#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h3z s ALA 3 N 0.00 0.70 -0.49 4.61 0.00 -1.26 -5.05 121.76 120.27 2h3z s ALA 3 Ca 0.00 -1.48 -0.32 0.00 0.00 0.00 0.00 51.96 50.16 2h3z s ALA 3 Cb 0.00 1.15 -0.12 0.00 0.00 0.00 0.00 23.12 24.15 2h3z s ALA 3 CO 0.00 -0.79 2.34 0.54 0.00 0.00 0.00 175.76 177.85 2h3z n ARG 4 N -0.55 0.92 -3.16 0.00 1.74 -1.26 -4.83 116.66 109.53 2h3z n ARG 4 Ca 0.01 0.18 -0.04 0.00 -0.77 0.00 0.00 57.85 57.22 2h3z n ARG 4 Cb 0.62 -2.59 0.02 0.00 -1.02 0.00 0.00 32.46 29.49 2h3z n ARG 4 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2h3z n ALA 5 N 11.63 -1.69 -2.47 7.54 0.00 -1.26 -5.18 120.51 129.08 2h3z n ALA 5 Ca 0.44 -0.85 -0.28 0.00 0.00 0.00 0.00 53.44 52.76 2h3z n ALA 5 Cb 0.29 0.57 -0.11 0.00 0.00 0.00 0.00 19.45 20.20 2h3z n ALA 5 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2h3z s SER 6 N -2.69 3.74 -0.11 0.00 0.15 -1.26 -5.06 113.70 108.47 2h3z s SER 6 Ca 0.15 -0.71 -0.24 0.00 0.70 0.00 0.00 55.95 55.84 2h3z s SER 6 Cb -0.03 -0.44 -0.21 0.00 -1.71 0.00 0.00 66.02 63.63 2h3z s SER 6 CO 0.06 0.13 0.74 0.58 1.20 0.00 0.00 173.24 175.96 2h3z h VAL 7 N 3.22 1.41 -3.60 4.45 2.07 -1.91 -3.46 116.25 118.42 2h3z h VAL 7 Ca -0.48 -1.89 -0.68 0.00 0.82 0.00 0.00 66.70 64.48 2h3z h VAL 7 Cb 1.19 2.58 -0.20 0.00 -1.52 0.00 0.00 31.29 33.34 2h3z h VAL 7 CO 0.48 0.45 -0.70 -0.76 0.02 0.00 0.00 177.57 177.06 2h3z s LEU 8 N -8.48 3.13 0.00 2.57 1.43 -1.26 -4.61 118.68 111.47 2h3z s LEU 8 Ca -0.15 -0.07 0.00 0.00 -1.03 0.00 0.00 54.13 52.88 2h3z s LEU 8 Cb -0.02 -1.69 0.00 0.00 0.03 0.00 0.00 46.19 44.51 2h3z s LEU 8 CO 0.57 0.32 0.00 -1.54 0.23 0.00 0.00 176.35 175.93 2h3z n SER 9 N 2.51 -0.52 0.35 2.29 3.41 -1.26 -4.57 113.62 115.83 2h3z n SER 9 Ca -0.18 -0.59 -0.14 0.00 -0.26 0.00 0.00 58.87 57.70 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 -0.26 -0.95 1.16 5.00 0.00 -2.00 0.22 103.07 106.25 2h3z h GLY 10 Ca 0.00 0.35 0.07 0.00 0.00 0.00 0.00 47.33 47.76 2h3z h GLY 10 CO 0.00 -0.34 0.38 -1.33 0.00 0.00 0.00 176.54 175.25 2h3z h GLY 11 N -0.99 0.63 1.31 4.60 0.00 -2.01 -1.68 103.07 104.92 2h3z h GLY 11 Ca -0.09 -0.19 -0.20 0.00 0.00 0.00 0.00 47.33 46.84 2h3z h GLY 11 CO 0.15 0.14 -0.68 0.83 0.00 0.00 0.00 176.54 176.98 2h3z h GLU 12 N 0.48 0.70 -0.11 4.80 5.08 -1.89 -3.08 114.58 120.55 2h3z h GLU 12 Ca 0.25 -0.52 0.03 0.00 -1.00 0.00 0.00 59.36 58.13 2h3z h GLU 12 Cb 0.38 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.68 2h3z h GLU 12 CO -0.07 1.14 -0.10 1.25 -1.00 0.00 0.00 179.01 180.22 2h3z h LEU 13 N 0.50 -0.32 0.45 1.33 5.85 0.39 0.29 115.31 123.80 2h3z h LEU 13 Ca -0.02 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 2h3z h LEU 13 Cb 1.28 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.45 2h3z h LEU 13 CO 0.14 -0.14 -0.44 0.44 -0.34 0.00 0.00 178.44 178.09 2h3z h ASP 14 N -0.12 -1.20 -0.81 1.25 5.19 -1.54 -2.25 116.42 116.93 2h3z h ASP 14 Ca 0.08 0.10 0.09 0.00 -0.62 0.00 0.00 57.03 56.68 2h3z h ASP 14 Cb 0.24 0.40 -0.07 0.00 0.18 0.00 0.00 39.33 40.07 2h3z h ASP 14 CO -0.19 -0.60 0.46 0.50 -3.12 0.00 0.00 179.24 176.30 2h3z h LYS 15 N -0.90 0.76 -0.67 3.56 1.63 -1.43 -1.70 116.57 117.81 2h3z h LYS 15 Ca -0.05 -0.05 0.13 0.00 -0.85 0.00 0.00 60.65 59.84 2h3z h LYS 15 Cb 0.79 -0.17 -0.10 0.00 -0.60 0.00 0.00 32.23 32.16 2h3z h LYS 15 CO -0.06 0.50 0.18 2.35 -3.45 0.00 0.00 179.45 178.97 2h3z h TRP 16 N 0.79 0.28 0.00 1.91 2.91 -0.01 0.50 115.95 122.33 2h3z h TRP 16 Ca 0.39 0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.45 2h3z h TRP 16 Cb 0.35 -0.02 0.00 0.00 -0.51 0.00 0.00 29.16 28.98 2h3z h TRP 16 CO -0.06 -0.03 0.00 0.93 -1.03 0.00 0.00 178.44 178.25 2h3z h GLU 17 N 0.30 0.00 -0.00 2.65 5.08 -0.75 -2.28 114.58 119.58 2h3z h GLU 17 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 2h3z h GLU 17 Cb 0.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.82 2h3z h GLU 17 CO -0.44 0.00 -0.22 1.63 -1.00 0.00 0.00 179.01 178.98 2h3z n LYS 18 N -2.65 0.26 -3.12 2.33 5.02 0.17 -4.05 118.16 116.12 2h3z n LYS 18 Ca 0.02 -0.10 -0.39 0.00 -2.02 0.00 0.00 58.31 55.81 2h3z n LYS 18 Cb 0.29 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.75 2h3z n LYS 18 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2h3z s ILE 19 N -2.81 4.77 -0.06 -0.18 1.01 -0.78 -4.94 121.20 118.20 2h3z s ILE 19 Ca 0.18 1.41 -0.12 0.00 0.00 0.00 0.00 60.65 62.12 2h3z s ILE 19 Cb 0.19 -4.01 -0.05 0.00 0.01 0.00 0.00 42.46 38.60 2h3z s ILE 19 CO 0.57 0.43 0.31 -0.13 0.00 0.00 0.00 174.94 176.12 2h3z s ARG 20 N -0.39 3.81 0.40 2.79 0.52 -1.25 0.00 118.95 124.83 2h3z s ARG 20 Ca 0.34 0.20 0.07 0.00 -0.52 0.00 0.00 55.73 55.81 2h3z s ARG 20 Cb -0.20 -3.24 0.83 0.00 0.52 0.00 0.00 34.95 32.87 2h3z s ARG 20 CO 0.20 0.66 2.04 -0.07 0.02 0.00 0.00 175.30 178.15 2h3z h LEU 21 N 5.05 0.52 -9.07 2.53 3.38 -1.38 -2.20 115.31 114.13 2h3z h LEU 21 Ca -0.51 -0.01 -0.48 0.00 0.09 0.00 0.00 57.88 56.96 2h3z h LEU 21 Cb 1.22 -0.13 -0.14 0.00 0.09 0.00 0.00 40.66 41.70 2h3z h LEU 21 CO 0.62 0.37 -0.69 -0.13 0.09 0.00 0.00 178.44 178.70 2h3z s ARG 22 N -5.54 1.49 0.28 1.13 0.52 -1.26 -3.98 118.95 111.59 2h3z s ARG 22 Ca -0.09 -1.73 0.06 0.00 -0.52 0.00 0.00 55.73 53.45 2h3z s ARG 22 Cb 0.18 -1.14 0.39 0.00 0.52 0.00 0.00 34.95 34.90 2h3z s ARG 22 CO 0.74 0.07 1.66 -1.00 0.02 0.00 0.00 175.30 176.79 2h3z h PRO 23 N 2.35 0.24 0.00 3.54 0.13 -1.93 -3.24 132.00 133.09 2h3z h PRO 23 Ca -0.39 -0.13 -0.01 0.00 -0.87 0.00 0.00 66.00 64.60 2h3z h PRO 23 Cb 1.23 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.34 2h3z h PRO 23 CO 0.66 0.66 -0.43 0.41 -0.23 0.00 0.00 178.00 179.06 2h3z n GLY 24 N -0.05 4.73 2.93 1.56 0.00 -1.26 -5.01 105.19 108.09 2h3z n GLY 24 Ca -0.02 -1.22 -0.18 0.00 0.00 0.00 0.00 46.02 44.60 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 -1.06 2.48 0.00 -0.02 0.00 -1.22 -5.05 105.19 100.32 2h3z n GLY 25 Ca 0.17 -2.24 0.00 0.00 0.00 0.00 0.00 46.02 43.95 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 -1.67 2.32 -2.51 1.61 3.00 -1.26 -4.88 118.16 114.77 2h3z n LYS 26 Ca 0.04 -0.18 -0.41 0.00 -0.00 0.00 0.00 58.31 57.75 2h3z n LYS 26 Cb 0.47 -0.62 -0.03 0.00 0.00 0.00 0.00 35.03 34.85 2h3z n LYS 26 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 2h3z s LYS 27 N -0.38 3.16 1.11 1.64 2.20 -1.26 -4.99 119.74 121.22 2h3z s LYS 27 Ca 0.00 -0.16 -0.17 0.00 -0.36 0.00 0.00 55.97 55.28 2h3z s LYS 27 Cb 0.00 -4.19 0.24 0.00 -1.51 0.00 0.00 37.83 32.38 2h3z s LYS 27 CO 0.00 -2.17 1.12 -0.65 -0.36 0.00 0.00 175.35 173.29 2h3z s GLN 28 N 5.80 -0.49 0.16 4.03 1.11 -1.26 -1.12 119.66 127.88 2h3z s GLN 28 Ca 0.38 0.08 -0.19 0.00 0.01 0.00 0.00 55.36 55.63 2h3z s GLN 28 Cb -0.08 -1.67 -0.07 0.00 -1.01 0.00 0.00 33.01 30.17 2h3z s GLN 28 CO 0.16 -3.26 0.65 0.71 0.01 0.00 0.00 175.29 173.56 2h3z s TYR 29 N -3.09 3.71 0.17 0.91 2.02 0.10 -4.62 117.35 116.56 2h3z s TYR 29 Ca 0.69 1.31 0.01 0.00 -0.37 0.00 0.00 57.07 58.71 2h3z s TYR 29 Cb -0.12 -2.54 -0.04 0.00 -0.40 0.00 0.00 41.96 38.85 2h3z s TYR 29 CO 0.56 0.45 0.03 0.15 -1.57 0.00 0.00 175.55 175.17 2h3z s LYS 30 N -1.63 1.08 0.39 -0.62 1.02 -1.26 -3.96 119.74 114.76 2h3z s LYS 30 Ca 0.37 -1.53 0.17 0.00 0.02 0.00 0.00 55.97 55.01 2h3z s LYS 30 Cb -0.18 -0.12 1.08 0.00 -0.52 0.00 0.00 37.83 38.09 2h3z s LYS 30 CO 0.21 -0.18 1.77 1.25 -0.92 0.00 0.00 175.35 177.48 2h3z h LEU 31 N 2.71 0.47 -0.55 3.17 5.85 -1.98 -0.47 115.31 124.52 2h3z h LEU 31 Ca -0.36 0.08 0.11 0.00 0.84 0.00 0.00 57.88 58.55 2h3z h LEU 31 Cb 1.21 0.01 -0.11 0.00 0.37 0.00 0.00 40.66 42.14 2h3z h LEU 31 CO 0.61 0.10 -0.17 0.11 -0.34 0.00 0.00 178.44 178.75 2h3z h LYS 32 N 0.42 -0.04 -0.49 1.25 1.57 -1.99 0.16 116.57 117.46 2h3z h LYS 32 Ca 0.59 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 59.39 2h3z h LYS 32 Cb 1.45 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.74 2h3z h LYS 32 CO -0.30 -0.02 0.32 0.45 -0.57 0.00 0.00 179.45 179.33 2h3z h HIS 33 N -0.04 0.58 0.00 -1.35 3.86 -1.49 -0.58 115.15 116.13 2h3z h HIS 33 Ca 0.26 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.48 2h3z h HIS 33 Cb 0.44 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.71 2h3z h HIS 33 CO -0.49 0.36 -0.00 0.82 0.86 0.00 0.00 177.93 179.48 2h3z h ILE 34 N 0.62 0.00 -1.24 2.45 2.04 -0.74 -3.19 117.51 117.45 2h3z h ILE 34 Ca 0.18 -0.00 0.37 0.00 1.00 0.00 0.00 64.86 66.41 2h3z h ILE 34 Cb -0.02 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 35.97 2h3z h ILE 34 CO -0.04 0.00 0.83 0.58 0.00 0.00 0.00 178.15 179.51 2h3z h VAL 35 N -0.00 0.32 0.33 1.67 2.07 -1.19 -0.28 116.25 119.17 2h3z h VAL 35 Ca -0.00 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.46 2h3z h VAL 35 Cb 0.00 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 29.87 2h3z h VAL 35 CO 0.00 0.03 -0.42 -0.25 0.02 0.00 0.00 177.57 176.95 2h3z h TRP 36 N 0.17 -1.16 -0.78 1.57 7.01 -1.18 -1.04 115.95 120.55 2h3z h TRP 36 Ca 0.70 0.01 0.11 0.00 2.11 0.00 0.00 58.89 61.82 2h3z h TRP 36 Cb 2.21 0.46 -0.05 0.00 -2.10 0.00 0.00 29.16 29.68 2h3z h TRP 36 CO -0.00 -0.56 0.51 0.00 -2.79 0.00 0.00 178.44 175.60 2h3z h ALA 37 N -0.42 1.84 -0.67 2.65 0.00 -1.04 -0.69 119.26 120.92 2h3z h ALA 37 Ca -0.02 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2h3z h ALA 37 Cb 0.73 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 2h3z h ALA 37 CO -0.12 -0.01 0.23 0.77 0.00 0.00 0.00 179.25 180.12 2h3z h SER 38 N 0.66 0.94 0.77 0.00 0.02 -1.06 -0.74 113.55 114.13 2h3z h SER 38 Ca 0.37 -0.15 -0.09 0.00 -0.84 0.00 0.00 61.79 61.07 2h3z h SER 38 Cb 0.53 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 2h3z h SER 38 CO -0.14 0.87 -0.45 0.03 -1.14 0.00 0.00 176.83 176.00 2h3z h ARG 39 N 0.98 0.00 0.00 3.45 3.08 0.12 -1.64 114.38 120.37 2h3z h ARG 39 Ca 0.22 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.13 2h3z h ARG 39 Cb 0.25 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 2h3z h ARG 39 CO -0.01 0.45 -0.69 1.49 -1.07 0.00 0.00 179.97 180.14 2h3z h GLU 40 N 0.00 0.00 0.11 0.04 4.57 -0.75 -3.18 114.58 115.36 2h3z h GLU 40 Ca -0.00 0.00 -0.29 0.00 -1.18 0.00 0.00 59.36 57.88 2h3z h GLU 40 Cb 0.95 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.53 2h3z h GLU 40 CO 0.06 0.63 -1.44 -0.07 -1.18 0.00 0.00 179.01 177.00 2h3z h LEU 41 N 0.00 0.35 -1.65 1.64 3.38 -0.98 -2.89 115.31 115.17 2h3z h LEU 41 Ca -0.02 -0.46 -0.01 0.00 0.09 0.00 0.00 57.88 57.49 2h3z h LEU 41 Cb 1.50 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 42.14 2h3z h LEU 41 CO 0.08 1.38 -0.04 1.05 0.09 0.00 0.00 178.44 180.99 2h3z h GLU 42 N 0.06 0.00 0.00 1.13 -0.00 -0.83 0.19 114.58 115.12 2h3z h GLU 42 Ca -0.20 0.00 -0.24 0.00 -0.00 0.00 0.00 59.36 58.91 2h3z h GLU 42 Cb 1.99 0.00 -0.04 0.00 -0.00 0.00 0.00 28.75 30.70 2h3z h GLU 42 CO 0.16 0.04 -1.70 -2.13 -0.00 0.00 0.00 179.01 175.38 2h3z n ARG 43 N -3.18 0.64 0.06 1.06 0.00 -1.20 -4.49 116.66 109.53 2h3z n ARG 43 Ca -0.00 0.20 -0.03 0.00 -0.00 0.00 0.00 57.85 58.02 2h3z n ARG 43 Cb 0.29 -1.75 -0.02 0.00 0.00 0.00 0.00 32.46 30.99 2h3z n ARG 43 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.63 178.37 2h3z h PHE 44 N 0.00 -0.20 0.00 -0.14 -1.00 -1.25 -3.48 116.94 110.87 2h3z h PHE 44 Ca -0.26 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.51 2h3z h PHE 44 Cb 1.83 0.07 0.00 0.00 3.61 0.00 0.00 35.95 41.46 2h3z h PHE 44 CO 0.00 -0.12 0.00 0.00 -1.61 0.00 0.00 178.31 176.58 2h3z n ALA 45 N -2.54 0.00 -2.44 2.45 0.00 -0.78 -5.11 120.51 112.09 2h3z n ALA 45 Ca -0.03 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.15 2h3z n ALA 45 Cb 0.08 0.00 -0.14 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 1.77 0.23 0.00 1.01 0.58 -5.03 120.40 118.96 2h3z s VAL 46 Ca 0.00 -1.20 -0.30 0.00 0.00 0.00 0.00 61.98 60.48 2h3z s VAL 46 Cb 0.00 -1.52 -0.09 0.00 0.00 0.00 0.00 36.38 34.77 2h3z s VAL 46 CO 0.00 0.28 0.96 0.20 0.00 0.00 0.00 175.10 176.54 2h3z s ASN 47 N -1.09 7.58 0.00 3.32 -0.87 -1.26 -2.23 114.94 120.39 2h3z s ASN 47 Ca 0.08 1.97 0.14 0.00 -1.57 0.00 0.00 52.86 53.49 2h3z s ASN 47 Cb -0.09 -2.61 0.68 0.00 -0.02 0.00 0.00 41.25 39.21 2h3z s ASN 47 CO 0.01 0.09 1.42 -0.81 -2.57 0.00 0.00 177.10 175.25 2h3z n PRO 48 N 1.62 0.12 0.16 -0.60 -0.04 -1.26 -2.57 135.00 132.43 2h3z n PRO 48 Ca -0.01 0.19 0.04 0.00 -0.04 0.00 0.00 63.50 63.68 2h3z n PRO 48 Cb 0.47 -1.50 0.12 0.00 -0.04 0.00 0.00 33.50 32.55 2h3z n PRO 48 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2h3z h GLY 49 N 2.43 0.00 2.00 0.55 0.00 -1.95 -3.17 103.07 102.92 2h3z h GLY 49 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 2h3z h GLY 49 CO 0.00 0.00 -0.02 1.41 0.00 0.00 0.00 176.54 177.93 2h3z h LEU 50 N 0.00 0.00 -0.05 3.11 3.38 -1.86 0.58 115.31 120.47 2h3z h LEU 50 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2h3z h LEU 50 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 2h3z h LEU 50 CO 0.06 0.02 0.00 0.18 0.09 0.00 0.00 178.44 178.78 2h3z n LEU 51 N -3.44 0.62 0.13 1.67 4.77 -1.20 -2.92 117.00 116.64 2h3z n LEU 51 Ca -0.03 0.57 -0.00 0.00 -0.03 0.00 0.00 56.01 56.52 2h3z n LEU 51 Cb 0.11 -0.38 0.14 0.00 -2.33 0.00 0.00 43.42 40.97 2h3z n LEU 51 CO 0.25 -0.17 0.47 -0.08 -1.33 0.00 0.00 177.39 176.52 2h3z h GLU 52 N 0.00 0.00 -5.27 3.23 4.81 -1.05 -3.43 114.58 112.87 2h3z h GLU 52 Ca 0.00 0.00 -0.66 0.00 -0.13 0.00 0.00 59.36 58.57 2h3z h GLU 52 Cb 0.65 0.00 -0.28 0.00 0.63 0.00 0.00 28.75 29.76 2h3z h GLU 52 CO 0.00 0.63 -0.77 0.95 -0.73 0.00 0.00 179.01 179.08 2h3z s THR 53 N -3.37 2.97 0.36 0.32 -4.23 -1.19 -4.90 115.64 105.60 2h3z s THR 53 Ca -0.00 -0.68 0.14 0.00 -1.18 0.00 0.00 61.69 59.97 2h3z s THR 53 Cb 0.11 -2.25 0.35 0.00 1.34 0.00 0.00 72.50 72.05 2h3z s THR 53 CO 0.75 0.52 1.74 0.28 -0.54 0.00 0.00 174.62 177.38 2h3z h SER 54 N 6.91 0.57 -0.88 3.99 0.02 -1.84 0.37 113.55 122.70 2h3z h SER 54 Ca -0.28 0.11 0.08 0.00 -0.84 0.00 0.00 61.79 60.87 2h3z h SER 54 Cb 1.21 0.03 -0.06 0.00 0.14 0.00 0.00 62.40 63.71 2h3z h SER 54 CO 0.56 0.09 0.57 -0.08 -1.14 0.00 0.00 176.83 176.83 2h3z h GLU 55 N 0.49 0.89 -0.23 3.45 4.81 -1.95 -1.89 114.58 120.16 2h3z h GLU 55 Ca 0.63 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.76 2h3z h GLU 55 Cb 1.38 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 2h3z h GLU 55 CO -0.40 0.59 -0.05 0.78 -0.73 0.00 0.00 179.01 179.21 2h3z h GLY 56 N 0.92 0.47 2.00 1.92 0.00 -0.32 -2.85 103.07 105.21 2h3z h GLY 56 Ca 0.39 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 47.33 2h3z h GLY 56 CO -0.16 0.35 -0.06 0.00 0.00 0.00 0.00 176.54 176.68 2h3z h ARG 58 N 0.00 0.76 0.00 0.00 2.43 -1.12 -1.98 114.38 114.48 2h3z h ARG 58 Ca -0.00 -0.28 -0.18 0.00 -0.81 0.00 0.00 59.98 58.71 2h3z h ARG 58 Cb 0.16 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 2h3z h ARG 58 CO 0.01 0.88 -0.85 0.37 -1.51 0.00 0.00 179.97 178.86 2h3z h GLN 59 N 0.68 0.03 0.03 0.20 5.75 -1.33 -2.90 115.11 117.57 2h3z h GLN 59 Ca 0.11 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.57 2h3z h GLN 59 Cb 0.65 0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.21 2h3z h GLN 59 CO 0.05 0.86 -0.01 0.82 -2.65 0.00 0.00 178.83 177.89 2h3z h ILE 60 N 0.02 1.27 -0.38 2.39 2.04 -1.26 -0.68 117.51 120.91 2h3z h ILE 60 Ca -0.02 -0.95 0.01 0.00 1.00 0.00 0.00 64.86 64.90 2h3z h ILE 60 Cb 1.49 1.90 -0.02 0.00 -0.74 0.00 0.00 36.82 39.45 2h3z h ILE 60 CO 0.11 0.24 0.25 -0.07 0.00 0.00 0.00 178.15 178.68 2h3z h LEU 61 N -0.46 0.42 -1.45 1.44 3.38 -1.45 0.24 115.31 117.44 2h3z h LEU 61 Ca -0.00 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 2h3z h LEU 61 Cb 0.43 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 2h3z h LEU 61 CO 0.01 0.30 -0.14 1.23 0.09 0.00 0.00 178.44 179.93 2h3z h GLY 62 N 0.50 0.00 0.76 0.83 0.00 -1.54 0.72 103.07 104.34 2h3z h GLY 62 Ca 0.14 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.26 2h3z h GLY 62 CO -0.04 0.00 -0.92 -1.61 0.00 0.00 0.00 176.54 173.98 2h3z h GLN 63 N 0.00 0.33 0.00 4.80 4.15 -0.36 -3.32 115.11 120.71 2h3z h GLN 63 Ca -0.00 -0.57 -0.09 0.00 0.77 0.00 0.00 58.65 58.76 2h3z h GLN 63 Cb 0.57 0.21 -0.01 0.00 0.21 0.00 0.00 27.48 28.46 2h3z h GLN 63 CO 0.02 1.27 -0.41 -0.07 -1.93 0.00 0.00 178.83 177.71 2h3z h LEU 64 N -0.30 0.00 -0.49 -2.39 3.38 -0.90 -3.36 115.31 111.24 2h3z h LEU 64 Ca -0.16 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.85 2h3z h LEU 64 Cb 1.72 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.41 2h3z h LEU 64 CO 0.17 0.41 -0.29 0.00 0.09 0.00 0.00 178.44 178.82 2h3z n GLN 65 N -3.26 -0.22 -0.04 1.13 1.13 0.24 0.04 117.38 116.40 2h3z n GLN 65 Ca 0.02 0.76 -0.13 0.00 -1.94 0.00 0.00 57.00 55.70 2h3z n GLN 65 Cb 0.66 -1.11 -0.08 0.00 0.11 0.00 0.00 30.24 29.81 2h3z n GLN 65 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 2h3z h PRO 66 N 0.00 0.21 0.00 -1.09 0.13 -1.80 -2.99 132.00 126.46 2h3z h PRO 66 Ca 0.08 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 2h3z h PRO 66 Cb 0.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.34 2h3z h PRO 66 CO -0.46 0.63 0.31 1.03 -0.23 0.00 0.00 178.00 179.28 2h3z h SER 67 N -0.21 0.00 0.36 1.44 0.87 -0.56 0.25 113.55 115.69 2h3z h SER 67 Ca 0.01 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.56 2h3z h SER 67 Cb 0.60 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.55 2h3z h SER 67 CO 0.02 0.00 -0.07 -0.07 -0.53 0.00 0.00 176.83 176.18 2h3z h LEU 68 N 0.00 0.00 -0.79 2.23 3.38 -0.34 -1.36 115.31 118.42 2h3z h LEU 68 Ca 0.00 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.12 2h3z h LEU 68 Cb 0.61 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.27 2h3z h LEU 68 CO 0.00 0.07 0.35 -0.61 0.09 0.00 0.00 178.44 178.34 2h3z h GLN 69 N 0.00 0.49 -0.56 1.13 4.15 -0.70 -3.09 115.11 116.53 2h3z h GLN 69 Ca -0.00 -0.03 -0.31 0.00 0.77 0.00 0.00 58.65 59.08 2h3z h GLN 69 Cb 0.27 -0.11 -0.41 0.00 0.21 0.00 0.00 27.48 27.44 2h3z h GLN 69 CO 0.01 0.32 -1.06 2.41 -1.93 0.00 0.00 178.83 178.58 2h3z n THR 70 N -4.96 1.50 -2.97 2.39 -1.04 -1.05 -5.09 114.28 103.06 2h3z n THR 70 Ca 0.16 -3.21 -0.40 0.00 -2.04 0.00 0.00 64.05 58.55 2h3z n THR 70 Cb 0.43 0.75 -0.05 0.00 -1.82 0.00 0.00 70.33 69.64 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 -3.71 2.75 0.12 3.41 0.00 -0.54 -4.76 107.32 104.59 2h3z s GLY 71 Ca 0.32 0.26 -0.02 0.00 0.00 0.00 0.00 44.72 45.28 2h3z s GLY 71 CO -0.02 1.18 0.10 -1.14 0.00 0.00 0.00 173.10 173.22 2h3z n SER 72 N 3.21 -1.31 0.25 1.64 3.41 -1.26 -4.47 113.62 115.10 2h3z n SER 72 Ca -0.01 -0.47 0.09 0.00 -0.26 0.00 0.00 58.87 58.21 2h3z n SER 72 Cb 0.51 -0.10 0.64 0.00 -0.26 0.00 0.00 64.21 65.00 2h3z n SER 72 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2h3z h GLU 73 N 0.00 0.00 0.06 4.33 4.11 -1.98 -0.27 114.58 120.83 2h3z h GLU 73 Ca -0.04 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.39 2h3z h GLU 73 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2h3z h GLU 73 CO 0.02 0.08 -0.03 0.93 0.07 0.00 0.00 179.01 180.09 2h3z h GLU 74 N 0.00 -0.08 -0.66 1.06 5.08 -1.99 -1.69 114.58 116.29 2h3z h GLU 74 Ca -0.00 0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 2h3z h GLU 74 Cb 0.16 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 2h3z h GLU 74 CO 0.01 0.40 0.09 1.25 -1.00 0.00 0.00 179.01 179.77 2h3z h LEU 75 N -0.61 1.07 0.53 1.33 6.46 -1.81 -2.48 115.31 119.80 2h3z h LEU 75 Ca -0.01 -0.27 -0.03 0.00 -0.12 0.00 0.00 57.88 57.46 2h3z h LEU 75 Cb 0.52 -0.28 0.01 0.00 -0.73 0.00 0.00 40.66 40.17 2h3z h LEU 75 CO 0.01 1.07 -0.26 -0.09 -0.62 0.00 0.00 178.44 178.55 2h3z h ARG 76 N 1.03 -0.69 -0.96 1.25 2.43 -1.10 -2.61 114.38 113.72 2h3z h ARG 76 Ca 0.20 0.05 0.17 0.00 -0.81 0.00 0.00 59.98 59.58 2h3z h ARG 76 Cb 0.46 0.16 -0.10 0.00 -0.42 0.00 0.00 29.97 30.07 2h3z h ARG 76 CO 0.02 -0.42 0.56 0.77 -1.51 0.00 0.00 179.97 179.39 2h3z h SER 77 N -0.80 0.73 0.40 -3.80 0.02 -1.29 -2.07 113.55 106.75 2h3z h SER 77 Ca -0.07 0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2h3z h SER 77 Cb 0.59 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 2h3z h SER 77 CO 0.12 0.29 -0.39 -0.07 -1.14 0.00 0.00 176.83 175.64 2h3z h LEU 78 N 0.76 -1.06 -0.90 5.07 -0.00 -1.24 -1.24 115.31 116.70 2h3z h LEU 78 Ca 0.53 0.09 0.21 0.00 -0.00 0.00 0.00 57.88 58.71 2h3z h LEU 78 Cb 0.76 0.35 -0.12 0.00 -0.00 0.00 0.00 40.66 41.66 2h3z h LEU 78 CO -0.36 -0.54 0.42 0.22 -0.00 0.00 0.00 178.44 178.18 2h3z h TYR 79 N -0.81 0.71 0.56 1.13 3.20 -1.01 0.24 116.97 120.98 2h3z h TYR 79 Ca -0.03 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 2h3z h TYR 79 Cb 0.72 -0.17 0.01 0.00 1.54 0.00 0.00 36.73 38.82 2h3z h TYR 79 CO -0.21 0.01 -0.27 -0.91 -1.64 0.00 0.00 178.16 175.14 2h3z h ASN 80 N 0.47 -0.63 -0.13 -2.11 -0.26 -1.02 -1.35 115.58 110.55 2h3z h ASN 80 Ca 0.55 0.02 0.05 0.00 -0.56 0.00 0.00 56.30 56.36 2h3z h ASN 80 Cb 0.99 0.16 -0.06 0.00 -1.06 0.00 0.00 38.32 38.36 2h3z h ASN 80 CO -0.49 -0.44 -0.29 0.74 -1.06 0.00 0.00 177.43 175.90 2h3z h THR 81 N -0.78 0.34 -1.00 2.81 2.02 -0.74 -1.10 112.91 114.46 2h3z h THR 81 Ca -0.08 0.00 0.22 0.00 0.77 0.00 0.00 66.41 67.33 2h3z h THR 81 Cb 0.57 0.34 -0.12 0.00 -1.74 0.00 0.00 68.15 67.20 2h3z h THR 81 CO 0.13 0.00 0.59 0.40 0.37 0.00 0.00 175.52 177.01 2h3z h ILE 82 N -0.36 0.60 -0.98 3.11 2.04 -0.59 0.20 117.51 121.53 2h3z h ILE 82 Ca 0.10 -0.22 0.13 0.00 1.00 0.00 0.00 64.86 65.86 2h3z h ILE 82 Cb 0.51 -0.10 -0.09 0.00 -0.74 0.00 0.00 36.82 36.40 2h3z h ILE 82 CO -0.33 0.12 0.61 0.00 0.00 0.00 0.00 178.15 178.54 2h3z h ALA 83 N 1.70 1.49 0.00 1.87 0.00 0.00 0.36 119.26 124.69 2h3z h ALA 83 Ca 0.62 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.56 2h3z h ALA 83 Cb 1.10 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2h3z h ALA 83 CO -0.44 0.17 -0.00 0.28 0.00 0.00 0.00 179.25 179.25 2h3z h VAL 84 N 0.94 1.39 -0.97 0.00 2.07 -0.55 -2.78 116.25 116.34 2h3z h VAL 84 Ca 0.50 -2.01 0.14 0.00 0.82 0.00 0.00 66.70 66.15 2h3z h VAL 84 Cb 0.53 2.61 -0.08 0.00 -1.52 0.00 0.00 31.29 32.83 2h3z h VAL 84 CO -0.28 0.47 0.61 0.25 0.02 0.00 0.00 177.57 178.63 2h3z h LEU 85 N -0.98 0.81 -0.13 2.57 5.85 -0.83 -0.62 115.31 121.97 2h3z h LEU 85 Ca -0.00 0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.73 2h3z h LEU 85 Cb 0.77 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.69 2h3z h LEU 85 CO 0.00 0.39 -0.09 0.22 -0.34 0.00 0.00 178.44 178.62 2h3z h TYR 86 N 0.84 0.35 -0.70 1.25 3.20 -0.40 -3.12 116.97 118.39 2h3z h TYR 86 Ca 0.50 -0.10 0.06 0.00 3.14 0.00 0.00 58.73 62.33 2h3z h TYR 86 Cb 0.66 -0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.79 2h3z h TYR 86 CO -0.00 0.67 0.39 0.00 -1.64 0.00 0.00 178.16 177.58 2h3z h VAL 88 N 0.72 0.74 -0.54 0.00 2.07 -1.11 0.26 116.25 118.39 2h3z h VAL 88 Ca 0.32 -0.16 -0.10 0.00 0.82 0.00 0.00 66.70 67.58 2h3z h VAL 88 Cb 0.20 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 2h3z h VAL 88 CO -0.19 0.09 -0.06 0.45 0.02 0.00 0.00 177.57 177.88 2h3z h HIS 89 N 0.47 1.06 0.00 1.57 -0.00 -1.31 -2.15 115.15 114.78 2h3z h HIS 89 Ca 0.36 -0.19 0.00 0.00 -0.00 0.00 0.00 60.37 60.54 2h3z h HIS 89 Cb 0.47 -0.27 0.00 0.00 -0.00 0.00 0.00 27.41 27.61 2h3z h HIS 89 CO -0.15 0.97 0.00 0.94 -0.00 0.00 0.00 177.93 179.69 2h3z n GLN 90 N -4.17 0.64 -0.70 2.45 7.27 -0.55 -4.78 117.38 117.54 2h3z n GLN 90 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.09 2h3z n GLN 90 Cb 0.36 -1.30 0.00 0.00 2.41 0.00 0.00 30.24 31.71 2h3z n GLN 90 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 2h3z n ARG 91 N -0.80 0.00 -2.58 3.69 0.00 -0.81 -5.02 116.66 111.14 2h3z n ARG 91 Ca 0.09 0.00 -0.42 0.00 -0.00 0.00 0.00 57.85 57.52 2h3z n ARG 91 Cb 0.04 -1.82 -0.03 0.00 0.00 0.00 0.00 32.46 30.65 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 -3.11 4.50 -0.63 5.15 1.01 0.82 -4.96 121.20 123.98 2h3z s ILE 92 Ca 0.00 1.79 0.01 0.00 0.00 0.00 0.00 60.65 62.45 2h3z s ILE 92 Cb 0.00 -4.15 0.39 0.00 0.01 0.00 0.00 42.46 38.72 2h3z s ILE 92 CO 0.00 0.14 1.61 0.47 0.00 0.00 0.00 174.94 177.16 2h3z n ASP 93 N 3.92 6.27 -3.31 3.58 8.00 -1.26 -3.20 116.55 130.56 2h3z n ASP 93 Ca 0.07 -3.78 -0.41 0.00 0.71 0.00 0.00 54.79 51.38 2h3z n ASP 93 Cb 0.49 -0.77 -0.05 0.00 -0.02 0.00 0.00 41.12 40.77 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 -0.56 0.41 0.24 2.53 0.24 -1.26 -4.79 118.33 115.14 2h3z n VAL 94 Ca 0.48 -0.10 0.10 0.00 -2.04 0.00 0.00 64.34 62.78 2h3z n VAL 94 Cb 0.49 0.00 0.61 0.00 -1.47 0.00 0.00 33.84 33.48 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 1.82 0.00 -2.68 7.34 3.64 -1.96 -3.45 116.57 121.27 2h3z h LYS 95 Ca -0.33 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.14 2h3z h LYS 95 Cb 1.06 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.79 2h3z h LYS 95 CO 0.46 0.18 0.35 0.16 -2.27 0.00 0.00 179.45 178.33 2h3z s ASP 96 N -6.34 -0.30 0.26 4.20 1.47 -1.26 -3.89 116.67 110.80 2h3z s ASP 96 Ca -0.02 -0.35 0.17 0.00 1.18 0.00 0.00 52.55 53.53 2h3z s ASP 96 Cb 0.13 0.58 0.91 0.00 -0.34 0.00 0.00 42.92 44.20 2h3z s ASP 96 CO 0.62 -1.03 1.51 0.41 0.68 0.00 0.00 175.17 177.36 2h3z n THR 97 N -0.42 1.21 0.01 2.11 -1.04 -0.83 -2.27 114.28 113.06 2h3z n THR 97 Ca -0.08 0.69 -0.07 0.00 -2.04 0.00 0.00 64.05 62.55 2h3z n THR 97 Cb 0.61 -1.69 -0.06 0.00 -1.82 0.00 0.00 70.33 67.37 2h3z n THR 97 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 2h3z h LYS 98 N 0.00 -0.14 0.00 -2.82 1.63 -1.86 -3.02 116.57 110.36 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 0.03 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.69 2h3z h LYS 98 CO 0.00 0.21 0.00 0.93 -3.45 0.00 0.00 179.45 177.14 2h3z h GLU 99 N -0.98 0.00 -0.01 1.90 4.39 -1.86 -2.45 114.58 115.57 2h3z h GLU 99 Ca -0.02 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.65 2h3z h GLU 99 Cb 0.42 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 2h3z h GLU 99 CO 0.03 0.00 -0.14 0.00 -1.16 0.00 0.00 179.01 177.73 2h3z h ALA 100 N 2.01 0.04 -0.55 3.43 0.00 -1.54 -3.06 119.26 119.59 2h3z h ALA 100 Ca 0.00 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 2h3z h ALA 100 Cb 0.10 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2h3z h ALA 100 CO 0.00 -0.01 0.28 1.25 0.00 0.00 0.00 179.25 180.77 2h3z h LEU 101 N -0.53 0.69 -1.20 0.00 7.12 -1.31 -2.00 115.31 118.08 2h3z h LEU 101 Ca -0.01 -0.06 -0.04 0.00 0.13 0.00 0.00 57.88 57.90 2h3z h LEU 101 Cb 0.85 -0.17 -0.02 0.00 -0.53 0.00 0.00 40.66 40.79 2h3z h LEU 101 CO 0.03 0.58 0.16 -0.78 -0.13 0.00 0.00 178.44 178.29 2h3z h ASP 102 N 0.77 0.66 0.81 1.25 3.58 -1.55 -1.81 116.42 120.12 2h3z h ASP 102 Ca 0.19 -0.09 -0.07 0.00 0.42 0.00 0.00 57.03 57.49 2h3z h ASP 102 Cb 0.06 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 40.93 2h3z h ASP 102 CO -0.03 0.62 -0.31 0.11 -2.88 0.00 0.00 179.24 176.75 2h3z h LYS 103 N 0.70 0.00 -0.03 0.28 1.79 -1.26 -1.05 116.57 117.00 2h3z h LYS 103 Ca 0.16 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.49 2h3z h LYS 103 Cb 0.20 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 2h3z h LYS 103 CO -0.01 0.31 -0.66 0.82 -1.08 0.00 0.00 179.45 178.83 2h3z h ILE 104 N 0.00 1.43 0.02 1.86 1.08 -1.04 -2.80 117.51 118.07 2h3z h ILE 104 Ca -0.00 -2.17 -0.16 0.00 -0.39 0.00 0.00 64.86 62.14 2h3z h ILE 104 Cb 0.80 2.15 -0.02 0.00 -3.07 0.00 0.00 36.82 36.69 2h3z h ILE 104 CO 0.04 0.63 -0.84 -0.08 -0.69 0.00 0.00 178.15 177.21 2h3z h GLU 105 N 0.09 0.05 -0.83 2.37 4.22 -1.29 -3.35 114.58 115.84 2h3z h GLU 105 Ca -0.01 -0.08 0.18 0.00 0.08 0.00 0.00 59.36 59.53 2h3z h GLU 105 Cb 1.18 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.40 2h3z h GLU 105 CO 0.10 1.04 0.56 1.49 -2.18 0.00 0.00 179.01 180.01 2h3z h GLU 106 N -0.87 0.37 -0.97 1.92 4.81 -1.29 0.48 114.58 119.03 2h3z h GLU 106 Ca -0.22 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.00 2h3z h GLU 106 Cb 1.28 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 30.53 2h3z h GLU 106 CO -0.09 0.25 0.64 1.49 -0.73 0.00 0.00 179.01 180.57 2h3z h GLU 107 N 0.38 1.27 -0.12 1.92 4.81 -1.63 -1.10 114.58 120.12 2h3z h GLU 107 Ca 0.42 -0.08 -0.16 0.00 -0.13 0.00 0.00 59.36 59.42 2h3z h GLU 107 Cb 1.06 -0.29 0.01 0.00 0.63 0.00 0.00 28.75 30.16 2h3z h GLU 107 CO -0.14 0.84 -0.55 0.37 -0.73 0.00 0.00 179.01 178.80 2h3z h GLN 108 N 1.30 0.58 -0.69 1.92 5.75 -1.07 -3.20 115.11 119.70 2h3z h GLN 108 Ca 0.36 -0.47 0.04 0.00 -0.15 0.00 0.00 58.65 58.43 2h3z h GLN 108 Cb -0.13 0.10 -0.04 0.00 1.07 0.00 0.00 27.48 28.47 2h3z h GLN 108 CO -0.08 1.09 0.45 -0.97 -2.65 0.00 0.00 178.83 176.67 2h3z h ASN 109 N 0.20 0.70 0.13 -0.69 -1.24 -1.05 0.10 115.58 113.74 2h3z h ASN 109 Ca -0.04 -0.01 -0.00 0.00 0.71 0.00 0.00 56.30 56.96 2h3z h ASN 109 Cb 1.19 -0.16 -0.00 0.00 0.73 0.00 0.00 38.32 40.08 2h3z h ASN 109 CO 0.11 0.48 -0.02 0.50 -1.29 0.00 0.00 177.43 177.22 2h3z h LYS 110 N 0.81 0.00 -0.31 6.67 3.64 -1.20 -0.48 116.57 125.70 2h3z h LYS 110 Ca 0.28 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 2h3z h LYS 110 Cb 0.09 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 2h3z h LYS 110 CO -0.08 0.02 0.00 0.43 -2.27 0.00 0.00 179.45 177.55 2h3z n SER 111 N -3.40 3.26 0.06 4.20 7.64 -0.05 -4.54 113.62 120.80 2h3z n SER 111 Ca -0.03 -2.37 -0.15 0.00 1.01 0.00 0.00 58.87 57.33 2h3z n SER 111 Cb 0.11 -0.34 -0.06 0.00 -1.01 0.00 0.00 64.21 62.91 2h3z n SER 111 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 2h3z h LYS 112 N 1.90 0.47 -0.70 1.43 3.64 -0.35 0.32 116.57 123.28 2h3z h LYS 112 Ca 0.00 -0.52 0.18 0.00 -1.27 0.00 0.00 60.65 59.05 2h3z h LYS 112 Cb 0.99 0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.92 2h3z h LYS 112 CO 0.08 1.16 0.49 -0.22 -2.27 0.00 0.00 179.45 178.70 2h3z h LYS 113 N 0.26 0.12 0.00 1.90 1.63 -1.80 -3.16 116.57 115.53 2h3z h LYS 113 Ca -0.09 -0.01 -0.27 0.00 -0.85 0.00 0.00 60.65 59.42 2h3z h LYS 113 Cb 1.62 -0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 33.19 2h3z h LYS 113 CO 0.17 0.08 -1.86 1.63 -3.45 0.00 0.00 179.45 176.03 2h3z n LYS 114 N -4.39 0.45 -3.04 1.90 4.76 -1.21 -5.06 118.16 111.57 2h3z n LYS 114 Ca 0.14 0.19 -0.09 0.00 -2.87 0.00 0.00 58.31 55.68 2h3z n LYS 114 Cb 0.69 -1.26 0.04 0.00 -1.84 0.00 0.00 35.03 32.66 2h3z n LYS 114 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2h3z n ALA 115 N -4.04 -2.35 -0.08 7.82 0.00 0.11 -4.99 120.51 116.98 2h3z n ALA 115 Ca -0.35 0.09 -0.17 0.00 0.00 0.00 0.00 53.44 53.01 2h3z n ALA 115 Cb 0.70 -4.06 -0.06 0.00 0.00 0.00 0.00 19.45 16.04 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 -2.63 0.40 0.20 0.00 0.00 -1.26 -4.59 117.38 109.49 2h3z n GLN 116 Ca -0.04 0.17 0.05 0.00 -0.00 0.00 0.00 57.00 57.18 2h3z n GLN 116 Cb 0.57 -1.18 0.40 0.00 0.00 0.00 0.00 30.24 30.03 2h3z n GLN 116 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.06 179.02 2h3z h GLN 117 N -0.70 0.00 -1.00 3.69 1.08 -1.94 -3.03 115.11 113.21 2h3z h GLN 117 Ca -0.36 0.00 0.20 0.00 -1.45 0.00 0.00 58.65 57.04 2h3z h GLN 117 Cb 1.23 0.00 -0.10 0.00 -0.05 0.00 0.00 27.48 28.55 2h3z h GLN 117 CO -0.22 0.35 0.61 0.00 -0.95 0.00 0.00 178.83 178.63 2h3z h ALA 118 N 1.65 1.79 -3.02 3.87 0.00 -1.92 -3.42 119.26 118.21 2h3z h ALA 118 Ca -0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2h3z h ALA 118 Cb 0.75 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2h3z h ALA 118 CO 0.05 -0.16 0.00 0.00 0.00 0.00 0.00 179.25 179.13 2h3z n ALA 119 N -2.36 0.00 -1.80 0.00 0.00 -1.15 -4.48 120.51 110.72 2h3z n ALA 119 Ca 0.23 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.54 2h3z n ALA 119 Cb 0.62 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.04 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 -3.00 -0.29 -2.12 0.00 0.00 -1.26 -4.91 120.51 108.94 2h3z n ALA 120 Ca 0.00 0.16 -0.23 0.00 0.00 0.00 0.00 53.44 53.37 2h3z n ALA 120 Cb 0.00 -1.51 0.02 0.00 0.00 0.00 0.00 19.45 17.96 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 -0.27 4.73 -4.50 0.00 -0.08 -1.26 -4.97 116.55 110.20 2h3z n ASP 121 Ca -0.14 -3.66 -0.43 0.00 -1.51 0.00 0.00 54.79 49.04 2h3z n ASP 121 Cb 0.52 -0.36 -0.01 0.00 2.34 0.00 0.00 41.12 43.60 2h3z n ASP 121 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 2h3z s THR 122 N -4.67 4.59 0.45 5.18 -4.23 -1.26 -4.98 115.64 110.73 2h3z s THR 122 Ca 0.49 -1.89 0.06 0.00 -1.18 0.00 0.00 61.69 59.18 2h3z s THR 122 Cb 0.41 -4.95 -0.02 0.00 1.34 0.00 0.00 72.50 69.27 2h3z s THR 122 CO 0.01 -1.72 0.24 -0.83 -0.54 0.00 0.00 174.62 171.79 2h3z s GLY 123 N 3.67 2.38 0.00 3.99 0.00 -1.26 -5.06 107.32 111.04 2h3z s GLY 123 Ca 0.42 -1.75 0.00 0.00 0.00 0.00 0.00 44.72 43.39 2h3z s GLY 123 CO -0.03 -1.91 0.00 1.16 0.00 0.00 0.00 173.10 172.32 2h3z n ASN 124 N -1.40 1.51 -4.25 1.64 0.23 -1.26 -5.09 115.26 106.64 2h3z n ASN 124 Ca -0.02 0.00 -0.31 0.00 -0.53 0.00 0.00 54.58 53.72 2h3z n ASN 124 Cb 0.64 0.00 0.20 0.00 -2.08 0.00 0.00 39.78 38.54 2h3z n ASN 124 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2h3z n ASN 125 N -2.38 -2.36 -3.02 0.53 3.02 -1.26 -4.27 115.26 105.52 2h3z n ASN 125 Ca 0.00 -0.19 -0.08 0.00 -0.03 0.00 0.00 54.58 54.29 2h3z n ASN 125 Cb 0.31 -1.00 0.04 0.00 -0.61 0.00 0.00 39.78 38.51 2h3z n ASN 125 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2h3z n SER 126 N -2.47 -6.72 -4.06 6.41 7.64 -1.26 -5.01 113.62 108.15 2h3z n SER 126 Ca 0.01 -0.39 -0.32 0.00 1.01 0.00 0.00 58.87 59.18 2h3z n SER 126 Cb 0.60 -4.87 -0.14 0.00 -1.01 0.00 0.00 64.21 58.78 2h3z n SER 126 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 2h3z s GLN 127 N -3.71 1.89 -0.13 1.43 0.74 -1.26 -5.08 119.66 113.54 2h3z s GLN 127 Ca 0.23 -1.64 -0.08 0.00 0.05 0.00 0.00 55.36 53.92 2h3z s GLN 127 Cb -0.03 -3.15 0.05 0.00 1.10 0.00 0.00 33.01 30.98 2h3z s GLN 127 CO 0.68 -0.80 0.33 0.54 -0.55 0.00 0.00 175.29 175.49 2h3z s VAL 128 N 1.03 -0.02 0.10 1.34 0.11 -1.26 -5.16 120.40 116.54 2h3z s VAL 128 Ca 0.03 0.09 -0.06 0.00 -2.93 0.00 0.00 61.98 59.11 2h3z s VAL 128 Cb -0.20 -0.49 0.02 0.00 -1.53 0.00 0.00 36.38 34.19 2h3z s VAL 128 CO -0.06 0.04 0.31 -0.24 -3.33 0.00 0.00 175.10 171.82 2h3z n SER 129 N 3.93 -0.71 -2.54 3.54 2.88 -1.26 -4.96 113.62 114.51 2h3z n SER 129 Ca -0.22 -1.44 -0.14 0.00 -1.33 0.00 0.00 58.87 55.74 2h3z n SER 129 Cb 0.55 1.16 -0.00 0.00 -0.75 0.00 0.00 64.21 65.17 2h3z n SER 129 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2h3z n GLN 130 N -0.21 -2.40 -1.60 -1.46 7.27 -1.26 -4.81 117.38 112.91 2h3z n GLN 130 Ca -0.02 0.60 -0.40 0.00 0.07 0.00 0.00 57.00 57.25 2h3z n GLN 130 Cb 0.20 -5.21 -0.03 0.00 2.41 0.00 0.00 30.24 27.61 2h3z n GLN 130 CO 0.00 0.00 0.00 -0.80 0.07 0.00 0.00 177.06 176.33 2h3z s ASN 131 N -2.11 4.99 0.00 1.69 -0.87 -1.26 -5.23 114.94 112.15 2h3z s ASN 131 Ca 0.04 1.49 0.27 0.00 -1.57 0.00 0.00 52.86 53.10 2h3z s ASN 131 Cb -0.02 -2.51 0.81 0.00 -0.02 0.00 0.00 41.25 39.51 2h3z s ASN 131 CO 0.05 -2.39 1.61 -1.22 -2.57 0.00 0.00 177.10 172.59