#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 0.14 0.19 4.61 0.00 -1.26 -4.91 120.51 119.28 2h3z n ALA 3 Ca 0.00 0.47 -0.08 0.00 0.00 0.00 0.00 53.44 53.83 2h3z n ALA 3 Cb 0.00 -2.19 -0.04 0.00 0.00 0.00 0.00 19.45 17.22 2h3z n ALA 3 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2h3z h ARG 4 N 4.81 -0.49 -0.34 0.00 2.43 -2.10 -3.46 114.38 115.23 2h3z h ARG 4 Ca -0.46 0.03 0.24 0.00 -0.81 0.00 0.00 59.98 58.98 2h3z h ARG 4 Cb 1.30 0.11 -0.21 0.00 -0.42 0.00 0.00 29.97 30.75 2h3z h ARG 4 CO 0.80 -0.32 0.15 0.00 -1.51 0.00 0.00 179.97 179.08 2h3z s ALA 5 N -4.17 -3.42 0.33 2.80 0.00 -1.26 -5.17 121.76 110.87 2h3z s ALA 5 Ca -0.08 1.46 -0.16 0.00 0.00 0.00 0.00 51.96 53.19 2h3z s ALA 5 Cb 0.01 -2.48 -0.09 0.00 0.00 0.00 0.00 23.12 20.56 2h3z s ALA 5 CO 0.23 -1.43 0.76 -1.54 0.00 0.00 0.00 175.76 173.78 2h3z s SER 6 N 2.92 6.80 -0.01 0.00 1.04 -1.26 -5.01 113.70 118.18 2h3z s SER 6 Ca -0.01 1.33 -0.02 0.00 0.48 0.00 0.00 55.95 57.72 2h3z s SER 6 Cb -0.10 -2.39 -0.01 0.00 0.10 0.00 0.00 66.02 63.62 2h3z s SER 6 CO -0.11 -0.21 -0.05 0.52 0.98 0.00 0.00 173.24 174.36 2h3z n VAL 7 N -0.36 0.57 -4.75 5.02 0.31 -1.26 -4.43 118.33 113.42 2h3z n VAL 7 Ca 0.04 0.09 -0.33 0.00 -0.01 0.00 0.00 64.34 64.12 2h3z n VAL 7 Cb 0.53 -1.60 -0.13 0.00 -0.91 0.00 0.00 33.84 31.73 2h3z n VAL 7 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2h3z s LEU 8 N -6.52 2.90 0.00 7.52 1.43 -1.26 -4.38 118.68 118.37 2h3z s LEU 8 Ca -0.05 -0.16 0.00 0.00 -1.03 0.00 0.00 54.13 52.89 2h3z s LEU 8 Cb 0.02 -1.62 0.00 0.00 0.03 0.00 0.00 46.19 44.61 2h3z s LEU 8 CO 0.07 0.31 0.00 -1.54 0.23 0.00 0.00 176.35 175.41 2h3z n SER 9 N 2.58 -0.55 0.35 2.29 3.41 -1.26 -4.53 113.62 115.92 2h3z n SER 9 Ca -0.18 -0.58 -0.14 0.00 -0.26 0.00 0.00 58.87 57.71 2h3z n SER 9 Cb 0.53 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 -0.27 -0.95 1.20 5.00 0.00 -2.00 0.29 103.07 106.34 2h3z h GLY 10 Ca 0.00 0.35 0.07 0.00 0.00 0.00 0.00 47.33 47.75 2h3z h GLY 10 CO 0.00 -0.34 0.37 -1.33 0.00 0.00 0.00 176.54 175.24 2h3z h GLY 11 N -0.98 0.63 1.00 4.60 0.00 -2.02 -2.09 103.07 104.21 2h3z h GLY 11 Ca -0.09 -0.20 -0.16 0.00 0.00 0.00 0.00 47.33 46.88 2h3z h GLY 11 CO 0.15 0.15 -0.52 0.83 0.00 0.00 0.00 176.54 177.14 2h3z h GLU 12 N 0.49 0.67 -0.53 4.80 5.08 -1.89 -3.20 114.58 120.01 2h3z h GLU 12 Ca 0.25 -0.48 0.11 0.00 -1.00 0.00 0.00 59.36 58.23 2h3z h GLU 12 Cb 0.34 0.08 -0.09 0.00 0.50 0.00 0.00 28.75 29.58 2h3z h GLU 12 CO -0.07 1.10 -0.03 1.25 -1.00 0.00 0.00 179.01 180.26 2h3z h LEU 13 N 0.36 -0.29 0.47 1.33 5.85 0.29 1.00 115.31 124.32 2h3z h LEU 13 Ca -0.02 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 2h3z h LEU 13 Cb 1.15 0.25 -0.02 0.00 0.37 0.00 0.00 40.66 42.40 2h3z h LEU 13 CO 0.11 -0.11 -0.48 -0.78 -0.34 0.00 0.00 178.44 176.84 2h3z h ASP 14 N 0.09 -1.32 -0.80 1.25 1.82 -1.55 -2.06 116.42 113.84 2h3z h ASP 14 Ca 0.27 0.11 0.13 0.00 -0.39 0.00 0.00 57.03 57.15 2h3z h ASP 14 Cb 0.42 0.44 -0.09 0.00 0.68 0.00 0.00 39.33 40.78 2h3z h ASP 14 CO -0.47 -0.64 0.39 0.11 -1.61 0.00 0.00 179.24 177.02 2h3z h LYS 15 N -0.96 0.57 -0.47 0.28 6.56 -1.43 -1.39 116.57 119.72 2h3z h LYS 15 Ca -0.05 -0.03 0.09 0.00 -1.06 0.00 0.00 60.65 59.59 2h3z h LYS 15 Cb 0.84 -0.13 -0.08 0.00 -0.57 0.00 0.00 32.23 32.30 2h3z h LYS 15 CO -0.07 0.38 0.01 2.35 -2.06 0.00 0.00 179.45 180.05 2h3z h TRP 16 N 0.59 -0.02 0.00 -1.35 2.91 -0.36 0.30 115.95 118.02 2h3z h TRP 16 Ca 0.43 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.48 2h3z h TRP 16 Cb 0.57 0.08 0.00 0.00 -0.51 0.00 0.00 29.16 29.30 2h3z h TRP 16 CO -0.11 -0.10 0.00 0.93 -1.03 0.00 0.00 178.44 178.13 2h3z h GLU 17 N 0.12 0.00 0.44 2.65 5.08 -0.58 -3.07 114.58 119.23 2h3z h GLU 17 Ca 0.24 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.57 2h3z h GLU 17 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2h3z h GLU 17 CO -0.39 0.00 -0.21 -0.22 -1.00 0.00 0.00 179.01 177.19 2h3z h LYS 18 N 0.00 -0.57 -6.36 2.33 3.11 -0.04 -3.31 116.57 111.73 2h3z h LYS 18 Ca 0.00 0.04 -0.61 0.00 -2.81 0.00 0.00 60.65 57.27 2h3z h LYS 18 Cb 0.19 0.13 0.14 0.00 -1.00 0.00 0.00 32.23 31.69 2h3z h LYS 18 CO 0.00 -0.38 -0.29 -0.89 -2.81 0.00 0.00 179.45 175.08 2h3z n ILE 19 N -4.90 1.89 -4.27 2.00 5.41 -1.01 -4.64 119.36 113.84 2h3z n ILE 19 Ca -0.07 -0.50 -0.27 0.00 1.00 0.00 0.00 62.75 62.90 2h3z n ILE 19 Cb 0.23 -0.62 -0.09 0.00 -0.71 0.00 0.00 39.64 38.45 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 -1.59 2.10 0.28 0.38 0.52 -1.26 -0.84 118.95 118.55 2h3z s ARG 20 Ca 0.63 -1.21 -0.03 0.00 -0.52 0.00 0.00 55.73 54.59 2h3z s ARG 20 Cb -0.63 -2.20 0.38 0.00 0.52 0.00 0.00 34.95 33.02 2h3z s ARG 20 CO 0.58 0.45 1.95 -0.07 0.02 0.00 0.00 175.30 178.23 2h3z h LEU 21 N 3.00 1.02 -8.96 2.53 3.38 -1.59 -2.05 115.31 112.64 2h3z h LEU 21 Ca -0.47 -0.03 -0.53 0.00 0.09 0.00 0.00 57.88 56.94 2h3z h LEU 21 Cb 1.20 -0.25 -0.16 0.00 0.09 0.00 0.00 40.66 41.54 2h3z h LEU 21 CO 0.54 0.73 -0.77 -0.13 0.09 0.00 0.00 178.44 178.91 2h3z s ARG 22 N -5.99 1.41 0.19 1.13 0.52 -1.26 -3.93 118.95 111.02 2h3z s ARG 22 Ca -0.12 -1.56 -0.05 0.00 -0.52 0.00 0.00 55.73 53.48 2h3z s ARG 22 Cb 0.18 -1.42 0.11 0.00 0.52 0.00 0.00 34.95 34.34 2h3z s ARG 22 CO 0.80 0.27 1.54 -1.00 0.02 0.00 0.00 175.30 176.93 2h3z h PRO 23 N 2.80 0.70 -0.50 3.54 0.13 -1.93 -3.23 132.00 133.51 2h3z h PRO 23 Ca -0.41 -0.37 -0.31 0.00 -0.87 0.00 0.00 66.00 64.05 2h3z h PRO 23 Cb 1.22 0.01 -0.19 0.00 0.13 0.00 0.00 31.00 32.18 2h3z h PRO 23 CO 0.56 0.98 -0.13 0.41 -0.23 0.00 0.00 178.00 179.60 2h3z n GLY 24 N 0.07 5.31 2.56 1.56 0.00 -1.26 -5.01 105.19 108.41 2h3z n GLY 24 Ca -0.02 -1.62 -0.19 0.00 0.00 0.00 0.00 46.02 44.19 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 -1.03 3.02 0.00 -0.02 0.00 -1.22 -5.06 105.19 100.89 2h3z n GLY 25 Ca 0.39 -2.27 0.00 0.00 0.00 0.00 0.00 46.02 44.14 2h3z n GLY 25 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2h3z n LYS 26 N -1.27 1.57 -2.75 1.61 4.81 -1.26 -4.93 118.16 115.92 2h3z n LYS 26 Ca -0.04 -0.28 -0.43 0.00 -0.87 0.00 0.00 58.31 56.69 2h3z n LYS 26 Cb 0.43 -0.76 -0.04 0.00 0.02 0.00 0.00 35.03 34.68 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 -0.30 3.34 0.99 1.64 2.20 -1.26 -5.03 119.74 121.31 2h3z s LYS 27 Ca 0.00 -0.20 -0.16 0.00 -0.36 0.00 0.00 55.97 55.25 2h3z s LYS 27 Cb 0.00 -4.07 0.20 0.00 -1.51 0.00 0.00 37.83 32.45 2h3z s LYS 27 CO 0.00 -1.63 1.27 -0.65 -0.36 0.00 0.00 175.35 173.99 2h3z s GLN 28 N 4.36 0.46 0.21 4.03 1.11 -1.26 -1.72 119.66 126.84 2h3z s GLN 28 Ca 0.33 -0.29 -0.18 0.00 0.01 0.00 0.00 55.36 55.22 2h3z s GLN 28 Cb -0.11 -1.81 -0.08 0.00 -1.01 0.00 0.00 33.01 29.99 2h3z s GLN 28 CO 0.19 -2.55 0.68 0.71 0.01 0.00 0.00 175.29 174.33 2h3z s TYR 29 N -3.71 3.62 0.21 0.91 2.02 -0.02 -4.61 117.35 115.77 2h3z s TYR 29 Ca 0.72 1.30 -0.02 0.00 -0.37 0.00 0.00 57.07 58.70 2h3z s TYR 29 Cb -0.06 -2.56 -0.04 0.00 -0.40 0.00 0.00 41.96 38.91 2h3z s TYR 29 CO 0.53 0.34 0.16 0.21 -1.57 0.00 0.00 175.55 175.23 2h3z s LYS 30 N -2.03 1.24 0.40 -0.62 2.20 -1.26 -4.03 119.74 115.63 2h3z s LYS 30 Ca 0.42 -1.60 0.17 0.00 -0.36 0.00 0.00 55.97 54.60 2h3z s LYS 30 Cb -0.16 0.29 1.05 0.00 -1.51 0.00 0.00 37.83 37.50 2h3z s LYS 30 CO 0.20 -0.42 1.83 -0.07 -0.36 0.00 0.00 175.35 176.54 2h3z h LEU 31 N 2.58 0.45 -0.50 5.43 3.38 -1.98 -1.29 115.31 123.38 2h3z h LEU 31 Ca -0.35 0.06 0.10 0.00 0.09 0.00 0.00 57.88 57.78 2h3z h LEU 31 Cb 1.25 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 41.87 2h3z h LEU 31 CO 0.51 0.16 -0.22 0.50 0.09 0.00 0.00 178.44 179.48 2h3z h LYS 32 N 0.44 -0.10 -0.30 1.13 1.63 -1.99 0.19 116.57 117.57 2h3z h LYS 32 Ca 0.51 0.01 0.01 0.00 -0.85 0.00 0.00 60.65 60.33 2h3z h LYS 32 Cb 1.22 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.86 2h3z h LYS 32 CO -0.22 -0.07 0.20 0.45 -3.45 0.00 0.00 179.45 176.36 2h3z h HIS 33 N -0.11 0.34 0.02 1.91 3.86 -1.65 -0.57 115.15 118.96 2h3z h HIS 33 Ca 0.23 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.45 2h3z h HIS 33 Cb 0.47 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 28.82 2h3z h HIS 33 CO -0.50 0.21 -0.01 0.82 0.86 0.00 0.00 177.93 179.31 2h3z h ILE 34 N 0.36 0.00 -1.16 2.45 2.04 -0.69 -3.17 117.51 117.34 2h3z h ILE 34 Ca 0.12 -0.05 0.33 0.00 1.00 0.00 0.00 64.86 66.26 2h3z h ILE 34 Cb 0.02 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.01 2h3z h ILE 34 CO -0.03 0.00 0.77 0.58 0.00 0.00 0.00 178.15 179.48 2h3z h VAL 35 N -0.07 0.39 0.38 1.67 2.07 -1.14 -0.21 116.25 119.33 2h3z h VAL 35 Ca -0.00 -0.08 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 2h3z h VAL 35 Cb 0.02 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 29.91 2h3z h VAL 35 CO 0.00 0.04 -0.37 -0.25 0.02 0.00 0.00 177.57 177.02 2h3z h TRP 36 N 0.23 -1.00 -0.72 1.57 7.01 -1.19 -1.49 115.95 120.35 2h3z h TRP 36 Ca 0.65 0.01 -0.06 0.00 2.11 0.00 0.00 58.89 61.60 2h3z h TRP 36 Cb 1.99 0.39 -0.03 0.00 -2.10 0.00 0.00 29.16 29.41 2h3z h TRP 36 CO -0.00 -0.52 0.22 0.00 -2.79 0.00 0.00 178.44 175.35 2h3z h ALA 37 N -0.34 1.03 -0.04 2.65 0.00 -1.05 -2.10 119.26 119.41 2h3z h ALA 37 Ca -0.03 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.67 2h3z h ALA 37 Cb 0.69 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2h3z h ALA 37 CO -0.06 0.65 0.07 0.66 0.00 0.00 0.00 179.25 180.57 2h3z h SER 38 N 1.07 0.00 1.38 0.00 4.64 -0.92 0.14 113.55 119.85 2h3z h SER 38 Ca 0.23 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.53 2h3z h SER 38 Cb 0.30 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.39 2h3z h SER 38 CO -0.01 0.00 -0.63 -0.09 -0.87 0.00 0.00 176.83 175.23 2h3z h ARG 39 N 0.00 0.00 0.22 4.77 2.43 -0.57 -3.25 114.38 117.97 2h3z h ARG 39 Ca 0.02 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 58.86 2h3z h ARG 39 Cb 0.15 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 29.73 2h3z h ARG 39 CO -0.00 0.06 -1.56 1.49 -1.51 0.00 0.00 179.97 178.44 2h3z h GLU 40 N 0.00 0.46 -0.79 0.20 4.57 -0.61 -3.23 114.58 115.18 2h3z h GLU 40 Ca -0.01 -0.78 -0.03 0.00 -1.18 0.00 0.00 59.36 57.36 2h3z h GLU 40 Cb 1.07 0.29 -0.04 0.00 -0.16 0.00 0.00 28.75 29.92 2h3z h GLU 40 CO 0.01 1.37 0.37 -0.07 -1.18 0.00 0.00 179.01 179.51 2h3z h LEU 41 N 0.08 1.04 -1.58 1.64 3.38 -1.45 -0.76 115.31 117.66 2h3z h LEU 41 Ca -0.29 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2h3z h LEU 41 Cb 2.09 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 42.58 2h3z h LEU 41 CO 0.22 0.89 0.00 -0.08 0.09 0.00 0.00 178.44 179.56 2h3z h GLU 42 N 1.12 0.00 0.01 1.13 4.81 -1.34 0.18 114.58 120.49 2h3z h GLU 42 Ca 0.27 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 59.21 2h3z h GLU 42 Cb 0.13 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.46 2h3z h GLU 42 CO -0.03 0.00 -1.64 0.00 -0.73 0.00 0.00 179.01 176.61 2h3z h ARG 43 N 0.00 0.02 0.19 1.92 2.47 -1.30 -3.40 114.38 114.27 2h3z h ARG 43 Ca 0.00 -0.03 -0.01 0.00 -1.26 0.00 0.00 59.98 58.68 2h3z h ARG 43 Cb 0.41 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.74 2h3z h ARG 43 CO 0.00 0.59 -0.09 0.74 0.56 0.00 0.00 179.97 181.77 2h3z h PHE 44 N 0.00 -0.23 0.00 3.04 0.04 -0.80 -3.48 116.94 115.51 2h3z h PHE 44 Ca -0.26 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.51 2h3z h PHE 44 Cb 1.99 0.08 0.00 0.00 2.20 0.00 0.00 35.95 40.21 2h3z h PHE 44 CO 0.00 -0.14 0.00 0.00 -0.60 0.00 0.00 178.31 177.57 2h3z n ALA 45 N -2.59 0.00 -2.41 2.45 0.00 -0.82 -5.11 120.51 112.03 2h3z n ALA 45 Ca -0.03 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.13 2h3z n ALA 45 Cb 0.10 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.39 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 1.75 0.27 0.00 1.01 0.57 -5.02 120.40 118.99 2h3z s VAL 46 Ca 0.00 -1.01 -0.29 0.00 0.00 0.00 0.00 61.98 60.68 2h3z s VAL 46 Cb 0.00 -1.47 -0.09 0.00 0.00 0.00 0.00 36.38 34.82 2h3z s VAL 46 CO 0.00 0.44 0.96 0.20 0.00 0.00 0.00 175.10 176.70 2h3z s ASN 47 N -0.67 7.49 0.00 3.32 -0.87 -1.26 -1.64 114.94 121.31 2h3z s ASN 47 Ca 0.09 1.95 0.15 0.00 -1.57 0.00 0.00 52.86 53.47 2h3z s ASN 47 Cb -0.09 -2.60 0.73 0.00 -0.02 0.00 0.00 41.25 39.27 2h3z s ASN 47 CO -0.00 0.04 1.41 -0.81 -2.57 0.00 0.00 177.10 175.17 2h3z n PRO 48 N 1.14 0.18 0.07 -0.60 -0.04 -1.26 -2.67 135.00 131.82 2h3z n PRO 48 Ca -0.01 0.16 0.11 0.00 -0.04 0.00 0.00 63.50 63.72 2h3z n PRO 48 Cb 0.48 -1.50 0.44 0.00 -0.04 0.00 0.00 33.50 32.88 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 -0.04 -1.31 0.20 0.55 0.00 -1.26 -2.38 105.19 100.95 2h3z n GLY 49 Ca 0.07 -0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.23 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 -1.92 0.67 -0.00 0.99 4.77 -1.09 -3.49 117.00 116.92 2h3z n LEU 50 Ca 0.04 -0.16 -0.04 0.00 -0.03 0.00 0.00 56.01 55.82 2h3z n LEU 50 Cb 0.27 -0.07 -0.11 0.00 -2.33 0.00 0.00 43.42 41.17 2h3z n LEU 50 CO 0.21 0.12 -0.49 0.18 -1.33 0.00 0.00 177.39 176.08 2h3z n LEU 51 N -0.62 0.74 0.25 2.23 4.77 -1.00 -0.81 117.00 122.55 2h3z n LEU 51 Ca 0.18 0.33 0.12 0.00 -0.03 0.00 0.00 56.01 56.62 2h3z n LEU 51 Cb 0.26 0.15 0.60 0.00 -2.33 0.00 0.00 43.42 42.10 2h3z n LEU 51 CO 0.20 0.26 0.89 1.05 -1.33 0.00 0.00 177.39 178.47 2h3z h GLU 52 N 0.00 0.00 -5.26 3.23 4.11 -1.70 -3.42 114.58 111.53 2h3z h GLU 52 Ca -0.24 0.00 -0.67 0.00 0.07 0.00 0.00 59.36 58.52 2h3z h GLU 52 Cb 1.79 0.00 -0.31 0.00 0.50 0.00 0.00 28.75 30.72 2h3z h GLU 52 CO 0.05 0.15 -0.84 0.95 0.07 0.00 0.00 179.01 179.40 2h3z s THR 53 N -3.81 2.41 0.41 -1.06 -4.23 -1.25 -4.83 115.64 103.27 2h3z s THR 53 Ca -0.00 -0.88 0.19 0.00 -1.18 0.00 0.00 61.69 59.82 2h3z s THR 53 Cb 0.11 -1.98 0.39 0.00 1.34 0.00 0.00 72.50 72.36 2h3z s THR 53 CO 0.60 0.54 1.80 0.77 -0.54 0.00 0.00 174.62 177.79 2h3z h SER 54 N 7.02 0.42 -0.72 3.99 4.64 -1.83 0.32 113.55 127.39 2h3z h SER 54 Ca -0.27 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 2h3z h SER 54 Cb 1.21 -0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 63.26 2h3z h SER 54 CO 0.53 0.12 0.47 -0.08 -0.87 0.00 0.00 176.83 177.00 2h3z h GLU 55 N 0.39 0.95 -0.01 4.77 4.81 -1.95 -1.81 114.58 121.74 2h3z h GLU 55 Ca 0.55 -0.06 -0.17 0.00 -0.13 0.00 0.00 59.36 59.55 2h3z h GLU 55 Cb 1.40 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 30.55 2h3z h GLU 55 CO -0.24 0.64 -0.75 0.78 -0.73 0.00 0.00 179.01 178.71 2h3z h GLY 56 N 0.99 0.13 2.00 1.92 0.00 -0.40 -3.06 103.07 104.64 2h3z h GLY 56 Ca 0.26 -0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.39 2h3z h GLY 56 CO -0.06 0.17 -0.01 0.00 0.00 0.00 0.00 176.54 176.65 2h3z h ARG 58 N 0.00 0.56 -0.03 0.00 2.43 -1.24 -2.78 114.38 113.32 2h3z h ARG 58 Ca -0.00 -0.34 -0.13 0.00 -0.81 0.00 0.00 59.98 58.70 2h3z h ARG 58 Cb 0.72 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.29 2h3z h ARG 58 CO 0.00 0.94 -0.60 0.37 -1.51 0.00 0.00 179.97 179.17 2h3z h GLN 59 N 0.44 0.10 0.08 0.20 4.15 -1.61 -2.22 115.11 116.25 2h3z h GLN 59 Ca 0.02 -0.07 -0.00 0.00 0.77 0.00 0.00 58.65 59.36 2h3z h GLN 59 Cb 1.04 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.74 2h3z h GLN 59 CO 0.10 0.67 -0.04 0.82 -1.93 0.00 0.00 178.83 178.44 2h3z h ILE 60 N 0.07 1.12 -0.35 2.39 2.04 -1.53 -1.62 117.51 119.64 2h3z h ILE 60 Ca -0.01 -0.79 -0.02 0.00 1.00 0.00 0.00 64.86 65.05 2h3z h ILE 60 Cb 1.07 1.63 -0.02 0.00 -0.74 0.00 0.00 36.82 38.77 2h3z h ILE 60 CO 0.08 0.19 0.15 -0.07 0.00 0.00 0.00 178.15 178.50 2h3z h LEU 61 N -0.47 0.47 -0.90 1.44 3.38 -1.53 -0.24 115.31 117.46 2h3z h LEU 61 Ca -0.01 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2h3z h LEU 61 Cb 0.40 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2h3z h LEU 61 CO 0.02 0.50 0.00 0.61 0.09 0.00 0.00 178.44 179.66 2h3z n GLY 62 N -0.78 -1.17 0.12 0.83 0.00 -0.84 0.01 105.19 103.36 2h3z n GLY 62 Ca -0.01 0.12 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 2h3z n GLY 62 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2h3z n GLN 63 N -2.25 0.64 0.11 1.61 1.13 -0.61 -4.32 117.38 113.68 2h3z n GLN 63 Ca 0.01 0.41 -0.02 0.00 -1.94 0.00 0.00 57.00 55.46 2h3z n GLN 63 Cb 0.18 -1.70 0.03 0.00 0.11 0.00 0.00 30.24 28.86 2h3z n GLN 63 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 2h3z h LEU 64 N -0.58 0.00 -0.35 1.08 3.38 -0.94 -3.32 115.31 114.58 2h3z h LEU 64 Ca -0.43 0.00 0.06 0.00 0.09 0.00 0.00 57.88 57.60 2h3z h LEU 64 Cb 1.62 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 42.29 2h3z h LEU 64 CO -0.13 0.73 -0.45 -0.61 0.09 0.00 0.00 178.44 178.07 2h3z h GLN 65 N 0.00 -0.36 0.00 1.13 -0.00 -0.61 0.42 115.11 115.69 2h3z h GLN 65 Ca -0.01 0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.67 2h3z h GLN 65 Cb 1.44 0.08 0.00 0.00 0.00 0.00 0.00 27.48 29.01 2h3z h GLN 65 CO 0.10 -0.24 0.00 -0.35 0.00 0.00 0.00 178.83 178.33 2h3z n PRO 66 N -5.41 0.09 -0.01 -2.39 -0.04 -1.25 -1.86 135.00 124.13 2h3z n PRO 66 Ca -0.02 0.21 0.09 0.00 -0.04 0.00 0.00 63.50 63.74 2h3z n PRO 66 Cb 0.35 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.39 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 -1.41 2.57 0.18 3.54 7.64 0.12 -4.37 113.62 121.89 2h3z n SER 67 Ca 0.05 -1.78 0.13 0.00 1.01 0.00 0.00 58.87 58.28 2h3z n SER 67 Cb 0.14 -0.01 0.63 0.00 -1.01 0.00 0.00 64.21 63.97 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 3.64 0.00 -0.11 -3.43 3.38 0.02 -0.14 115.31 118.68 2h3z h LEU 68 Ca 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 2h3z h LEU 68 Cb 0.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.53 2h3z h LEU 68 CO 0.00 0.00 -0.25 -0.61 0.09 0.00 0.00 178.44 177.67 2h3z h GLN 69 N 0.00 0.36 -0.37 1.13 5.75 -1.80 -3.31 115.11 116.87 2h3z h GLN 69 Ca 0.00 -0.24 -0.24 0.00 -0.15 0.00 0.00 58.65 58.02 2h3z h GLN 69 Cb 0.15 0.03 -0.17 0.00 1.07 0.00 0.00 27.48 28.57 2h3z h GLN 69 CO 0.00 0.85 -0.38 0.25 -2.65 0.00 0.00 178.83 176.90 2h3z n THR 70 N -4.47 2.49 -3.52 2.39 -2.24 -0.95 -5.01 114.28 102.97 2h3z n THR 70 Ca -0.07 -3.34 -0.38 0.00 -2.27 0.00 0.00 64.05 57.99 2h3z n THR 70 Cb 0.45 -0.56 -0.09 0.00 -2.10 0.00 0.00 70.33 68.03 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 -3.04 2.01 0.12 3.38 0.00 -0.11 -5.08 107.32 104.59 2h3z s GLY 71 Ca 0.45 -0.76 -0.02 0.00 0.00 0.00 0.00 44.72 44.39 2h3z s GLY 71 CO -0.02 0.65 0.07 -1.14 0.00 0.00 0.00 173.10 172.66 2h3z n SER 72 N 4.54 -2.04 -0.10 1.64 3.41 -1.26 -4.67 113.62 115.14 2h3z n SER 72 Ca -0.12 -0.13 -0.08 0.00 -0.26 0.00 0.00 58.87 58.29 2h3z n SER 72 Cb 0.51 -0.08 0.08 0.00 -0.26 0.00 0.00 64.21 64.47 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 0.81 -0.83 4.33 5.08 -1.99 -2.58 114.58 119.40 2h3z h GLU 73 Ca -0.03 -0.32 0.07 0.00 -1.00 0.00 0.00 59.36 58.07 2h3z h GLU 73 Cb 0.11 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.25 2h3z h GLU 73 CO 0.02 0.94 0.50 0.93 -1.00 0.00 0.00 179.01 180.41 2h3z h GLU 74 N 0.71 0.88 -0.02 2.33 5.08 -2.01 -1.15 114.58 120.39 2h3z h GLU 74 Ca 0.10 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 58.28 2h3z h GLU 74 Cb 0.72 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 2h3z h GLU 74 CO 0.06 0.58 -0.58 1.25 -1.00 0.00 0.00 179.01 179.31 2h3z h LEU 75 N 0.91 0.07 0.68 1.33 6.46 -1.84 -3.11 115.31 119.81 2h3z h LEU 75 Ca 0.37 -0.04 -0.03 0.00 -0.12 0.00 0.00 57.88 58.05 2h3z h LEU 75 Cb 0.20 -0.02 0.01 0.00 -0.73 0.00 0.00 40.66 40.12 2h3z h LEU 75 CO -0.19 0.64 -0.33 -0.09 -0.62 0.00 0.00 178.44 177.86 2h3z h ARG 76 N 0.05 -0.88 -0.97 1.25 2.43 -0.83 -2.56 114.38 112.88 2h3z h ARG 76 Ca -0.01 0.06 0.16 0.00 -0.81 0.00 0.00 59.98 59.38 2h3z h ARG 76 Cb 1.04 0.20 -0.10 0.00 -0.42 0.00 0.00 29.97 30.70 2h3z h ARG 76 CO 0.08 -0.57 0.57 0.66 -1.51 0.00 0.00 179.97 179.21 2h3z h SER 77 N -0.98 0.77 0.34 -3.80 4.64 -1.46 -2.13 113.55 110.92 2h3z h SER 77 Ca -0.09 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2h3z h SER 77 Cb 0.72 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 62.72 2h3z h SER 77 CO 0.15 0.33 -0.41 -0.07 -0.87 0.00 0.00 176.83 175.96 2h3z h LEU 78 N 0.80 -1.13 -0.96 5.97 -0.00 -1.44 -1.28 115.31 117.27 2h3z h LEU 78 Ca 0.53 0.10 0.21 0.00 -0.00 0.00 0.00 57.88 58.72 2h3z h LEU 78 Cb 0.72 0.39 -0.11 0.00 -0.00 0.00 0.00 40.66 41.65 2h3z h LEU 78 CO -0.34 -0.54 0.54 0.22 -0.00 0.00 0.00 178.44 178.32 2h3z h TYR 79 N -0.78 0.93 0.63 1.13 3.20 -0.98 0.22 116.97 121.31 2h3z h TYR 79 Ca -0.02 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 2h3z h TYR 79 Cb 0.72 -0.26 0.01 0.00 1.54 0.00 0.00 36.73 38.74 2h3z h TYR 79 CO -0.25 0.12 -0.30 -0.91 -1.64 0.00 0.00 178.16 175.17 2h3z h ASN 80 N 0.61 -0.72 0.17 -2.11 -0.26 -0.99 0.28 115.58 112.56 2h3z h ASN 80 Ca 0.58 0.02 0.02 0.00 -0.56 0.00 0.00 56.30 56.36 2h3z h ASN 80 Cb 1.00 0.19 -0.04 0.00 -1.06 0.00 0.00 38.32 38.41 2h3z h ASN 80 CO -0.44 -0.50 -0.34 0.74 -1.06 0.00 0.00 177.43 175.83 2h3z h THR 81 N -0.88 0.28 -0.86 2.81 2.02 -0.75 -2.08 112.91 113.45 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 0.28 -0.11 0.00 -1.74 0.00 0.00 68.15 67.24 2h3z h THR 81 CO 0.14 0.00 0.41 0.40 0.37 0.00 0.00 175.52 176.84 2h3z h ILE 82 N -0.60 0.63 -0.92 3.11 2.04 -0.64 1.00 117.51 122.13 2h3z h ILE 82 Ca 0.02 -0.18 0.11 0.00 1.00 0.00 0.00 64.86 65.80 2h3z h ILE 82 Cb 0.61 0.06 -0.08 0.00 -0.74 0.00 0.00 36.82 36.67 2h3z h ILE 82 CO -0.17 0.10 0.56 0.00 0.00 0.00 0.00 178.15 178.63 2h3z h ALA 83 N 1.61 1.35 -0.01 1.87 0.00 -0.25 0.23 119.26 124.06 2h3z h ALA 83 Ca 0.49 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.40 2h3z h ALA 83 Cb 0.80 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2h3z h ALA 83 CO -0.43 0.17 -0.11 0.28 0.00 0.00 0.00 179.25 179.17 2h3z h VAL 84 N 0.90 1.53 0.76 0.00 2.07 -0.50 -3.08 116.25 117.93 2h3z h VAL 84 Ca 0.45 -1.72 -0.03 0.00 0.82 0.00 0.00 66.70 66.21 2h3z h VAL 84 Cb 0.42 2.63 -0.01 0.00 -1.52 0.00 0.00 31.29 32.82 2h3z h VAL 84 CO -0.26 0.46 -0.49 0.25 0.02 0.00 0.00 177.57 177.55 2h3z h LEU 85 N -0.56 -1.26 -0.88 2.57 5.85 -0.66 -1.87 115.31 118.50 2h3z h LEU 85 Ca -0.01 0.07 0.23 0.00 0.84 0.00 0.00 57.88 59.01 2h3z h LEU 85 Cb 0.81 0.37 -0.15 0.00 0.37 0.00 0.00 40.66 42.06 2h3z h LEU 85 CO 0.02 -0.74 0.10 0.22 -0.34 0.00 0.00 178.44 177.70 2h3z h TYR 86 N -1.18 0.10 -0.25 1.25 3.20 -0.69 0.23 116.97 119.62 2h3z h TYR 86 Ca -0.10 0.06 0.02 0.00 3.14 0.00 0.00 58.73 61.84 2h3z h TYR 86 Cb 0.95 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.30 2h3z h TYR 86 CO -0.12 -0.30 0.12 0.00 -1.64 0.00 0.00 178.16 176.22 2h3z h VAL 88 N 0.26 0.55 -0.36 0.00 2.07 0.28 0.18 116.25 119.24 2h3z h VAL 88 Ca 0.10 -0.17 -0.11 0.00 0.82 0.00 0.00 66.70 67.34 2h3z h VAL 88 Cb 0.03 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.79 2h3z h VAL 88 CO -0.07 0.09 -0.25 0.45 0.02 0.00 0.00 177.57 177.81 2h3z h HIS 89 N 0.50 0.82 0.00 1.57 -0.00 -1.02 -2.58 115.15 114.45 2h3z h HIS 89 Ca 0.56 -0.19 0.00 0.00 -0.00 0.00 0.00 60.37 60.74 2h3z h HIS 89 Cb 1.02 -0.19 0.00 0.00 -0.00 0.00 0.00 27.41 28.23 2h3z h HIS 89 CO -0.09 0.90 0.00 1.04 -0.00 0.00 0.00 177.93 179.77 2h3z n GLN 90 N -4.10 0.95 -0.96 2.45 1.13 0.39 -4.76 117.38 112.47 2h3z n GLN 90 Ca -0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2h3z n GLN 90 Cb 0.44 -1.44 0.00 0.00 0.11 0.00 0.00 30.24 29.35 2h3z n GLN 90 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 2h3z n ARG 91 N -0.02 -0.51 -3.01 -1.09 1.85 -0.97 -4.99 116.66 107.93 2h3z n ARG 91 Ca 0.00 0.13 -0.40 0.00 -1.00 0.00 0.00 57.85 56.58 2h3z n ARG 91 Cb 0.22 -3.55 -0.05 0.00 -1.05 0.00 0.00 32.46 28.03 2h3z n ARG 91 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 2h3z s ILE 92 N -1.98 4.88 -0.53 8.89 1.01 0.25 -4.97 121.20 128.75 2h3z s ILE 92 Ca 0.00 1.56 0.04 0.00 0.00 0.00 0.00 60.65 62.25 2h3z s ILE 92 Cb 0.00 -4.09 0.39 0.00 0.01 0.00 0.00 42.46 38.77 2h3z s ILE 92 CO 0.00 0.31 1.13 0.47 0.00 0.00 0.00 174.94 176.85 2h3z n ASP 93 N 3.26 4.89 -3.51 3.58 8.00 -1.26 -2.63 116.55 128.88 2h3z n ASP 93 Ca -0.02 -3.72 -0.43 0.00 0.71 0.00 0.00 54.79 51.34 2h3z n ASP 93 Cb 0.51 -0.55 -0.05 0.00 -0.02 0.00 0.00 41.12 41.01 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 -0.39 0.58 -0.24 2.53 0.24 -1.26 -4.79 118.33 115.00 2h3z n VAL 94 Ca 0.37 -0.15 0.06 0.00 -2.04 0.00 0.00 64.34 62.59 2h3z n VAL 94 Cb 0.53 0.00 0.31 0.00 -1.47 0.00 0.00 33.84 33.21 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 1.78 0.82 -3.37 7.34 3.64 -1.98 -3.43 116.57 121.38 2h3z h LYS 95 Ca -0.33 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 58.94 2h3z h LYS 95 Cb 1.13 -0.19 -0.05 0.00 -0.41 0.00 0.00 32.23 32.71 2h3z h LYS 95 CO 0.49 0.54 0.08 0.16 -2.27 0.00 0.00 179.45 178.45 2h3z s ASP 96 N -6.06 0.09 0.36 4.20 1.47 -1.26 -4.00 116.67 111.47 2h3z s ASP 96 Ca -0.10 -1.03 0.25 0.00 1.18 0.00 0.00 52.55 52.85 2h3z s ASP 96 Cb 0.20 0.72 1.32 0.00 -0.34 0.00 0.00 42.92 44.82 2h3z s ASP 96 CO 0.78 -1.40 1.77 0.74 0.68 0.00 0.00 175.17 177.74 2h3z h THR 97 N 2.08 0.00 0.07 2.11 2.02 -1.49 -2.63 112.91 115.07 2h3z h THR 97 Ca -0.27 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 66.86 2h3z h THR 97 Cb 1.25 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 68.30 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 -0.08 0.00 6.66 1.63 -1.87 -3.25 116.57 119.66 2h3z h LYS 98 Ca 0.00 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 2h3z h LYS 98 Cb 0.07 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.71 2h3z h LYS 98 CO 0.00 0.43 0.00 1.49 -3.45 0.00 0.00 179.45 177.92 2h3z h GLU 99 N -0.94 0.00 -0.10 1.90 4.81 -1.88 -1.45 114.58 116.93 2h3z h GLU 99 Ca -0.01 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.06 2h3z h GLU 99 Cb 0.56 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 2h3z h GLU 99 CO 0.01 0.00 -0.62 0.00 -0.73 0.00 0.00 179.01 177.67 2h3z h ALA 100 N 2.02 0.76 0.00 2.92 0.00 -1.53 -1.15 119.26 122.27 2h3z h ALA 100 Ca 0.00 -0.55 -0.13 0.00 0.00 0.00 0.00 54.91 54.23 2h3z h ALA 100 Cb 0.08 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2h3z h ALA 100 CO 0.00 0.73 -0.60 -0.07 0.00 0.00 0.00 179.25 179.31 2h3z h LEU 101 N 0.26 0.00 0.09 0.00 3.38 -1.31 -2.55 115.31 115.17 2h3z h LEU 101 Ca -0.01 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.69 2h3z h LEU 101 Cb 1.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 2h3z h LEU 101 CO 0.10 0.60 -1.35 -0.78 0.09 0.00 0.00 178.44 177.10 2h3z h ASP 102 N 0.00 0.29 -0.08 -0.43 3.58 -1.46 -3.33 116.42 114.98 2h3z h ASP 102 Ca -0.01 -0.36 -0.18 0.00 0.42 0.00 0.00 57.03 56.91 2h3z h ASP 102 Cb 1.27 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 42.22 2h3z h ASP 102 CO 0.08 1.29 -0.58 0.50 -2.88 0.00 0.00 179.24 177.65 2h3z h LYS 103 N 0.05 0.68 -0.08 0.28 3.64 -1.22 -2.74 116.57 117.18 2h3z h LYS 103 Ca -0.17 -0.45 0.02 0.00 -1.27 0.00 0.00 60.65 58.79 2h3z h LYS 103 Cb 1.95 0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 33.83 2h3z h LYS 103 CO 0.16 1.07 0.12 0.97 -2.27 0.00 0.00 179.45 179.50 2h3z h ILE 104 N 0.51 0.36 0.08 2.00 6.09 -1.56 0.23 117.51 125.22 2h3z h ILE 104 Ca 0.00 0.00 -0.32 0.00 -1.37 0.00 0.00 64.86 63.17 2h3z h ILE 104 Cb 1.16 0.90 -0.03 0.00 0.47 0.00 0.00 36.82 39.32 2h3z h ILE 104 CO 0.12 0.00 -1.79 -0.33 -3.07 0.00 0.00 178.15 173.08 2h3z h GLU 105 N 0.00 0.16 -0.28 2.19 4.39 -1.63 -3.37 114.58 116.04 2h3z h GLU 105 Ca 0.04 -0.28 -0.14 0.00 0.34 0.00 0.00 59.36 59.32 2h3z h GLU 105 Cb 0.27 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 2h3z h GLU 105 CO -0.00 0.92 -0.41 1.49 -1.16 0.00 0.00 179.01 179.85 2h3z h GLU 106 N 0.04 0.67 -0.61 2.33 4.22 -0.94 -2.95 114.58 117.34 2h3z h GLU 106 Ca -0.33 -0.35 0.13 0.00 0.08 0.00 0.00 59.36 58.88 2h3z h GLU 106 Cb 2.02 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 31.25 2h3z h GLU 106 CO 0.10 0.96 0.42 0.93 -2.18 0.00 0.00 179.01 179.24 2h3z h GLU 107 N 0.55 0.27 -0.19 1.92 4.39 -1.16 0.34 114.58 120.71 2h3z h GLU 107 Ca 0.04 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.61 2h3z h GLU 107 Cb 0.95 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.52 2h3z h GLU 107 CO 0.09 0.18 -0.40 1.96 -1.16 0.00 0.00 179.01 179.68 2h3z h GLN 108 N 0.28 0.43 -0.29 2.33 1.08 -1.67 -2.89 115.11 114.38 2h3z h GLN 108 Ca 0.29 -0.21 -0.02 0.00 -1.45 0.00 0.00 58.65 57.26 2h3z h GLN 108 Cb 0.76 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.17 2h3z h GLN 108 CO -0.07 0.76 0.11 -0.97 -0.95 0.00 0.00 178.83 177.72 2h3z h ASN 109 N 0.36 0.37 -0.43 1.46 -0.00 -0.97 -2.68 115.58 113.69 2h3z h ASN 109 Ca 0.03 -0.03 0.07 0.00 -0.00 0.00 0.00 56.30 56.38 2h3z h ASN 109 Cb 0.86 -0.09 -0.06 0.00 -0.00 0.00 0.00 38.32 39.02 2h3z h ASN 109 CO 0.07 0.34 0.05 0.50 -0.00 0.00 0.00 177.43 178.40 2h3z h LYS 110 N 0.41 0.17 -0.99 6.67 3.64 -1.39 -1.72 116.57 123.36 2h3z h LYS 110 Ca 0.10 -0.01 0.28 0.00 -1.27 0.00 0.00 60.65 59.76 2h3z h LYS 110 Cb 0.10 -0.04 -0.18 0.00 -0.41 0.00 0.00 32.23 31.70 2h3z h LYS 110 CO -0.01 0.11 0.07 0.66 -2.27 0.00 0.00 179.45 178.01 2h3z h SER 111 N 0.17 -0.42 0.22 4.20 4.64 -1.59 0.20 113.55 120.97 2h3z h SER 111 Ca 0.21 0.28 -0.01 0.00 -0.47 0.00 0.00 61.79 61.80 2h3z h SER 111 Cb 0.29 0.47 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 2h3z h SER 111 CO -0.31 -0.36 -0.10 0.11 -0.87 0.00 0.00 176.83 175.29 2h3z h LYS 112 N 0.01 -0.28 -0.92 4.77 1.57 -1.49 -2.81 116.57 117.41 2h3z h LYS 112 Ca 0.62 0.02 0.37 0.00 -1.87 0.00 0.00 60.65 59.79 2h3z h LYS 112 Cb 1.31 0.06 -0.17 0.00 0.08 0.00 0.00 32.23 33.52 2h3z h LYS 112 CO -0.91 -0.02 0.44 1.17 -0.57 0.00 0.00 179.45 179.56 2h3z n LYS 113 N -4.96 -0.06 0.02 3.15 4.81 -0.42 0.44 118.16 121.14 2h3z n LYS 113 Ca -0.06 1.28 -0.12 0.00 -0.87 0.00 0.00 58.31 58.54 2h3z n LYS 113 Cb 0.20 -2.27 -0.09 0.00 0.02 0.00 0.00 35.03 32.88 2h3z n LYS 113 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 2h3z h LYS 114 N 0.00 -0.10 -1.27 1.64 1.57 -1.08 -1.72 116.57 115.62 2h3z h LYS 114 Ca 0.75 0.01 -0.32 0.00 -1.87 0.00 0.00 60.65 59.22 2h3z h LYS 114 Cb 1.96 0.02 -0.16 0.00 0.08 0.00 0.00 32.23 34.13 2h3z h LYS 114 CO -0.73 0.40 0.42 0.00 -0.57 0.00 0.00 179.45 178.97 2h3z n ALA 115 N -2.45 4.77 -2.53 3.86 0.00 0.17 -3.97 120.51 120.36 2h3z n ALA 115 Ca -0.08 -1.71 -0.01 0.00 0.00 0.00 0.00 53.44 51.64 2h3z n ALA 115 Cb 0.28 -1.34 -0.01 0.00 0.00 0.00 0.00 19.45 18.38 2h3z n ALA 115 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2h3z n GLN 116 N -0.04 0.00 0.09 0.00 -0.06 0.14 -4.93 117.38 112.59 2h3z n GLN 116 Ca 0.33 -0.10 0.16 0.00 -2.00 0.00 0.00 57.00 55.39 2h3z n GLN 116 Cb 0.82 0.00 0.68 0.00 -4.06 0.00 0.00 30.24 27.68 2h3z n GLN 116 CO 0.00 0.00 0.00 -0.56 -0.20 0.00 0.00 177.06 176.30 2h3z h GLN 117 N 0.19 0.00 0.00 3.69 3.07 -1.44 0.29 115.11 120.92 2h3z h GLN 117 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.62 2h3z h GLN 117 Cb 1.04 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.60 2h3z h GLN 117 CO -0.05 0.00 0.00 0.00 0.09 0.00 0.00 178.83 178.87 2h3z n ALA 118 N -2.59 1.61 -1.21 0.06 0.00 -1.26 -2.64 120.51 114.48 2h3z n ALA 118 Ca 0.05 -0.05 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 2h3z n ALA 118 Cb 0.43 -1.22 0.12 0.00 0.00 0.00 0.00 19.45 18.78 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 -1.50 5.87 0.00 0.00 0.00 0.10 -4.13 120.51 120.84 2h3z n ALA 119 Ca 0.03 -3.04 0.00 0.00 0.00 0.00 0.00 53.44 50.43 2h3z n ALA 119 Cb 0.16 -1.59 0.00 0.00 0.00 0.00 0.00 19.45 18.01 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 -0.92 2.22 0.82 0.00 0.00 -1.08 -4.75 120.51 116.80 2h3z n ALA 120 Ca 0.58 0.00 0.13 0.00 0.00 0.00 0.00 53.44 54.16 2h3z n ALA 120 Cb 1.10 0.31 0.48 0.00 0.00 0.00 0.00 19.45 21.34 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 -2.28 0.42 -4.61 0.00 2.03 -1.26 -4.74 116.55 106.11 2h3z n ASP 121 Ca 0.00 0.47 -0.42 0.00 0.52 0.00 0.00 54.79 55.36 2h3z n ASP 121 Cb 0.31 -0.55 -0.04 0.00 -0.72 0.00 0.00 41.12 40.13 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 -3.05 4.63 0.00 5.18 -4.23 -1.26 -4.70 115.64 112.20 2h3z s THR 122 Ca 0.12 1.27 0.00 0.00 -1.18 0.00 0.00 61.69 61.90 2h3z s THR 122 Cb 0.16 -4.30 0.00 0.00 1.34 0.00 0.00 72.50 69.70 2h3z s THR 122 CO 0.58 -0.46 0.00 0.61 -0.54 0.00 0.00 174.62 174.81 2h3z n GLY 123 N 4.26 0.91 1.67 3.99 0.00 -1.26 -5.00 105.19 109.75 2h3z n GLY 123 Ca 0.07 -0.86 -0.16 0.00 0.00 0.00 0.00 46.02 45.08 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 3.85 -4.75 1.61 4.13 -1.26 -4.99 115.26 113.85 2h3z n ASN 124 Ca 0.00 -3.76 -0.31 0.00 1.68 0.00 0.00 54.58 52.19 2h3z n ASN 124 Cb 0.00 -0.69 -0.07 0.00 -1.54 0.00 0.00 39.78 37.48 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 -2.35 5.40 -0.24 6.41 2.20 -1.26 -5.11 114.94 119.99 2h3z s ASN 125 Ca 0.51 -0.03 -0.36 0.00 -0.94 0.00 0.00 52.86 52.04 2h3z s ASN 125 Cb 0.44 -1.43 0.15 0.00 -2.00 0.00 0.00 41.25 38.41 2h3z s ASN 125 CO 0.02 0.19 1.29 -0.44 -2.94 0.00 0.00 177.10 175.23 2h3z s SER 126 N -2.22 -0.08 -0.25 3.54 0.01 -1.26 -5.14 113.70 108.30 2h3z s SER 126 Ca 0.27 0.01 0.01 0.00 1.31 0.00 0.00 55.95 57.54 2h3z s SER 126 Cb -0.12 0.08 0.07 0.00 0.21 0.00 0.00 66.02 66.26 2h3z s SER 126 CO 0.19 -0.13 -0.02 0.00 0.41 0.00 0.00 173.24 173.69 2h3z s GLN 127 N -2.15 1.44 0.30 12.44 0.00 -1.26 -5.12 119.66 125.31 2h3z s GLN 127 Ca 0.10 -1.02 -0.28 0.00 -0.00 0.00 0.00 55.36 54.16 2h3z s GLN 127 Cb -0.01 -2.54 -0.09 0.00 0.00 0.00 0.00 33.01 30.37 2h3z s GLN 127 CO -0.04 -0.67 1.07 0.14 0.00 0.00 0.00 175.29 175.79 2h3z s VAL 128 N 1.42 3.61 -0.23 3.63 -7.23 -1.26 -5.04 120.40 115.30 2h3z s VAL 128 Ca -0.03 1.54 -0.05 0.00 -1.81 0.00 0.00 61.98 61.63 2h3z s VAL 128 Cb -0.19 -3.94 0.12 0.00 0.56 0.00 0.00 36.38 32.93 2h3z s VAL 128 CO -0.08 0.30 0.42 -0.55 -0.31 0.00 0.00 175.10 174.88 2h3z s SER 129 N -1.07 -0.15 1.07 4.85 0.15 -1.26 -5.16 113.70 112.12 2h3z s SER 129 Ca 0.47 0.68 -0.13 0.00 0.70 0.00 0.00 55.95 57.67 2h3z s SER 129 Cb -0.29 1.34 0.23 0.00 -1.71 0.00 0.00 66.02 65.58 2h3z s SER 129 CO 0.37 -0.26 1.07 -1.10 1.20 0.00 0.00 173.24 174.52 2h3z s GLN 130 N 2.61 -0.12 0.04 5.44 -1.52 -1.26 -5.03 119.66 119.83 2h3z s GLN 130 Ca 0.06 0.55 -0.09 0.00 -1.95 0.00 0.00 55.36 53.93 2h3z s GLN 130 Cb -0.14 -1.67 -0.05 0.00 -0.22 0.00 0.00 33.01 30.93 2h3z s GLN 130 CO -0.15 -3.11 0.34 1.21 -0.25 0.00 0.00 175.29 173.34 2h3z s ASN 131 N -3.21 6.59 0.00 5.90 2.47 -1.26 -5.34 114.94 120.09 2h3z s ASN 131 Ca 0.66 0.70 0.07 0.00 0.42 0.00 0.00 52.86 54.72 2h3z s ASN 131 Cb -0.20 -2.14 0.44 0.00 -1.45 0.00 0.00 41.25 37.90 2h3z s ASN 131 CO 0.60 0.22 0.90 0.00 -3.72 0.00 0.00 177.10 175.10