1.29 0.43 -0.07 -1.18 0.00 0.00 179.01 179.47 2h3z h LEU 41 N 0.09 0.56 -2.58 1.64 3.38 0.47 0.26 115.31 119.13 2h3z h LEU 41 Ca -0.38 0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.68 2h3z h LEU 41 Cb 2.08 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 42.80 2h3z h LEU 41 CO 0.15 0.28 0.10 -0.33 0.09 0.00 0.00 178.44 178.73 2h3z h GLU 42 N 0.67 0.00 0.00 1.13 4.39 -0.87 0.22 114.58 120.12 2h3z h GLU 42 Ca 0.42 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 60.08 2h3z h GLU 42 Cb 0.49 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 2h3z h GLU 42 CO -0.31 0.00 -0.84 -0.09 -1.16 0.00 0.00 179.01 176.61 2h3z h ARG 43 N 0.00 0.00 -0.80 2.33 2.43 -0.67 -3.31 114.38 114.37 2h3z h ARG 43 Ca 0.02 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 59.00 2h3z h ARG 43 Cb 0.22 0.00 -0.11 0.00 -0.42 0.00 0.00 29.97 29.65 2h3z h ARG 43 CO -0.00 0.09 0.24 1.19 -1.51 0.00 0.00 179.97 179.98 2h3z n PHE 44 N -2.84 2.15 -1.73 2.20 3.72 0.57 -4.87 117.46 116.66 2h3z n PHE 44 Ca -0.01 -1.06 -0.17 0.00 -0.05 0.00 0.00 57.45 56.16 2h3z n PHE 44 Cb 0.61 -0.62 -0.05 0.00 -0.94 0.00 0.00 39.48 38.48 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 -0.08 -0.32 -2.55 4.37 0.00 -1.14 -4.98 120.51 115.80 2h3z n ALA 45 Ca 0.35 0.23 -0.30 0.00 0.00 0.00 0.00 53.44 53.72 2h3z n ALA 45 Cb 1.25 -1.78 -0.16 0.00 0.00 0.00 0.00 19.45 18.76 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 -2.68 1.96 0.25 0.00 1.01 -0.11 -5.02 120.40 115.81 2h3z s VAL 46 Ca 0.00 -1.04 -0.28 0.00 0.00 0.00 0.00 61.98 60.66 2h3z s VAL 46 Cb 0.00 -1.64 -0.09 0.00 0.00 0.00 0.00 36.38 34.65 2h3z s VAL 46 CO 0.00 0.55 0.92 0.20 0.00 0.00 0.00 175.10 176.77 2h3z s ASN 47 N -0.36 7.54 0.00 3.32 -0.87 -1.26 -1.64 114.94 121.67 2h3z s ASN 47 Ca 0.03 1.88 0.15 0.00 -1.57 0.00 0.00 52.86 53.34 2h3z s ASN 47 Cb -0.11 -2.59 0.67 0.00 -0.02 0.00 0.00 41.25 39.20 2h3z s ASN 47 CO 0.01 0.12 1.44 -0.81 -2.57 0.00 0.00 177.10 175.29 2h3z n PRO 48 N 1.29 0.09 0.25 -0.60 -0.04 -1.26 -2.61 135.00 132.12 2h3z n PRO 48 Ca -0.02 0.21 0.15 0.00 -0.04 0.00 0.00 63.50 63.80 2h3z n PRO 48 Cb 0.48 -1.50 0.51 0.00 -0.04 0.00 0.00 33.50 32.95 2h3z n PRO 48 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2h3z h GLY 49 N 2.46 0.00 2.00 0.55 0.00 -1.97 -3.01 103.07 103.10 2h3z h GLY 49 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2h3z h GLY 49 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.54 177.95 2h3z h LEU 50 N 0.00 0.00 -0.08 3.11 3.38 -1.88 0.16 115.31 119.99 2h3z h LEU 50 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2h3z h LEU 50 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2h3z h LEU 50 CO 0.00 0.00 -0.05 0.18 0.09 0.00 0.00 178.44 178.66 2h3z n LEU 51 N -2.92 0.18 -1.68 1.67 4.77 -1.14 -2.81 117.00 115.08 2h3z n LEU 51 Ca -0.03 0.16 -0.01 0.00 -0.03 0.00 0.00 56.01 56.11 2h3z n LEU 51 Cb 0.07 -0.23 0.27 0.00 -2.33 0.00 0.00 43.42 41.20 2h3z n LEU 51 CO 0.18 0.03 0.83 1.21 -1.33 0.00 0.00 177.39 178.32 2h3z n GLU 52 N -1.15 3.49 -3.40 3.23 2.13 0.55 -4.74 120.64 120.75 2h3z n GLU 52 Ca 0.15 -2.41 0.02 0.00 0.66 0.00 0.00 57.16 55.58 2h3z n GLU 52 Cb 0.25 -2.05 -0.03 0.00 0.27 0.00 0.00 31.44 29.88 2h3z n GLU 52 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 2h3z s THR 53 N -2.41 -0.76 0.36 6.31 -1.32 -1.21 -5.03 115.64 111.58 2h3z s THR 53 Ca 0.43 0.00 0.14 0.00 -1.21 0.00 0.00 61.69 61.05 2h3z s THR 53 Cb 0.33 -1.00 0.35 0.00 -1.51 0.00 0.00 72.50 70.68 2h3z s THR 53 CO 0.11 0.00 1.73 0.77 -2.21 0.00 0.00 174.62 175.03 2h3z h SER 54 N 7.84 0.56 -0.33 8.08 4.64 -1.86 0.66 113.55 133.14 2h3z h SER 54 Ca -0.18 0.12 -0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2h3z h SER 54 Cb 1.13 0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 63.24 2h3z h SER 54 CO 0.10 0.06 0.20 -0.08 -0.87 0.00 0.00 176.83 176.24 2h3z h GLU 55 N 0.47 0.46 0.22 4.77 4.57 -1.96 -2.66 114.58 120.46 2h3z h GLU 55 Ca 0.64 -0.04 -0.32 0.00 -1.18 0.00 0.00 59.36 58.46 2h3z h GLU 55 Cb 1.43 -0.10 0.03 0.00 -0.16 0.00 0.00 28.75 29.95 2h3z h GLU 55 CO -0.42 0.34 -1.45 0.78 -1.18 0.00 0.00 179.01 177.08 2h3z h GLY 56 N 0.53 0.53 1.49 1.92 0.00 0.10 -3.27 103.07 104.37 2h3z h GLY 56 Ca 0.12 -1.35 0.06 0.00 0.00 0.00 0.00 47.33 46.16 2h3z h GLY 56 CO -0.02 1.19 0.20 0.00 0.00 0.00 0.00 176.54 177.90 2h3z h ARG 58 N 0.00 0.58 -0.37 0.00 2.43 -1.56 -3.18 114.38 112.28 2h3z h ARG 58 Ca 0.10 -0.49 -0.09 0.00 -0.81 0.00 0.00 59.98 58.69 2h3z h ARG 58 Cb 0.49 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.13 2h3z h ARG 58 CO -0.00 1.11 -0.13 1.96 -1.51 0.00 0.00 179.97 181.40 2h3z h GLN 59 N 0.39 0.66 0.33 0.20 7.50 -1.17 -2.24 115.11 120.79 2h3z h GLN 59 Ca -0.05 -0.21 -0.01 0.00 0.50 0.00 0.00 58.65 58.88 2h3z h GLN 59 Cb 1.38 -0.06 -0.01 0.00 0.05 0.00 0.00 27.48 28.84 2h3z h GLN 59 CO 0.15 0.77 -0.23 0.82 -1.50 0.00 0.00 178.83 178.84 2h3z h ILE 60 N 0.60 0.52 -0.57 2.54 2.04 -1.46 0.15 117.51 121.34 2h3z h ILE 60 Ca 0.10 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.94 2h3z h ILE 60 Cb 0.57 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 2h3z h ILE 60 CO 0.04 0.00 0.27 -0.07 0.00 0.00 0.00 178.15 178.39 2h3z h LEU 61 N -0.55 0.72 -1.00 1.44 3.38 -1.53 -1.22 115.31 116.55 2h3z h LEU 61 Ca -0.03 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 2h3z h LEU 61 Cb 0.47 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2h3z h LEU 61 CO 0.02 0.61 -0.33 1.23 0.09 0.00 0.00 178.44 180.06 2h3z h GLY 62 N 0.90 0.00 0.31 0.83 0.00 -1.02 0.08 103.07 104.16 2h3z h GLY 62 Ca 0.20 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.44 2h3z h GLY 62 CO -0.03 0.00 -0.39 -1.61 0.00 0.00 0.00 176.54 174.52 2h3z h GLN 63 N 0.00 0.14 0.00 4.80 -0.00 0.11 -3.32 115.11 116.83 2h3z h GLN 63 Ca -0.00 -0.23 -0.06 0.00 -0.00 0.00 0.00 58.65 58.36 2h3z h GLN 63 Cb 0.85 0.09 -0.01 0.00 0.00 0.00 0.00 27.48 28.40 2h3z h GLN 63 CO 0.04 1.11 -0.26 -0.07 0.00 0.00 0.00 178.83 179.65 2h3z h LEU 64 N -0.72 0.00 -0.24 -2.39 3.38 -1.28 -3.32 115.31 110.75 2h3z h LEU 64 Ca -0.07 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.94 2h3z h LEU 64 Cb 1.30 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.98 2h3z h LEU 64 CO 0.07 0.26 -0.48 1.56 0.09 0.00 0.00 178.44 179.94 2h3z h GLN 65 N 0.00 -0.41 0.00 1.13 4.20 -1.07 0.45 115.11 119.41 2h3z h GLN 65 Ca -0.00 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.74 2h3z h GLN 65 Cb 0.92 0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.79 2h3z h GLN 65 CO 0.03 -0.27 0.00 -0.35 -0.67 0.00 0.00 178.83 177.57 2h3z n PRO 66 N -5.03 0.49 0.00 1.46 -0.04 -1.25 -1.78 135.00 128.85 2h3z n PRO 66 Ca -0.04 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.45 2h3z n PRO 66 Cb 0.31 -1.38 -0.02 0.00 -0.04 0.00 0.00 33.50 32.37 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 -0.88 0.59 0.26 3.54 7.64 0.12 -4.54 113.62 120.35 2h3z n SER 67 Ca 0.09 -0.79 0.17 0.00 1.01 0.00 0.00 58.87 59.35 2h3z n SER 67 Cb 0.04 0.78 0.93 0.00 -1.01 0.00 0.00 64.21 64.95 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 0.31 0.00 0.14 -3.43 3.38 0.45 -1.69 115.31 114.47 2h3z h LEU 68 Ca 0.00 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.72 2h3z h LEU 68 Cb 0.18 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.94 2h3z h LEU 68 CO 0.00 0.00 -1.21 -0.61 0.09 0.00 0.00 178.44 176.71 2h3z h GLN 69 N 0.00 0.29 -1.11 1.13 5.75 -1.80 -3.34 115.11 116.03 2h3z h GLN 69 Ca 0.00 -0.49 -0.52 0.00 -0.15 0.00 0.00 58.65 57.49 2h3z h GLN 69 Cb 0.03 0.18 -0.25 0.00 1.07 0.00 0.00 27.48 28.51 2h3z h GLN 69 CO 0.00 1.23 0.67 -2.37 -2.65 0.00 0.00 178.83 175.72 2h3z n THR 70 N -3.98 3.19 -3.81 2.39 5.66 -0.68 -4.91 114.28 112.14 2h3z n THR 70 Ca -0.20 -2.22 -0.12 0.00 -3.05 0.00 0.00 64.05 58.46 2h3z n THR 70 Cb 0.89 -0.99 -0.10 0.00 -1.55 0.00 0.00 70.33 68.58 2h3z n THR 70 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 2h3z s GLY 71 N -1.10 -0.07 0.00 1.09 0.00 -0.93 -5.05 107.32 101.25 2h3z s GLY 71 Ca 0.52 0.21 0.00 0.00 0.00 0.00 0.00 44.72 45.45 2h3z s GLY 71 CO 0.03 0.05 0.00 -1.14 0.00 0.00 0.00 173.10 172.04 2h3z n SER 72 N 1.70 0.00 -0.01 1.64 3.41 -1.26 -4.87 113.62 114.24 2h3z n SER 72 Ca -0.20 -0.67 0.21 0.00 -0.26 0.00 0.00 58.87 57.95 2h3z n SER 72 Cb 0.56 0.00 0.70 0.00 -0.26 0.00 0.00 64.21 65.21 2h3z n SER 72 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2h3z h GLU 73 N 0.00 0.00 -1.08 4.33 4.57 -1.98 -0.87 114.58 119.56 2h3z h GLU 73 Ca 0.00 0.00 0.29 0.00 -1.18 0.00 0.00 59.36 58.47 2h3z h GLU 73 Cb 0.00 0.00 -0.10 0.00 -0.16 0.00 0.00 28.75 28.49 2h3z h GLU 73 CO 0.00 0.00 0.69 0.93 -1.18 0.00 0.00 179.01 179.45 2h3z h GLU 74 N 0.00 0.33 0.00 1.92 5.08 -2.01 0.27 114.58 120.17 2h3z h GLU 74 Ca 0.26 -0.02 -0.18 0.00 -1.00 0.00 0.00 59.36 58.43 2h3z h GLU 74 Cb 1.07 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.21 2h3z h GLU 74 CO -0.00 0.22 -1.69 -0.11 -1.00 0.00 0.00 179.01 176.43 2h3z n LEU 75 N -4.63 0.55 -0.20 1.33 7.94 -0.35 -4.06 117.00 117.58 2h3z n LEU 75 Ca 0.27 0.24 -0.09 0.00 -1.11 0.00 0.00 56.01 55.32 2h3z n LEU 75 Cb 0.95 0.14 0.02 0.00 0.53 0.00 0.00 43.42 45.07 2h3z n LEU 75 CO 0.25 0.18 0.85 -0.09 -1.11 0.00 0.00 177.39 177.47 2h3z h ARG 76 N 0.00 0.99 -0.50 1.96 1.12 -0.35 -2.77 114.38 114.82 2h3z h ARG 76 Ca -0.21 -0.29 -0.02 0.00 -1.11 0.00 0.00 59.98 58.35 2h3z h ARG 76 Cb 1.60 -0.10 -0.02 0.00 -0.01 0.00 0.00 29.97 31.44 2h3z h ARG 76 CO 0.03 0.96 0.22 0.66 -3.11 0.00 0.00 179.97 178.73 2h3z h SER 77 N 0.88 0.68 0.26 -3.80 4.64 -1.07 -2.90 113.55 112.24 2h3z h SER 77 Ca 0.17 -0.15 0.01 0.00 -0.47 0.00 0.00 61.79 61.35 2h3z h SER 77 Cb 0.47 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.36 2h3z h SER 77 CO 0.02 0.64 -0.32 -0.07 -0.87 0.00 0.00 176.83 176.23 2h3z h LEU 78 N 0.67 -0.90 -0.91 5.97 -0.00 -1.67 -2.04 115.31 116.43 2h3z h LEU 78 Ca 0.17 0.09 0.23 0.00 -0.00 0.00 0.00 57.88 58.37 2h3z h LEU 78 Cb 0.16 0.32 -0.13 0.00 -0.00 0.00 0.00 40.66 41.01 2h3z h LEU 78 CO -0.02 -0.44 0.40 0.22 -0.00 0.00 0.00 178.44 178.60 2h3z h TYR 79 N -0.64 0.66 0.90 1.13 5.03 -1.43 0.86 116.97 123.49 2h3z h TYR 79 Ca -0.00 0.04 -0.04 0.00 2.58 0.00 0.00 58.73 61.31 2h3z h TYR 79 Cb 0.60 -0.15 0.01 0.00 1.55 0.00 0.00 36.73 38.74 2h3z h TYR 79 CO -0.22 -0.07 -0.44 -0.91 -1.32 0.00 0.00 178.16 175.20 2h3z h ASN 80 N 0.39 -1.05 -0.03 -2.11 4.21 -1.19 -0.55 115.58 115.24 2h3z h ASN 80 Ca 0.58 0.04 0.04 0.00 1.21 0.00 0.00 56.30 58.16 2h3z h ASN 80 Cb 1.12 0.28 -0.05 0.00 -1.12 0.00 0.00 38.32 38.54 2h3z h ASN 80 CO -0.54 -0.74 -0.31 0.74 -1.29 0.00 0.00 177.43 175.28 2h3z h THR 81 N -1.22 0.32 -0.94 2.81 2.02 -0.67 -1.52 112.91 113.70 2h3z h THR 81 Ca -0.12 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.24 2h3z h THR 81 Cb 0.94 0.32 -0.10 0.00 -1.74 0.00 0.00 68.15 67.56 2h3z h THR 81 CO 0.20 0.00 0.52 0.40 0.37 0.00 0.00 175.52 177.01 2h3z h ILE 82 N -0.44 0.68 -0.57 3.11 2.04 -0.87 -0.20 117.51 121.26 2h3z h ILE 82 Ca 0.07 -0.23 0.08 0.00 1.00 0.00 0.00 64.86 65.78 2h3z h ILE 82 Cb 0.54 -0.04 -0.06 0.00 -0.74 0.00 0.00 36.82 36.52 2h3z h ILE 82 CO -0.28 0.12 0.23 0.00 0.00 0.00 0.00 178.15 178.22 2h3z h ALA 83 N 1.62 0.73 -0.10 1.87 0.00 -0.05 0.29 119.26 123.62 2h3z h ALA 83 Ca 0.54 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.49 2h3z h ALA 83 Cb 0.84 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 2h3z h ALA 83 CO -0.40 -0.17 -0.03 0.28 0.00 0.00 0.00 179.25 178.93 2h3z h VAL 84 N 0.42 1.30 0.67 0.00 2.07 -0.74 -2.84 116.25 117.14 2h3z h VAL 84 Ca 0.28 -0.98 -0.03 0.00 0.82 0.00 0.00 66.70 66.78 2h3z h VAL 84 Cb 0.30 1.76 -0.00 0.00 -1.52 0.00 0.00 31.29 31.82 2h3z h VAL 84 CO -0.26 0.28 -0.40 0.25 0.02 0.00 0.00 177.57 177.46 2h3z h LEU 85 N -0.14 -0.99 -0.82 2.57 5.85 -0.85 -2.36 115.31 118.57 2h3z h LEU 85 Ca 0.02 0.05 0.19 0.00 0.84 0.00 0.00 57.88 58.99 2h3z h LEU 85 Cb 0.45 0.28 -0.15 0.00 0.37 0.00 0.00 40.66 41.62 2h3z h LEU 85 CO 0.01 -0.63 -0.01 0.22 -0.34 0.00 0.00 178.44 177.70 2h3z h TYR 86 N -1.00 -0.08 -0.46 1.25 3.20 -0.51 0.24 116.97 119.59 2h3z h TYR 86 Ca -0.09 0.06 0.05 0.00 3.14 0.00 0.00 58.73 61.90 2h3z h TYR 86 Cb 0.80 0.17 -0.05 0.00 1.54 0.00 0.00 36.73 39.19 2h3z h TYR 86 CO -0.09 -0.29 0.20 0.00 -1.64 0.00 0.00 178.16 176.34 2h3z h VAL 88 N 0.39 0.53 -0.82 0.00 2.07 -0.01 0.31 116.25 118.72 2h3z h VAL 88 Ca 0.21 -0.07 -0.03 0.00 0.82 0.00 0.00 66.70 67.63 2h3z h VAL 88 Cb 0.18 0.30 -0.04 0.00 -1.52 0.00 0.00 31.29 30.21 2h3z h VAL 88 CO -0.19 0.04 0.40 0.45 0.02 0.00 0.00 177.57 178.29 2h3z h HIS 89 N 0.21 1.18 -0.01 1.57 -0.00 -1.07 -1.42 115.15 115.60 2h3z h HIS 89 Ca 0.36 -0.05 0.00 0.00 -0.00 0.00 0.00 60.37 60.68 2h3z h HIS 89 Cb 0.59 -0.37 0.00 0.00 -0.00 0.00 0.00 27.41 27.63 2h3z h HIS 89 CO -0.30 0.85 0.00 0.94 -0.00 0.00 0.00 177.93 179.42 2h3z n GLN 90 N -4.31 1.04 -2.89 2.45 7.27 -0.11 -4.82 117.38 116.01 2h3z n GLN 90 Ca 0.08 -0.04 -0.10 0.00 0.07 0.00 0.00 57.00 57.01 2h3z n GLN 90 Cb 0.14 -1.29 0.04 0.00 2.41 0.00 0.00 30.24 31.53 2h3z n GLN 90 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 2h3z n ARG 91 N -0.20 -3.56 -4.90 3.69 0.63 -0.54 -5.05 116.66 106.75 2h3z n ARG 91 Ca 0.00 0.40 -0.27 0.00 -0.92 0.00 0.00 57.85 57.07 2h3z n ARG 91 Cb 0.15 -4.11 -0.15 0.00 0.45 0.00 0.00 32.46 28.80 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 -3.16 1.62 -0.42 5.15 1.01 0.92 -4.98 121.20 121.35 2h3z s ILE 92 Ca 0.17 -0.96 0.11 0.00 0.00 0.00 0.00 60.65 59.97 2h3z s ILE 92 Cb -0.08 -1.37 0.36 0.00 0.01 0.00 0.00 42.46 41.39 2h3z s ILE 92 CO 0.35 0.38 0.82 -0.90 0.00 0.00 0.00 174.94 175.59 2h3z n ASP 93 N 2.37 1.90 -3.86 3.58 5.75 -1.26 -2.57 116.55 122.46 2h3z n ASP 93 Ca -0.16 -3.16 -0.41 0.00 -0.01 0.00 0.00 54.79 51.05 2h3z n ASP 93 Cb 0.53 -0.59 -0.02 0.00 -1.03 0.00 0.00 41.12 40.01 2h3z n ASP 93 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 2h3z n VAL 94 N 0.09 1.41 0.20 2.12 0.24 -1.26 -4.74 118.33 116.38 2h3z n VAL 94 Ca 0.25 -0.44 0.18 0.00 -2.04 0.00 0.00 64.34 62.29 2h3z n VAL 94 Cb 0.62 0.00 0.83 0.00 -1.47 0.00 0.00 33.84 33.81 2h3z n VAL 94 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2h3z h LYS 95 N 0.71 0.00 -2.24 7.34 1.57 -1.98 -3.43 116.57 118.54 2h3z h LYS 95 Ca -0.27 0.00 0.20 0.00 -1.87 0.00 0.00 60.65 58.71 2h3z h LYS 95 Cb 1.27 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.51 2h3z h LYS 95 CO 0.48 0.00 0.59 0.16 -0.57 0.00 0.00 179.45 180.10 2h3z s ASP 96 N -5.44 -0.09 0.24 0.86 1.47 -1.26 -4.24 116.67 108.21 2h3z s ASP 96 Ca -0.04 -0.44 0.18 0.00 1.18 0.00 0.00 52.55 53.43 2h3z s ASP 96 Cb 0.14 0.43 0.92 0.00 -0.34 0.00 0.00 42.92 44.08 2h3z s ASP 96 CO 0.51 -0.81 1.56 0.41 0.68 0.00 0.00 175.17 177.52 2h3z n THR 97 N -0.56 1.13 -0.01 2.11 -1.04 -0.87 -2.15 114.28 112.89 2h3z n THR 97 Ca -0.05 0.56 -0.17 0.00 -2.04 0.00 0.00 64.05 62.34 2h3z n THR 97 Cb 0.61 -1.53 -0.13 0.00 -1.82 0.00 0.00 70.33 67.46 2h3z n THR 97 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 2h3z h LYS 98 N 0.00 0.20 0.00 -2.82 1.57 -1.87 -3.16 116.57 110.49 2h3z h LYS 98 Ca 0.00 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 2h3z h LYS 98 Cb 0.10 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.51 2h3z h LYS 98 CO 0.00 1.08 0.00 0.93 -0.57 0.00 0.00 179.45 180.89 2h3z h GLU 99 N -0.54 0.00 0.11 3.15 3.07 -1.82 -2.50 114.58 116.04 2h3z h GLU 99 Ca -0.07 0.00 -0.27 0.00 -0.50 0.00 0.00 59.36 58.52 2h3z h GLU 99 Cb 1.28 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 29.19 2h3z h GLU 99 CO 0.08 0.00 -1.19 0.00 -1.40 0.00 0.00 179.01 176.50 2h3z h ALA 100 N 2.14 0.14 -0.01 3.43 0.00 -1.55 -2.60 119.26 120.80 2h3z h ALA 100 Ca 0.00 -0.84 -0.21 0.00 0.00 0.00 0.00 54.91 53.86 2h3z h ALA 100 Cb 0.32 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2h3z h ALA 100 CO 0.00 0.92 -0.88 1.25 0.00 0.00 0.00 179.25 180.54 2h3z h LEU 101 N 0.11 0.44 -0.55 0.00 7.12 -1.42 -3.08 115.31 117.93 2h3z h LEU 101 Ca -0.13 -0.34 -0.16 0.00 0.13 0.00 0.00 57.88 57.38 2h3z h LEU 101 Cb 1.90 -0.13 -0.02 0.00 -0.53 0.00 0.00 40.66 41.88 2h3z h LEU 101 CO 0.20 1.12 -0.71 0.44 -0.13 0.00 0.00 178.44 179.37 2h3z h ASP 102 N 0.20 0.16 0.56 1.25 5.19 -1.57 0.11 116.42 122.31 2h3z h ASP 102 Ca -0.06 -0.10 -0.07 0.00 -0.62 0.00 0.00 57.03 56.17 2h3z h ASP 102 Cb 1.50 -0.05 -0.01 0.00 0.18 0.00 0.00 39.33 40.95 2h3z h ASP 102 CO 0.15 0.81 -0.34 0.11 -3.12 0.00 0.00 179.24 176.84 2h3z h LYS 103 N 0.09 0.00 0.00 3.56 6.56 -1.46 0.26 116.57 125.58 2h3z h LYS 103 Ca -0.02 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 2h3z h LYS 103 Cb 1.25 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.91 2h3z h LYS 103 CO 0.10 0.34 -1.87 -0.89 -2.06 0.00 0.00 179.45 175.08 2h3z n ILE 104 N -3.79 0.04 0.03 1.86 5.41 -1.15 -4.27 119.36 117.49 2h3z n ILE 104 Ca -0.01 -0.47 -0.22 0.00 1.00 0.00 0.00 62.75 63.05 2h3z n ILE 104 Cb 0.43 0.04 -0.14 0.00 -0.71 0.00 0.00 39.64 39.25 2h3z n ILE 104 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2h3z h GLU 105 N 0.00 0.31 -0.91 0.38 4.39 -0.62 -3.36 114.58 114.77 2h3z h GLU 105 Ca 0.00 -0.53 0.11 0.00 0.34 0.00 0.00 59.36 59.27 2h3z h GLU 105 Cb 0.97 0.20 -0.07 0.00 -0.10 0.00 0.00 28.75 29.75 2h3z h GLU 105 CO 0.00 1.25 0.58 1.49 -1.16 0.00 0.00 179.01 181.17 2h3z h GLU 106 N 0.09 0.85 -0.38 2.33 4.22 -0.69 0.31 114.58 121.31 2h3z h GLU 106 Ca -0.39 -0.05 0.03 0.00 0.08 0.00 0.00 59.36 59.03 2h3z h GLU 106 Cb 2.06 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 31.10 2h3z h GLU 106 CO 0.12 0.56 0.25 1.49 -2.18 0.00 0.00 179.01 179.26 2h3z h GLU 107 N 0.87 0.36 0.00 1.92 4.22 -1.74 -1.86 114.58 118.35 2h3z h GLU 107 Ca 0.43 -0.02 -0.20 0.00 0.08 0.00 0.00 59.36 59.65 2h3z h GLU 107 Cb 0.46 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 2h3z h GLU 107 CO -0.19 0.24 -1.59 0.94 -2.18 0.00 0.00 179.01 176.23 2h3z n GLN 108 N -4.48 0.63 -0.16 1.92 -0.06 -0.01 -4.11 117.38 111.11 2h3z n GLN 108 Ca 0.04 0.19 -0.02 0.00 -2.00 0.00 0.00 57.00 55.21 2h3z n GLN 108 Cb 0.17 -1.76 0.20 0.00 -4.06 0.00 0.00 30.24 24.79 2h3z n GLN 108 CO 0.00 0.00 0.00 -0.97 -0.20 0.00 0.00 177.06 175.89 2h3z h ASN 109 N 0.00 0.82 -0.83 1.69 -0.73 0.30 -2.38 115.58 114.45 2h3z h ASN 109 Ca -0.21 -0.10 0.12 0.00 1.87 0.00 0.00 56.30 57.98 2h3z h ASN 109 Cb 1.69 -0.21 -0.09 0.00 0.27 0.00 0.00 38.32 39.98 2h3z h ASN 109 CO 0.05 0.73 0.44 0.11 -0.37 0.00 0.00 177.43 178.39 2h3z h LYS 110 N 0.88 0.66 -0.12 6.67 1.79 -1.57 0.20 116.57 125.09 2h3z h LYS 110 Ca 0.21 -0.04 -0.20 0.00 -2.18 0.00 0.00 60.65 58.44 2h3z h LYS 110 Cb 0.16 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 2h3z h LYS 110 CO -0.02 0.44 -0.73 1.03 -1.08 0.00 0.00 179.45 179.09 2h3z h SER 111 N 0.68 0.67 0.31 0.86 0.87 -1.67 -2.76 113.55 112.51 2h3z h SER 111 Ca 0.43 -0.43 -0.02 0.00 -1.23 0.00 0.00 61.79 60.55 2h3z h SER 111 Cb 0.53 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 2h3z h SER 111 CO -0.32 1.19 -0.15 0.11 -0.53 0.00 0.00 176.83 177.13 2h3z h LYS 112 N 0.39 -0.40 -0.47 2.24 6.56 -0.73 0.20 116.57 124.36 2h3z h LYS 112 Ca -0.03 0.03 0.14 0.00 -1.06 0.00 0.00 60.65 59.72 2h3z h LYS 112 Cb 1.32 0.09 -0.02 0.00 -0.57 0.00 0.00 32.23 33.05 2h3z h LYS 112 CO 0.14 -0.27 0.56 -0.22 -2.06 0.00 0.00 179.45 177.60 2h3z h LYS 113 N -0.54 0.00 0.00 3.15 1.63 -0.79 0.36 116.57 120.38 2h3z h LYS 113 Ca -0.04 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.76 2h3z h LYS 113 Cb 0.32 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.95 2h3z h LYS 113 CO 0.07 0.00 -0.01 0.87 -3.45 0.00 0.00 179.45 176.93 2h3z h LYS 114 N 0.00 0.00 -0.67 1.90 1.79 -1.36 0.31 116.57 118.54 2h3z h LYS 114 Ca 0.22 0.00 0.17 0.00 -2.18 0.00 0.00 60.65 58.86 2h3z h LYS 114 Cb 1.34 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.95 2h3z h LYS 114 CO -0.00 0.11 0.47 0.00 -1.08 0.00 0.00 179.45 178.95 2h3z h ALA 115 N -0.89 2.38 -1.52 3.86 0.00 0.23 -3.33 119.26 120.00 2h3z h ALA 115 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2h3z h ALA 115 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2h3z h ALA 115 CO -0.00 -0.57 0.00 1.04 0.00 0.00 0.00 179.25 179.72 2h3z n GLN 116 N -4.41 0.00 -1.94 0.00 3.00 0.04 -4.96 117.38 109.10 2h3z n GLN 116 Ca 0.13 0.00 -0.16 0.00 -0.01 0.00 0.00 57.00 56.96 2h3z n GLN 116 Cb 0.62 -0.24 -0.04 0.00 0.00 0.00 0.00 30.24 30.58 2h3z n GLN 116 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.06 178.00 2h3z n GLN 117 N -1.99 -1.66 0.00 -1.09 7.27 0.11 -4.27 117.38 115.75 2h3z n GLN 117 Ca 0.00 0.88 0.00 0.00 0.07 0.00 0.00 57.00 57.95 2h3z n GLN 117 Cb 0.00 -5.34 0.00 0.00 2.41 0.00 0.00 30.24 27.31 2h3z n GLN 117 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2h3z n ALA 118 N -0.62 0.00 -0.41 1.69 0.00 -1.26 -4.93 120.51 114.97 2h3z n ALA 118 Ca -0.18 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.33 2h3z n ALA 118 Cb 0.59 0.00 0.32 0.00 0.00 0.00 0.00 19.45 20.36 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 -1.75 3.36 -1.69 0.00 0.00 -1.26 -3.35 120.51 115.83 2h3z n ALA 119 Ca 0.00 -1.45 0.06 0.00 0.00 0.00 0.00 53.44 52.05 2h3z n ALA 119 Cb 0.00 -1.07 0.19 0.00 0.00 0.00 0.00 19.45 18.56 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 0.68 3.47 0.01 0.00 0.00 -1.26 -4.89 120.51 118.51 2h3z n ALA 120 Ca 0.22 -3.17 0.00 0.00 0.00 0.00 0.00 53.44 50.49 2h3z n ALA 120 Cb 0.91 -0.40 0.00 0.00 0.00 0.00 0.00 19.45 19.97 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 -0.94 -0.18 -0.69 0.00 8.00 -1.26 -4.98 116.55 116.49 2h3z n ASP 121 Ca 0.17 0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.90 2h3z n ASP 121 Cb 0.74 0.39 0.00 0.00 -0.02 0.00 0.00 41.12 42.23 2h3z n ASP 121 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2h3z n THR 122 N -2.21 0.00 0.00 -3.53 -2.24 -1.21 -4.86 114.28 100.23 2h3z n THR 122 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2h3z n THR 122 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 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 0.00 0.48 3.37 3.38 0.00 -1.26 -4.99 105.19 106.17 2h3z n GLY 123 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2h3z n GLY 123 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2h3z s ASN 124 N -1.00 5.40 -0.24 1.61 0.01 -1.26 -4.86 114.94 114.60 2h3z s ASN 124 Ca 0.00 -0.76 0.02 0.00 -0.71 0.00 0.00 52.86 51.41 2h3z s ASN 124 Cb 0.00 -1.94 0.07 0.00 0.41 0.00 0.00 41.25 39.79 2h3z s ASN 124 CO 0.00 -0.25 0.95 -3.20 -1.51 0.00 0.00 177.10 173.09 2h3z n ASN 125 N 4.92 -0.88 -4.05 -1.22 2.85 -1.26 -5.12 115.26 110.49 2h3z n ASN 125 Ca -0.13 -1.53 -0.32 0.00 -0.11 0.00 0.00 54.58 52.49 2h3z n ASN 125 Cb 0.47 0.72 -0.15 0.00 1.24 0.00 0.00 39.78 42.07 2h3z n ASN 125 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 2h3z s SER 126 N -0.22 4.36 0.27 1.20 0.01 -1.26 -5.11 113.70 112.95 2h3z s SER 126 Ca 0.03 -1.37 0.09 0.00 1.31 0.00 0.00 55.95 56.01 2h3z s SER 126 Cb 0.08 -1.50 -0.04 0.00 0.21 0.00 0.00 66.02 64.77 2h3z s SER 126 CO -0.02 -0.20 0.06 -1.10 0.41 0.00 0.00 173.24 172.40 2h3z s GLN 127 N 1.14 2.48 -0.22 12.44 -1.52 -1.26 -5.14 119.66 127.58 2h3z s GLN 127 Ca -0.09 -1.33 -0.27 0.00 -1.95 0.00 0.00 55.36 51.73 2h3z s GLN 127 Cb -0.20 -2.27 0.09 0.00 -0.22 0.00 0.00 33.01 30.41 2h3z s GLN 127 CO -0.05 0.35 0.82 0.54 -0.25 0.00 0.00 175.29 176.70 2h3z s VAL 128 N -2.28 0.00 -0.24 1.09 0.11 -1.26 -5.15 120.40 112.67 2h3z s VAL 128 Ca 0.32 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.35 2h3z s VAL 128 Cb -0.06 -1.00 0.12 0.00 -1.53 0.00 0.00 36.38 33.90 2h3z s VAL 128 CO 0.22 0.00 0.30 -0.55 -3.33 0.00 0.00 175.10 171.73 2h3z s SER 129 N -0.10 1.06 0.78 3.54 0.15 -1.26 -5.15 113.70 112.72 2h3z s SER 129 Ca -0.01 -0.22 -0.12 0.00 0.70 0.00 0.00 55.95 56.30 2h3z s SER 129 Cb -0.04 0.67 0.06 0.00 -1.71 0.00 0.00 66.02 65.00 2h3z s SER 129 CO 0.01 -0.33 1.12 0.00 1.20 0.00 0.00 173.24 175.23 2h3z s GLN 130 N 2.41 2.21 0.03 5.44 0.00 -1.26 -5.09 119.66 123.40 2h3z s GLN 130 Ca 0.09 0.43 0.00 0.00 -0.00 0.00 0.00 55.36 55.88 2h3z s GLN 130 Cb -0.15 -1.95 0.01 0.00 0.00 0.00 0.00 33.01 30.91 2h3z s GLN 130 CO -0.19 -1.49 0.04 0.27 0.00 0.00 0.00 175.29 173.92 2h3z n ASN 131 N -3.30 0.06 -0.19 12.60 6.94 -1.26 -5.38 115.26 124.74 2h3z n ASN 131 Ca 0.07 -1.05 0.02 0.00 -0.02 0.00 0.00 54.58 53.60 2h3z n ASN 131 Cb 0.58 -0.03 0.02 0.00 -2.36 0.00 0.00 39.78 37.99 2h3z n ASN 131 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23