#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h3z h ALA 3 N 0.00 1.23 -3.36 4.61 0.00 -2.08 -3.42 119.26 116.25 2h3z h ALA 3 Ca 0.00 -0.35 -0.65 0.00 0.00 0.00 0.00 54.91 53.91 2h3z h ALA 3 Cb 0.00 -0.09 -0.20 0.00 0.00 0.00 0.00 17.79 17.50 2h3z h ALA 3 CO 0.00 0.52 -0.66 1.03 0.00 0.00 0.00 179.25 180.14 2h3z s ARG 4 N -4.29 3.44 -0.16 0.00 3.00 -1.26 -5.09 118.95 114.58 2h3z s ARG 4 Ca -0.05 -0.50 -0.05 0.00 0.00 0.00 0.00 55.73 55.13 2h3z s ARG 4 Cb 0.14 -2.86 0.08 0.00 0.00 0.00 0.00 34.95 32.31 2h3z s ARG 4 CO 0.76 0.38 0.32 0.00 0.00 0.00 0.00 175.30 176.75 2h3z s ALA 5 N -0.01 -0.76 -0.26 2.13 0.00 -1.26 -5.13 121.76 116.47 2h3z s ALA 5 Ca 0.01 1.06 -0.22 0.00 0.00 0.00 0.00 51.96 52.81 2h3z s ALA 5 Cb -0.13 -1.18 -0.01 0.00 0.00 0.00 0.00 23.12 21.79 2h3z s ALA 5 CO 0.03 -0.76 0.72 -1.12 0.00 0.00 0.00 175.76 174.62 2h3z s SER 6 N 2.48 6.67 -0.03 0.00 0.01 -1.26 -4.96 113.70 116.61 2h3z s SER 6 Ca 0.02 0.80 -0.23 0.00 1.31 0.00 0.00 55.95 57.85 2h3z s SER 6 Cb -0.12 -2.38 -0.16 0.00 0.21 0.00 0.00 66.02 63.56 2h3z s SER 6 CO -0.11 -0.46 1.02 0.58 0.41 0.00 0.00 173.24 174.69 2h3z h VAL 7 N 5.45 0.83 -3.72 3.43 2.07 -1.95 -3.42 116.25 118.93 2h3z h VAL 7 Ca -0.25 -0.95 -0.69 0.00 0.82 0.00 0.00 66.70 65.63 2h3z h VAL 7 Cb 1.11 1.33 -0.32 0.00 -1.52 0.00 0.00 31.29 31.89 2h3z h VAL 7 CO 0.82 0.19 -0.88 -0.76 0.02 0.00 0.00 177.57 176.96 2h3z s LEU 8 N -9.18 2.10 0.00 2.57 1.43 -1.26 -4.62 118.68 109.72 2h3z s LEU 8 Ca -0.13 -0.52 0.00 0.00 -1.03 0.00 0.00 54.13 52.44 2h3z s LEU 8 Cb 0.01 -1.40 0.00 0.00 0.03 0.00 0.00 46.19 44.84 2h3z s LEU 8 CO 0.51 0.21 0.00 -1.54 0.23 0.00 0.00 176.35 175.76 2h3z n SER 9 N 3.19 -0.36 0.36 2.29 3.41 -1.26 -4.58 113.62 116.67 2h3z n SER 9 Ca -0.18 -0.61 -0.14 0.00 -0.26 0.00 0.00 58.87 57.68 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 -0.18 -0.96 0.76 5.00 0.00 -1.96 0.19 103.07 105.93 2h3z h GLY 10 Ca 0.00 0.35 0.08 0.00 0.00 0.00 0.00 47.33 47.76 2h3z h GLY 10 CO 0.00 -0.35 0.60 -1.33 0.00 0.00 0.00 176.54 175.46 2h3z h GLY 11 N -0.96 1.38 1.05 4.60 0.00 -2.02 -1.99 103.07 105.13 2h3z h GLY 11 Ca -0.09 -0.42 -0.10 0.00 0.00 0.00 0.00 47.33 46.72 2h3z h GLY 11 CO 0.15 0.27 -0.09 0.83 0.00 0.00 0.00 176.54 177.70 2h3z h GLU 12 N 1.02 0.94 -0.48 4.80 5.08 -1.90 -3.12 114.58 120.91 2h3z h GLU 12 Ca 0.41 -0.35 0.10 0.00 -1.00 0.00 0.00 59.36 58.52 2h3z h GLU 12 Cb 0.27 -0.06 -0.09 0.00 0.50 0.00 0.00 28.75 29.37 2h3z h GLU 12 CO -0.17 1.00 -0.07 1.25 -1.00 0.00 0.00 179.01 180.02 2h3z h LEU 13 N 0.79 -0.36 0.45 1.33 5.85 0.16 0.51 115.31 124.04 2h3z h LEU 13 Ca 0.13 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.97 2h3z h LEU 13 Cb 0.64 0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.91 2h3z h LEU 13 CO 0.04 -0.13 -0.52 0.44 -0.34 0.00 0.00 178.44 177.94 2h3z h ASP 14 N 0.04 -1.44 -0.77 1.25 3.32 -1.46 -1.85 116.42 115.51 2h3z h ASP 14 Ca 0.24 0.12 0.15 0.00 0.02 0.00 0.00 57.03 57.56 2h3z h ASP 14 Cb 0.36 0.48 -0.10 0.00 0.22 0.00 0.00 39.33 40.30 2h3z h ASP 14 CO -0.46 -0.66 0.32 0.11 -1.72 0.00 0.00 179.24 176.82 2h3z h LYS 15 N -0.98 0.44 -0.29 3.56 1.57 -1.41 -1.37 116.57 118.08 2h3z h LYS 15 Ca -0.06 -0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.76 2h3z h LYS 15 Cb 0.87 -0.10 -0.07 0.00 0.08 0.00 0.00 32.23 33.01 2h3z h LYS 15 CO -0.10 0.29 -0.15 2.35 -0.57 0.00 0.00 179.45 181.28 2h3z h TRP 16 N 0.46 -0.35 0.00 -1.35 2.91 -0.42 0.19 115.95 117.39 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 0.66 0.20 -0.00 0.00 -0.51 0.00 0.00 29.16 29.51 2h3z h TRP 16 CO -0.16 -0.22 -0.01 0.93 -1.03 0.00 0.00 178.44 177.96 2h3z h GLU 17 N -0.10 0.00 0.28 2.65 5.08 -0.45 -3.02 114.58 119.02 2h3z h GLU 17 Ca 0.15 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 2h3z h GLU 17 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2h3z h GLU 17 CO -0.36 0.01 -0.14 -0.22 -1.00 0.00 0.00 179.01 177.30 2h3z h LYS 18 N 0.00 -0.37 -6.29 2.33 3.11 -0.16 -3.32 116.57 111.87 2h3z h LYS 18 Ca -0.00 0.03 -0.61 0.00 -2.81 0.00 0.00 60.65 57.25 2h3z h LYS 18 Cb 0.05 0.08 0.14 0.00 -1.00 0.00 0.00 32.23 31.50 2h3z h LYS 18 CO 0.00 -0.25 -0.38 -0.89 -2.81 0.00 0.00 179.45 175.12 2h3z n ILE 19 N -3.93 1.75 -4.38 2.00 5.41 -0.96 -4.59 119.36 114.65 2h3z n ILE 19 Ca -0.05 -0.50 -0.24 0.00 1.00 0.00 0.00 62.75 62.97 2h3z n ILE 19 Cb 0.15 -0.50 -0.09 0.00 -0.71 0.00 0.00 39.64 38.49 2h3z n ILE 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2h3z s ARG 20 N -1.47 1.97 0.19 0.38 3.03 -1.26 -0.38 118.95 121.42 2h3z s ARG 20 Ca 0.62 -1.59 -0.08 0.00 2.03 0.00 0.00 55.73 56.71 2h3z s ARG 20 Cb -0.66 -1.96 0.10 0.00 -1.03 0.00 0.00 34.95 31.40 2h3z s ARG 20 CO 0.58 0.35 1.67 -0.07 -1.13 0.00 0.00 175.30 176.71 2h3z h LEU 21 N 2.11 1.05 -8.94 -1.89 3.38 -1.66 -1.22 115.31 108.13 2h3z h LEU 21 Ca -0.42 -0.28 -0.65 0.00 0.09 0.00 0.00 57.88 56.62 2h3z h LEU 21 Cb 1.25 -0.28 -0.20 0.00 0.09 0.00 0.00 40.66 41.52 2h3z h LEU 21 CO 0.60 1.07 -0.84 -0.13 0.09 0.00 0.00 178.44 179.23 2h3z s ARG 22 N -5.11 1.42 0.26 1.13 0.52 -1.26 -3.97 118.95 111.94 2h3z s ARG 22 Ca -0.12 -1.42 0.03 0.00 -0.52 0.00 0.00 55.73 53.70 2h3z s ARG 22 Cb 0.14 -1.79 0.32 0.00 0.52 0.00 0.00 34.95 34.14 2h3z s ARG 22 CO 0.85 0.40 1.63 -1.00 0.02 0.00 0.00 175.30 177.21 2h3z h PRO 23 N 3.54 0.36 -0.34 3.54 0.13 -1.93 -3.19 132.00 134.10 2h3z h PRO 23 Ca -0.48 -0.19 -0.20 0.00 -0.87 0.00 0.00 66.00 64.26 2h3z h PRO 23 Cb 1.19 0.01 -0.12 0.00 0.13 0.00 0.00 31.00 32.20 2h3z h PRO 23 CO 0.44 0.74 -0.20 0.41 -0.23 0.00 0.00 178.00 179.16 2h3z n GLY 24 N -0.03 5.13 0.77 1.56 0.00 -1.26 -5.02 105.19 106.33 2h3z n GLY 24 Ca -0.02 -1.41 -0.05 0.00 0.00 0.00 0.00 46.02 44.54 2h3z n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h3z n GLY 25 N -1.08 3.10 0.00 -0.02 0.00 -1.21 -5.06 105.19 100.91 2h3z n GLY 25 Ca 0.33 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 44.15 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 -0.71 0.20 -2.92 1.61 4.81 -1.26 -4.96 118.16 114.94 2h3z n LYS 26 Ca -0.01 -0.31 -0.43 0.00 -0.87 0.00 0.00 58.31 56.69 2h3z n LYS 26 Cb 0.13 -0.79 -0.05 0.00 0.02 0.00 0.00 35.03 34.34 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 -0.12 3.42 0.79 1.64 2.20 -1.26 -5.04 119.74 121.37 2h3z s LYS 27 Ca 0.00 -0.09 -0.08 0.00 -0.36 0.00 0.00 55.97 55.44 2h3z s LYS 27 Cb 0.00 -3.96 0.12 0.00 -1.51 0.00 0.00 37.83 32.48 2h3z s LYS 27 CO 0.00 -1.20 1.11 -0.65 -0.36 0.00 0.00 175.35 174.25 2h3z s GLN 28 N 3.48 1.58 0.28 4.03 1.11 -1.26 -1.96 119.66 126.92 2h3z s GLN 28 Ca 0.31 -0.50 -0.26 0.00 0.01 0.00 0.00 55.36 54.92 2h3z s GLN 28 Cb -0.12 -2.10 -0.09 0.00 -1.01 0.00 0.00 33.01 29.69 2h3z s GLN 28 CO 0.23 -1.67 0.90 0.71 0.01 0.00 0.00 175.29 175.47 2h3z s TYR 29 N -3.43 3.75 0.20 0.91 2.02 0.48 -4.67 117.35 116.60 2h3z s TYR 29 Ca 0.66 1.73 -0.01 0.00 -0.37 0.00 0.00 57.07 59.09 2h3z s TYR 29 Cb -0.07 -2.87 -0.04 0.00 -0.40 0.00 0.00 41.96 38.57 2h3z s TYR 29 CO 0.47 0.29 0.11 0.15 -1.57 0.00 0.00 175.55 175.00 2h3z s LYS 30 N -1.84 1.18 0.36 -0.62 -0.14 -1.26 -4.02 119.74 113.40 2h3z s LYS 30 Ca 0.47 -1.61 0.12 0.00 -1.36 0.00 0.00 55.97 53.59 2h3z s LYS 30 Cb -0.20 0.17 0.93 0.00 -1.68 0.00 0.00 37.83 37.06 2h3z s LYS 30 CO 0.25 -0.35 1.81 -0.07 -0.76 0.00 0.00 175.35 176.23 2h3z h LEU 31 N 2.63 0.59 -0.56 3.17 -0.00 -1.98 -1.30 115.31 117.85 2h3z h LEU 31 Ca -0.36 0.07 0.11 0.00 -0.00 0.00 0.00 57.88 57.70 2h3z h LEU 31 Cb 1.24 -0.03 -0.11 0.00 -0.00 0.00 0.00 40.66 41.76 2h3z h LEU 31 CO 0.55 0.20 -0.22 0.11 -0.00 0.00 0.00 178.44 179.09 2h3z h LYS 32 N 0.57 -0.08 -0.25 1.13 1.57 -1.99 0.28 116.57 117.81 2h3z h LYS 32 Ca 0.54 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.34 2h3z h LYS 32 Cb 1.10 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 2h3z h LYS 32 CO -0.29 -0.05 0.17 0.45 -0.57 0.00 0.00 179.45 179.16 2h3z h HIS 33 N -0.08 0.25 0.03 -1.35 3.86 -1.65 -0.36 115.15 115.84 2h3z h HIS 33 Ca 0.26 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.47 2h3z h HIS 33 Cb 0.48 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.87 2h3z h HIS 33 CO -0.53 0.15 -0.01 0.82 0.86 0.00 0.00 177.93 179.22 2h3z h ILE 34 N 0.26 0.00 -1.12 2.45 2.04 -0.50 -3.13 117.51 117.51 2h3z h ILE 34 Ca 0.10 -0.06 0.31 0.00 1.00 0.00 0.00 64.86 66.21 2h3z h ILE 34 Cb 0.07 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.06 2h3z h ILE 34 CO -0.02 0.00 0.74 0.58 0.00 0.00 0.00 178.15 179.45 2h3z h VAL 35 N -0.09 0.43 0.42 1.67 2.07 -1.21 -0.47 116.25 119.08 2h3z h VAL 35 Ca -0.00 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 2h3z h VAL 35 Cb 0.03 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 29.92 2h3z h VAL 35 CO 0.01 0.05 -0.37 -0.25 0.02 0.00 0.00 177.57 177.02 2h3z h TRP 36 N 0.27 -1.01 -0.68 1.57 7.01 -1.16 -1.16 115.95 120.80 2h3z h TRP 36 Ca 0.63 0.00 -0.06 0.00 2.11 0.00 0.00 58.89 61.57 2h3z h TRP 36 Cb 1.83 0.38 -0.03 0.00 -2.10 0.00 0.00 29.16 29.25 2h3z h TRP 36 CO -0.00 -0.53 0.18 0.00 -2.79 0.00 0.00 178.44 175.30 2h3z h ALA 37 N -0.40 1.04 0.00 2.65 0.00 -1.09 -2.04 119.26 119.41 2h3z h ALA 37 Ca -0.04 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2h3z h ALA 37 Cb 0.70 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 2h3z h ALA 37 CO -0.03 0.64 -0.01 0.66 0.00 0.00 0.00 179.25 180.51 2h3z h SER 38 N 1.02 0.00 0.86 0.00 4.64 -0.89 -0.05 113.55 119.12 2h3z h SER 38 Ca 0.22 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.43 2h3z h SER 38 Cb 0.33 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.41 2h3z h SER 38 CO -0.00 0.01 -1.21 -0.09 -0.87 0.00 0.00 176.83 174.67 2h3z h ARG 39 N 0.00 0.00 0.02 4.77 2.43 -0.51 -3.32 114.38 117.76 2h3z h ARG 39 Ca -0.00 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 58.93 2h3z h ARG 39 Cb 0.04 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 2h3z h ARG 39 CO 0.00 0.20 -1.22 1.49 -1.51 0.00 0.00 179.97 178.93 2h3z h GLU 40 N 0.00 0.03 -0.53 0.20 4.57 -0.65 -3.33 114.58 114.87 2h3z h GLU 40 Ca -0.10 -0.06 -0.09 0.00 -1.18 0.00 0.00 59.36 57.93 2h3z h GLU 40 Cb 1.38 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.97 2h3z h GLU 40 CO 0.03 0.90 -0.01 -0.07 -1.18 0.00 0.00 179.01 178.68 2h3z h LEU 41 N 0.01 0.93 -2.53 1.64 3.38 -1.26 0.30 115.31 117.78 2h3z h LEU 41 Ca -0.10 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.56 2h3z h LEU 41 Cb 1.86 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 42.36 2h3z h LEU 41 CO 0.12 1.02 0.00 -0.08 0.09 0.00 0.00 178.44 179.59 2h3z h GLU 42 N 0.82 0.00 0.00 1.13 4.81 -1.57 -0.92 114.58 118.84 2h3z h GLU 42 Ca 0.15 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.21 2h3z h GLU 42 Cb 0.55 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.90 2h3z h GLU 42 CO 0.03 0.00 -2.06 0.54 -0.73 0.00 0.00 179.01 176.79 2h3z n ARG 43 N -3.05 0.85 0.13 1.92 1.74 -0.90 -4.63 116.66 112.72 2h3z n ARG 43 Ca -0.02 -0.09 -0.06 0.00 -0.77 0.00 0.00 57.85 56.91 2h3z n ARG 43 Cb 0.13 -1.46 -0.03 0.00 -1.02 0.00 0.00 32.46 30.08 2h3z n ARG 43 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 2h3z h PHE 44 N 0.00 -0.37 0.00 -1.55 -1.00 0.30 -3.48 116.94 110.85 2h3z h PHE 44 Ca -0.25 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.52 2h3z h PHE 44 Cb 1.52 0.12 0.00 0.00 3.61 0.00 0.00 35.95 41.20 2h3z h PHE 44 CO 0.00 -0.23 0.00 0.00 -1.61 0.00 0.00 178.31 176.47 2h3z n ALA 45 N -2.61 0.00 -2.61 2.45 0.00 -0.68 -5.08 120.51 111.98 2h3z n ALA 45 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.06 2h3z n ALA 45 Cb 0.16 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.50 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 3.79 0.29 0.00 1.01 -0.44 -5.02 120.40 120.03 2h3z s VAL 46 Ca 0.00 -0.64 -0.29 0.00 0.00 0.00 0.00 61.98 61.05 2h3z s VAL 46 Cb 0.00 -2.63 -0.09 0.00 0.00 0.00 0.00 36.38 33.66 2h3z s VAL 46 CO 0.00 0.45 1.05 0.20 0.00 0.00 0.00 175.10 176.80 2h3z s ASN 47 N -1.27 7.27 0.06 3.32 -0.87 -1.26 -2.43 114.94 119.76 2h3z s ASN 47 Ca 0.16 2.15 0.16 0.00 -1.57 0.00 0.00 52.86 53.77 2h3z s ASN 47 Cb -0.11 -2.62 0.69 0.00 -0.02 0.00 0.00 41.25 39.19 2h3z s ASN 47 CO 0.06 -0.13 1.51 -0.81 -2.57 0.00 0.00 177.10 175.16 2h3z n PRO 48 N 1.03 0.04 0.00 -0.60 -0.04 -1.26 -2.34 135.00 131.83 2h3z n PRO 48 Ca -0.00 0.30 0.14 0.00 -0.04 0.00 0.00 63.50 63.89 2h3z n PRO 48 Cb 0.46 -1.59 0.56 0.00 -0.04 0.00 0.00 33.50 32.90 2h3z n PRO 48 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2h3z n GLY 49 N -0.04 -1.45 0.03 0.55 0.00 -1.26 -3.22 105.19 99.80 2h3z n GLY 49 Ca 0.03 -0.14 0.16 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.49 0.11 0.07 0.99 4.77 -0.99 -3.03 117.00 117.43 2h3z n LEU 50 Ca 0.07 -0.02 0.12 0.00 -0.03 0.00 0.00 56.01 56.14 2h3z n LEU 50 Cb 0.34 -0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.49 2h3z n LEU 50 CO 0.28 0.02 0.16 0.18 -1.33 0.00 0.00 177.39 176.70 2h3z n LEU 51 N -0.93 0.73 -1.62 2.23 4.77 -1.20 -2.33 117.00 118.65 2h3z n LEU 51 Ca 0.23 0.21 -0.08 0.00 -0.03 0.00 0.00 56.01 56.34 2h3z n LEU 51 Cb 0.13 -0.12 0.16 0.00 -2.33 0.00 0.00 43.42 41.26 2h3z n LEU 51 CO 0.18 -0.08 0.86 -1.84 -1.33 0.00 0.00 177.39 175.18 2h3z n GLU 52 N -2.27 2.36 -3.33 3.23 -0.00 -1.17 -4.73 120.64 114.73 2h3z n GLU 52 Ca 0.02 -1.89 0.02 0.00 -0.00 0.00 0.00 57.16 55.31 2h3z n GLU 52 Cb 0.48 -1.82 -0.02 0.00 -0.00 0.00 0.00 31.44 30.08 2h3z n GLU 52 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.13 177.05 2h3z s THR 53 N -2.05 -0.92 0.37 3.84 -1.32 -1.25 -5.01 115.64 109.29 2h3z s THR 53 Ca 0.35 0.00 0.15 0.00 -1.21 0.00 0.00 61.69 60.97 2h3z s THR 53 Cb 0.28 -1.00 0.36 0.00 -1.51 0.00 0.00 72.50 70.63 2h3z s THR 53 CO 0.08 0.00 1.76 0.77 -2.21 0.00 0.00 174.62 175.02 2h3z h SER 54 N 7.97 0.54 0.10 8.08 4.64 -1.85 0.64 113.55 133.67 2h3z h SER 54 Ca -0.20 0.10 -0.07 0.00 -0.47 0.00 0.00 61.79 61.15 2h3z h SER 54 Cb 1.14 0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 2h3z h SER 54 CO 0.17 0.12 -0.22 -0.08 -0.87 0.00 0.00 176.83 175.94 2h3z h GLU 55 N 0.49 0.22 0.00 4.77 4.57 -1.95 -2.59 114.58 120.08 2h3z h GLU 55 Ca 0.60 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.70 2h3z h GLU 55 Cb 1.35 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.92 2h3z h GLU 55 CO -0.35 0.44 -0.56 0.78 -1.18 0.00 0.00 179.01 178.14 2h3z h GLY 56 N 0.89 0.00 2.00 1.92 0.00 -0.00 -3.30 103.07 104.58 2h3z h GLY 56 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.27 2h3z h GLY 56 CO 0.03 0.00 -0.46 0.00 0.00 0.00 0.00 176.54 176.11 2h3z h ARG 58 N 0.00 0.75 -0.25 0.00 2.43 -1.60 -2.72 114.38 112.98 2h3z h ARG 58 Ca -0.00 -0.30 0.07 0.00 -0.81 0.00 0.00 59.98 58.94 2h3z h ARG 58 Cb 0.98 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.48 2h3z h ARG 58 CO 0.06 0.90 0.29 1.96 -1.51 0.00 0.00 179.97 181.67 2h3z h GLN 59 N 0.55 0.00 0.24 0.20 1.08 -1.69 0.02 115.11 115.51 2h3z h GLN 59 Ca 0.09 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.28 2h3z h GLN 59 Cb 0.64 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.08 2h3z h GLN 59 CO 0.04 0.00 -0.12 0.82 -0.95 0.00 0.00 178.83 178.63 2h3z h ILE 60 N 0.00 0.50 -0.93 2.54 2.04 -1.58 -3.07 117.51 117.01 2h3z h ILE 60 Ca 0.12 -0.93 -0.00 0.00 1.00 0.00 0.00 64.86 65.05 2h3z h ILE 60 Cb 0.69 0.83 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 2h3z h ILE 60 CO -0.00 0.13 0.56 -0.07 0.00 0.00 0.00 178.15 178.77 2h3z h LEU 61 N -0.97 1.11 -1.03 1.44 3.38 -1.38 -1.07 115.31 116.78 2h3z h LEU 61 Ca -0.03 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2h3z h LEU 61 Cb 0.46 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2h3z h LEU 61 CO 0.05 0.85 0.00 0.61 0.09 0.00 0.00 178.44 180.05 2h3z n GLY 62 N -1.25 -0.98 0.11 0.83 0.00 -0.06 0.05 105.19 103.88 2h3z n GLY 62 Ca 0.10 0.14 -0.22 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.17 0.56 0.10 1.61 1.13 -0.45 -4.33 117.38 113.82 2h3z n GLN 63 Ca 0.00 0.48 -0.04 0.00 -1.94 0.00 0.00 57.00 55.50 2h3z n GLN 63 Cb 0.10 -1.67 0.15 0.00 0.11 0.00 0.00 30.24 28.93 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 -1.00 0.22 -0.37 1.08 3.38 -1.28 -3.22 115.31 114.13 2h3z h LEU 64 Ca -0.40 -0.12 0.04 0.00 0.09 0.00 0.00 57.88 57.49 2h3z h LEU 64 Cb 1.31 -0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.92 2h3z h LEU 64 CO -0.24 0.75 -0.52 -0.61 0.09 0.00 0.00 178.44 177.91 2h3z h GLN 65 N 0.15 -0.36 0.00 1.13 4.15 -0.59 0.49 115.11 120.07 2h3z h GLN 65 Ca -0.00 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.44 2h3z h GLN 65 Cb 1.06 0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.83 2h3z h GLN 65 CO 0.09 -0.24 0.00 -0.35 -1.93 0.00 0.00 178.83 176.39 2h3z n PRO 66 N -5.18 0.15 -0.01 -2.39 -0.04 -1.24 -1.85 135.00 124.44 2h3z n PRO 66 Ca -0.03 0.18 0.08 0.00 -0.04 0.00 0.00 63.50 63.69 2h3z n PRO 66 Cb 0.32 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.35 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 -1.35 2.44 0.20 3.54 7.64 0.12 -4.41 113.62 121.81 2h3z n SER 67 Ca 0.06 -1.71 0.14 0.00 1.01 0.00 0.00 58.87 58.37 2h3z n SER 67 Cb 0.13 -0.01 0.71 0.00 -1.01 0.00 0.00 64.21 64.03 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 3.29 0.00 -0.15 -3.43 3.38 0.49 0.46 115.31 119.35 2h3z h LEU 68 Ca 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2h3z h LEU 68 Cb 0.71 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.46 2h3z h LEU 68 CO 0.00 0.00 -0.30 -0.61 0.09 0.00 0.00 178.44 177.62 2h3z h GLN 69 N 0.00 0.46 -0.34 1.13 4.15 -1.80 -3.31 115.11 115.41 2h3z h GLN 69 Ca 0.00 -0.30 -0.24 0.00 0.77 0.00 0.00 58.65 58.88 2h3z h GLN 69 Cb 0.11 0.04 -0.18 0.00 0.21 0.00 0.00 27.48 27.66 2h3z h GLN 69 CO 0.00 0.91 -0.57 0.25 -1.93 0.00 0.00 178.83 177.49 2h3z n THR 70 N -4.39 2.39 -3.57 2.39 -2.24 -0.87 -5.02 114.28 102.97 2h3z n THR 70 Ca -0.07 -3.59 -0.37 0.00 -2.27 0.00 0.00 64.05 57.75 2h3z n THR 70 Cb 0.48 -0.61 -0.09 0.00 -2.10 0.00 0.00 70.33 68.00 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 -3.31 1.99 0.52 3.38 0.00 0.10 -5.08 107.32 104.92 2h3z s GLY 71 Ca 0.44 -0.82 -0.09 0.00 0.00 0.00 0.00 44.72 44.25 2h3z s GLY 71 CO -0.02 0.57 0.32 -1.14 0.00 0.00 0.00 173.10 172.83 2h3z n SER 72 N 4.50 -2.61 -0.17 1.64 3.41 -1.26 -4.73 113.62 114.41 2h3z n SER 72 Ca -0.13 -0.37 -0.10 0.00 -0.26 0.00 0.00 58.87 58.01 2h3z n SER 72 Cb 0.52 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 64.11 2h3z n SER 72 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2h3z h GLU 73 N 0.00 0.81 -0.73 4.33 4.81 -2.00 -2.64 114.58 119.16 2h3z h GLU 73 Ca -0.14 -0.24 0.18 0.00 -0.13 0.00 0.00 59.36 59.03 2h3z h GLU 73 Cb 0.48 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.73 2h3z h GLU 73 CO 0.09 0.84 0.50 0.93 -0.73 0.00 0.00 179.01 180.64 2h3z h GLU 74 N 0.67 0.17 0.01 1.92 3.07 -2.02 0.15 114.58 118.56 2h3z h GLU 74 Ca 0.14 -0.01 -0.20 0.00 -0.50 0.00 0.00 59.36 58.79 2h3z h GLU 74 Cb 0.44 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 2h3z h GLU 74 CO 0.02 0.11 -0.90 1.25 -1.40 0.00 0.00 179.01 178.09 2h3z h LEU 75 N 0.18 0.27 0.48 1.33 6.46 -1.79 -3.22 115.31 119.02 2h3z h LEU 75 Ca 0.36 -0.23 -0.02 0.00 -0.12 0.00 0.00 57.88 57.86 2h3z h LEU 75 Cb 1.14 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 40.99 2h3z h LEU 75 CO -0.06 1.04 -0.23 -0.09 -0.62 0.00 0.00 178.44 178.48 2h3z h ARG 76 N 0.11 -0.62 -0.79 1.25 1.12 -0.50 -2.16 114.38 112.80 2h3z h ARG 76 Ca -0.05 0.04 0.14 0.00 -1.11 0.00 0.00 59.98 59.00 2h3z h ARG 76 Cb 1.54 0.14 -0.09 0.00 -0.01 0.00 0.00 29.97 31.55 2h3z h ARG 76 CO 0.14 -0.40 0.37 0.77 -3.11 0.00 0.00 179.97 177.74 2h3z h SER 77 N -0.67 0.41 0.71 -3.80 0.02 -1.57 -1.63 113.55 107.03 2h3z h SER 77 Ca -0.07 0.10 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 2h3z h SER 77 Cb 0.50 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.08 2h3z h SER 77 CO 0.11 0.17 -0.50 -0.07 -1.14 0.00 0.00 176.83 175.40 2h3z h LEU 78 N 0.54 -1.28 -0.74 5.07 -0.00 -1.51 -0.49 115.31 116.90 2h3z h LEU 78 Ca 0.43 0.08 0.16 0.00 -0.00 0.00 0.00 57.88 58.56 2h3z h LEU 78 Cb 0.62 0.39 -0.12 0.00 -0.00 0.00 0.00 40.66 41.55 2h3z h LEU 78 CO -0.37 -0.73 0.13 0.22 -0.00 0.00 0.00 178.44 177.69 2h3z h TYR 79 N -1.15 0.18 0.74 1.13 3.20 -0.91 0.35 116.97 120.52 2h3z h TYR 79 Ca -0.09 0.05 -0.03 0.00 3.14 0.00 0.00 58.73 61.79 2h3z h TYR 79 Cb 0.94 0.03 -0.00 0.00 1.54 0.00 0.00 36.73 39.24 2h3z h TYR 79 CO -0.15 -0.13 -0.43 -0.91 -1.64 0.00 0.00 178.16 174.89 2h3z h ASN 80 N 0.21 -1.08 0.55 -2.11 -0.26 -1.03 -0.16 115.58 111.71 2h3z h ASN 80 Ca 0.42 0.06 -0.02 0.00 -0.56 0.00 0.00 56.30 56.19 2h3z h ASN 80 Cb 0.72 0.31 -0.02 0.00 -1.06 0.00 0.00 38.32 38.28 2h3z h ASN 80 CO -0.55 -0.68 -0.44 0.74 -1.06 0.00 0.00 177.43 175.44 2h3z h THR 81 N -1.10 0.13 -0.87 2.81 2.02 -0.32 -2.51 112.91 113.07 2h3z h THR 81 Ca -0.10 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.30 2h3z h THR 81 Cb 0.87 0.13 -0.13 0.00 -1.74 0.00 0.00 68.15 67.29 2h3z h THR 81 CO 0.11 0.00 0.33 0.40 0.37 0.00 0.00 175.52 176.74 2h3z h ILE 82 N -0.96 0.45 -0.78 3.11 2.04 -0.35 0.23 117.51 121.24 2h3z h ILE 82 Ca -0.06 -0.12 0.10 0.00 1.00 0.00 0.00 64.86 65.78 2h3z h ILE 82 Cb 0.82 0.08 -0.08 0.00 -0.74 0.00 0.00 36.82 36.90 2h3z h ILE 82 CO 0.00 0.06 0.41 0.00 0.00 0.00 0.00 178.15 178.63 2h3z h ALA 83 N 1.71 1.11 -0.06 1.87 0.00 -0.59 0.12 119.26 123.42 2h3z h ALA 83 Ca 0.54 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.46 2h3z h ALA 83 Cb 1.02 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2h3z h ALA 83 CO -0.55 -0.00 -0.11 0.28 0.00 0.00 0.00 179.25 178.87 2h3z h VAL 84 N 0.68 1.42 0.55 0.00 2.07 -0.31 -2.97 116.25 117.68 2h3z h VAL 84 Ca 0.39 -1.40 -0.02 0.00 0.82 0.00 0.00 66.70 66.49 2h3z h VAL 84 Cb 0.42 2.21 -0.01 0.00 -1.52 0.00 0.00 31.29 32.39 2h3z h VAL 84 CO -0.28 0.39 -0.42 0.25 0.02 0.00 0.00 177.57 177.53 2h3z h LEU 85 N -0.32 -1.10 -0.89 2.57 5.85 -0.66 -2.10 115.31 118.67 2h3z h LEU 85 Ca 0.00 0.07 0.24 0.00 0.84 0.00 0.00 57.88 59.04 2h3z h LEU 85 Cb 0.68 0.34 -0.15 0.00 0.37 0.00 0.00 40.66 41.90 2h3z h LEU 85 CO 0.02 -0.60 0.15 0.22 -0.34 0.00 0.00 178.44 177.90 2h3z h TYR 86 N -0.93 0.19 -0.33 1.25 3.20 -0.89 0.25 116.97 119.71 2h3z h TYR 86 Ca -0.07 0.06 0.05 0.00 3.14 0.00 0.00 58.73 61.90 2h3z h TYR 86 Cb 0.77 0.06 -0.04 0.00 1.54 0.00 0.00 36.73 39.06 2h3z h TYR 86 CO -0.15 -0.28 0.08 0.00 -1.64 0.00 0.00 178.16 176.17 2h3z h VAL 88 N 0.20 0.70 -0.55 0.00 2.07 0.18 0.21 116.25 119.06 2h3z h VAL 88 Ca 0.15 -0.25 -0.10 0.00 0.82 0.00 0.00 66.70 67.33 2h3z h VAL 88 Cb 0.16 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.83 2h3z h VAL 88 CO -0.19 0.13 -0.04 0.45 0.02 0.00 0.00 177.57 177.94 2h3z h HIS 89 N 0.72 1.07 -0.09 1.57 -0.00 -1.00 -2.55 115.15 114.87 2h3z h HIS 89 Ca 0.55 -0.19 -0.03 0.00 -0.00 0.00 0.00 60.37 60.70 2h3z h HIS 89 Cb 0.84 -0.28 -0.02 0.00 -0.00 0.00 0.00 27.41 27.96 2h3z h HIS 89 CO -0.03 0.97 0.04 0.94 -0.00 0.00 0.00 177.93 179.85 2h3z n GLN 90 N -4.17 1.27 -3.22 2.45 -0.06 -0.09 -4.78 117.38 108.78 2h3z n GLN 90 Ca 0.02 -0.34 -0.19 0.00 -2.00 0.00 0.00 57.00 54.50 2h3z n GLN 90 Cb 0.36 -1.34 0.05 0.00 -4.06 0.00 0.00 30.24 25.25 2h3z n GLN 90 CO 0.00 0.00 0.00 -2.13 -0.20 0.00 0.00 177.06 174.73 2h3z n ARG 91 N 0.20 -5.66 -4.88 3.69 3.00 -0.96 -5.01 116.66 107.04 2h3z n ARG 91 Ca 0.05 0.70 -0.33 0.00 -0.00 0.00 0.00 57.85 58.27 2h3z n ARG 91 Cb 0.50 -5.25 -0.15 0.00 0.00 0.00 0.00 32.46 27.56 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 -3.19 2.86 -0.47 5.15 1.01 0.54 -4.99 121.20 122.10 2h3z s ILE 92 Ca 0.40 -0.74 0.06 0.00 0.00 0.00 0.00 60.65 60.37 2h3z s ILE 92 Cb -0.18 -2.17 0.40 0.00 0.01 0.00 0.00 42.46 40.52 2h3z s ILE 92 CO 0.50 0.54 1.04 -0.67 0.00 0.00 0.00 174.94 176.34 2h3z n ASP 93 N 3.34 4.28 -3.44 3.58 2.03 -1.26 -2.63 116.55 122.45 2h3z n ASP 93 Ca -0.18 -3.61 -0.36 0.00 0.52 0.00 0.00 54.79 51.15 2h3z n ASP 93 Cb 0.53 -0.50 -0.02 0.00 -0.72 0.00 0.00 41.12 40.41 2h3z n ASP 93 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2h3z n VAL 94 N -0.35 1.25 -0.30 5.18 0.24 -1.26 -4.79 118.33 118.30 2h3z n VAL 94 Ca 0.34 -0.39 0.04 0.00 -2.04 0.00 0.00 64.34 62.28 2h3z n VAL 94 Cb 0.59 0.00 0.24 0.00 -1.47 0.00 0.00 33.84 33.20 2h3z n VAL 94 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2h3z h LYS 95 N 0.63 1.00 -3.36 7.34 6.56 -1.98 -3.42 116.57 123.33 2h3z h LYS 95 Ca -0.24 -0.06 -0.07 0.00 -1.06 0.00 0.00 60.65 59.22 2h3z h LYS 95 Cb 1.14 -0.22 -0.04 0.00 -0.57 0.00 0.00 32.23 32.53 2h3z h LYS 95 CO 0.42 0.66 0.10 0.16 -2.06 0.00 0.00 179.45 178.73 2h3z s ASP 96 N -6.04 0.17 0.39 0.86 1.47 -1.26 -3.99 116.67 108.26 2h3z s ASP 96 Ca -0.11 -1.11 0.25 0.00 1.18 0.00 0.00 52.55 52.76 2h3z s ASP 96 Cb 0.20 0.75 1.37 0.00 -0.34 0.00 0.00 42.92 44.90 2h3z s ASP 96 CO 0.80 -1.46 1.77 0.74 0.68 0.00 0.00 175.17 177.69 2h3z h THR 97 N 2.06 0.00 0.10 2.11 2.02 -1.34 -2.52 112.91 115.34 2h3z h THR 97 Ca -0.28 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.89 2h3z h THR 97 Cb 1.25 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 2h3z h THR 97 CO 0.36 0.00 -0.05 0.11 0.37 0.00 0.00 175.52 176.32 2h3z h LYS 98 N 0.00 -0.13 0.00 6.66 1.79 -1.86 -3.26 116.57 119.78 2h3z h LYS 98 Ca 0.00 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 2h3z h LYS 98 Cb 0.05 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.72 2h3z h LYS 98 CO 0.00 0.22 0.08 1.49 -1.08 0.00 0.00 179.45 180.16 2h3z h GLU 99 N -0.98 0.00 -0.11 3.15 4.81 -1.85 -0.19 114.58 119.41 2h3z h GLU 99 Ca -0.01 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.09 2h3z h GLU 99 Cb 0.41 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 2h3z h GLU 99 CO 0.02 0.00 -0.50 0.00 -0.73 0.00 0.00 179.01 177.80 2h3z h ALA 100 N 1.83 0.95 0.00 2.92 0.00 -1.54 0.49 119.26 123.91 2h3z h ALA 100 Ca 0.00 -0.48 -0.11 0.00 0.00 0.00 0.00 54.91 54.33 2h3z h ALA 100 Cb 0.16 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2h3z h ALA 100 CO 0.00 0.66 -0.50 -0.07 0.00 0.00 0.00 179.25 179.34 2h3z h LEU 101 N 0.22 0.00 0.06 0.00 3.38 -1.10 -2.76 115.31 115.12 2h3z h LEU 101 Ca 0.01 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.69 2h3z h LEU 101 Cb 0.96 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.69 2h3z h LEU 101 CO 0.08 0.50 -1.57 -0.78 0.09 0.00 0.00 178.44 176.76 2h3z h ASP 102 N 0.00 0.19 -0.26 -0.43 3.58 -1.42 -3.36 116.42 114.73 2h3z h ASP 102 Ca -0.01 -0.31 -0.18 0.00 0.42 0.00 0.00 57.03 56.95 2h3z h ASP 102 Cb 1.33 -0.06 -0.00 0.00 1.72 0.00 0.00 39.33 42.32 2h3z h ASP 102 CO 0.07 1.27 -0.53 0.50 -2.88 0.00 0.00 179.24 177.66 2h3z h LYS 103 N 0.03 0.85 -0.77 0.28 1.63 -0.95 -3.02 116.57 114.62 2h3z h LYS 103 Ca -0.24 -0.53 0.22 0.00 -0.85 0.00 0.00 60.65 59.25 2h3z h LYS 103 Cb 1.98 0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 33.64 2h3z h LYS 103 CO 0.12 1.16 0.56 0.97 -3.45 0.00 0.00 179.45 178.81 2h3z h ILE 104 N 0.65 0.60 0.00 2.00 6.09 -1.63 0.55 117.51 125.77 2h3z h ILE 104 Ca 0.02 0.00 -0.12 0.00 -1.37 0.00 0.00 64.86 63.39 2h3z h ILE 104 Cb 1.13 0.61 -0.02 0.00 0.47 0.00 0.00 36.82 39.02 2h3z h ILE 104 CO 0.12 0.00 -0.57 -0.33 -3.07 0.00 0.00 178.15 174.30 2h3z h GLU 105 N 0.00 0.00 0.14 2.19 5.08 -1.68 -3.11 114.58 117.19 2h3z h GLU 105 Ca 0.36 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.36 2h3z h GLU 105 Cb 1.48 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.72 2h3z h GLU 105 CO -0.00 0.57 -1.93 0.93 -1.00 0.00 0.00 179.01 177.57 2h3z h GLU 106 N 0.00 0.29 -0.68 2.33 5.08 -0.20 -3.35 114.58 118.05 2h3z h GLU 106 Ca -0.01 -0.50 0.19 0.00 -1.00 0.00 0.00 59.36 58.05 2h3z h GLU 106 Cb 1.05 0.19 -0.03 0.00 0.50 0.00 0.00 28.75 30.45 2h3z h GLU 106 CO 0.07 1.24 0.49 0.93 -1.00 0.00 0.00 179.01 180.74 2h3z h GLU 107 N 0.06 0.05 -0.14 2.33 4.39 -0.48 0.21 114.58 120.99 2h3z h GLU 107 Ca -0.41 -0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.33 2h3z h GLU 107 Cb 2.04 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 30.67 2h3z h GLU 107 CO 0.10 0.03 0.17 1.96 -1.16 0.00 0.00 179.01 180.12 2h3z h GLN 108 N 0.05 0.00 0.00 2.33 4.20 -1.68 0.29 115.11 120.31 2h3z h GLN 108 Ca 0.33 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.04 2h3z h GLN 108 Cb 1.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.01 2h3z h GLN 108 CO -0.02 0.00 0.00 -1.71 -0.67 0.00 0.00 178.83 176.43 2h3z n ASN 109 N -3.73 0.00 -2.71 1.46 2.85 0.73 -2.52 115.26 111.33 2h3z n ASN 109 Ca 0.01 -1.30 -0.19 0.00 -0.11 0.00 0.00 54.58 52.98 2h3z n ASN 109 Cb 0.29 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.31 2h3z n ASN 109 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2h3z n LYS 110 N -0.77 2.21 0.00 1.20 5.02 0.10 -4.81 118.16 121.11 2h3z n LYS 110 Ca 0.11 -3.93 0.00 0.00 -2.02 0.00 0.00 58.31 52.47 2h3z n LYS 110 Cb 0.05 -1.80 0.00 0.00 -0.02 0.00 0.00 35.03 33.26 2h3z n LYS 110 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2h3z n SER 111 N -0.18 0.00 -0.24 4.39 7.64 -1.23 -4.97 113.62 119.03 2h3z n SER 111 Ca 0.25 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.13 2h3z n SER 111 Cb 0.68 0.00 0.07 0.00 -1.01 0.00 0.00 64.21 63.96 2h3z n SER 111 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2h3z h LYS 112 N 0.00 -0.00 -0.10 1.43 1.57 -1.80 0.54 116.57 118.20 2h3z h LYS 112 Ca 0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 2h3z h LYS 112 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2h3z h LYS 112 CO 0.00 -0.00 -0.30 1.57 -0.57 0.00 0.00 179.45 180.15 2h3z h LYS 113 N -0.00 0.19 -0.96 3.15 2.10 -1.89 -2.57 116.57 116.58 2h3z h LYS 113 Ca 0.33 -0.07 -0.49 0.00 -2.00 0.00 0.00 60.65 58.42 2h3z h LYS 113 Cb 0.51 -0.01 -0.29 0.00 -0.90 0.00 0.00 32.23 31.53 2h3z h LYS 113 CO -0.71 0.47 0.61 1.17 -2.00 0.00 0.00 179.45 178.99 2h3z n LYS 114 N -4.14 2.32 0.12 0.07 4.81 0.14 -4.47 118.16 117.02 2h3z n LYS 114 Ca -0.01 -3.02 -0.02 0.00 -0.87 0.00 0.00 58.31 54.38 2h3z n LYS 114 Cb 0.38 -2.17 0.20 0.00 0.02 0.00 0.00 35.03 33.46 2h3z n LYS 114 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2h3z h ALA 115 N 1.10 1.03 0.11 3.14 0.00 0.15 0.28 119.26 125.07 2h3z h ALA 115 Ca 0.60 -0.49 -0.26 0.00 0.00 0.00 0.00 54.91 54.76 2h3z h ALA 115 Cb 2.81 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 20.51 2h3z h ALA 115 CO 1.06 0.67 -1.19 1.96 0.00 0.00 0.00 179.25 181.75 2h3z h GLN 116 N 0.11 0.29 0.00 0.00 4.20 -1.83 -3.02 115.11 114.85 2h3z h GLN 116 Ca 0.00 -0.45 0.00 0.00 0.06 0.00 0.00 58.65 58.26 2h3z h GLN 116 Cb 0.96 0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.91 2h3z h GLN 116 CO 0.08 1.20 -0.10 1.96 -0.67 0.00 0.00 178.83 181.29 2h3z h GLN 117 N 0.10 0.00 0.06 1.46 1.08 -1.85 -3.39 115.11 112.57 2h3z h GLN 117 Ca -0.12 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.08 2h3z h GLN 117 Cb 1.90 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 29.31 2h3z h GLN 117 CO 0.20 0.00 -0.27 0.00 -0.95 0.00 0.00 178.83 177.80 2h3z h ALA 118 N -1.62 -0.79 0.00 3.87 0.00 -0.64 -3.04 119.26 117.04 2h3z h ALA 118 Ca 0.00 -0.06 -0.63 0.00 0.00 0.00 0.00 54.91 54.23 2h3z h ALA 118 Cb 0.10 0.68 0.01 0.00 0.00 0.00 0.00 17.79 18.59 2h3z h ALA 118 CO 0.00 -0.85 2.83 0.00 0.00 0.00 0.00 179.25 181.22 2h3z n ALA 119 N -2.70 4.82 0.14 0.00 0.00 -1.14 -3.64 120.51 117.99 2h3z n ALA 119 Ca -0.04 -3.29 0.00 0.00 0.00 0.00 0.00 53.44 50.10 2h3z n ALA 119 Cb 0.21 -3.46 0.00 0.00 0.00 0.00 0.00 19.45 16.20 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 5.97 0.00 -2.81 0.00 0.00 -1.15 -4.66 120.51 117.84 2h3z n ALA 120 Ca 0.53 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.54 2h3z n ALA 120 Cb 0.33 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.77 2h3z n ALA 120 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2h3z s ASP 121 N -1.75 6.85 0.63 0.00 2.15 -1.19 -4.99 116.67 118.38 2h3z s ASP 121 Ca 0.00 -2.47 0.04 0.00 0.43 0.00 0.00 52.55 50.55 2h3z s ASP 121 Cb 0.00 -2.46 0.09 0.00 -0.30 0.00 0.00 42.92 40.25 2h3z s ASP 121 CO 0.00 -1.01 0.87 0.42 -0.17 0.00 0.00 175.17 175.28 2h3z s THR 122 N 2.84 2.26 0.00 1.71 -4.23 -1.26 -5.00 115.64 111.96 2h3z s THR 122 Ca 0.43 -0.77 0.00 0.00 -1.18 0.00 0.00 61.69 60.17 2h3z s THR 122 Cb -0.01 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.33 2h3z s THR 122 CO -0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.67 2h3z n GLY 123 N -2.51 2.45 0.00 3.99 0.00 -1.26 -5.17 105.19 102.69 2h3z n GLY 123 Ca 0.14 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 0.00 -0.05 1.61 4.13 -1.26 -5.06 115.26 114.63 2h3z n ASN 124 Ca 0.00 -0.96 -0.04 0.00 1.68 0.00 0.00 54.58 55.27 2h3z n ASN 124 Cb 0.00 0.00 -0.10 0.00 -1.54 0.00 0.00 39.78 38.14 2h3z n ASN 124 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2h3z n ASN 125 N -2.87 2.01 -1.06 6.41 4.13 -1.26 -5.12 115.26 117.51 2h3z n ASN 125 Ca 0.00 0.00 0.11 0.00 1.68 0.00 0.00 54.58 56.37 2h3z n ASN 125 Cb 0.00 0.93 -0.03 0.00 -1.54 0.00 0.00 39.78 39.15 2h3z n ASN 125 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 2h3z n SER 126 N -2.36 -6.29 -2.97 6.41 2.88 -1.26 -4.99 113.62 105.03 2h3z n SER 126 Ca -0.17 0.90 -0.08 0.00 -1.33 0.00 0.00 58.87 58.20 2h3z n SER 126 Cb 0.80 -2.54 0.01 0.00 -0.75 0.00 0.00 64.21 61.73 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 -3.05 -2.01 -1.12 -1.46 6.02 -1.26 -4.94 117.38 109.56 2h3z n GLN 127 Ca 0.01 1.86 -0.12 0.00 -0.01 0.00 0.00 57.00 58.74 2h3z n GLN 127 Cb 0.38 -5.43 0.15 0.00 1.02 0.00 0.00 30.24 26.36 2h3z n GLN 127 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 2h3z n VAL 128 N -0.81 2.69 -2.67 5.09 0.24 -1.26 -4.97 118.33 116.64 2h3z n VAL 128 Ca 0.06 -3.05 -0.05 0.00 -2.04 0.00 0.00 64.34 59.26 2h3z n VAL 128 Cb 0.49 -0.57 0.01 0.00 -1.47 0.00 0.00 33.84 32.29 2h3z n VAL 128 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2h3z n SER 129 N -1.03 -7.02 0.28 -1.34 7.64 -1.26 -4.85 113.62 106.05 2h3z n SER 129 Ca 0.39 0.36 0.19 0.00 1.01 0.00 0.00 58.87 60.82 2h3z n SER 129 Cb 1.00 -4.71 1.01 0.00 -1.01 0.00 0.00 64.21 60.50 2h3z n SER 129 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2h3z h GLN 130 N 1.44 0.00 0.00 1.43 1.08 -2.03 -3.46 115.11 113.58 2h3z h GLN 130 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2h3z h GLN 130 Cb 0.87 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.30 2h3z h GLN 130 CO 0.19 0.00 0.00 0.09 -0.95 0.00 0.00 178.83 178.16 2h3z n ASN 131 N -2.83 0.00 0.00 1.46 3.02 -1.26 -5.15 115.26 110.50 2h3z n ASN 131 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.53 2h3z n ASN 131 Cb 0.07 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.24 2h3z n ASN 131 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64