#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 3.40 0.00 4.61 0.00 -1.26 -4.90 121.76 123.61 2h3z s ALA 3 Ca 0.00 0.86 0.00 0.00 0.00 0.00 0.00 51.96 52.82 2h3z s ALA 3 Cb 0.00 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.70 2h3z s ALA 3 CO 0.00 -0.38 0.00 0.54 0.00 0.00 0.00 175.76 175.92 2h3z n ARG 4 N 3.39 0.00 -4.17 0.00 1.74 -1.26 -5.01 116.66 111.35 2h3z n ARG 4 Ca 0.07 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 57.02 2h3z n ARG 4 Cb 0.46 -0.36 -0.11 0.00 -1.02 0.00 0.00 32.46 31.43 2h3z n ARG 4 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2h3z s ALA 5 N -1.93 1.07 0.38 7.54 0.00 -1.26 -5.10 121.76 122.45 2h3z s ALA 5 Ca 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 50.74 2h3z s ALA 5 Cb 0.00 0.06 0.00 0.00 0.00 0.00 0.00 23.12 23.18 2h3z s ALA 5 CO 0.00 -0.09 0.00 0.43 0.00 0.00 0.00 175.76 176.10 2h3z n SER 6 N 0.42 -6.84 0.11 0.00 7.64 -1.26 -4.70 113.62 108.99 2h3z n SER 6 Ca -0.15 0.79 -0.08 0.00 1.01 0.00 0.00 58.87 60.44 2h3z n SER 6 Cb 0.58 -3.67 -0.05 0.00 -1.01 0.00 0.00 64.21 60.07 2h3z n SER 6 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2h3z h VAL 7 N -1.09 0.26 -3.79 0.44 2.07 -1.95 -3.41 116.25 108.78 2h3z h VAL 7 Ca -0.06 -0.83 -0.68 0.00 0.82 0.00 0.00 66.70 65.95 2h3z h VAL 7 Cb 1.07 0.44 -0.25 0.00 -1.52 0.00 0.00 31.29 31.03 2h3z h VAL 7 CO 0.04 0.07 -0.77 -0.76 0.02 0.00 0.00 177.57 176.17 2h3z s LEU 8 N -8.99 2.72 0.00 2.57 1.43 -1.26 -4.37 118.68 110.78 2h3z s LEU 8 Ca -0.08 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.77 2h3z s LEU 8 Cb 0.01 -1.57 0.00 0.00 0.03 0.00 0.00 46.19 44.65 2h3z s LEU 8 CO 0.28 0.28 0.00 -1.54 0.23 0.00 0.00 176.35 175.60 2h3z n SER 9 N 2.73 -0.37 0.36 2.29 3.41 -1.26 -4.57 113.62 116.20 2h3z n SER 9 Ca -0.17 -0.57 -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 64.41 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 -0.19 -0.96 1.04 5.00 0.00 -1.99 0.19 103.07 106.17 2h3z h GLY 10 Ca 0.00 0.35 0.06 0.00 0.00 0.00 0.00 47.33 47.74 2h3z h GLY 10 CO 0.00 -0.35 0.50 -1.33 0.00 0.00 0.00 176.54 175.36 2h3z h GLY 11 N -0.98 1.03 1.29 4.60 0.00 -2.01 -1.87 103.07 105.13 2h3z h GLY 11 Ca -0.09 -0.33 -0.14 0.00 0.00 0.00 0.00 47.33 46.76 2h3z h GLY 11 CO 0.15 0.25 -0.35 0.83 0.00 0.00 0.00 176.54 177.42 2h3z h GLU 12 N 0.83 0.78 -0.25 4.80 5.08 -1.89 -2.82 114.58 121.11 2h3z h GLU 12 Ca 0.32 -0.39 0.05 0.00 -1.00 0.00 0.00 59.36 58.35 2h3z h GLU 12 Cb 0.21 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.41 2h3z h GLU 12 CO -0.11 1.01 -0.08 1.25 -1.00 0.00 0.00 179.01 180.09 2h3z h LEU 13 N 0.65 -0.28 -0.07 1.33 5.85 0.24 0.34 115.31 123.38 2h3z h LEU 13 Ca 0.06 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 2h3z h LEU 13 Cb 0.90 0.18 -0.00 0.00 0.37 0.00 0.00 40.66 42.10 2h3z h LEU 13 CO 0.08 -0.10 0.04 0.44 -0.34 0.00 0.00 178.44 178.56 2h3z h ASP 14 N -0.02 0.08 0.07 1.25 5.19 -1.50 -2.27 116.42 119.21 2h3z h ASP 14 Ca 0.13 -0.06 -0.01 0.00 -0.62 0.00 0.00 57.03 56.47 2h3z h ASP 14 Cb 0.21 -0.02 -0.00 0.00 0.18 0.00 0.00 39.33 39.70 2h3z h ASP 14 CO -0.27 0.11 -0.07 0.50 -3.12 0.00 0.00 179.24 176.39 2h3z h LYS 15 N 0.04 0.00 -0.32 3.56 1.63 -1.19 -2.41 116.57 117.87 2h3z h LYS 15 Ca 0.02 0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.79 2h3z h LYS 15 Cb 0.05 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.66 2h3z h LYS 15 CO -0.00 0.07 0.06 2.35 -3.45 0.00 0.00 179.45 178.47 2h3z h TRP 16 N 0.00 0.55 0.00 1.91 2.91 0.23 -2.23 115.95 119.33 2h3z h TRP 16 Ca -0.00 -0.07 0.00 0.00 1.13 0.00 0.00 58.89 59.95 2h3z h TRP 16 Cb 0.12 -0.15 0.00 0.00 -0.51 0.00 0.00 29.16 28.62 2h3z h TRP 16 CO 0.00 0.59 0.00 0.39 -1.03 0.00 0.00 178.44 178.39 2h3z n GLU 17 N -4.62 0.14 0.07 2.65 1.02 -0.92 -3.30 120.64 115.68 2h3z n GLU 17 Ca -0.02 0.47 -0.03 0.00 -0.02 0.00 0.00 57.16 57.56 2h3z n GLU 17 Cb 0.21 -1.83 -0.02 0.00 -0.02 0.00 0.00 31.44 29.78 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 -0.20 -6.36 3.49 3.64 -1.24 -3.33 116.57 112.57 2h3z h LYS 18 Ca 0.00 0.01 -0.61 0.00 -1.27 0.00 0.00 60.65 58.79 2h3z h LYS 18 Cb 0.22 0.05 0.13 0.00 -0.41 0.00 0.00 32.23 32.22 2h3z h LYS 18 CO 0.00 -0.14 -0.25 -0.89 -2.27 0.00 0.00 179.45 175.90 2h3z n ILE 19 N -3.15 1.92 -4.24 2.00 5.41 -1.20 -4.61 119.36 115.48 2h3z n ILE 19 Ca -0.03 -0.50 -0.24 0.00 1.00 0.00 0.00 62.75 62.99 2h3z n ILE 19 Cb 0.08 -0.65 -0.07 0.00 -0.71 0.00 0.00 39.64 38.30 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 -1.58 2.44 0.26 0.38 0.52 -1.25 -0.91 118.95 118.80 2h3z s ARG 20 Ca 0.62 -1.26 -0.04 0.00 -0.52 0.00 0.00 55.73 54.53 2h3z s ARG 20 Cb -0.65 -2.29 0.32 0.00 0.52 0.00 0.00 34.95 32.85 2h3z s ARG 20 CO 0.58 0.40 1.87 -0.07 0.02 0.00 0.00 175.30 178.10 2h3z h LEU 21 N 2.07 0.99 -9.05 2.53 3.38 -1.78 -2.38 115.31 111.07 2h3z h LEU 21 Ca -0.46 -0.10 -0.52 0.00 0.09 0.00 0.00 57.88 56.89 2h3z h LEU 21 Cb 1.23 -0.25 -0.14 0.00 0.09 0.00 0.00 40.66 41.59 2h3z h LEU 21 CO 0.60 0.82 -0.74 -0.13 0.09 0.00 0.00 178.44 179.07 2h3z s ARG 22 N -5.66 1.50 0.26 1.13 0.52 -1.26 -4.11 118.95 111.33 2h3z s ARG 22 Ca -0.12 -1.68 0.04 0.00 -0.52 0.00 0.00 55.73 53.46 2h3z s ARG 22 Cb 0.17 -1.42 0.34 0.00 0.52 0.00 0.00 34.95 34.56 2h3z s ARG 22 CO 0.81 0.25 1.64 -1.00 0.02 0.00 0.00 175.30 177.02 2h3z h PRO 23 N 2.42 0.32 -0.24 3.54 0.13 -1.93 -3.23 132.00 133.00 2h3z h PRO 23 Ca -0.39 -0.17 -0.17 0.00 -0.87 0.00 0.00 66.00 64.40 2h3z h PRO 23 Cb 1.24 0.01 -0.12 0.00 0.13 0.00 0.00 31.00 32.25 2h3z h PRO 23 CO 0.61 0.72 -0.53 0.41 -0.23 0.00 0.00 178.00 178.98 2h3z n GLY 24 N -0.03 5.47 3.93 1.56 0.00 -1.26 -5.00 105.19 109.85 2h3z n GLY 24 Ca -0.02 -1.67 -0.19 0.00 0.00 0.00 0.00 46.02 44.14 2h3z n GLY 24 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2h3z s GLY 25 N -3.26 2.00 0.00 -0.02 0.00 -1.22 -5.03 107.32 99.79 2h3z s GLY 25 Ca 0.42 -1.76 0.15 0.00 0.00 0.00 0.00 44.72 43.54 2h3z s GLY 25 CO -0.04 -1.59 0.79 1.17 0.00 0.00 0.00 173.10 173.43 2h3z n LYS 26 N -1.65 1.82 -3.33 2.90 4.81 -1.26 -4.92 118.16 116.53 2h3z n LYS 26 Ca 0.04 -0.65 -0.38 0.00 -0.87 0.00 0.00 58.31 56.46 2h3z n LYS 26 Cb 0.60 -1.24 -0.06 0.00 0.02 0.00 0.00 35.03 34.35 2h3z n LYS 26 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 2h3z s LYS 27 N -1.91 4.31 0.62 1.64 2.20 -1.26 -5.08 119.74 120.26 2h3z s LYS 27 Ca 0.11 0.41 0.07 0.00 -0.36 0.00 0.00 55.97 56.20 2h3z s LYS 27 Cb 0.12 -3.45 0.11 0.00 -1.51 0.00 0.00 37.83 33.10 2h3z s LYS 27 CO 0.42 0.12 0.86 1.04 -0.36 0.00 0.00 175.35 177.43 2h3z n GLN 28 N 3.83 0.42 -2.96 4.03 3.00 -1.26 -2.88 117.38 121.55 2h3z n GLN 28 Ca -0.07 -3.05 -0.37 0.00 -0.01 0.00 0.00 57.00 53.50 2h3z n GLN 28 Cb 0.51 -0.35 -0.06 0.00 0.00 0.00 0.00 30.24 30.34 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 -2.75 3.72 0.18 1.08 2.02 -0.09 -4.62 117.35 116.90 2h3z s TYR 29 Ca 0.63 1.58 -0.00 0.00 -0.37 0.00 0.00 57.07 58.90 2h3z s TYR 29 Cb -0.05 -2.76 -0.04 0.00 -0.40 0.00 0.00 41.96 38.71 2h3z s TYR 29 CO 0.40 0.33 0.09 0.21 -1.57 0.00 0.00 175.55 175.01 2h3z s LYS 30 N -1.83 1.12 0.37 -0.62 2.20 -1.26 -4.03 119.74 115.69 2h3z s LYS 30 Ca 0.44 -1.57 0.14 0.00 -0.36 0.00 0.00 55.97 54.62 2h3z s LYS 30 Cb -0.19 0.15 0.98 0.00 -1.51 0.00 0.00 37.83 37.26 2h3z s LYS 30 CO 0.23 -0.31 1.78 -0.07 -0.36 0.00 0.00 175.35 176.63 2h3z h LEU 31 N 2.68 0.56 -0.56 5.43 4.07 -1.98 -0.96 115.31 124.55 2h3z h LEU 31 Ca -0.36 0.08 0.11 0.00 0.08 0.00 0.00 57.88 57.80 2h3z h LEU 31 Cb 1.23 -0.01 -0.11 0.00 1.08 0.00 0.00 40.66 42.85 2h3z h LEU 31 CO 0.57 0.16 -0.21 0.11 -1.08 0.00 0.00 178.44 177.99 2h3z h LYS 32 N 0.52 -0.07 -0.38 1.13 1.79 -1.99 0.25 116.57 117.83 2h3z h LYS 32 Ca 0.57 0.00 0.03 0.00 -2.18 0.00 0.00 60.65 59.08 2h3z h LYS 32 Cb 1.24 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.89 2h3z h LYS 32 CO -0.32 -0.05 0.25 0.45 -1.08 0.00 0.00 179.45 178.71 2h3z h HIS 33 N -0.07 0.36 0.02 -1.35 3.86 -1.58 -0.48 115.15 115.91 2h3z h HIS 33 Ca 0.26 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.48 2h3z h HIS 33 Cb 0.48 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 28.83 2h3z h HIS 33 CO -0.52 0.21 -0.01 0.82 0.86 0.00 0.00 177.93 179.29 2h3z h ILE 34 N 0.38 0.00 -1.18 2.45 2.04 -0.55 -3.15 117.51 117.50 2h3z h ILE 34 Ca 0.16 -0.04 0.34 0.00 1.00 0.00 0.00 64.86 66.31 2h3z h ILE 34 Cb 0.16 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.15 2h3z h ILE 34 CO -0.04 0.00 0.80 0.58 0.00 0.00 0.00 178.15 179.49 2h3z h VAL 35 N -0.07 0.39 0.60 1.67 2.07 -1.24 -0.71 116.25 118.96 2h3z h VAL 35 Ca -0.00 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 2h3z h VAL 35 Cb 0.02 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 29.96 2h3z h VAL 35 CO 0.00 0.03 -0.47 -0.25 0.02 0.00 0.00 177.57 176.91 2h3z h TRP 36 N 0.19 -1.27 -0.76 1.57 7.01 -1.16 -0.24 115.95 121.29 2h3z h TRP 36 Ca 0.64 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.64 2h3z h TRP 36 Cb 2.05 0.48 -0.04 0.00 -2.10 0.00 0.00 29.16 29.55 2h3z h TRP 36 CO -0.00 -0.67 0.49 0.00 -2.79 0.00 0.00 178.44 175.48 2h3z h ALA 37 N -0.87 1.45 -0.16 2.65 0.00 -1.11 -1.63 119.26 119.59 2h3z h ALA 37 Ca -0.07 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2h3z h ALA 37 Cb 0.87 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2h3z h ALA 37 CO 0.01 0.51 -0.02 0.77 0.00 0.00 0.00 179.25 180.51 2h3z h SER 38 N 1.03 0.22 1.43 0.00 0.02 -0.97 -0.58 113.55 114.69 2h3z h SER 38 Ca 0.28 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 2h3z h SER 38 Cb -0.11 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.38 2h3z h SER 38 CO -0.06 0.28 0.00 -0.09 -1.14 0.00 0.00 176.83 175.83 2h3z h ARG 39 N 0.24 0.00 0.10 3.45 2.43 -0.06 -3.14 114.38 117.40 2h3z h ARG 39 Ca 0.06 0.00 -0.34 0.00 -0.81 0.00 0.00 59.98 58.89 2h3z h ARG 39 Cb 0.20 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 2h3z h ARG 39 CO 0.01 0.00 -1.83 -1.91 -1.51 0.00 0.00 179.97 174.73 2h3z n GLU 40 N -2.67 0.72 -0.32 0.20 2.13 -0.37 -3.78 120.64 116.54 2h3z n GLU 40 Ca 0.04 0.34 0.02 0.00 0.66 0.00 0.00 57.16 58.21 2h3z n GLU 40 Cb 0.40 -1.72 0.15 0.00 0.27 0.00 0.00 31.44 30.55 2h3z n GLU 40 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 2h3z h LEU 41 N -0.18 0.87 -1.62 4.31 3.38 -1.21 0.13 115.31 120.99 2h3z h LEU 41 Ca -0.41 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.56 2h3z h LEU 41 Cb 1.87 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 42.45 2h3z h LEU 41 CO 0.02 0.54 -0.09 -0.08 0.09 0.00 0.00 178.44 178.92 2h3z h GLU 42 N 1.00 0.00 0.03 1.13 4.22 -1.31 0.17 114.58 119.82 2h3z h GLU 42 Ca 0.39 0.00 -0.28 0.00 0.08 0.00 0.00 59.36 59.55 2h3z h GLU 42 Cb 0.20 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 2h3z h GLU 42 CO -0.18 0.09 -1.55 0.00 -2.18 0.00 0.00 179.01 175.19 2h3z h ARG 43 N 0.00 0.07 0.26 1.92 2.47 -1.02 -3.40 114.38 114.69 2h3z h ARG 43 Ca -0.00 -0.12 -0.01 0.00 -1.26 0.00 0.00 59.98 58.58 2h3z h ARG 43 Cb 0.49 0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.85 2h3z h ARG 43 CO 0.01 0.78 -0.13 0.74 0.56 0.00 0.00 179.97 181.94 2h3z h PHE 44 N 0.02 -0.33 0.00 3.04 0.04 -0.55 -3.48 116.94 115.69 2h3z h PHE 44 Ca -0.23 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.53 2h3z h PHE 44 Cb 1.96 0.11 0.00 0.00 2.20 0.00 0.00 35.95 40.22 2h3z h PHE 44 CO 0.02 -0.20 0.00 0.00 -0.60 0.00 0.00 178.31 177.52 2h3z n ALA 45 N -2.49 0.00 -2.40 2.45 0.00 -0.85 -5.11 120.51 112.11 2h3z n ALA 45 Ca -0.04 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.11 2h3z n ALA 45 Cb 0.14 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.44 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 0.00 1.93 0.26 0.00 1.01 0.54 -5.02 120.40 119.13 2h3z s VAL 46 Ca 0.00 -1.28 -0.29 0.00 0.00 0.00 0.00 61.98 60.40 2h3z s VAL 46 Cb 0.00 -1.66 -0.09 0.00 0.00 0.00 0.00 36.38 34.63 2h3z s VAL 46 CO 0.00 0.32 0.95 0.20 0.00 0.00 0.00 175.10 176.57 2h3z s ASN 47 N -1.16 7.54 0.00 3.32 -0.87 -1.26 -1.85 114.94 120.67 2h3z s ASN 47 Ca 0.10 1.95 0.15 0.00 -1.57 0.00 0.00 52.86 53.49 2h3z s ASN 47 Cb -0.09 -2.60 0.75 0.00 -0.02 0.00 0.00 41.25 39.28 2h3z s ASN 47 CO 0.02 0.08 1.39 -0.81 -2.57 0.00 0.00 177.10 175.21 2h3z n PRO 48 N 1.25 0.23 0.01 -0.60 -0.04 -1.26 -2.64 135.00 131.94 2h3z n PRO 48 Ca -0.01 0.14 0.11 0.00 -0.04 0.00 0.00 63.50 63.70 2h3z n PRO 48 Cb 0.47 -1.50 0.47 0.00 -0.04 0.00 0.00 33.50 32.91 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 -0.05 -1.28 0.17 0.55 0.00 -1.26 -2.70 105.19 100.62 2h3z n GLY 49 Ca 0.07 -0.07 0.10 0.00 0.00 0.00 0.00 46.02 46.12 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 -1.54 0.52 0.10 0.99 4.77 -1.08 -3.26 117.00 117.49 2h3z n LEU 50 Ca 0.05 -0.21 0.10 0.00 -0.03 0.00 0.00 56.01 55.92 2h3z n LEU 50 Cb 0.27 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.32 2h3z n LEU 50 CO 0.21 0.10 -0.02 0.18 -1.33 0.00 0.00 177.39 176.54 2h3z n LEU 51 N -0.46 0.85 -1.93 2.23 4.77 -1.10 -2.86 117.00 118.50 2h3z n LEU 51 Ca 0.16 0.33 -0.16 0.00 -0.03 0.00 0.00 56.01 56.31 2h3z n LEU 51 Cb 0.15 -0.04 0.17 0.00 -2.33 0.00 0.00 43.42 41.37 2h3z n LEU 51 CO 0.12 -0.15 1.08 -1.84 -1.33 0.00 0.00 177.39 175.27 2h3z n GLU 52 N -2.70 2.30 -3.25 3.23 0.28 -1.20 -4.76 120.64 114.53 2h3z n GLU 52 Ca -0.01 -2.42 -0.01 0.00 -0.16 0.00 0.00 57.16 54.56 2h3z n GLU 52 Cb 0.58 -1.97 -0.04 0.00 1.43 0.00 0.00 31.44 31.45 2h3z n GLU 52 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 2h3z s THR 53 N -2.60 -0.86 0.35 3.84 -4.23 -1.25 -4.70 115.64 106.20 2h3z s THR 53 Ca 0.45 -0.02 0.15 0.00 -1.18 0.00 0.00 61.69 61.09 2h3z s THR 53 Cb 0.38 -0.93 0.35 0.00 1.34 0.00 0.00 72.50 73.64 2h3z s THR 53 CO 0.09 -0.04 1.71 0.77 -0.54 0.00 0.00 174.62 176.62 2h3z h SER 54 N 8.07 0.54 -0.62 3.99 4.64 -1.86 0.67 113.55 128.99 2h3z h SER 54 Ca -0.21 0.14 0.07 0.00 -0.47 0.00 0.00 61.79 61.32 2h3z h SER 54 Cb 1.15 0.06 -0.04 0.00 -0.31 0.00 0.00 62.40 63.27 2h3z h SER 54 CO 0.26 0.02 0.41 -0.33 -0.87 0.00 0.00 176.83 176.31 2h3z h GLU 55 N 0.43 0.54 0.21 4.77 5.08 -1.95 -2.40 114.58 121.25 2h3z h GLU 55 Ca 0.67 -0.03 -0.29 0.00 -1.00 0.00 0.00 59.36 58.71 2h3z h GLU 55 Cb 1.52 -0.12 0.03 0.00 0.50 0.00 0.00 28.75 30.68 2h3z h GLU 55 CO -0.46 0.36 -1.28 0.78 -1.00 0.00 0.00 179.01 177.40 2h3z h GLY 56 N 0.56 0.52 0.98 -3.84 0.00 0.13 -3.28 103.07 98.13 2h3z h GLY 56 Ca 0.27 -1.32 0.15 0.00 0.00 0.00 0.00 47.33 46.43 2h3z h GLY 56 CO -0.08 1.15 0.37 0.00 0.00 0.00 0.00 176.54 177.98 2h3z h ARG 58 N 0.01 0.30 -0.13 0.00 2.43 -1.52 -3.14 114.38 112.33 2h3z h ARG 58 Ca 0.24 -0.25 -0.22 0.00 -0.81 0.00 0.00 59.98 58.95 2h3z h ARG 58 Cb 0.96 0.05 0.01 0.00 -0.42 0.00 0.00 29.97 30.57 2h3z h ARG 58 CO -0.01 0.90 -0.79 0.37 -1.51 0.00 0.00 179.97 178.94 2h3z h GLN 59 N 0.20 0.72 -0.92 0.20 4.15 -0.90 -2.53 115.11 116.03 2h3z h GLN 59 Ca -0.03 -0.60 0.07 0.00 0.77 0.00 0.00 58.65 58.86 2h3z h GLN 59 Cb 1.29 0.13 -0.07 0.00 0.21 0.00 0.00 27.48 29.05 2h3z h GLN 59 CO 0.12 1.21 0.58 0.82 -1.93 0.00 0.00 178.83 179.63 2h3z h ILE 60 N 0.49 1.05 -0.08 2.39 2.04 -1.25 0.27 117.51 122.41 2h3z h ILE 60 Ca -0.05 -0.36 -0.20 0.00 1.00 0.00 0.00 64.86 65.25 2h3z h ILE 60 Cb 1.41 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 2h3z h ILE 60 CO 0.16 0.19 -0.78 -0.07 0.00 0.00 0.00 178.15 177.64 2h3z h LEU 61 N 1.04 0.62 -0.33 1.44 3.38 -1.55 -2.68 115.31 117.23 2h3z h LEU 61 Ca 0.40 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2h3z h LEU 61 Cb 0.19 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2h3z h LEU 61 CO -0.18 1.19 0.00 1.23 0.09 0.00 0.00 178.44 180.77 2h3z h GLY 62 N 1.07 0.00 0.82 0.83 0.00 -0.92 -2.36 103.07 102.51 2h3z h GLY 62 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 46.94 2h3z h GLY 62 CO 0.14 0.00 -1.77 1.46 0.00 0.00 0.00 176.54 176.38 2h3z h GLN 63 N 0.00 0.36 0.00 4.80 4.20 -0.41 -3.34 115.11 120.71 2h3z h GLN 63 Ca 0.00 -0.61 0.00 0.00 0.06 0.00 0.00 58.65 58.10 2h3z h GLN 63 Cb 0.65 0.23 0.00 0.00 0.30 0.00 0.00 27.48 28.66 2h3z h GLN 63 CO 0.00 1.29 0.00 -0.07 -0.67 0.00 0.00 178.83 179.38 2h3z h LEU 64 N 0.05 0.00 -0.51 1.46 3.38 -1.50 -3.37 115.31 114.83 2h3z h LEU 64 Ca -0.36 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.66 2h3z h LEU 64 Cb 2.05 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.74 2h3z h LEU 64 CO 0.15 0.00 -0.30 0.00 0.09 0.00 0.00 178.44 178.38 2h3z n GLN 65 N -3.03 -0.22 -0.04 1.13 6.02 -0.89 0.26 117.38 120.61 2h3z n GLN 65 Ca 0.04 0.78 -0.13 0.00 -0.01 0.00 0.00 57.00 57.67 2h3z n GLN 65 Cb 0.48 -1.14 -0.08 0.00 1.02 0.00 0.00 30.24 30.52 2h3z n GLN 65 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 2h3z h PRO 66 N 0.00 0.23 -0.35 -1.09 0.13 -1.84 -3.05 132.00 126.03 2h3z h PRO 66 Ca 0.08 -0.12 0.10 0.00 -0.87 0.00 0.00 66.00 65.19 2h3z h PRO 66 Cb 0.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.33 2h3z h PRO 66 CO -0.48 0.65 0.45 0.77 -0.23 0.00 0.00 178.00 179.16 2h3z h SER 67 N -0.19 0.00 -0.37 1.44 0.02 -0.63 0.19 113.55 114.02 2h3z h SER 67 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2h3z h SER 67 Cb 0.61 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.13 2h3z h SER 67 CO 0.02 0.00 0.24 -0.07 -1.14 0.00 0.00 176.83 175.88 2h3z h LEU 68 N 0.00 0.44 -0.19 5.07 3.38 -0.08 -0.85 115.31 123.08 2h3z h LEU 68 Ca 0.16 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 2h3z h LEU 68 Cb 1.05 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 2h3z h LEU 68 CO -0.00 0.33 -0.12 -0.61 0.09 0.00 0.00 178.44 178.12 2h3z h GLN 69 N 0.51 0.41 -0.99 1.13 4.15 -0.78 -3.18 115.11 116.37 2h3z h GLN 69 Ca 0.14 -0.19 -0.66 0.00 0.77 0.00 0.00 58.65 58.70 2h3z h GLN 69 Cb -0.04 -0.00 -0.30 0.00 0.21 0.00 0.00 27.48 27.35 2h3z h GLN 69 CO -0.03 0.73 0.80 0.25 -1.93 0.00 0.00 178.83 178.66 2h3z n THR 70 N -4.55 3.56 -3.92 2.39 -2.24 -0.95 -4.94 114.28 103.63 2h3z n THR 70 Ca -0.05 -2.88 -0.10 0.00 -2.27 0.00 0.00 64.05 58.75 2h3z n THR 70 Cb 0.34 -1.09 -0.10 0.00 -2.10 0.00 0.00 70.33 67.38 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 -1.85 0.15 0.00 3.38 0.00 -0.37 -5.00 107.32 103.64 2h3z s GLY 71 Ca 0.64 -0.43 0.00 0.00 0.00 0.00 0.00 44.72 44.93 2h3z s GLY 71 CO 0.00 -0.55 0.00 -1.14 0.00 0.00 0.00 173.10 171.41 2h3z n SER 72 N 1.18 0.00 -0.32 1.64 3.41 -1.26 -4.85 113.62 113.41 2h3z n SER 72 Ca -0.21 -0.53 0.24 0.00 -0.26 0.00 0.00 58.87 58.10 2h3z n SER 72 Cb 0.57 0.00 0.53 0.00 -0.26 0.00 0.00 64.21 65.05 2h3z n SER 72 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2h3z h GLU 73 N 0.00 0.34 -1.18 4.33 4.11 -1.98 0.19 114.58 120.40 2h3z h GLU 73 Ca 0.00 -0.02 0.34 0.00 0.07 0.00 0.00 59.36 59.75 2h3z h GLU 73 Cb 0.00 -0.08 -0.09 0.00 0.50 0.00 0.00 28.75 29.08 2h3z h GLU 73 CO 0.00 0.23 0.79 0.93 0.07 0.00 0.00 179.01 181.03 2h3z h GLU 74 N 0.35 0.20 0.00 1.06 3.07 -2.01 0.20 114.58 117.45 2h3z h GLU 74 Ca 0.59 -0.01 -0.30 0.00 -0.50 0.00 0.00 59.36 59.14 2h3z h GLU 74 Cb 1.56 -0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 29.37 2h3z h GLU 74 CO -0.27 0.13 -2.12 -0.11 -1.40 0.00 0.00 179.01 175.24 2h3z n LEU 75 N -4.49 0.25 0.20 1.33 7.94 0.61 -4.30 117.00 118.54 2h3z n LEU 75 Ca 0.29 0.11 -0.15 0.00 -1.11 0.00 0.00 56.01 55.15 2h3z n LEU 75 Cb 1.14 0.34 -0.08 0.00 0.53 0.00 0.00 43.42 45.35 2h3z n LEU 75 CO 0.29 0.39 0.73 -0.09 -1.11 0.00 0.00 177.39 177.61 2h3z h ARG 76 N 0.00 -0.43 -0.82 1.96 2.43 -0.01 -2.78 114.38 114.73 2h3z h ARG 76 Ca -0.40 0.03 0.18 0.00 -0.81 0.00 0.00 59.98 58.97 2h3z h ARG 76 Cb 2.01 0.10 -0.11 0.00 -0.42 0.00 0.00 29.97 31.54 2h3z h ARG 76 CO 0.04 -0.26 0.33 0.77 -1.51 0.00 0.00 179.97 179.34 2h3z h SER 77 N -0.50 0.27 0.40 -3.80 0.02 -1.24 -1.86 113.55 106.84 2h3z h SER 77 Ca -0.05 0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 2h3z h SER 77 Cb 0.37 0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 2h3z h SER 77 CO 0.08 0.05 -0.44 -0.07 -1.14 0.00 0.00 176.83 175.30 2h3z h LEU 78 N 0.41 -1.21 -0.87 5.07 4.07 -1.69 0.01 115.31 121.11 2h3z h LEU 78 Ca 0.48 0.10 0.21 0.00 0.08 0.00 0.00 57.88 58.75 2h3z h LEU 78 Cb 0.82 0.40 -0.13 0.00 1.08 0.00 0.00 40.66 42.84 2h3z h LEU 78 CO -0.47 -0.57 0.33 0.22 -1.08 0.00 0.00 178.44 176.87 2h3z h TYR 79 N -0.85 0.53 0.63 1.13 5.03 -1.14 0.26 116.97 122.57 2h3z h TYR 79 Ca -0.05 0.04 -0.03 0.00 2.58 0.00 0.00 58.73 61.27 2h3z h TYR 79 Cb 0.74 -0.10 0.01 0.00 1.55 0.00 0.00 36.73 38.93 2h3z h TYR 79 CO -0.25 -0.09 -0.30 -0.91 -1.32 0.00 0.00 178.16 175.30 2h3z h ASN 80 N 0.34 -0.71 0.05 -2.11 -0.26 -0.86 0.21 115.58 112.24 2h3z h ASN 80 Ca 0.54 0.02 0.03 0.00 -0.56 0.00 0.00 56.30 56.33 2h3z h ASN 80 Cb 1.02 0.18 -0.05 0.00 -1.06 0.00 0.00 38.32 38.41 2h3z h ASN 80 CO -0.55 -0.50 -0.39 0.74 -1.06 0.00 0.00 177.43 175.67 2h3z h THR 81 N -0.87 0.20 -0.89 2.81 2.02 -0.39 -1.63 112.91 114.14 2h3z h THR 81 Ca -0.09 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.27 2h3z h THR 81 Cb 0.65 0.20 -0.10 0.00 -1.74 0.00 0.00 68.15 67.15 2h3z h THR 81 CO 0.14 0.00 0.47 0.40 0.37 0.00 0.00 175.52 176.90 2h3z h ILE 82 N -0.58 0.67 -0.71 3.11 2.04 -0.55 0.10 117.51 121.60 2h3z h ILE 82 Ca 0.04 -0.21 0.08 0.00 1.00 0.00 0.00 64.86 65.77 2h3z h ILE 82 Cb 0.64 0.01 -0.07 0.00 -0.74 0.00 0.00 36.82 36.66 2h3z h ILE 82 CO -0.27 0.11 0.37 0.00 0.00 0.00 0.00 178.15 178.36 2h3z h ALA 83 N 1.61 0.97 -0.02 1.87 0.00 -0.00 0.27 119.26 123.96 2h3z h ALA 83 Ca 0.51 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.46 2h3z h ALA 83 Cb 0.80 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 2h3z h ALA 83 CO -0.40 -0.01 -0.00 0.28 0.00 0.00 0.00 179.25 179.12 2h3z h VAL 84 N 0.64 1.30 0.06 0.00 2.07 -0.50 -2.87 116.25 116.95 2h3z h VAL 84 Ca 0.34 -0.89 0.01 0.00 0.82 0.00 0.00 66.70 66.98 2h3z h VAL 84 Cb 0.31 1.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 2h3z h VAL 84 CO -0.24 0.23 -0.08 0.25 0.02 0.00 0.00 177.57 177.75 2h3z h LEU 85 N -0.33 -0.23 -0.63 2.57 5.85 -0.90 -2.39 115.31 119.26 2h3z h LEU 85 Ca 0.00 0.03 0.13 0.00 0.84 0.00 0.00 57.88 58.88 2h3z h LEU 85 Cb 0.38 0.09 -0.12 0.00 0.37 0.00 0.00 40.66 41.38 2h3z h LEU 85 CO 0.00 -0.13 -0.14 0.22 -0.34 0.00 0.00 178.44 178.06 2h3z h TYR 86 N -0.17 -0.30 -0.53 1.25 3.20 -0.52 0.20 116.97 120.11 2h3z h TYR 86 Ca 0.01 0.06 0.05 0.00 3.14 0.00 0.00 58.73 61.99 2h3z h TYR 86 Cb 0.18 0.23 -0.05 0.00 1.54 0.00 0.00 36.73 38.63 2h3z h TYR 86 CO -0.12 -0.26 0.26 0.00 -1.64 0.00 0.00 178.16 176.40 2h3z h VAL 88 N 0.50 0.56 -0.57 0.00 2.07 -0.46 0.38 116.25 118.74 2h3z h VAL 88 Ca 0.24 -0.14 -0.08 0.00 0.82 0.00 0.00 66.70 67.54 2h3z h VAL 88 Cb 0.16 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.02 2h3z h VAL 88 CO -0.17 0.08 0.05 0.45 0.02 0.00 0.00 177.57 177.99 2h3z h HIS 89 N 0.42 1.00 -0.03 1.57 -0.00 -0.98 -2.23 115.15 114.90 2h3z h HIS 89 Ca 0.48 -0.14 0.00 0.00 -0.00 0.00 0.00 60.37 60.71 2h3z h HIS 89 Cb 0.83 -0.27 0.00 0.00 -0.00 0.00 0.00 27.41 27.96 2h3z h HIS 89 CO -0.17 0.88 0.00 1.04 -0.00 0.00 0.00 177.93 179.68 2h3z n GLN 90 N -4.21 1.18 -0.97 2.45 1.13 0.12 -4.77 117.38 112.31 2h3z n GLN 90 Ca 0.03 -0.15 0.00 0.00 -1.94 0.00 0.00 57.00 54.95 2h3z n GLN 90 Cb 0.30 -1.53 0.00 0.00 0.11 0.00 0.00 30.24 29.12 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 0.03 -0.67 -3.14 -1.09 0.00 -0.84 -4.98 116.66 105.96 2h3z n ARG 91 Ca 0.01 0.17 -0.39 0.00 -0.00 0.00 0.00 57.85 57.64 2h3z n ARG 91 Cb 0.29 -3.72 -0.06 0.00 0.00 0.00 0.00 32.46 28.97 2h3z n ARG 91 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2h3z s ILE 92 N -1.79 4.79 -0.46 5.15 1.01 0.11 -4.96 121.20 125.06 2h3z s ILE 92 Ca 0.00 1.38 0.08 0.00 0.00 0.00 0.00 60.65 62.11 2h3z s ILE 92 Cb 0.00 -3.99 0.38 0.00 0.01 0.00 0.00 42.46 38.86 2h3z s ILE 92 CO 0.00 0.43 0.95 0.47 0.00 0.00 0.00 174.94 176.79 2h3z n ASP 93 N 2.50 3.38 -3.63 3.58 8.00 -1.26 -2.17 116.55 126.95 2h3z n ASP 93 Ca -0.06 -3.42 -0.39 0.00 0.71 0.00 0.00 54.79 51.63 2h3z n ASP 93 Cb 0.51 -0.54 -0.02 0.00 -0.02 0.00 0.00 41.12 41.04 2h3z n ASP 93 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2h3z n VAL 94 N -0.18 1.46 -0.27 2.53 0.24 -1.26 -4.79 118.33 116.06 2h3z n VAL 94 Ca 0.29 -0.41 0.06 0.00 -2.04 0.00 0.00 64.34 62.23 2h3z n VAL 94 Cb 0.58 0.00 0.29 0.00 -1.47 0.00 0.00 33.84 33.24 2h3z n VAL 94 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 2h3z h LYS 95 N 0.73 0.89 -3.36 7.34 3.64 -1.98 -3.42 116.57 120.40 2h3z h LYS 95 Ca -0.24 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.03 2h3z h LYS 95 Cb 1.19 -0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 32.77 2h3z h LYS 95 CO 0.46 0.59 0.08 0.16 -2.27 0.00 0.00 179.45 178.47 2h3z s ASP 96 N -6.03 0.08 0.36 4.20 1.47 -1.26 -3.91 116.67 111.57 2h3z s ASP 96 Ca -0.11 -1.02 0.25 0.00 1.18 0.00 0.00 52.55 52.85 2h3z s ASP 96 Cb 0.20 0.72 1.29 0.00 -0.34 0.00 0.00 42.92 44.79 2h3z s ASP 96 CO 0.79 -1.40 1.77 0.74 0.68 0.00 0.00 175.17 177.75 2h3z h THR 97 N 2.08 0.00 0.06 2.11 2.02 -1.57 -2.72 112.91 114.89 2h3z h THR 97 Ca -0.27 -0.07 -0.00 0.00 0.77 0.00 0.00 66.41 66.84 2h3z h THR 97 Cb 1.25 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 68.35 2h3z h THR 97 CO 0.35 0.00 -0.03 0.50 0.37 0.00 0.00 175.52 176.71 2h3z h LYS 98 N 0.00 -0.07 0.00 6.66 3.11 -1.87 -3.26 116.57 121.14 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 0.02 0.00 0.00 -1.00 0.00 0.00 32.23 31.35 2h3z h LYS 98 CO 0.00 0.45 0.00 0.93 -2.81 0.00 0.00 179.45 178.02 2h3z h GLU 99 N -0.95 0.00 -0.13 1.90 5.08 -1.90 -1.78 114.58 116.82 2h3z h GLU 99 Ca -0.01 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.17 2h3z h GLU 99 Cb 0.56 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 2h3z h GLU 99 CO 0.01 0.00 -0.66 0.00 -1.00 0.00 0.00 179.01 177.36 2h3z h ALA 100 N 2.04 0.61 0.00 3.43 0.00 -1.53 -1.71 119.26 122.10 2h3z h ALA 100 Ca 0.00 -0.57 -0.12 0.00 0.00 0.00 0.00 54.91 54.22 2h3z h ALA 100 Cb 0.12 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2h3z h ALA 100 CO 0.00 0.72 -0.58 1.25 0.00 0.00 0.00 179.25 180.65 2h3z h LEU 101 N 0.36 0.00 0.00 0.00 7.12 -1.36 -1.55 115.31 119.88 2h3z h LEU 101 Ca -0.02 0.00 -0.16 0.00 0.13 0.00 0.00 57.88 57.84 2h3z h LEU 101 Cb 1.23 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 41.34 2h3z h LEU 101 CO 0.12 0.58 -0.84 0.44 -0.13 0.00 0.00 178.44 178.61 2h3z h ASP 102 N 0.00 0.00 0.46 1.25 5.19 -1.46 -3.21 116.42 118.65 2h3z h ASP 102 Ca -0.01 0.00 -0.30 0.00 -0.62 0.00 0.00 57.03 56.10 2h3z h ASP 102 Cb 1.27 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.77 2h3z h ASP 102 CO 0.08 0.70 -1.55 0.11 -3.12 0.00 0.00 179.24 175.46 2h3z h LYS 103 N 0.00 0.22 0.00 3.56 6.56 -1.27 -3.28 116.57 122.36 2h3z h LYS 103 Ca -0.04 -0.37 -0.04 0.00 -1.06 0.00 0.00 60.65 59.14 2h3z h LYS 103 Cb 1.57 0.14 -0.01 0.00 -0.57 0.00 0.00 32.23 33.36 2h3z h LYS 103 CO 0.08 1.06 -0.19 0.97 -2.06 0.00 0.00 179.45 179.32 2h3z h ILE 104 N 0.06 0.92 -0.02 1.86 2.10 -1.38 0.14 117.51 121.19 2h3z h ILE 104 Ca -0.25 -0.71 -0.21 0.00 1.08 0.00 0.00 64.86 64.78 2h3z h ILE 104 Cb 2.01 1.40 -0.00 0.00 -1.09 0.00 0.00 36.82 39.14 2h3z h ILE 104 CO 0.15 0.19 -0.87 -0.33 -1.08 0.00 0.00 178.15 176.20 2h3z h GLU 105 N 0.00 0.40 0.01 2.19 4.39 -1.65 -2.25 114.58 117.68 2h3z h GLU 105 Ca -0.00 -0.40 -0.23 0.00 0.34 0.00 0.00 59.36 59.07 2h3z h GLU 105 Cb 0.39 0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 29.11 2h3z h GLU 105 CO 0.02 1.06 -1.19 1.49 -1.16 0.00 0.00 179.01 179.23 2h3z h GLU 106 N 0.24 0.02 -0.14 2.33 4.81 -1.50 -3.31 114.58 117.03 2h3z h GLU 106 Ca -0.06 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.04 2h3z h GLU 106 Cb 1.49 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.89 2h3z h GLU 106 CO 0.15 0.90 -0.27 0.93 -0.73 0.00 0.00 179.01 179.99 2h3z h GLU 107 N 0.01 0.44 -0.45 1.92 4.39 -0.77 -3.07 114.58 117.05 2h3z h GLU 107 Ca -0.09 -0.28 0.13 0.00 0.34 0.00 0.00 59.36 59.47 2h3z h GLU 107 Cb 1.84 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 30.51 2h3z h GLU 107 CO 0.12 0.88 0.35 0.37 -1.16 0.00 0.00 179.01 179.57 2h3z h GLN 108 N 0.05 0.00 -0.11 2.33 5.75 -1.52 0.13 115.11 121.73 2h3z h GLN 108 Ca 0.01 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.47 2h3z h GLN 108 Cb 0.86 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.40 2h3z h GLN 108 CO 0.06 0.00 -0.10 -0.97 -2.65 0.00 0.00 178.83 175.17 2h3z h ASN 109 N 0.00 0.16 0.19 -0.69 -0.00 -1.62 0.26 115.58 113.87 2h3z h ASN 109 Ca 0.21 -0.02 -0.16 0.00 -0.00 0.00 0.00 56.30 56.32 2h3z h ASN 109 Cb 0.92 -0.04 -0.01 0.00 -0.00 0.00 0.00 38.32 39.19 2h3z h ASN 109 CO -0.00 0.28 -0.63 0.50 -0.00 0.00 0.00 177.43 177.58 2h3z h LYS 110 N 0.17 0.42 0.00 6.67 3.11 -0.85 -3.12 116.57 122.96 2h3z h LYS 110 Ca 0.04 -0.30 -0.07 0.00 -2.81 0.00 0.00 60.65 57.51 2h3z h LYS 110 Cb 0.28 0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 31.55 2h3z h LYS 110 CO 0.02 0.91 -0.76 1.03 -2.81 0.00 0.00 179.45 177.84 2h3z h SER 111 N 0.31 0.00 -0.87 4.20 0.87 -1.36 -3.34 113.55 113.36 2h3z h SER 111 Ca -0.01 0.00 0.13 0.00 -1.23 0.00 0.00 61.79 60.68 2h3z h SER 111 Cb 1.17 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 63.04 2h3z h SER 111 CO 0.11 0.27 0.49 0.50 -0.53 0.00 0.00 176.83 177.66 2h3z h LYS 112 N 0.00 0.71 -0.08 2.24 3.64 -0.45 0.14 116.57 122.78 2h3z h LYS 112 Ca -0.04 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2h3z h LYS 112 Cb 1.24 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.90 2h3z h LYS 112 CO 0.03 0.47 0.05 1.57 -2.27 0.00 0.00 179.45 179.30 2h3z h LYS 113 N 0.73 0.10 -0.07 1.90 5.09 -1.68 -0.98 116.57 121.66 2h3z h LYS 113 Ca 0.46 -0.01 -0.04 0.00 0.09 0.00 0.00 60.65 61.16 2h3z h LYS 113 Cb 0.57 -0.02 -0.01 0.00 0.10 0.00 0.00 32.23 32.87 2h3z h LYS 113 CO -0.32 0.07 -0.13 -0.22 -2.09 0.00 0.00 179.45 176.76 2h3z h LYS 114 N 0.10 0.10 0.00 0.07 3.64 -0.91 0.27 116.57 119.84 2h3z h LYS 114 Ca 0.03 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2h3z h LYS 114 Cb -0.01 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2h3z h LYS 114 CO -0.01 0.24 -0.57 0.00 -2.27 0.00 0.00 179.45 176.84 2h3z h ALA 115 N 1.78 0.72 -1.42 5.00 0.00 -1.14 -3.37 119.26 120.83 2h3z h ALA 115 Ca 0.02 -0.01 -0.45 0.00 0.00 0.00 0.00 54.91 54.47 2h3z h ALA 115 Cb 0.29 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 17.68 2h3z h ALA 115 CO 0.02 0.01 -1.05 1.04 0.00 0.00 0.00 179.25 179.27 2h3z n GLN 116 N -2.87 1.78 -0.20 0.00 1.13 -0.71 -4.90 117.38 111.61 2h3z n GLN 116 Ca 0.02 -3.69 0.28 0.00 -1.94 0.00 0.00 57.00 51.67 2h3z n GLN 116 Cb 0.55 -1.64 0.71 0.00 0.11 0.00 0.00 30.24 29.96 2h3z n GLN 116 CO 0.00 0.00 0.00 0.37 -1.44 0.00 0.00 177.06 175.99 2h3z h GLN 117 N 2.91 0.04 0.03 -1.09 5.75 -0.66 -0.16 115.11 121.93 2h3z h GLN 117 Ca 0.05 -0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.54 2h3z h GLN 117 Cb 1.02 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.57 2h3z h GLN 117 CO 0.60 0.03 -0.02 0.00 -2.65 0.00 0.00 178.83 176.79 2h3z h ALA 118 N 1.54 -0.47 -1.01 3.38 0.00 -1.91 0.10 119.26 120.90 2h3z h ALA 118 Ca 0.45 -0.01 0.27 0.00 0.00 0.00 0.00 54.91 55.62 2h3z h ALA 118 Cb 1.72 0.02 -0.13 0.00 0.00 0.00 0.00 17.79 19.40 2h3z h ALA 118 CO -0.03 -0.47 0.59 0.00 0.00 0.00 0.00 179.25 179.34 2h3z h ALA 119 N -1.94 1.85 0.41 0.00 0.00 -1.80 -0.15 119.26 117.62 2h3z h ALA 119 Ca -0.00 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2h3z h ALA 119 Cb 0.04 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2h3z h ALA 119 CO 0.01 -0.36 -0.20 0.00 0.00 0.00 0.00 179.25 178.70 2h3z h ALA 120 N 1.76 -0.55 -1.01 0.00 0.00 -1.12 -3.19 119.26 115.16 2h3z h ALA 120 Ca 0.67 -0.18 0.25 0.00 0.00 0.00 0.00 54.91 55.64 2h3z h ALA 120 Cb 1.36 0.21 -0.12 0.00 0.00 0.00 0.00 17.79 19.24 2h3z h ALA 120 CO -0.51 -0.59 0.61 0.22 0.00 0.00 0.00 179.25 178.98 2h3z h ASP 121 N -0.98 0.63 -3.44 0.00 3.58 0.01 -3.37 116.42 112.85 2h3z h ASP 121 Ca -0.06 0.12 -0.61 0.00 0.42 0.00 0.00 57.03 56.91 2h3z h ASP 121 Cb 0.55 0.02 -0.11 0.00 1.72 0.00 0.00 39.33 41.51 2h3z h ASP 121 CO 0.09 0.12 0.23 0.42 -2.88 0.00 0.00 179.24 177.22 2h3z s THR 122 N -5.72 4.95 0.00 2.25 -4.23 -0.16 -4.92 115.64 107.81 2h3z s THR 122 Ca -0.10 1.21 0.00 0.00 -1.18 0.00 0.00 61.69 61.61 2h3z s THR 122 Cb 0.27 -3.98 0.00 0.00 1.34 0.00 0.00 72.50 70.13 2h3z s THR 122 CO 0.80 -0.01 0.00 0.61 -0.54 0.00 0.00 174.62 175.48 2h3z n GLY 123 N 4.09 2.17 0.07 3.99 0.00 -1.26 -4.81 105.19 109.45 2h3z n GLY 123 Ca 0.01 -2.16 -0.05 0.00 0.00 0.00 0.00 46.02 43.82 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 0.00 1.70 -0.56 1.61 4.13 -1.26 -5.08 115.26 115.80 2h3z n ASN 124 Ca 0.00 0.53 0.00 0.00 1.68 0.00 0.00 54.58 56.79 2h3z n ASN 124 Cb 0.00 -0.81 0.00 0.00 -1.54 0.00 0.00 39.78 37.43 2h3z n ASN 124 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2h3z n ASN 125 N -4.40 -4.03 -2.45 6.41 2.85 -1.26 -5.02 115.26 107.36 2h3z n ASN 125 Ca -0.08 0.00 -0.00 0.00 -0.11 0.00 0.00 54.58 54.38 2h3z n ASN 125 Cb 0.31 0.00 -0.00 0.00 1.24 0.00 0.00 39.78 41.33 2h3z n ASN 125 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 2h3z n SER 126 N -2.19 -6.44 -2.69 1.20 2.88 -1.26 -5.04 113.62 100.08 2h3z n SER 126 Ca 0.00 1.13 -0.06 0.00 -1.33 0.00 0.00 58.87 58.61 2h3z n SER 126 Cb 0.00 -4.42 0.10 0.00 -0.75 0.00 0.00 64.21 59.14 2h3z n SER 126 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2h3z n GLN 127 N 0.60 0.60 -4.16 -1.46 10.64 -1.26 -5.16 117.38 117.18 2h3z n GLN 127 Ca -0.02 -1.33 -0.25 0.00 -1.83 0.00 0.00 57.00 53.57 2h3z n GLN 127 Cb 0.03 -0.54 -0.06 0.00 -0.86 0.00 0.00 30.24 28.81 2h3z n GLN 127 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.06 176.56 2h3z n VAL 128 N 0.32 0.00 -3.61 -0.39 0.24 -1.26 -5.17 118.33 108.46 2h3z n VAL 128 Ca -0.01 -2.00 0.00 0.00 -2.04 0.00 0.00 64.34 60.29 2h3z n VAL 128 Cb 0.73 0.51 0.00 0.00 -1.47 0.00 0.00 33.84 33.61 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 -1.38 0.00 -4.62 -1.34 3.41 -1.26 -5.16 113.62 103.27 2h3z n SER 129 Ca -0.13 -0.97 -0.29 0.00 -0.26 0.00 0.00 58.87 57.22 2h3z n SER 129 Cb 0.53 0.00 0.20 0.00 -0.26 0.00 0.00 64.21 64.68 2h3z n SER 129 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2h3z s GLN 130 N -1.92 0.02 -0.01 4.33 -2.07 -1.26 -5.00 119.66 113.75 2h3z s GLN 130 Ca 0.00 0.61 0.07 0.00 -1.82 0.00 0.00 55.36 54.22 2h3z s GLN 130 Cb 0.00 -1.68 0.12 0.00 -1.09 0.00 0.00 33.01 30.36 2h3z s GLN 130 CO 0.00 -3.03 1.05 -1.71 -1.32 0.00 0.00 175.29 170.28 2h3z n ASN 131 N -4.40 0.41 0.00 12.60 2.85 -1.26 -5.33 115.26 120.14 2h3z n ASN 131 Ca 0.05 -2.12 0.00 0.00 -0.11 0.00 0.00 54.58 52.40 2h3z n ASN 131 Cb 0.56 -0.24 0.00 0.00 1.24 0.00 0.00 39.78 41.34 2h3z n ASN 131 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15