#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 0.00 -0.37 4.61 0.00 -1.26 -5.05 120.51 118.44 2h3z n ALA 3 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2h3z n ALA 3 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -0.18 0.00 -3.59 0.00 3.00 -1.26 -4.90 116.66 109.74 2h3z n ARG 4 Ca 0.00 0.59 -0.12 0.00 -0.01 0.00 0.00 57.85 58.31 2h3z n ARG 4 Cb 0.00 -1.32 -0.06 0.00 0.00 0.00 0.00 32.46 31.08 2h3z n ARG 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2h3z s ALA 5 N -3.19 -1.90 0.37 7.54 0.00 -1.26 -5.15 121.76 118.18 2h3z s ALA 5 Ca 0.00 1.69 0.00 0.00 0.00 0.00 0.00 51.96 53.65 2h3z s ALA 5 Cb 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 23.12 22.24 2h3z s ALA 5 CO 0.00 -0.30 0.00 0.45 0.00 0.00 0.00 175.76 175.91 2h3z n SER 6 N 1.47 -7.13 -0.08 0.00 2.88 -1.26 -4.71 113.62 104.79 2h3z n SER 6 Ca -0.13 0.76 -0.15 0.00 -1.33 0.00 0.00 58.87 58.02 2h3z n SER 6 Cb 0.57 -3.79 -0.12 0.00 -0.75 0.00 0.00 64.21 60.12 2h3z n SER 6 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2h3z h VAL 7 N -1.13 1.44 -3.71 2.46 2.07 -1.95 -3.44 116.25 111.98 2h3z h VAL 7 Ca -0.05 -2.21 -0.68 0.00 0.82 0.00 0.00 66.70 64.58 2h3z h VAL 7 Cb 1.11 2.85 -0.27 0.00 -1.52 0.00 0.00 31.29 33.47 2h3z h VAL 7 CO 0.03 0.49 -0.80 -0.76 0.02 0.00 0.00 177.57 176.56 2h3z s LEU 8 N -8.15 2.57 0.00 2.57 1.43 -1.26 -4.54 118.68 111.30 2h3z s LEU 8 Ca -0.20 -0.33 0.00 0.00 -1.03 0.00 0.00 54.13 52.57 2h3z s LEU 8 Cb -0.00 -1.54 0.00 0.00 0.03 0.00 0.00 46.19 44.68 2h3z s LEU 8 CO 0.62 0.24 0.00 -1.54 0.23 0.00 0.00 176.35 175.90 2h3z n SER 9 N 2.98 -0.55 0.35 2.29 3.41 -1.26 -4.55 113.62 116.29 2h3z n SER 9 Ca -0.18 -0.56 -0.14 0.00 -0.26 0.00 0.00 58.87 57.74 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 -0.28 -0.94 0.70 5.00 0.00 -1.99 0.15 103.07 105.71 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 0.65 -1.33 0.00 0.00 0.00 176.54 175.52 2h3z h GLY 11 N -0.96 1.55 0.94 4.60 0.00 -2.01 -2.27 103.07 104.92 2h3z h GLY 11 Ca -0.09 -0.47 -0.05 0.00 0.00 0.00 0.00 47.33 46.72 2h3z h GLY 11 CO 0.15 0.31 0.06 0.83 0.00 0.00 0.00 176.54 177.89 2h3z h GLU 12 N 1.15 0.67 -0.53 4.80 5.08 -1.90 -2.82 114.58 121.03 2h3z h GLU 12 Ca 0.44 -0.19 0.11 0.00 -1.00 0.00 0.00 59.36 58.72 2h3z h GLU 12 Cb 0.21 -0.08 -0.10 0.00 0.50 0.00 0.00 28.75 29.29 2h3z h GLU 12 CO -0.19 0.72 -0.10 1.25 -1.00 0.00 0.00 179.01 179.70 2h3z h LEU 13 N 0.52 -0.42 0.36 1.33 5.85 -0.11 0.29 115.31 123.13 2h3z h LEU 13 Ca 0.12 0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.98 2h3z h LEU 13 Cb 0.39 0.30 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 2h3z h LEU 13 CO 0.01 -0.15 -0.23 -0.78 -0.34 0.00 0.00 178.44 176.94 2h3z h ASP 14 N 0.03 -0.58 -0.92 1.25 3.58 -1.42 -2.50 116.42 115.85 2h3z h ASP 14 Ca 0.26 0.04 0.10 0.00 0.42 0.00 0.00 57.03 57.85 2h3z h ASP 14 Cb 0.40 0.18 -0.07 0.00 1.72 0.00 0.00 39.33 41.56 2h3z h ASP 14 CO -0.52 -0.37 0.59 0.50 -2.88 0.00 0.00 179.24 176.56 2h3z h LYS 15 N -0.58 0.88 -0.39 0.28 3.64 -1.13 -1.85 116.57 117.43 2h3z h LYS 15 Ca -0.04 -0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.35 2h3z h LYS 15 Cb 0.48 -0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 32.05 2h3z h LYS 15 CO 0.03 0.58 0.07 2.35 -2.27 0.00 0.00 179.45 180.22 2h3z h TRP 16 N 0.91 0.11 0.00 1.91 2.91 -0.03 0.12 115.95 121.88 2h3z h TRP 16 Ca 0.43 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.48 2h3z h TRP 16 Cb 0.43 0.01 0.00 0.00 -0.51 0.00 0.00 29.16 29.09 2h3z h TRP 16 CO -0.00 0.00 0.00 0.93 -1.03 0.00 0.00 178.44 178.34 2h3z h GLU 17 N 0.19 0.00 0.22 2.65 5.08 -0.99 -3.19 114.58 118.55 2h3z h GLU 17 Ca 0.19 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 2h3z h GLU 17 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 2h3z h GLU 17 CO -0.25 0.00 -0.11 -0.22 -1.00 0.00 0.00 179.01 177.43 2h3z h LYS 18 N 0.00 -0.29 -6.27 2.33 3.64 -0.48 -3.32 116.57 112.17 2h3z h LYS 18 Ca 0.00 0.02 -0.62 0.00 -1.27 0.00 0.00 60.65 58.78 2h3z h LYS 18 Cb 0.24 0.07 0.13 0.00 -0.41 0.00 0.00 32.23 32.26 2h3z h LYS 18 CO 0.00 -0.19 -0.32 -0.89 -2.27 0.00 0.00 179.45 175.78 2h3z n ILE 19 N -3.64 1.82 -4.19 2.00 -0.00 -1.08 -4.66 119.36 109.61 2h3z n ILE 19 Ca -0.04 -0.50 -0.22 0.00 -0.00 0.00 0.00 62.75 61.99 2h3z n ILE 19 Cb 0.12 -0.50 -0.06 0.00 -0.00 0.00 0.00 39.64 39.20 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 -1.40 2.67 0.15 0.38 3.00 -1.26 -1.67 118.95 120.83 2h3z s ARG 20 Ca 0.62 -1.19 -0.09 0.00 0.00 0.00 0.00 55.73 55.06 2h3z s ARG 20 Cb -0.71 -2.40 -0.01 0.00 0.00 0.00 0.00 34.95 31.83 2h3z s ARG 20 CO 0.58 0.39 1.49 -0.07 0.00 0.00 0.00 175.30 177.70 2h3z h LEU 21 N 1.68 0.95 -9.01 2.53 3.38 -1.71 -1.62 115.31 111.51 2h3z h LEU 21 Ca -0.47 -0.43 -0.53 0.00 0.09 0.00 0.00 57.88 56.54 2h3z h LEU 21 Cb 1.24 -0.27 -0.15 0.00 0.09 0.00 0.00 40.66 41.58 2h3z h LEU 21 CO 0.61 1.22 -0.75 -0.13 0.09 0.00 0.00 178.44 179.47 2h3z s ARG 22 N -4.37 1.47 0.11 1.13 0.52 -1.26 -3.93 118.95 112.61 2h3z s ARG 22 Ca -0.10 -1.64 -0.14 0.00 -0.52 0.00 0.00 55.73 53.33 2h3z s ARG 22 Cb 0.11 -1.43 -0.07 0.00 0.52 0.00 0.00 34.95 34.08 2h3z s ARG 22 CO 0.87 0.26 1.44 -1.00 0.02 0.00 0.00 175.30 176.89 2h3z h PRO 23 N 2.56 0.77 -0.63 3.54 0.13 -1.89 -3.24 132.00 133.23 2h3z h PRO 23 Ca -0.40 -0.41 -0.37 0.00 -0.87 0.00 0.00 66.00 63.95 2h3z h PRO 23 Cb 1.23 0.01 -0.22 0.00 0.13 0.00 0.00 31.00 32.16 2h3z h PRO 23 CO 0.59 1.03 0.12 0.41 -0.23 0.00 0.00 178.00 179.92 2h3z n GLY 24 N 0.15 5.16 2.89 1.56 0.00 -1.26 -5.00 105.19 108.68 2h3z n GLY 24 Ca -0.03 -1.54 -0.19 0.00 0.00 0.00 0.00 46.02 44.26 2h3z n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h3z n GLY 25 N -1.05 2.70 0.00 -0.02 0.00 -1.23 -5.05 105.19 100.54 2h3z n GLY 25 Ca 0.45 -2.26 0.00 0.00 0.00 0.00 0.00 46.02 44.21 2h3z n GLY 25 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h3z n LYS 26 N -1.54 1.17 -3.01 1.61 5.02 -1.26 -4.94 118.16 115.21 2h3z n LYS 26 Ca 0.00 -0.26 -0.42 0.00 -2.02 0.00 0.00 58.31 55.61 2h3z n LYS 26 Cb 0.47 -0.73 -0.06 0.00 -0.02 0.00 0.00 35.03 34.70 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 -0.24 3.79 0.61 1.97 2.20 -1.26 -5.05 119.74 121.76 2h3z s LYS 27 Ca 0.00 0.30 -0.04 0.00 -0.36 0.00 0.00 55.97 55.87 2h3z s LYS 27 Cb 0.00 -3.78 0.13 0.00 -1.51 0.00 0.00 37.83 32.67 2h3z s LYS 27 CO 0.00 -0.76 0.84 1.04 -0.36 0.00 0.00 175.35 176.11 2h3z n GLN 28 N 6.23 -0.29 -3.22 4.03 3.00 -1.26 -2.21 117.38 123.67 2h3z n GLN 28 Ca 0.02 -1.88 -0.36 0.00 -0.01 0.00 0.00 57.00 54.77 2h3z n GLN 28 Cb 0.48 -0.68 -0.06 0.00 0.00 0.00 0.00 30.24 29.98 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 -2.58 3.64 0.18 1.08 2.02 -0.67 -4.65 117.35 116.37 2h3z s TYR 29 Ca 0.52 1.24 -0.01 0.00 -0.37 0.00 0.00 57.07 58.46 2h3z s TYR 29 Cb -0.02 -2.51 -0.04 0.00 -0.40 0.00 0.00 41.96 38.99 2h3z s TYR 29 CO 0.35 0.39 0.10 0.15 -1.57 0.00 0.00 175.55 174.97 2h3z s LYS 30 N -1.93 1.13 0.35 -0.62 1.02 -1.26 -4.03 119.74 114.40 2h3z s LYS 30 Ca 0.40 -1.58 0.11 0.00 0.02 0.00 0.00 55.97 54.92 2h3z s LYS 30 Cb -0.16 0.19 0.90 0.00 -0.52 0.00 0.00 37.83 38.24 2h3z s LYS 30 CO 0.20 -0.33 1.78 -0.07 -0.92 0.00 0.00 175.35 176.01 2h3z h LEU 31 N 2.68 0.63 -0.59 3.17 3.38 -1.98 -1.09 115.31 121.50 2h3z h LEU 31 Ca -0.36 0.09 0.12 0.00 0.09 0.00 0.00 57.88 57.82 2h3z h LEU 31 Cb 1.23 -0.02 -0.11 0.00 0.09 0.00 0.00 40.66 41.85 2h3z h LEU 31 CO 0.56 0.19 -0.21 0.11 0.09 0.00 0.00 178.44 179.18 2h3z h LYS 32 N 0.59 -0.06 -0.35 1.13 6.56 -1.99 0.31 116.57 122.76 2h3z h LYS 32 Ca 0.58 0.00 0.03 0.00 -1.06 0.00 0.00 60.65 60.20 2h3z h LYS 32 Cb 1.14 0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 32.79 2h3z h LYS 32 CO -0.34 -0.04 0.23 0.45 -2.06 0.00 0.00 179.45 177.69 2h3z h HIS 33 N -0.07 0.33 0.04 -1.35 3.86 -1.61 -0.58 115.15 115.78 2h3z h HIS 33 Ca 0.27 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.49 2h3z h HIS 33 Cb 0.49 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 28.85 2h3z h HIS 33 CO -0.54 0.19 -0.02 0.82 0.86 0.00 0.00 177.93 179.24 2h3z h ILE 34 N 0.34 0.00 -1.17 2.45 2.04 -0.44 -3.16 117.51 117.57 2h3z h ILE 34 Ca 0.14 -0.09 0.33 0.00 1.00 0.00 0.00 64.86 66.25 2h3z h ILE 34 Cb 0.15 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.14 2h3z h ILE 34 CO -0.03 0.00 0.78 0.58 0.00 0.00 0.00 178.15 179.48 2h3z h VAL 35 N -0.14 0.39 0.61 1.67 2.07 -1.21 -0.75 116.25 118.89 2h3z h VAL 35 Ca -0.01 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 2h3z h VAL 35 Cb 0.04 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 29.96 2h3z h VAL 35 CO 0.01 0.04 -0.48 -0.25 0.02 0.00 0.00 177.57 176.91 2h3z h TRP 36 N 0.21 -1.30 -0.78 1.57 7.01 -1.19 -1.29 115.95 120.18 2h3z h TRP 36 Ca 0.65 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.66 2h3z h TRP 36 Cb 2.02 0.49 -0.04 0.00 -2.10 0.00 0.00 29.16 29.52 2h3z h TRP 36 CO -0.00 -0.68 0.52 0.00 -2.79 0.00 0.00 178.44 175.49 2h3z h ALA 37 N -0.90 1.45 0.00 2.65 0.00 -1.13 -1.23 119.26 120.10 2h3z h ALA 37 Ca -0.08 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2h3z h ALA 37 Cb 0.89 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 2h3z h ALA 37 CO 0.01 0.51 -0.03 0.66 0.00 0.00 0.00 179.25 180.40 2h3z h SER 38 N 1.05 0.00 1.25 0.00 4.64 -0.97 0.22 113.55 119.74 2h3z h SER 38 Ca 0.29 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.52 2h3z h SER 38 Cb -0.11 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 61.97 2h3z h SER 38 CO -0.06 0.03 -0.78 0.03 -0.87 0.00 0.00 176.83 175.18 2h3z h ARG 39 N 0.00 0.00 0.04 4.77 2.47 -0.07 -3.26 114.38 118.34 2h3z h ARG 39 Ca -0.00 0.00 -0.27 0.00 -1.26 0.00 0.00 59.98 58.45 2h3z h ARG 39 Cb 0.05 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.34 2h3z h ARG 39 CO 0.00 0.26 -1.45 1.49 0.56 0.00 0.00 179.97 180.83 2h3z h GLU 40 N 0.00 0.09 -0.47 0.04 4.57 -0.54 -3.33 114.58 114.94 2h3z h GLU 40 Ca -0.05 -0.15 -0.06 0.00 -1.18 0.00 0.00 59.36 57.92 2h3z h GLU 40 Cb 1.31 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.94 2h3z h GLU 40 CO 0.04 0.86 0.06 -0.07 -1.18 0.00 0.00 179.01 178.72 2h3z h LEU 41 N 0.02 0.77 -2.48 1.64 3.38 -0.74 0.31 115.31 118.21 2h3z h LEU 41 Ca -0.20 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 57.50 2h3z h LEU 41 Cb 1.94 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 42.49 2h3z h LEU 41 CO 0.12 0.85 -0.02 -0.08 0.09 0.00 0.00 178.44 179.41 2h3z h GLU 42 N 0.67 0.00 0.00 1.13 4.22 -1.50 -0.68 114.58 118.42 2h3z h GLU 42 Ca 0.14 0.00 -0.25 0.00 0.08 0.00 0.00 59.36 59.34 2h3z h GLU 42 Cb 0.42 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.63 2h3z h GLU 42 CO 0.01 0.02 -2.15 0.54 -2.18 0.00 0.00 179.01 175.25 2h3z n ARG 43 N -3.24 0.67 0.14 1.92 5.12 -0.89 -4.58 116.66 115.81 2h3z n ARG 43 Ca -0.02 -0.02 -0.06 0.00 -1.93 0.00 0.00 57.85 55.81 2h3z n ARG 43 Cb 0.14 -1.56 -0.03 0.00 -1.16 0.00 0.00 32.46 29.85 2h3z n ARG 43 CO 0.00 0.00 0.00 0.74 -1.93 0.00 0.00 177.63 176.44 2h3z h PHE 44 N 0.00 -0.39 0.00 -1.55 -1.00 0.31 -3.48 116.94 110.83 2h3z h PHE 44 Ca -0.35 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.42 2h3z h PHE 44 Cb 1.84 0.13 0.00 0.00 3.61 0.00 0.00 35.95 41.53 2h3z h PHE 44 CO 0.00 -0.24 0.00 0.00 -1.61 0.00 0.00 178.31 176.46 2h3z n ALA 45 N -2.59 0.00 -2.58 2.45 0.00 -0.64 -5.08 120.51 112.07 2h3z n ALA 45 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.06 2h3z n ALA 45 Cb 0.17 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.51 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 3.56 0.30 0.00 1.01 -0.36 -5.02 120.40 119.89 2h3z s VAL 46 Ca 0.00 -0.74 -0.28 0.00 0.00 0.00 0.00 61.98 60.95 2h3z s VAL 46 Cb 0.00 -2.52 -0.09 0.00 0.00 0.00 0.00 36.38 33.77 2h3z s VAL 46 CO 0.00 0.44 1.05 0.20 0.00 0.00 0.00 175.10 176.79 2h3z s ASN 47 N -1.26 7.25 0.00 3.32 -0.87 -1.26 -2.31 114.94 119.81 2h3z s ASN 47 Ca 0.16 2.14 0.14 0.00 -1.57 0.00 0.00 52.86 53.73 2h3z s ASN 47 Cb -0.11 -2.61 0.67 0.00 -0.02 0.00 0.00 41.25 39.17 2h3z s ASN 47 CO 0.06 -0.15 1.44 -0.81 -2.57 0.00 0.00 177.10 175.07 2h3z n PRO 48 N 0.96 0.09 0.00 -0.60 -0.04 -1.26 -2.32 135.00 131.83 2h3z n PRO 48 Ca 0.00 0.21 0.14 0.00 -0.04 0.00 0.00 63.50 63.81 2h3z n PRO 48 Cb 0.46 -1.50 0.53 0.00 -0.04 0.00 0.00 33.50 32.96 2h3z n PRO 48 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2h3z n GLY 49 N -0.03 -1.25 0.42 0.55 0.00 -1.26 -3.38 105.19 100.23 2h3z n GLY 49 Ca 0.05 -0.22 0.07 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.32 1.24 0.08 0.99 4.77 -0.98 -3.51 117.00 118.27 2h3z n LEU 50 Ca 0.09 -0.57 0.10 0.00 -0.03 0.00 0.00 56.01 55.60 2h3z n LEU 50 Cb 0.31 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.26 2h3z n LEU 50 CO 0.28 0.29 -0.09 0.18 -1.33 0.00 0.00 177.39 176.71 2h3z n LEU 51 N 0.10 0.76 -1.86 2.23 4.77 -1.22 -2.39 117.00 119.39 2h3z n LEU 51 Ca 0.12 0.30 -0.12 0.00 -0.03 0.00 0.00 56.01 56.27 2h3z n LEU 51 Cb 0.23 -0.04 0.19 0.00 -2.33 0.00 0.00 43.42 41.47 2h3z n LEU 51 CO 0.09 -0.13 1.02 -1.84 -1.33 0.00 0.00 177.39 175.19 2h3z n GLU 52 N -2.66 2.53 -3.29 3.23 0.28 -1.23 -4.76 120.64 114.75 2h3z n GLU 52 Ca -0.02 -2.38 -0.05 0.00 -0.16 0.00 0.00 57.16 54.55 2h3z n GLU 52 Cb 0.58 -1.97 -0.06 0.00 1.43 0.00 0.00 31.44 31.43 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 -2.52 -0.73 0.35 3.84 -4.23 -1.25 -4.45 115.64 106.64 2h3z s THR 53 Ca 0.44 -0.06 0.14 0.00 -1.18 0.00 0.00 61.69 61.03 2h3z s THR 53 Cb 0.36 -0.88 0.34 0.00 1.34 0.00 0.00 72.50 73.67 2h3z s THR 53 CO 0.10 -0.09 1.72 0.77 -0.54 0.00 0.00 174.62 176.58 2h3z h SER 54 N 8.12 0.57 0.35 3.99 4.64 -1.86 1.01 113.55 130.38 2h3z h SER 54 Ca -0.20 0.13 -0.06 0.00 -0.47 0.00 0.00 61.79 61.20 2h3z h SER 54 Cb 1.16 0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 2h3z h SER 54 CO 0.27 0.04 -0.26 -0.08 -0.87 0.00 0.00 176.83 175.92 2h3z h GLU 55 N 0.47 0.00 0.00 4.77 4.57 -1.95 -2.64 114.58 119.79 2h3z h GLU 55 Ca 0.66 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.75 2h3z h GLU 55 Cb 1.44 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 30.02 2h3z h GLU 55 CO -0.46 0.26 -1.17 0.78 -1.18 0.00 0.00 179.01 177.24 2h3z h GLY 56 N 0.97 0.00 1.93 1.92 0.00 0.70 -3.35 103.07 105.24 2h3z h GLY 56 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.18 2h3z h GLY 56 CO 0.03 0.00 -0.69 0.00 0.00 0.00 0.00 176.54 175.89 2h3z h ARG 58 N 0.05 0.87 -0.07 0.00 2.43 -1.61 -2.71 114.38 113.34 2h3z h ARG 58 Ca -0.01 -0.36 0.02 0.00 -0.81 0.00 0.00 59.98 58.82 2h3z h ARG 58 Cb 1.22 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.73 2h3z h ARG 58 CO 0.09 1.00 0.10 1.96 -1.51 0.00 0.00 179.97 181.62 2h3z h GLN 59 N 0.69 0.00 -0.30 0.20 4.20 -1.68 -0.92 115.11 117.31 2h3z h GLN 59 Ca 0.10 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.63 2h3z h GLN 59 Cb 0.71 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.49 2h3z h GLN 59 CO 0.05 0.00 -0.52 0.82 -0.67 0.00 0.00 178.83 178.51 2h3z h ILE 60 N 0.00 1.28 0.01 2.54 2.04 -1.54 -2.07 117.51 119.77 2h3z h ILE 60 Ca 0.03 -1.70 -0.26 0.00 1.00 0.00 0.00 64.86 63.93 2h3z h ILE 60 Cb 0.24 1.61 0.02 0.00 -0.74 0.00 0.00 36.82 37.95 2h3z h ILE 60 CO -0.00 0.56 -1.04 -0.07 0.00 0.00 0.00 178.15 177.59 2h3z h LEU 61 N 0.66 0.85 -0.40 1.44 3.38 -1.25 -2.86 115.31 117.13 2h3z h LEU 61 Ca 0.02 -0.69 0.00 0.00 0.09 0.00 0.00 57.88 57.30 2h3z h LEU 61 Cb 1.13 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.62 2h3z h LEU 61 CO 0.12 1.49 0.00 0.61 0.09 0.00 0.00 178.44 180.75 2h3z n GLY 62 N 1.08 -1.31 0.14 0.83 0.00 -0.55 -1.63 105.19 103.74 2h3z n GLY 62 Ca -0.10 0.03 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 2h3z n GLY 62 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2h3z h GLN 63 N 0.00 0.26 0.00 1.61 4.20 -1.33 -3.36 115.11 116.49 2h3z h GLN 63 Ca 0.00 -0.44 -0.01 0.00 0.06 0.00 0.00 58.65 58.26 2h3z h GLN 63 Cb 0.42 0.16 -0.00 0.00 0.30 0.00 0.00 27.48 28.36 2h3z h GLN 63 CO 0.00 1.21 -0.04 -0.07 -0.67 0.00 0.00 178.83 179.26 2h3z h LEU 64 N -0.07 0.00 -0.49 1.46 3.38 -1.45 -3.37 115.31 114.78 2h3z h LEU 64 Ca -0.40 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.62 2h3z h LEU 64 Cb 1.94 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.63 2h3z h LEU 64 CO 0.07 0.04 -0.29 0.00 0.09 0.00 0.00 178.44 178.35 2h3z n GLN 65 N -3.11 -0.21 -0.04 1.13 6.02 -0.65 0.47 117.38 120.99 2h3z n GLN 65 Ca 0.03 0.74 -0.13 0.00 -0.01 0.00 0.00 57.00 57.63 2h3z n GLN 65 Cb 0.51 -1.09 -0.08 0.00 1.02 0.00 0.00 30.24 30.61 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 -0.19 -1.09 0.13 -1.85 -3.03 132.00 126.20 2h3z h PRO 66 Ca 0.08 -0.12 0.05 0.00 -0.87 0.00 0.00 66.00 65.14 2h3z h PRO 66 Cb 0.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.33 2h3z h PRO 66 CO -0.46 0.65 0.33 0.77 -0.23 0.00 0.00 178.00 179.07 2h3z h SER 67 N -0.18 0.00 0.14 1.44 0.02 -0.49 0.20 113.55 114.67 2h3z h SER 67 Ca 0.02 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2h3z h SER 67 Cb 0.61 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.15 2h3z h SER 67 CO 0.02 0.00 -0.03 -0.07 -1.14 0.00 0.00 176.83 175.61 2h3z h LEU 68 N 0.00 0.00 -0.79 5.07 3.38 0.15 0.88 115.31 123.99 2h3z h LEU 68 Ca 0.09 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.21 2h3z h LEU 68 Cb 0.75 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.40 2h3z h LEU 68 CO -0.00 0.03 0.33 -0.61 0.09 0.00 0.00 178.44 178.29 2h3z h GLN 69 N 0.00 0.45 -0.37 1.13 4.15 -0.77 -3.20 115.11 116.51 2h3z h GLN 69 Ca -0.00 -0.03 -0.23 0.00 0.77 0.00 0.00 58.65 59.16 2h3z h GLN 69 Cb 0.11 -0.10 -0.37 0.00 0.21 0.00 0.00 27.48 27.33 2h3z h GLN 69 CO 0.00 0.30 -1.03 2.41 -1.93 0.00 0.00 178.83 178.59 2h3z n THR 70 N -4.99 1.08 -2.91 2.39 -1.04 -0.97 -5.11 114.28 102.73 2h3z n THR 70 Ca 0.16 -2.63 -0.37 0.00 -2.04 0.00 0.00 64.05 59.17 2h3z n THR 70 Cb 0.46 1.26 -0.06 0.00 -1.82 0.00 0.00 70.33 70.17 2h3z n THR 70 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2h3z s GLY 71 N -3.45 2.74 1.08 3.41 0.00 0.27 -5.06 107.32 106.30 2h3z s GLY 71 Ca 0.25 0.38 -0.17 0.00 0.00 0.00 0.00 44.72 45.18 2h3z s GLY 71 CO -0.05 0.80 1.21 -1.35 0.00 0.00 0.00 173.10 173.71 2h3z s SER 72 N -1.60 2.05 0.40 1.64 1.04 -1.26 -4.70 113.70 111.26 2h3z s SER 72 Ca 0.47 0.47 0.13 0.00 0.48 0.00 0.00 55.95 57.50 2h3z s SER 72 Cb -0.18 -0.63 0.96 0.00 0.10 0.00 0.00 66.02 66.27 2h3z s SER 72 CO 0.23 -3.41 1.89 1.05 0.98 0.00 0.00 173.24 173.98 2h3z h GLU 73 N -2.10 0.51 -0.66 4.02 4.11 -1.99 0.70 114.58 119.18 2h3z h GLU 73 Ca -0.45 -0.03 0.02 0.00 0.07 0.00 0.00 59.36 58.97 2h3z h GLU 73 Cb 1.27 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.37 2h3z h GLU 73 CO 0.37 0.34 0.43 0.93 0.07 0.00 0.00 179.01 181.15 2h3z h GLU 74 N 0.52 0.80 0.19 1.06 5.08 -2.00 0.03 114.58 120.27 2h3z h GLU 74 Ca 0.41 -0.05 -0.32 0.00 -1.00 0.00 0.00 59.36 58.41 2h3z h GLU 74 Cb 0.83 -0.18 0.03 0.00 0.50 0.00 0.00 28.75 29.93 2h3z h GLU 74 CO -0.16 0.53 -1.35 1.25 -1.00 0.00 0.00 179.01 178.28 2h3z h LEU 75 N 0.82 0.86 0.33 1.33 6.46 -1.23 -3.13 115.31 120.75 2h3z h LEU 75 Ca 0.25 -0.88 -0.02 0.00 -0.12 0.00 0.00 57.88 57.12 2h3z h LEU 75 Cb 0.00 -0.27 0.00 0.00 -0.73 0.00 0.00 40.66 39.66 2h3z h LEU 75 CO -0.07 1.66 -0.16 -0.09 -0.62 0.00 0.00 178.44 179.17 2h3z h ARG 76 N 0.19 -0.42 -0.96 1.25 2.43 -0.85 -2.60 114.38 113.42 2h3z h ARG 76 Ca -0.22 0.03 0.13 0.00 -0.81 0.00 0.00 59.98 59.11 2h3z h ARG 76 Cb 2.04 0.10 -0.08 0.00 -0.42 0.00 0.00 29.97 31.60 2h3z h ARG 76 CO 0.26 -0.24 0.61 0.77 -1.51 0.00 0.00 179.97 179.86 2h3z h SER 77 N -0.51 0.81 0.74 -3.80 0.02 -1.13 -2.52 113.55 107.17 2h3z h SER 77 Ca -0.04 0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 2h3z h SER 77 Cb 0.38 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2h3z h SER 77 CO 0.07 0.42 -0.50 -0.07 -1.14 0.00 0.00 176.83 175.61 2h3z h LEU 78 N 0.86 -1.30 -0.94 5.07 -0.00 -1.43 -2.05 115.31 115.53 2h3z h LEU 78 Ca 0.48 0.08 0.26 0.00 -0.00 0.00 0.00 57.88 58.70 2h3z h LEU 78 Cb 0.60 0.39 -0.14 0.00 -0.00 0.00 0.00 40.66 41.52 2h3z h LEU 78 CO -0.25 -0.75 0.44 0.22 -0.00 0.00 0.00 178.44 178.10 2h3z h TYR 79 N -1.18 0.71 0.85 1.13 5.03 -1.09 0.25 116.97 122.67 2h3z h TYR 79 Ca -0.10 0.04 -0.04 0.00 2.58 0.00 0.00 58.73 61.21 2h3z h TYR 79 Cb 0.96 -0.16 -0.00 0.00 1.55 0.00 0.00 36.73 39.08 2h3z h TYR 79 CO -0.14 -0.11 -0.49 -0.91 -1.32 0.00 0.00 178.16 175.19 2h3z h ASN 80 N 0.36 -1.21 0.12 -2.11 4.21 -1.13 -0.45 115.58 115.38 2h3z h ASN 80 Ca 0.62 0.06 0.01 0.00 1.21 0.00 0.00 56.30 58.20 2h3z h ASN 80 Cb 1.27 0.34 -0.01 0.00 -1.12 0.00 0.00 38.32 38.80 2h3z h ASN 80 CO -0.57 -0.77 -0.13 0.74 -1.29 0.00 0.00 177.43 175.41 2h3z h THR 81 N -1.24 0.71 -0.77 2.81 2.02 -0.54 -2.61 112.91 113.29 2h3z h THR 81 Ca -0.11 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.23 2h3z h THR 81 Cb 0.98 0.71 -0.11 0.00 -1.74 0.00 0.00 68.15 67.99 2h3z h THR 81 CO 0.14 0.00 0.24 0.40 0.37 0.00 0.00 175.52 176.67 2h3z h ILE 82 N -0.28 0.54 -0.56 3.11 2.04 -0.54 0.41 117.51 122.22 2h3z h ILE 82 Ca 0.01 -0.11 0.11 0.00 1.00 0.00 0.00 64.86 65.87 2h3z h ILE 82 Cb 0.27 0.18 -0.10 0.00 -0.74 0.00 0.00 36.82 36.44 2h3z h ILE 82 CO -0.04 0.06 -0.02 0.00 0.00 0.00 0.00 178.15 178.15 2h3z h ALA 83 N 1.61 0.52 -0.04 1.87 0.00 -0.68 0.06 119.26 122.59 2h3z h ALA 83 Ca 0.44 0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.51 2h3z h ALA 83 Cb 0.75 0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 2h3z h ALA 83 CO -0.49 -0.40 -0.05 0.28 0.00 0.00 0.00 179.25 178.59 2h3z h VAL 84 N 0.10 1.39 -0.98 0.00 2.07 -1.01 -2.80 116.25 115.02 2h3z h VAL 84 Ca 0.29 -1.23 0.25 0.00 0.82 0.00 0.00 66.70 66.82 2h3z h VAL 84 Cb 0.45 2.12 -0.07 0.00 -1.52 0.00 0.00 31.29 32.27 2h3z h VAL 84 CO -0.49 0.33 0.66 0.25 0.02 0.00 0.00 177.57 178.34 2h3z h LEU 85 N -0.36 0.30 -0.08 2.57 6.46 -0.42 0.25 115.31 124.03 2h3z h LEU 85 Ca 0.01 0.04 -0.08 0.00 -0.12 0.00 0.00 57.88 57.73 2h3z h LEU 85 Cb 0.56 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.49 2h3z h LEU 85 CO 0.01 0.09 -0.28 0.22 -0.62 0.00 0.00 178.44 177.87 2h3z h TYR 86 N 0.28 0.44 0.00 1.25 3.20 -0.93 -3.05 116.97 118.16 2h3z h TYR 86 Ca 0.51 -0.18 0.00 0.00 3.14 0.00 0.00 58.73 62.20 2h3z h TYR 86 Cb 1.50 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.69 2h3z h TYR 86 CO -0.00 0.89 0.00 0.00 -1.64 0.00 0.00 178.16 177.41 2h3z h VAL 88 N 0.00 1.40 0.13 0.00 2.07 -1.05 0.31 116.25 119.11 2h3z h VAL 88 Ca 0.00 -2.43 -0.33 0.00 0.82 0.00 0.00 66.70 64.76 2h3z h VAL 88 Cb 0.18 2.40 -0.01 0.00 -1.52 0.00 0.00 31.29 32.34 2h3z h VAL 88 CO 0.00 0.73 -1.74 0.45 0.02 0.00 0.00 177.57 177.03 2h3z h HIS 89 N 0.23 0.50 0.00 1.57 -0.00 -1.32 -3.33 115.15 112.81 2h3z h HIS 89 Ca -0.08 -0.37 0.00 0.00 -0.00 0.00 0.00 60.37 59.93 2h3z h HIS 89 Cb 1.56 -0.02 0.00 0.00 -0.00 0.00 0.00 27.41 28.95 2h3z h HIS 89 CO 0.06 1.68 0.00 1.04 -0.00 0.00 0.00 177.93 180.71 2h3z n GLN 90 N -3.69 0.41 -3.13 2.45 6.02 -0.18 -4.89 117.38 114.36 2h3z n GLN 90 Ca -0.28 0.04 -0.14 0.00 -0.01 0.00 0.00 57.00 56.60 2h3z n GLN 90 Cb 0.99 -1.50 0.06 0.00 1.02 0.00 0.00 30.24 30.81 2h3z n GLN 90 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 2h3z n ARG 91 N -1.26 -5.07 -3.34 -1.09 0.63 -0.86 -4.98 116.66 100.68 2h3z n ARG 91 Ca 0.13 0.57 -0.43 0.00 -0.92 0.00 0.00 57.85 57.21 2h3z n ARG 91 Cb 0.20 -4.81 -0.09 0.00 0.45 0.00 0.00 32.46 28.20 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 -3.23 5.11 0.29 5.15 1.01 0.10 -5.03 121.20 124.61 2h3z s ILE 92 Ca 0.23 -0.35 -0.30 0.00 0.00 0.00 0.00 60.65 60.23 2h3z s ILE 92 Cb -0.10 -4.01 -0.12 0.00 0.01 0.00 0.00 42.46 38.24 2h3z s ILE 92 CO 0.50 -0.38 1.51 0.47 0.00 0.00 0.00 174.94 177.03 2h3z n ASP 93 N 5.54 3.47 -3.64 3.58 9.92 -1.26 -4.69 116.55 129.46 2h3z n ASP 93 Ca -0.08 1.16 -0.12 0.00 -0.53 0.00 0.00 54.79 55.22 2h3z n ASP 93 Cb 0.47 -1.54 -0.12 0.00 -0.64 0.00 0.00 41.12 39.29 2h3z n ASP 93 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 2h3z s VAL 94 N -0.25 -0.48 0.30 2.53 -7.23 -1.26 -4.89 120.40 109.12 2h3z s VAL 94 Ca 0.63 0.22 0.38 0.00 -1.81 0.00 0.00 61.98 61.39 2h3z s VAL 94 Cb -0.54 -0.53 0.41 0.00 0.56 0.00 0.00 36.38 36.28 2h3z s VAL 94 CO 0.52 0.08 2.13 0.11 -0.31 0.00 0.00 175.10 177.62 2h3z h LYS 95 N 8.26 0.00 -1.92 4.82 1.57 -1.94 -3.45 116.57 123.90 2h3z h LYS 95 Ca -0.15 0.00 0.29 0.00 -1.87 0.00 0.00 60.65 58.92 2h3z h LYS 95 Cb 1.12 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.34 2h3z h LYS 95 CO 0.14 0.00 0.77 0.16 -0.57 0.00 0.00 179.45 179.95 2h3z s ASP 96 N -5.44 -0.04 0.41 0.86 1.47 -1.26 -4.50 116.67 108.16 2h3z s ASP 96 Ca -0.01 -0.28 0.26 0.00 1.18 0.00 0.00 52.55 53.70 2h3z s ASP 96 Cb 0.10 0.25 1.42 0.00 -0.34 0.00 0.00 42.92 44.36 2h3z s ASP 96 CO 0.49 -0.48 1.79 0.74 0.68 0.00 0.00 175.17 178.39 2h3z h THR 97 N 2.00 0.00 0.04 2.11 2.02 -1.41 -2.14 112.91 115.53 2h3z h THR 97 Ca -0.27 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 2h3z h THR 97 Cb 1.20 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 68.20 2h3z h THR 97 CO 0.30 0.00 -0.02 0.50 0.37 0.00 0.00 175.52 176.67 2h3z h LYS 98 N 0.00 -0.05 0.00 6.66 3.11 -1.87 -3.17 116.57 121.26 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 0.07 0.01 0.00 0.00 -1.00 0.00 0.00 32.23 31.31 2h3z h LYS 98 CO 0.00 0.63 0.00 1.49 -2.81 0.00 0.00 179.45 178.76 2h3z h GLU 99 N -0.86 0.00 0.00 1.90 4.57 -1.79 -1.82 114.58 116.58 2h3z h GLU 99 Ca -0.00 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.08 2h3z h GLU 99 Cb 0.70 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.28 2h3z h GLU 99 CO 0.01 0.00 -0.47 0.00 -1.18 0.00 0.00 179.01 177.36 2h3z h ALA 100 N 2.01 0.84 0.10 2.92 0.00 -1.49 -2.59 119.26 121.05 2h3z h ALA 100 Ca 0.00 -0.43 -0.34 0.00 0.00 0.00 0.00 54.91 54.14 2h3z h ALA 100 Cb 0.30 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2h3z h ALA 100 CO 0.00 0.59 -1.85 1.25 0.00 0.00 0.00 179.25 179.24 2h3z h LEU 101 N 0.00 0.32 -1.26 0.00 7.12 -1.32 -3.34 115.31 116.82 2h3z h LEU 101 Ca -0.00 -0.66 -0.07 0.00 0.13 0.00 0.00 57.88 57.27 2h3z h LEU 101 Cb 1.13 -0.10 -0.01 0.00 -0.53 0.00 0.00 40.66 41.14 2h3z h LEU 101 CO 0.06 1.58 -0.36 0.44 -0.13 0.00 0.00 178.44 180.04 2h3z h ASP 102 N 0.06 0.00 0.66 1.25 5.19 -1.46 0.23 116.42 122.34 2h3z h ASP 102 Ca -0.36 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 55.99 2h3z h ASP 102 Cb 2.03 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 41.53 2h3z h ASP 102 CO 0.10 0.36 -0.30 0.11 -3.12 0.00 0.00 179.24 176.39 2h3z h LYS 103 N 0.00 0.00 0.00 3.56 1.79 -1.60 0.27 116.57 120.60 2h3z h LYS 103 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2h3z h LYS 103 Cb 0.68 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.33 2h3z h LYS 103 CO 0.05 0.30 -1.81 -0.89 -1.08 0.00 0.00 179.45 176.01 2h3z n ILE 104 N -3.64 0.00 -0.00 1.86 5.41 -0.95 -4.37 119.36 117.67 2h3z n ILE 104 Ca -0.01 -0.42 -0.22 0.00 1.00 0.00 0.00 62.75 63.11 2h3z n ILE 104 Cb 0.42 0.13 -0.14 0.00 -0.71 0.00 0.00 39.64 39.34 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 0.24 -0.90 0.38 4.39 -0.42 -3.37 114.58 114.90 2h3z h GLU 105 Ca 0.00 -0.42 0.16 0.00 0.34 0.00 0.00 59.36 59.45 2h3z h GLU 105 Cb 0.86 0.16 -0.07 0.00 -0.10 0.00 0.00 28.75 29.59 2h3z h GLU 105 CO 0.00 1.20 0.58 1.49 -1.16 0.00 0.00 179.01 181.12 2h3z h GLU 106 N -0.08 0.60 -0.03 2.33 4.81 -0.67 0.43 114.58 121.97 2h3z h GLU 106 Ca -0.40 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 58.80 2h3z h GLU 106 Cb 1.94 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 31.18 2h3z h GLU 106 CO 0.06 0.40 0.03 0.93 -0.73 0.00 0.00 179.01 179.69 2h3z h GLU 107 N 0.62 0.00 0.00 1.92 4.39 -1.76 -0.34 114.58 119.41 2h3z h GLU 107 Ca 0.47 0.00 -0.37 0.00 0.34 0.00 0.00 59.36 59.79 2h3z h GLU 107 Cb 0.86 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.44 2h3z h GLU 107 CO -0.22 0.00 -2.39 0.94 -1.16 0.00 0.00 179.01 176.18 2h3z n GLN 108 N -4.05 0.69 0.01 2.33 7.27 0.93 -4.37 117.38 120.19 2h3z n GLN 108 Ca -0.02 0.00 -0.04 0.00 0.07 0.00 0.00 57.00 57.01 2h3z n GLN 108 Cb 0.12 -1.52 0.20 0.00 2.41 0.00 0.00 30.24 31.45 2h3z n GLN 108 CO 0.00 0.00 0.00 -0.91 0.07 0.00 0.00 177.06 176.22 2h3z h ASN 109 N 0.00 0.51 -0.76 1.69 2.35 0.16 -2.67 115.58 116.86 2h3z h ASN 109 Ca -0.55 -0.17 0.14 0.00 -0.55 0.00 0.00 56.30 55.17 2h3z h ASN 109 Cb 2.22 -0.14 -0.05 0.00 0.05 0.00 0.00 38.32 40.41 2h3z h ASN 109 CO 0.02 0.74 0.50 0.11 -1.65 0.00 0.00 177.43 177.16 2h3z h LYS 110 N 0.45 0.44 0.00 0.81 1.79 -1.27 0.24 116.57 119.03 2h3z h LYS 110 Ca 0.07 -0.03 -0.10 0.00 -2.18 0.00 0.00 60.65 58.41 2h3z h LYS 110 Cb 0.66 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 31.19 2h3z h LYS 110 CO 0.05 0.29 -0.88 1.03 -1.08 0.00 0.00 179.45 178.86 2h3z h SER 111 N 0.45 0.00 0.01 0.86 0.87 -1.72 -3.22 113.55 110.80 2h3z h SER 111 Ca 0.37 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.93 2h3z h SER 111 Cb 0.80 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.76 2h3z h SER 111 CO -0.12 0.41 -0.00 0.50 -0.53 0.00 0.00 176.83 177.08 2h3z h LYS 112 N 0.00 -0.01 -1.16 2.24 3.64 -0.53 -3.33 116.57 117.42 2h3z h LYS 112 Ca -0.06 0.00 0.33 0.00 -1.27 0.00 0.00 60.65 59.64 2h3z h LYS 112 Cb 1.37 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 33.11 2h3z h LYS 112 CO 0.04 -0.01 0.78 -0.22 -2.27 0.00 0.00 179.45 177.78 2h3z h LYS 113 N -0.22 0.19 -0.43 1.90 1.63 -0.85 0.50 116.57 119.29 2h3z h LYS 113 Ca -0.00 -0.01 0.09 0.00 -0.85 0.00 0.00 60.65 59.87 2h3z h LYS 113 Cb 0.01 -0.04 -0.08 0.00 -0.60 0.00 0.00 32.23 31.51 2h3z h LYS 113 CO 0.00 0.12 -0.11 -0.22 -3.45 0.00 0.00 179.45 175.80 2h3z h LYS 114 N 0.19 -0.00 -0.79 1.90 1.63 -1.68 0.35 116.57 118.17 2h3z h LYS 114 Ca 0.62 0.00 0.21 0.00 -0.85 0.00 0.00 60.65 60.63 2h3z h LYS 114 Cb 2.00 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 33.59 2h3z h LYS 114 CO -0.20 -0.00 0.55 0.00 -3.45 0.00 0.00 179.45 176.35 2h3z h ALA 115 N 1.42 2.51 -0.41 5.00 0.00 -0.99 -0.05 119.26 126.75 2h3z h ALA 115 Ca 0.21 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.82 2h3z h ALA 115 Cb 0.31 0.02 -0.21 0.00 0.00 0.00 0.00 17.79 17.92 2h3z h ALA 115 CO -0.44 -0.75 -0.51 1.04 0.00 0.00 0.00 179.25 178.59 2h3z n GLN 116 N -4.38 2.52 0.19 0.00 6.02 0.42 -4.71 117.38 117.44 2h3z n GLN 116 Ca 0.16 -3.65 0.05 0.00 -0.01 0.00 0.00 57.00 53.55 2h3z n GLN 116 Cb 0.76 -1.95 0.36 0.00 1.02 0.00 0.00 30.24 30.43 2h3z n GLN 116 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.06 176.42 2h3z h GLN 117 N 1.54 0.00 0.01 -1.09 -0.00 0.16 -3.31 115.11 112.42 2h3z h GLN 117 Ca 0.22 0.00 -0.34 0.00 -0.00 0.00 0.00 58.65 58.52 2h3z h GLN 117 Cb 1.32 0.00 -0.05 0.00 0.00 0.00 0.00 27.48 28.75 2h3z h GLN 117 CO 0.45 0.37 -1.90 0.00 0.00 0.00 0.00 178.83 177.75 2h3z n ALA 118 N -2.32 0.99 -2.39 3.38 0.00 -1.26 -4.62 120.51 114.30 2h3z n ALA 118 Ca -0.01 -0.77 -0.43 0.00 0.00 0.00 0.00 53.44 52.24 2h3z n ALA 118 Cb 0.48 -0.28 0.00 0.00 0.00 0.00 0.00 19.45 19.65 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 -3.67 4.89 0.12 0.00 0.00 -1.24 -4.20 120.51 116.40 2h3z n ALA 119 Ca -0.42 -4.18 0.00 0.00 0.00 0.00 0.00 53.44 48.85 2h3z n ALA 119 Cb 0.82 -3.16 0.00 0.00 0.00 0.00 0.00 19.45 17.11 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 5.10 0.00 0.30 0.00 0.00 -1.25 -4.87 120.51 119.79 2h3z n ALA 120 Ca 0.42 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.74 2h3z n ALA 120 Cb 0.39 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.78 2h3z n ALA 120 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2h3z h ASP 121 N 0.00 -0.67 -0.63 0.00 1.82 -1.82 -3.49 116.42 111.63 2h3z h ASP 121 Ca 0.00 0.02 0.01 0.00 -0.39 0.00 0.00 57.03 56.67 2h3z h ASP 121 Cb 0.00 0.17 -0.00 0.00 0.68 0.00 0.00 39.33 40.18 2h3z h ASP 121 CO 0.00 -0.38 -0.01 0.35 -1.61 0.00 0.00 179.24 177.59 2h3z n THR 122 N -4.70 0.00 -3.00 2.25 -2.24 -1.26 -4.37 114.28 100.96 2h3z n THR 122 Ca -0.10 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.42 2h3z n THR 122 Cb 0.31 -0.01 -0.04 0.00 -2.10 0.00 0.00 70.33 68.48 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 -0.13 5.46 2.69 3.38 0.00 -1.26 -5.01 105.19 110.33 2h3z n GLY 123 Ca 0.00 -2.74 -0.22 0.00 0.00 0.00 0.00 46.02 43.05 2h3z n GLY 123 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2h3z s ASN 124 N -3.33 1.53 -0.28 1.61 3.84 -1.26 -5.13 114.94 111.92 2h3z s ASN 124 Ca 0.48 -0.11 -0.20 0.00 0.21 0.00 0.00 52.86 53.23 2h3z s ASN 124 Cb 0.27 -0.26 0.10 0.00 -0.55 0.00 0.00 41.25 40.81 2h3z s ASN 124 CO -0.12 -0.25 0.85 0.21 -2.79 0.00 0.00 177.10 174.99 2h3z s ASN 125 N 2.10 -0.68 0.42 -4.21 2.47 -1.26 -5.07 114.94 108.71 2h3z s ASN 125 Ca 0.04 1.18 0.00 0.00 0.42 0.00 0.00 52.86 54.50 2h3z s ASN 125 Cb -0.13 1.24 0.00 0.00 -1.45 0.00 0.00 41.25 40.91 2h3z s ASN 125 CO -0.05 -0.19 0.00 -1.20 -3.72 0.00 0.00 177.10 171.94 2h3z n SER 126 N 3.26 -3.62 -3.46 -4.21 7.64 -1.26 -5.17 113.62 106.80 2h3z n SER 126 Ca -0.16 0.81 -0.11 0.00 1.01 0.00 0.00 58.87 60.42 2h3z n SER 126 Cb 0.57 3.42 -0.02 0.00 -1.01 0.00 0.00 64.21 67.16 2h3z n SER 126 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2h3z s GLN 127 N -2.00 1.06 -0.29 1.43 -0.21 -1.26 -5.18 119.66 113.21 2h3z s GLN 127 Ca 0.00 -0.35 -0.22 0.00 0.02 0.00 0.00 55.36 54.82 2h3z s GLN 127 Cb 0.00 0.49 0.18 0.00 1.00 0.00 0.00 33.01 34.68 2h3z s GLN 127 CO 0.00 -0.45 1.28 0.54 -2.12 0.00 0.00 175.29 174.54 2h3z s VAL 128 N -3.29 0.00 -0.69 1.09 0.11 -1.26 -5.11 120.40 111.26 2h3z s VAL 128 Ca 0.02 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 58.80 2h3z s VAL 128 Cb -0.01 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.85 2h3z s VAL 128 CO -0.10 0.00 1.51 -0.44 -3.33 0.00 0.00 175.10 172.74 2h3z s SER 129 N 0.45 5.81 -0.02 3.54 0.01 -1.26 -4.97 113.70 117.26 2h3z s SER 129 Ca 0.01 -0.13 0.03 0.00 1.31 0.00 0.00 55.95 57.17 2h3z s SER 129 Cb -0.04 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.64 2h3z s SER 129 CO -0.13 -2.05 -0.09 -1.58 0.41 0.00 0.00 173.24 169.80 2h3z s GLN 130 N 6.25 0.96 -0.26 12.44 0.74 -1.26 -5.13 119.66 133.39 2h3z s GLN 130 Ca 0.48 -0.32 -0.08 0.00 0.05 0.00 0.00 55.36 55.49 2h3z s GLN 130 Cb -0.10 -0.90 -0.03 0.00 1.10 0.00 0.00 33.01 33.08 2h3z s GLN 130 CO 0.17 0.13 0.10 -0.80 -0.55 0.00 0.00 175.29 174.35 2h3z s ASN 131 N 0.13 5.36 0.00 6.67 -0.87 -1.26 -5.32 114.94 119.64 2h3z s ASN 131 Ca -0.02 -0.21 0.13 0.00 -1.57 0.00 0.00 52.86 51.19 2h3z s ASN 131 Cb -0.08 -1.97 0.75 0.00 -0.02 0.00 0.00 41.25 39.93 2h3z s ASN 131 CO 0.00 -0.06 1.18 -1.22 -2.57 0.00 0.00 177.10 174.44