#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 1.42 -2.40 4.61 0.00 -1.26 -5.09 120.51 117.79 2h3z n ALA 3 Ca 0.00 -2.92 -0.21 0.00 0.00 0.00 0.00 53.44 50.31 2h3z n ALA 3 Cb 0.00 -0.96 -0.10 0.00 0.00 0.00 0.00 19.45 18.39 2h3z n ALA 3 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2h3z s ARG 4 N -1.17 1.49 -1.23 0.00 0.52 -1.26 -5.07 118.95 112.23 2h3z s ARG 4 Ca 0.35 -1.69 -0.12 0.00 -0.52 0.00 0.00 55.73 53.75 2h3z s ARG 4 Cb 0.25 -1.35 0.18 0.00 0.52 0.00 0.00 34.95 34.54 2h3z s ARG 4 CO -0.11 0.21 1.60 0.00 0.02 0.00 0.00 175.30 177.01 2h3z n ALA 5 N -0.50 4.47 -2.18 2.13 0.00 -1.26 -4.95 120.51 118.22 2h3z n ALA 5 Ca -0.07 -4.29 -0.11 0.00 0.00 0.00 0.00 53.44 48.97 2h3z n ALA 5 Cb 0.61 -3.00 -0.10 0.00 0.00 0.00 0.00 19.45 16.96 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 1.96 1.20 0.23 0.00 0.15 -1.26 -5.05 113.70 110.93 2h3z s SER 6 Ca 0.41 -1.02 -0.08 0.00 0.70 0.00 0.00 55.95 55.96 2h3z s SER 6 Cb 0.02 0.09 0.22 0.00 -1.71 0.00 0.00 66.02 64.64 2h3z s SER 6 CO 0.00 -0.46 1.89 0.58 1.20 0.00 0.00 173.24 176.45 2h3z h VAL 7 N 2.93 1.18 -4.00 4.45 2.07 -1.92 -3.43 116.25 117.53 2h3z h VAL 7 Ca -0.35 -0.38 -0.37 0.00 0.82 0.00 0.00 66.70 66.42 2h3z h VAL 7 Cb 1.17 -0.02 -0.26 0.00 -1.52 0.00 0.00 31.29 30.66 2h3z h VAL 7 CO 0.64 0.20 -0.77 -0.76 0.02 0.00 0.00 177.57 176.91 2h3z s LEU 8 N -10.15 2.11 0.37 2.57 1.43 -1.26 -4.64 118.68 109.10 2h3z s LEU 8 Ca -0.13 -0.31 -0.06 0.00 -1.03 0.00 0.00 54.13 52.61 2h3z s LEU 8 Cb 0.16 -0.40 -0.05 0.00 0.03 0.00 0.00 46.19 45.94 2h3z s LEU 8 CO 0.79 0.02 0.66 -0.94 0.23 0.00 0.00 176.35 177.10 2h3z s SER 9 N -0.73 6.40 0.23 2.29 1.04 -1.26 -4.69 113.70 116.98 2h3z s SER 9 Ca -0.00 0.83 0.04 0.00 0.48 0.00 0.00 55.95 57.30 2h3z s SER 9 Cb -0.06 -2.19 0.63 0.00 0.10 0.00 0.00 66.02 64.50 2h3z s SER 9 CO 0.00 -0.34 1.11 0.61 0.98 0.00 0.00 173.24 175.60 2h3z n GLY 10 N -1.44 -0.87 0.09 7.32 0.00 -1.26 0.80 105.19 109.84 2h3z n GLY 10 Ca -0.01 0.67 -0.13 0.00 0.00 0.00 0.00 46.02 46.55 2h3z n GLY 10 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2h3z h GLY 11 N 0.00 -0.14 1.14 -0.02 0.00 -2.02 -3.03 103.07 99.01 2h3z h GLY 11 Ca 0.46 0.05 -0.08 0.00 0.00 0.00 0.00 47.33 47.76 2h3z h GLY 11 CO -0.64 -0.05 0.05 0.83 0.00 0.00 0.00 176.54 176.73 2h3z h GLU 12 N -0.29 1.04 -0.91 4.80 5.08 0.04 -2.92 114.58 121.42 2h3z h GLU 12 Ca -0.01 -0.30 0.22 0.00 -1.00 0.00 0.00 59.36 58.27 2h3z h GLU 12 Cb 0.24 -0.11 -0.12 0.00 0.50 0.00 0.00 28.75 29.26 2h3z h GLU 12 CO 0.02 0.99 0.43 1.25 -1.00 0.00 0.00 179.01 180.70 2h3z h LEU 13 N 0.97 0.40 0.06 1.33 5.85 -0.18 -0.99 115.31 122.75 2h3z h LEU 13 Ca 0.18 0.15 0.01 0.00 0.84 0.00 0.00 57.88 59.06 2h3z h LEU 13 Cb 0.49 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 2h3z h LEU 13 CO 0.02 0.03 -0.36 -0.78 -0.34 0.00 0.00 178.44 177.01 2h3z h ASP 14 N 0.44 -1.08 -0.61 1.25 1.82 -1.39 0.12 116.42 116.98 2h3z h ASP 14 Ca 0.57 0.11 0.08 0.00 -0.39 0.00 0.00 57.03 57.40 2h3z h ASP 14 Cb 1.07 0.40 -0.06 0.00 0.68 0.00 0.00 39.33 41.42 2h3z h ASP 14 CO -0.51 -0.37 0.28 0.11 -1.61 0.00 0.00 179.24 177.14 2h3z h LYS 15 N -0.49 0.49 -0.28 0.28 1.57 -1.49 -2.08 116.57 114.56 2h3z h LYS 15 Ca -0.00 -0.03 0.06 0.00 -1.87 0.00 0.00 60.65 58.81 2h3z h LYS 15 Cb 0.50 -0.11 -0.06 0.00 0.08 0.00 0.00 32.23 32.64 2h3z h LYS 15 CO -0.20 0.33 -0.13 2.35 -0.57 0.00 0.00 179.45 181.22 2h3z h TRP 16 N 0.51 -0.32 0.00 -1.35 2.91 -0.69 0.17 115.95 117.17 2h3z h TRP 16 Ca 0.29 0.03 -0.00 0.00 1.13 0.00 0.00 58.89 60.34 2h3z h TRP 16 Cb 0.29 0.18 -0.00 0.00 -0.51 0.00 0.00 29.16 29.12 2h3z h TRP 16 CO -0.13 -0.20 -0.01 0.93 -1.03 0.00 0.00 178.44 178.01 2h3z h GLU 17 N -0.09 0.00 0.43 2.65 5.08 -0.19 -3.03 114.58 119.44 2h3z h GLU 17 Ca 0.15 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 2h3z h GLU 17 Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 2h3z h GLU 17 CO -0.34 0.01 -0.21 -0.22 -1.00 0.00 0.00 179.01 177.25 2h3z h LYS 18 N 0.00 -0.56 -6.39 2.33 3.64 -0.03 -3.31 116.57 112.25 2h3z h LYS 18 Ca -0.00 0.04 -0.60 0.00 -1.27 0.00 0.00 60.65 58.82 2h3z h LYS 18 Cb 0.14 0.13 0.14 0.00 -0.41 0.00 0.00 32.23 32.23 2h3z h LYS 18 CO 0.00 -0.37 -0.30 -0.89 -2.27 0.00 0.00 179.45 175.62 2h3z n ILE 19 N -4.88 1.94 -4.28 2.00 5.41 -0.92 -4.65 119.36 113.98 2h3z n ILE 19 Ca -0.07 -0.50 -0.27 0.00 1.00 0.00 0.00 62.75 62.91 2h3z n ILE 19 Cb 0.23 -0.65 -0.09 0.00 -0.71 0.00 0.00 39.64 38.41 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 -1.69 2.08 0.34 0.38 0.52 -1.26 -1.08 118.95 118.23 2h3z s ARG 20 Ca 0.64 -1.25 0.03 0.00 -0.52 0.00 0.00 55.73 54.63 2h3z s ARG 20 Cb -0.59 -2.18 0.63 0.00 0.52 0.00 0.00 34.95 33.33 2h3z s ARG 20 CO 0.57 0.44 1.96 -0.07 0.02 0.00 0.00 175.30 178.23 2h3z h LEU 21 N 2.93 0.77 -8.89 2.53 3.38 -1.65 -2.07 115.31 112.31 2h3z h LEU 21 Ca -0.47 -0.01 -0.45 0.00 0.09 0.00 0.00 57.88 57.04 2h3z h LEU 21 Cb 1.20 -0.17 -0.15 0.00 0.09 0.00 0.00 40.66 41.63 2h3z h LEU 21 CO 0.54 0.52 -0.74 -0.13 0.09 0.00 0.00 178.44 178.73 2h3z s ARG 22 N -5.77 1.32 0.22 1.13 0.52 -1.26 -3.95 118.95 111.16 2h3z s ARG 22 Ca -0.10 -1.57 -0.01 0.00 -0.52 0.00 0.00 55.73 53.52 2h3z s ARG 22 Cb 0.19 -1.14 0.22 0.00 0.52 0.00 0.00 34.95 34.74 2h3z s ARG 22 CO 0.78 0.19 1.59 -1.00 0.02 0.00 0.00 175.30 176.88 2h3z h PRO 23 N 2.61 0.53 -0.25 3.54 0.13 -1.89 -3.22 132.00 133.45 2h3z h PRO 23 Ca -0.38 -0.28 -0.13 0.00 -0.87 0.00 0.00 66.00 64.34 2h3z h PRO 23 Cb 1.22 0.01 -0.08 0.00 0.13 0.00 0.00 31.00 32.28 2h3z h PRO 23 CO 0.61 0.86 -0.23 0.41 -0.23 0.00 0.00 178.00 179.42 2h3z n GLY 24 N 0.02 5.02 3.95 1.56 0.00 -1.26 -5.02 105.19 109.46 2h3z n GLY 24 Ca -0.02 -1.28 -0.25 0.00 0.00 0.00 0.00 46.02 44.48 2h3z n GLY 24 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2h3z s GLY 25 N -2.78 2.18 0.00 -0.02 0.00 -1.22 -5.05 107.32 100.43 2h3z s GLY 25 Ca 0.43 -1.48 0.01 0.00 0.00 0.00 0.00 44.72 43.67 2h3z s GLY 25 CO -0.03 -1.89 0.19 1.17 0.00 0.00 0.00 173.10 172.55 2h3z n LYS 26 N -1.97 4.16 -2.72 2.90 4.81 -1.26 -4.92 118.16 119.16 2h3z n LYS 26 Ca 0.04 -0.19 -0.42 0.00 -0.87 0.00 0.00 58.31 56.87 2h3z n LYS 26 Cb 0.64 -0.69 -0.03 0.00 0.02 0.00 0.00 35.03 34.96 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 -0.71 3.31 0.91 1.64 2.20 -1.26 -5.02 119.74 120.81 2h3z s LYS 27 Ca 0.00 -0.22 -0.14 0.00 -0.36 0.00 0.00 55.97 55.25 2h3z s LYS 27 Cb 0.00 -4.10 0.16 0.00 -1.51 0.00 0.00 37.83 32.38 2h3z s LYS 27 CO 0.02 -1.72 1.26 -0.65 -0.36 0.00 0.00 175.35 173.89 2h3z s GLN 28 N 4.57 1.10 0.26 4.03 1.11 -1.26 -1.91 119.66 127.57 2h3z s GLN 28 Ca 0.33 -0.18 -0.23 0.00 0.01 0.00 0.00 55.36 55.30 2h3z s GLN 28 Cb -0.11 -1.88 -0.09 0.00 -1.01 0.00 0.00 33.01 29.92 2h3z s GLN 28 CO 0.18 -2.14 0.82 0.71 0.01 0.00 0.00 175.29 174.88 2h3z s TYR 29 N -3.72 3.68 0.19 0.91 2.02 -0.24 -4.68 117.35 115.50 2h3z s TYR 29 Ca 0.69 1.57 -0.01 0.00 -0.37 0.00 0.00 57.07 58.95 2h3z s TYR 29 Cb -0.07 -2.76 -0.04 0.00 -0.40 0.00 0.00 41.96 38.69 2h3z s TYR 29 CO 0.52 0.29 0.12 0.15 -1.57 0.00 0.00 175.55 175.05 2h3z s LYS 30 N -1.98 1.15 0.34 -0.62 1.02 -1.26 -4.03 119.74 114.37 2h3z s LYS 30 Ca 0.46 -1.59 0.10 0.00 0.02 0.00 0.00 55.97 54.96 2h3z s LYS 30 Cb -0.18 0.27 0.85 0.00 -0.52 0.00 0.00 37.83 38.25 2h3z s LYS 30 CO 0.22 -0.37 1.81 1.25 -0.92 0.00 0.00 175.35 177.34 2h3z h LEU 31 N 2.66 0.66 -0.57 3.17 7.12 -1.98 -1.59 115.31 124.78 2h3z h LEU 31 Ca -0.36 0.07 0.11 0.00 0.13 0.00 0.00 57.88 57.83 2h3z h LEU 31 Cb 1.24 -0.05 -0.11 0.00 -0.53 0.00 0.00 40.66 41.21 2h3z h LEU 31 CO 0.54 0.26 -0.26 0.11 -0.13 0.00 0.00 178.44 178.96 2h3z h LYS 32 N 0.66 -0.11 -0.22 1.25 1.79 -1.99 0.35 116.57 118.30 2h3z h LYS 32 Ca 0.53 0.01 0.03 0.00 -2.18 0.00 0.00 60.65 59.04 2h3z h LYS 32 Cb 0.96 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.63 2h3z h LYS 32 CO -0.30 -0.07 0.15 0.45 -1.08 0.00 0.00 179.45 178.60 2h3z h HIS 33 N -0.11 0.16 0.04 -1.35 3.86 -1.70 -0.00 115.15 116.04 2h3z h HIS 33 Ca 0.25 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.46 2h3z h HIS 33 Cb 0.51 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.93 2h3z h HIS 33 CO -0.56 0.09 -0.02 0.82 0.86 0.00 0.00 177.93 179.12 2h3z h ILE 34 N 0.16 0.00 -1.07 2.45 2.04 -0.37 -3.22 117.51 117.51 2h3z h ILE 34 Ca 0.09 -0.13 0.29 0.00 1.00 0.00 0.00 64.86 66.11 2h3z h ILE 34 Cb 0.18 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.18 2h3z h ILE 34 CO -0.02 0.00 0.72 0.58 0.00 0.00 0.00 178.15 179.43 2h3z h VAL 35 N -0.18 0.49 0.43 1.67 2.07 -1.15 -1.43 116.25 118.15 2h3z h VAL 35 Ca -0.01 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 2h3z h VAL 35 Cb 0.04 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.01 2h3z h VAL 35 CO 0.01 0.05 -0.48 -0.25 0.02 0.00 0.00 177.57 176.91 2h3z h TRP 36 N 0.25 -1.34 -0.57 1.57 7.01 -1.09 -1.82 115.95 119.96 2h3z h TRP 36 Ca 0.57 0.01 0.10 0.00 2.11 0.00 0.00 58.89 61.68 2h3z h TRP 36 Cb 1.74 0.53 -0.03 0.00 -2.10 0.00 0.00 29.16 29.29 2h3z h TRP 36 CO -0.00 -0.64 0.38 0.00 -2.79 0.00 0.00 178.44 175.39 2h3z h ALA 37 N -0.72 2.04 0.00 2.65 0.00 -1.27 0.22 119.26 122.18 2h3z h ALA 37 Ca -0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2h3z h ALA 37 Cb 0.83 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 2h3z h ALA 37 CO -0.09 -0.16 -0.07 0.77 0.00 0.00 0.00 179.25 179.70 2h3z h SER 38 N 0.37 0.00 1.10 0.00 0.02 -0.97 0.58 113.55 114.65 2h3z h SER 38 Ca 0.26 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 61.03 2h3z h SER 38 Cb 0.54 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.05 2h3z h SER 38 CO -0.07 0.07 -0.92 -0.09 -1.14 0.00 0.00 176.83 174.68 2h3z h ARG 39 N 0.00 0.00 0.19 3.45 2.43 -0.44 -3.02 114.38 116.98 2h3z h ARG 39 Ca -0.00 0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 58.86 2h3z h ARG 39 Cb 0.13 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 29.71 2h3z h ARG 39 CO 0.01 0.78 -1.36 1.49 -1.51 0.00 0.00 179.97 179.38 2h3z h GLU 40 N 0.00 0.50 -0.57 0.20 4.22 -1.00 -3.11 114.58 114.81 2h3z h GLU 40 Ca -0.04 -0.79 -0.09 0.00 0.08 0.00 0.00 59.36 58.53 2h3z h GLU 40 Cb 1.66 0.28 -0.02 0.00 0.50 0.00 0.00 28.75 31.17 2h3z h GLU 40 CO 0.10 1.37 0.01 -0.07 -2.18 0.00 0.00 179.01 178.24 2h3z h LEU 41 N 0.16 0.99 -1.74 1.64 3.38 -1.02 -0.63 115.31 118.09 2h3z h LEU 41 Ca -0.21 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.45 2h3z h LEU 41 Cb 2.05 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 42.53 2h3z h LEU 41 CO 0.25 1.05 -0.03 -0.08 0.09 0.00 0.00 178.44 179.72 2h3z h GLU 42 N 0.90 0.00 0.02 1.13 4.81 -1.24 0.15 114.58 120.35 2h3z h GLU 42 Ca 0.16 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 59.10 2h3z h GLU 42 Cb 0.54 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.87 2h3z h GLU 42 CO 0.03 0.03 -1.69 -0.09 -0.73 0.00 0.00 179.01 176.56 2h3z h ARG 43 N 0.00 0.04 0.27 1.92 2.43 -1.36 -3.40 114.38 114.28 2h3z h ARG 43 Ca -0.00 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 2h3z h ARG 43 Cb 0.43 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 2h3z h ARG 43 CO 0.00 0.62 -0.13 0.74 -1.51 0.00 0.00 179.97 179.70 2h3z h PHE 44 N 0.01 -0.33 0.00 2.20 -1.00 -0.79 -3.48 116.94 113.55 2h3z h PHE 44 Ca -0.28 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.49 2h3z h PHE 44 Cb 2.00 0.11 0.00 0.00 3.61 0.00 0.00 35.95 41.67 2h3z h PHE 44 CO 0.01 -0.21 0.00 0.00 -1.61 0.00 0.00 178.31 176.50 2h3z n ALA 45 N -2.53 0.00 -2.38 2.45 0.00 -0.85 -5.11 120.51 112.10 2h3z n ALA 45 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.09 2h3z n ALA 45 Cb 0.14 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.45 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 2.31 0.26 0.00 1.01 0.48 -5.02 120.40 119.45 2h3z s VAL 46 Ca 0.00 -1.42 -0.29 0.00 0.00 0.00 0.00 61.98 60.27 2h3z s VAL 46 Cb 0.00 -1.94 -0.09 0.00 0.00 0.00 0.00 36.38 34.35 2h3z s VAL 46 CO 0.00 0.30 0.96 0.20 0.00 0.00 0.00 175.10 176.57 2h3z s ASN 47 N -1.46 7.52 0.41 3.32 0.01 -1.26 -1.90 114.94 121.58 2h3z s ASN 47 Ca 0.13 1.97 0.29 0.00 -0.71 0.00 0.00 52.86 54.54 2h3z s ASN 47 Cb -0.10 -2.61 1.20 0.00 0.41 0.00 0.00 41.25 40.16 2h3z s ASN 47 CO 0.04 0.06 1.86 1.55 -1.51 0.00 0.00 177.10 179.10 2h3z h PRO 48 N 3.88 0.00 0.00 -0.60 0.13 -1.90 -2.84 132.00 130.68 2h3z h PRO 48 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2h3z h PRO 48 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2h3z h PRO 48 CO 0.67 0.00 0.00 0.78 -0.23 0.00 0.00 178.00 179.22 2h3z h GLY 49 N 2.07 0.00 2.00 1.56 0.00 -1.95 -2.65 103.07 104.10 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 0.00 1.41 0.00 0.00 0.00 176.54 177.95 2h3z h LEU 50 N 0.00 0.00 -0.01 3.11 3.38 -1.88 0.02 115.31 119.93 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 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2h3z h LEU 50 CO 0.00 0.00 -0.07 0.18 0.09 0.00 0.00 178.44 178.64 2h3z n LEU 51 N -2.55 0.08 -1.83 1.67 4.77 -1.00 -3.13 117.00 115.00 2h3z n LEU 51 Ca -0.01 0.40 -0.09 0.00 -0.03 0.00 0.00 56.01 56.28 2h3z n LEU 51 Cb 0.11 -0.44 0.22 0.00 -2.33 0.00 0.00 43.42 40.99 2h3z n LEU 51 CO 0.16 0.02 0.97 1.21 -1.33 0.00 0.00 177.39 178.42 2h3z n GLU 52 N -1.46 2.93 -3.42 3.23 2.13 -0.01 -4.75 120.64 119.30 2h3z n GLU 52 Ca 0.08 -2.47 0.01 0.00 0.66 0.00 0.00 57.16 55.44 2h3z n GLU 52 Cb 0.33 -2.02 -0.03 0.00 0.27 0.00 0.00 31.44 29.98 2h3z n GLU 52 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2h3z s THR 53 N -2.55 -0.90 0.32 6.31 -4.23 -1.21 -5.03 115.64 108.34 2h3z s THR 53 Ca 0.45 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 61.05 2h3z s THR 53 Cb 0.36 -1.00 0.31 0.00 1.34 0.00 0.00 72.50 73.52 2h3z s THR 53 CO 0.11 0.00 1.70 -1.28 -0.54 0.00 0.00 174.62 174.61 2h3z h SER 54 N 7.94 0.54 -0.36 3.99 0.87 -1.86 0.71 113.55 125.38 2h3z h SER 54 Ca -0.19 0.16 0.03 0.00 -1.23 0.00 0.00 61.79 60.56 2h3z h SER 54 Cb 1.13 0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 63.15 2h3z h SER 54 CO 0.14 0.01 0.24 -0.08 -0.53 0.00 0.00 176.83 176.61 2h3z h GLU 55 N 0.47 0.35 0.16 2.24 4.57 -1.96 -2.39 114.58 118.03 2h3z h GLU 55 Ca 0.65 -0.02 -0.31 0.00 -1.18 0.00 0.00 59.36 58.50 2h3z h GLU 55 Cb 1.30 -0.08 0.03 0.00 -0.16 0.00 0.00 28.75 29.84 2h3z h GLU 55 CO -0.53 0.23 -1.30 0.78 -1.18 0.00 0.00 179.01 177.01 2h3z h GLY 56 N 0.36 0.67 1.81 1.92 0.00 0.24 -3.25 103.07 104.82 2h3z h GLY 56 Ca 0.15 -1.49 0.02 0.00 0.00 0.00 0.00 47.33 46.01 2h3z h GLY 56 CO -0.03 1.31 0.07 0.00 0.00 0.00 0.00 176.54 177.89 2h3z h ARG 58 N 0.00 0.87 -0.49 0.00 2.43 -1.50 -2.97 114.38 112.72 2h3z h ARG 58 Ca 0.04 -0.57 -0.11 0.00 -0.81 0.00 0.00 59.98 58.53 2h3z h ARG 58 Cb 0.18 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 2h3z h ARG 58 CO -0.00 1.20 -0.14 0.37 -1.51 0.00 0.00 179.97 179.89 2h3z h GLN 59 N 0.66 0.93 0.31 0.20 4.15 -1.32 -2.41 115.11 117.63 2h3z h GLN 59 Ca 0.01 -0.35 -0.01 0.00 0.77 0.00 0.00 58.65 59.07 2h3z h GLN 59 Cb 1.19 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.81 2h3z h GLN 59 CO 0.13 1.01 -0.22 0.82 -1.93 0.00 0.00 178.83 178.63 2h3z h ILE 60 N 0.83 0.53 -0.98 2.39 2.04 -1.41 -2.16 117.51 118.75 2h3z h ILE 60 Ca 0.13 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.03 2h3z h ILE 60 Cb 0.68 0.53 -0.06 0.00 -0.74 0.00 0.00 36.82 37.24 2h3z h ILE 60 CO 0.05 0.00 0.64 -0.07 0.00 0.00 0.00 178.15 178.77 2h3z h LEU 61 N -0.53 1.06 -2.40 1.44 3.38 -1.51 -0.49 115.31 116.25 2h3z h LEU 61 Ca -0.03 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2h3z h LEU 61 Cb 0.45 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 2h3z h LEU 61 CO 0.01 0.72 -0.01 1.23 0.09 0.00 0.00 178.44 180.48 2h3z h GLY 62 N 1.22 0.00 0.00 0.83 0.00 -1.07 0.20 103.07 104.25 2h3z h GLY 62 Ca 0.39 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.64 2h3z h GLY 62 CO -0.13 0.00 -0.48 1.46 0.00 0.00 0.00 176.54 177.39 2h3z h GLN 63 N 0.00 0.00 -0.11 4.80 4.20 -0.46 -3.36 115.11 120.18 2h3z h GLN 63 Ca -0.00 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.60 2h3z h GLN 63 Cb 0.19 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 2h3z h GLN 63 CO 0.00 0.85 -0.44 -0.07 -0.67 0.00 0.00 178.83 178.51 2h3z h LEU 64 N -1.00 0.26 -0.34 1.46 3.38 -1.30 -3.20 115.31 114.57 2h3z h LEU 64 Ca -0.13 -0.12 0.04 0.00 0.09 0.00 0.00 57.88 57.77 2h3z h LEU 64 Cb 0.99 -0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.60 2h3z h LEU 64 CO -0.08 0.67 -0.45 1.56 0.09 0.00 0.00 178.44 180.24 2h3z h GLN 65 N 0.21 -0.30 0.00 1.13 4.20 -0.77 0.54 115.11 120.12 2h3z h GLN 65 Ca 0.02 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2h3z h GLN 65 Cb 0.86 0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.71 2h3z h GLN 65 CO 0.07 -0.20 0.00 -0.35 -0.67 0.00 0.00 178.83 177.68 2h3z n PRO 66 N -4.85 0.29 0.00 1.46 -0.04 -1.23 -1.81 135.00 128.82 2h3z n PRO 66 Ca -0.03 0.10 0.07 0.00 -0.04 0.00 0.00 63.50 63.60 2h3z n PRO 66 Cb 0.27 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.26 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 -1.20 1.77 -0.10 3.54 7.64 0.13 -4.49 113.62 120.91 2h3z n SER 67 Ca 0.08 -1.38 -0.02 0.00 1.01 0.00 0.00 58.87 58.56 2h3z n SER 67 Cb 0.10 0.27 0.22 0.00 -1.01 0.00 0.00 64.21 63.79 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 2.06 0.71 -0.74 -3.43 3.38 0.63 0.25 115.31 118.18 2h3z h LEU 68 Ca 0.00 -0.12 0.16 0.00 0.09 0.00 0.00 57.88 58.01 2h3z h LEU 68 Cb 0.52 -0.19 -0.11 0.00 0.09 0.00 0.00 40.66 40.98 2h3z h LEU 68 CO 0.00 0.71 0.21 -0.61 0.09 0.00 0.00 178.44 178.84 2h3z h GLN 69 N 0.74 0.30 -0.27 1.13 4.15 -1.79 -2.28 115.11 117.09 2h3z h GLN 69 Ca 0.17 -0.02 -0.21 0.00 0.77 0.00 0.00 58.65 59.36 2h3z h GLN 69 Cb 0.28 -0.07 -0.19 0.00 0.21 0.00 0.00 27.48 27.71 2h3z h GLN 69 CO -0.00 0.20 -0.67 0.25 -1.93 0.00 0.00 178.83 176.68 2h3z n THR 70 N -5.12 2.15 -3.48 2.39 -2.24 -1.06 -5.03 114.28 101.89 2h3z n THR 70 Ca 0.14 -3.43 -0.37 0.00 -2.27 0.00 0.00 64.05 58.12 2h3z n THR 70 Cb 0.46 -0.41 -0.08 0.00 -2.10 0.00 0.00 70.33 68.19 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 2.09 0.05 3.38 0.00 0.87 -5.07 107.32 105.34 2h3z s GLY 71 Ca 0.42 -0.58 -0.01 0.00 0.00 0.00 0.00 44.72 44.54 2h3z s GLY 71 CO -0.04 0.64 0.04 -1.14 0.00 0.00 0.00 173.10 172.60 2h3z n SER 72 N 4.23 -1.62 -0.01 1.64 3.41 -1.26 -4.74 113.62 115.26 2h3z n SER 72 Ca -0.11 -0.25 -0.09 0.00 -0.26 0.00 0.00 58.87 58.16 2h3z n SER 72 Cb 0.51 -0.04 0.07 0.00 -0.26 0.00 0.00 64.21 64.50 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 0.60 -0.10 4.33 4.11 -2.00 -2.74 114.58 118.78 2h3z h GLU 73 Ca -0.02 -0.34 0.03 0.00 0.07 0.00 0.00 59.36 59.11 2h3z h GLU 73 Cb 0.05 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 2h3z h GLU 73 CO 0.01 0.94 0.10 1.49 0.07 0.00 0.00 179.01 181.62 2h3z h GLU 74 N 0.48 0.00 0.00 1.06 4.81 -2.02 -0.83 114.58 118.08 2h3z h GLU 74 Ca 0.03 0.00 -0.26 0.00 -0.13 0.00 0.00 59.36 58.99 2h3z h GLU 74 Cb 1.00 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.33 2h3z h GLU 74 CO 0.09 0.00 -1.51 1.25 -0.73 0.00 0.00 179.01 178.11 2h3z h LEU 75 N 0.00 0.00 0.45 1.64 6.46 -1.83 -3.34 115.31 118.69 2h3z h LEU 75 Ca 0.05 0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 57.79 2h3z h LEU 75 Cb 0.25 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.18 2h3z h LEU 75 CO -0.00 0.98 -0.22 -0.09 -0.62 0.00 0.00 178.44 178.49 2h3z h ARG 76 N 0.00 -0.58 -0.68 1.25 2.43 -0.87 -1.96 114.38 113.97 2h3z h ARG 76 Ca -0.21 0.04 0.12 0.00 -0.81 0.00 0.00 59.98 59.12 2h3z h ARG 76 Cb 1.93 0.13 -0.09 0.00 -0.42 0.00 0.00 29.97 31.53 2h3z h ARG 76 CO 0.09 -0.39 0.23 0.77 -1.51 0.00 0.00 179.97 179.17 2h3z h SER 77 N -0.60 0.18 0.60 -3.80 0.02 -1.66 -1.10 113.55 107.20 2h3z h SER 77 Ca -0.06 0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 2h3z h SER 77 Cb 0.46 0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 2h3z h SER 77 CO 0.10 0.08 -0.46 -0.07 -1.14 0.00 0.00 176.83 175.35 2h3z h LEU 78 N 0.38 -1.21 -0.70 5.07 4.07 -1.63 0.96 115.31 122.26 2h3z h LEU 78 Ca 0.36 0.08 0.15 0.00 0.08 0.00 0.00 57.88 58.55 2h3z h LEU 78 Cb 0.52 0.37 -0.11 0.00 1.08 0.00 0.00 40.66 42.52 2h3z h LEU 78 CO -0.38 -0.66 0.07 0.22 -1.08 0.00 0.00 178.44 176.61 2h3z h TYR 79 N -1.02 0.08 0.94 1.13 3.20 -0.97 0.37 116.97 120.69 2h3z h TYR 79 Ca -0.08 0.05 -0.05 0.00 3.14 0.00 0.00 58.73 61.79 2h3z h TYR 79 Cb 0.85 0.08 0.01 0.00 1.54 0.00 0.00 36.73 39.20 2h3z h TYR 79 CO -0.16 -0.16 -0.47 -0.91 -1.64 0.00 0.00 178.16 174.82 2h3z h ASN 80 N 0.17 -1.12 0.39 -2.11 4.21 -0.95 -0.57 115.58 115.59 2h3z h ASN 80 Ca 0.38 0.04 -0.01 0.00 1.21 0.00 0.00 56.30 57.93 2h3z h ASN 80 Cb 0.65 0.30 -0.03 0.00 -1.12 0.00 0.00 38.32 38.12 2h3z h ASN 80 CO -0.56 -0.78 -0.48 0.74 -1.29 0.00 0.00 177.43 175.06 2h3z h THR 81 N -1.28 0.00 -0.93 2.81 2.02 -0.22 -2.14 112.91 113.17 2h3z h THR 81 Ca -0.13 0.00 0.25 0.00 0.77 0.00 0.00 66.41 67.30 2h3z h THR 81 Cb 0.99 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 67.27 2h3z h THR 81 CO 0.20 0.00 0.43 0.40 0.37 0.00 0.00 175.52 176.92 2h3z h ILE 82 N -0.90 0.40 -0.72 3.11 2.04 -0.34 0.26 117.51 121.37 2h3z h ILE 82 Ca -0.05 -0.12 0.09 0.00 1.00 0.00 0.00 64.86 65.78 2h3z h ILE 82 Cb 0.80 0.01 -0.07 0.00 -0.74 0.00 0.00 36.82 36.82 2h3z h ILE 82 CO -0.11 0.07 0.36 0.00 0.00 0.00 0.00 178.15 178.46 2h3z h ALA 83 N 1.76 0.99 -0.08 1.87 0.00 -0.44 0.28 119.26 123.65 2h3z h ALA 83 Ca 0.61 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.55 2h3z h ALA 83 Cb 1.25 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 2h3z h ALA 83 CO -0.57 -0.05 -0.04 0.28 0.00 0.00 0.00 179.25 178.87 2h3z h VAL 84 N 0.60 1.33 0.41 0.00 2.07 -0.16 -2.91 116.25 117.60 2h3z h VAL 84 Ca 0.35 -1.09 -0.01 0.00 0.82 0.00 0.00 66.70 66.77 2h3z h VAL 84 Cb 0.38 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 2h3z h VAL 84 CO -0.27 0.30 -0.26 0.25 0.02 0.00 0.00 177.57 177.61 2h3z h LEU 85 N -0.22 -0.65 -0.73 2.57 5.85 -0.83 -2.21 115.31 119.09 2h3z h LEU 85 Ca 0.02 0.04 0.16 0.00 0.84 0.00 0.00 57.88 58.93 2h3z h LEU 85 Cb 0.50 0.19 -0.13 0.00 0.37 0.00 0.00 40.66 41.59 2h3z h LEU 85 CO 0.01 -0.41 -0.09 0.22 -0.34 0.00 0.00 178.44 177.83 2h3z h TYR 86 N -0.64 -0.23 -0.95 1.25 3.20 -0.53 0.29 116.97 119.36 2h3z h TYR 86 Ca -0.04 0.06 0.04 0.00 3.14 0.00 0.00 58.73 61.93 2h3z h TYR 86 Cb 0.53 0.22 -0.06 0.00 1.54 0.00 0.00 36.73 38.96 2h3z h TYR 86 CO -0.10 -0.28 0.62 0.00 -1.64 0.00 0.00 178.16 176.76 2h3z h VAL 88 N 1.18 0.83 -0.68 0.00 2.07 0.18 0.32 116.25 120.16 2h3z h VAL 88 Ca 0.38 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.87 2h3z h VAL 88 Cb 0.03 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 2h3z h VAL 88 CO -0.13 0.02 0.44 0.45 0.02 0.00 0.00 177.57 178.37 2h3z h HIS 89 N 0.12 0.86 -0.17 1.57 -0.00 -0.96 -1.13 115.15 115.45 2h3z h HIS 89 Ca 0.13 0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.48 2h3z h HIS 89 Cb 0.16 -0.29 -0.02 0.00 -0.00 0.00 0.00 27.41 27.25 2h3z h HIS 89 CO -0.19 0.56 0.05 0.94 -0.00 0.00 0.00 177.93 179.29 2h3z n GLN 90 N -4.42 1.75 -3.89 2.45 -0.06 -0.77 -4.84 117.38 107.60 2h3z n GLN 90 Ca 0.07 -0.75 -0.30 0.00 -2.00 0.00 0.00 57.00 54.02 2h3z n GLN 90 Cb 0.05 -1.56 0.03 0.00 -4.06 0.00 0.00 30.24 24.70 2h3z n GLN 90 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 2h3z n ARG 91 N 0.14 -5.65 -3.74 3.69 1.74 -0.43 -4.95 116.66 107.46 2h3z n ARG 91 Ca 0.09 0.61 -0.37 0.00 -0.77 0.00 0.00 57.85 57.42 2h3z n ARG 91 Cb 0.58 -5.50 -0.12 0.00 -1.02 0.00 0.00 32.46 26.39 2h3z n ARG 91 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2h3z s ILE 92 N -3.32 4.31 -0.33 0.55 1.01 0.11 -5.01 121.20 118.51 2h3z s ILE 92 Ca 0.63 -0.26 -0.18 0.00 0.00 0.00 0.00 60.65 60.84 2h3z s ILE 92 Cb -0.31 -3.06 -0.01 0.00 0.01 0.00 0.00 42.46 39.09 2h3z s ILE 92 CO 0.82 0.28 0.50 -1.81 0.00 0.00 0.00 174.94 174.73 2h3z s ASP 93 N 1.60 6.32 0.03 3.58 1.11 -1.26 -3.93 116.67 124.13 2h3z s ASP 93 Ca 0.06 0.05 0.02 0.00 0.18 0.00 0.00 52.55 52.86 2h3z s ASP 93 Cb -0.16 -2.26 -0.04 0.00 1.07 0.00 0.00 42.92 41.53 2h3z s ASP 93 CO 0.04 -0.44 0.01 0.68 1.18 0.00 0.00 175.17 176.64 2h3z s VAL 94 N 2.36 4.15 0.11 -1.27 -7.23 -1.26 -5.01 120.40 112.25 2h3z s VAL 94 Ca 0.19 -0.72 0.20 0.00 -1.81 0.00 0.00 61.98 59.84 2h3z s VAL 94 Cb -0.15 -2.90 0.17 0.00 0.56 0.00 0.00 36.38 34.06 2h3z s VAL 94 CO 0.13 0.29 1.74 0.11 -0.31 0.00 0.00 175.10 177.05 2h3z h LYS 95 N 4.02 0.00 -1.91 4.82 1.57 -1.97 -3.43 116.57 119.66 2h3z h LYS 95 Ca -0.48 0.00 0.30 0.00 -1.87 0.00 0.00 60.65 58.59 2h3z h LYS 95 Cb 1.17 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.40 2h3z h LYS 95 CO 0.59 0.33 0.80 0.16 -0.57 0.00 0.00 179.45 180.75 2h3z s ASP 96 N -6.34 -0.03 0.43 0.86 1.47 -1.26 -4.41 116.67 107.38 2h3z s ASP 96 Ca 0.01 -0.26 0.29 0.00 1.18 0.00 0.00 52.55 53.77 2h3z s ASP 96 Cb 0.10 0.23 1.55 0.00 -0.34 0.00 0.00 42.92 44.46 2h3z s ASP 96 CO 0.67 -0.44 1.89 0.74 0.68 0.00 0.00 175.17 178.72 2h3z h THR 97 N 2.00 0.00 0.10 2.11 2.02 -1.49 -1.99 112.91 115.66 2h3z h THR 97 Ca -0.27 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 66.87 2h3z h THR 97 Cb 1.20 0.71 0.00 0.00 -1.74 0.00 0.00 68.15 68.32 2h3z h THR 97 CO 0.30 0.00 -0.05 0.50 0.37 0.00 0.00 175.52 176.65 2h3z h LYS 98 N 0.00 -0.13 0.00 6.66 3.11 -1.86 -3.20 116.57 121.15 2h3z h LYS 98 Ca 0.00 0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.85 2h3z h LYS 98 Cb 0.05 0.03 0.00 0.00 -1.00 0.00 0.00 32.23 31.31 2h3z h LYS 98 CO 0.00 -0.09 0.00 1.49 -2.81 0.00 0.00 179.45 178.04 2h3z h GLU 99 N -0.95 0.00 -0.18 1.90 4.57 -1.91 -1.37 114.58 116.64 2h3z h GLU 99 Ca -0.01 0.00 -0.16 0.00 -1.18 0.00 0.00 59.36 58.01 2h3z h GLU 99 Cb 0.10 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.68 2h3z h GLU 99 CO 0.02 0.00 -0.53 0.00 -1.18 0.00 0.00 179.01 177.32 2h3z h ALA 100 N 2.00 0.73 -0.04 2.92 0.00 -1.45 -0.57 119.26 122.85 2h3z h ALA 100 Ca 0.00 -0.50 -0.14 0.00 0.00 0.00 0.00 54.91 54.27 2h3z h ALA 100 Cb 0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2h3z h ALA 100 CO 0.00 0.68 -0.59 -0.07 0.00 0.00 0.00 179.25 179.27 2h3z h LEU 101 N 0.41 0.15 0.17 0.00 3.38 -1.24 -2.63 115.31 115.54 2h3z h LEU 101 Ca 0.01 -0.09 -0.30 0.00 0.09 0.00 0.00 57.88 57.60 2h3z h LEU 101 Cb 1.07 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.79 2h3z h LEU 101 CO 0.10 0.71 -1.34 -0.78 0.09 0.00 0.00 178.44 177.22 2h3z h ASP 102 N 0.10 0.55 -0.61 -0.43 3.58 -1.45 -3.25 116.42 114.91 2h3z h ASP 102 Ca -0.01 -0.60 -0.04 0.00 0.42 0.00 0.00 57.03 56.81 2h3z h ASP 102 Cb 1.07 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 41.92 2h3z h ASP 102 CO 0.09 1.47 0.24 0.50 -2.88 0.00 0.00 179.24 178.65 2h3z h LYS 103 N 0.10 0.91 -0.34 0.28 1.63 -1.07 -2.51 116.57 115.57 2h3z h LYS 103 Ca -0.18 -0.17 0.03 0.00 -0.85 0.00 0.00 60.65 59.48 2h3z h LYS 103 Cb 2.04 -0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 33.49 2h3z h LYS 103 CO 0.22 0.78 0.16 0.82 -3.45 0.00 0.00 179.45 177.98 2h3z h ILE 104 N 0.84 0.96 -0.63 2.00 2.04 -1.57 -1.97 117.51 119.19 2h3z h ILE 104 Ca 0.20 -0.11 0.02 0.00 1.00 0.00 0.00 64.86 65.97 2h3z h ILE 104 Cb 0.21 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 36.86 2h3z h ILE 104 CO -0.02 0.06 0.42 -0.08 0.00 0.00 0.00 178.15 178.53 2h3z h GLU 105 N 0.33 0.79 -0.66 2.37 4.81 -1.55 -1.66 114.58 119.01 2h3z h GLU 105 Ca 0.15 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2h3z h GLU 105 Cb 0.07 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.24 2h3z h GLU 105 CO -0.11 0.52 0.39 1.49 -0.73 0.00 0.00 179.01 180.57 2h3z h GLU 106 N 0.81 0.89 -0.41 1.92 4.81 -0.92 0.21 114.58 121.90 2h3z h GLU 106 Ca 0.24 -0.08 -0.09 0.00 -0.13 0.00 0.00 59.36 59.31 2h3z h GLU 106 Cb -0.02 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.16 2h3z h GLU 106 CO -0.06 0.63 -0.08 1.49 -0.73 0.00 0.00 179.01 180.26 2h3z h GLU 107 N 0.91 0.78 -0.24 1.92 4.81 -1.00 -2.59 114.58 119.16 2h3z h GLU 107 Ca 0.24 -0.29 -0.17 0.00 -0.13 0.00 0.00 59.36 59.01 2h3z h GLU 107 Cb -0.03 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.31 2h3z h GLU 107 CO -0.04 0.90 -0.50 0.37 -0.73 0.00 0.00 179.01 179.01 2h3z h GLN 108 N 0.60 0.76 -0.52 1.92 5.75 -1.18 -3.11 115.11 119.34 2h3z h GLN 108 Ca 0.11 -0.50 0.07 0.00 -0.15 0.00 0.00 58.65 58.17 2h3z h GLN 108 Cb 0.60 0.07 -0.03 0.00 1.07 0.00 0.00 27.48 29.19 2h3z h GLN 108 CO 0.04 1.13 0.35 -0.91 -2.65 0.00 0.00 178.83 176.78 2h3z h ASN 109 N 0.50 0.38 0.21 -0.69 -0.26 -0.58 0.11 115.58 115.26 2h3z h ASN 109 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.75 2h3z h ASN 109 Cb 1.11 -0.08 0.00 0.00 -1.06 0.00 0.00 38.32 38.29 2h3z h ASN 109 CO 0.11 0.25 0.00 0.50 -1.06 0.00 0.00 177.43 177.23 2h3z h LYS 110 N 0.44 0.00 -0.21 0.81 3.64 -1.38 -0.46 116.57 119.41 2h3z h LYS 110 Ca 0.23 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 2h3z h LYS 110 Cb 0.34 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2h3z h LYS 110 CO -0.06 0.00 0.00 0.45 -2.27 0.00 0.00 179.45 177.57 2h3z n SER 111 N -2.79 2.49 0.03 4.20 2.88 0.34 -4.53 113.62 116.24 2h3z n SER 111 Ca -0.02 -1.87 -0.11 0.00 -1.33 0.00 0.00 58.87 55.55 2h3z n SER 111 Cb 0.11 -0.14 -0.13 0.00 -0.75 0.00 0.00 64.21 63.30 2h3z n SER 111 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2h3z h LYS 112 N 1.54 0.09 0.00 -1.46 3.64 -0.55 -3.16 116.57 116.66 2h3z h LYS 112 Ca 0.00 -0.15 -0.05 0.00 -1.27 0.00 0.00 60.65 59.18 2h3z h LYS 112 Cb 0.61 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.48 2h3z h LYS 112 CO 0.00 0.87 -0.24 0.87 -2.27 0.00 0.00 179.45 178.68 2h3z h LYS 113 N 0.02 0.00 -0.46 1.90 1.79 -1.79 -2.14 116.57 115.89 2h3z h LYS 113 Ca -0.19 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.28 2h3z h LYS 113 Cb 1.94 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.59 2h3z h LYS 113 CO 0.12 0.24 0.00 1.17 -1.08 0.00 0.00 179.45 179.90 2h3z n LYS 114 N -3.68 2.51 0.03 3.15 4.81 -1.25 -3.04 118.16 120.70 2h3z n LYS 114 Ca -0.01 -2.30 -0.16 0.00 -0.87 0.00 0.00 58.31 54.96 2h3z n LYS 114 Cb 0.36 -1.52 -0.14 0.00 0.02 0.00 0.00 35.03 33.75 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 4.45 0.42 0.00 3.14 0.00 -1.35 -3.43 119.26 122.50 2h3z h ALA 115 Ca 0.00 -1.26 -0.21 0.00 0.00 0.00 0.00 54.91 53.44 2h3z h ALA 115 Cb 0.96 0.44 -0.14 0.00 0.00 0.00 0.00 17.79 19.04 2h3z h ALA 115 CO 0.00 1.28 -0.32 0.00 0.00 0.00 0.00 179.25 180.21 2h3z n GLN 116 N -3.38 1.06 0.24 0.00 10.64 -1.24 -4.96 117.38 119.75 2h3z n GLN 116 Ca -0.21 -1.73 0.17 0.00 -1.83 0.00 0.00 57.00 53.40 2h3z n GLN 116 Cb 1.05 -0.25 0.86 0.00 -0.86 0.00 0.00 30.24 31.03 2h3z n GLN 116 CO 0.00 0.00 0.00 0.37 -1.83 0.00 0.00 177.06 175.60 2h3z h GLN 117 N 2.15 0.00 0.00 2.61 4.15 -1.80 0.30 115.11 122.52 2h3z h GLN 117 Ca -0.27 0.00 -0.21 0.00 0.77 0.00 0.00 58.65 58.95 2h3z h GLN 117 Cb 1.25 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.90 2h3z h GLN 117 CO -0.04 0.00 -1.97 0.00 -1.93 0.00 0.00 178.83 174.89 2h3z n ALA 118 N -1.93 1.98 -1.70 3.38 0.00 -1.26 -4.35 120.51 116.63 2h3z n ALA 118 Ca -0.02 -0.87 -0.06 0.00 0.00 0.00 0.00 53.44 52.49 2h3z n ALA 118 Cb 0.09 -0.58 0.15 0.00 0.00 0.00 0.00 19.45 19.10 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 -2.51 4.29 -0.10 0.00 0.00 -0.45 -4.64 120.51 117.10 2h3z n ALA 119 Ca -0.18 -3.44 -0.14 0.00 0.00 0.00 0.00 53.44 49.68 2h3z n ALA 119 Cb 0.90 -0.45 -0.14 0.00 0.00 0.00 0.00 19.45 19.76 2h3z n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h3z n ALA 120 N -0.99 1.43 -1.00 0.00 0.00 0.92 -4.78 120.51 116.09 2h3z n ALA 120 Ca 0.31 -1.15 0.00 0.00 0.00 0.00 0.00 53.44 52.60 2h3z n ALA 120 Cb 0.84 -0.22 0.00 0.00 0.00 0.00 0.00 19.45 20.07 2h3z n ALA 120 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2h3z n ASP 121 N -3.05 0.00 -0.58 0.00 9.92 -1.26 -4.91 116.55 116.67 2h3z n ASP 121 Ca -0.38 0.12 0.02 0.00 -0.53 0.00 0.00 54.79 54.02 2h3z n ASP 121 Cb 1.07 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 41.54 2h3z n ASP 121 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 2h3z n THR 122 N -0.31 0.00 0.34 -3.53 -2.24 -1.26 -4.32 114.28 102.95 2h3z n THR 122 Ca 0.00 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 2h3z n THR 122 Cb 0.00 -0.06 -0.04 0.00 -2.10 0.00 0.00 70.33 68.13 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 -0.52 -1.20 3.52 3.38 0.00 -1.26 -4.94 105.19 104.16 2h3z n GLY 123 Ca 0.00 -0.41 -0.13 0.00 0.00 0.00 0.00 46.02 45.49 2h3z n GLY 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h3z s ASN 124 N -4.35 -0.67 -0.08 1.61 2.20 -1.26 -5.16 114.94 107.22 2h3z s ASN 124 Ca -0.00 1.25 0.03 0.00 -0.94 0.00 0.00 52.86 53.20 2h3z s ASN 124 Cb 0.13 1.24 -0.02 0.00 -2.00 0.00 0.00 41.25 40.60 2h3z s ASN 124 CO 0.83 -0.22 -0.16 0.20 -2.94 0.00 0.00 177.10 174.82 2h3z s ASN 125 N 0.57 3.87 0.35 3.54 0.01 -1.26 -5.06 114.94 116.97 2h3z s ASN 125 Ca -0.02 -0.29 -0.28 0.00 -0.71 0.00 0.00 52.86 51.56 2h3z s ASN 125 Cb -0.05 -1.11 -0.12 0.00 0.41 0.00 0.00 41.25 40.39 2h3z s ASN 125 CO -0.03 0.27 1.45 -0.24 -1.51 0.00 0.00 177.10 177.04 2h3z n SER 126 N 2.83 3.52 -3.78 -1.22 2.88 -1.26 -5.01 113.62 111.57 2h3z n SER 126 Ca -0.18 1.21 -0.13 0.00 -1.33 0.00 0.00 58.87 58.45 2h3z n SER 126 Cb 0.52 -1.58 -0.13 0.00 -0.75 0.00 0.00 64.21 62.27 2h3z n SER 126 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2h3z s GLN 127 N -1.78 0.15 0.37 -1.46 -1.52 -1.26 -5.14 119.66 109.03 2h3z s GLN 127 Ca 0.56 0.31 -0.28 0.00 -1.95 0.00 0.00 55.36 53.99 2h3z s GLN 127 Cb -0.51 -0.03 -0.11 0.00 -0.22 0.00 0.00 33.01 32.14 2h3z s GLN 127 CO 0.61 -0.09 1.48 0.14 -0.25 0.00 0.00 175.29 177.18 2h3z s VAL 128 N 0.60 2.09 -0.31 1.09 -7.23 -1.26 -5.00 120.40 110.38 2h3z s VAL 128 Ca -0.04 0.09 0.05 0.00 -1.81 0.00 0.00 61.98 60.27 2h3z s VAL 128 Cb -0.06 -3.05 0.20 0.00 0.56 0.00 0.00 36.38 34.02 2h3z s VAL 128 CO -0.03 0.02 0.62 -0.44 -0.31 0.00 0.00 175.10 174.96 2h3z s SER 129 N -0.14 -1.56 -0.21 4.85 0.01 -1.26 -5.13 113.70 110.26 2h3z s SER 129 Ca 0.53 0.04 -0.04 0.00 1.31 0.00 0.00 55.95 57.79 2h3z s SER 129 Cb -0.46 1.98 0.10 0.00 0.21 0.00 0.00 66.02 67.85 2h3z s SER 129 CO 0.62 -0.27 0.26 -1.10 0.41 0.00 0.00 173.24 173.16 2h3z s GLN 130 N 2.68 0.23 -0.02 12.44 -0.21 -1.26 -5.14 119.66 128.38 2h3z s GLN 130 Ca 0.12 0.29 0.01 0.00 0.02 0.00 0.00 55.36 55.79 2h3z s GLN 130 Cb -0.09 -1.03 0.01 0.00 1.00 0.00 0.00 33.01 32.91 2h3z s GLN 130 CO -0.23 -0.65 -0.03 -0.80 -2.12 0.00 0.00 175.29 171.46 2h3z s ASN 131 N 2.38 0.59 0.00 5.90 -0.87 -1.26 -4.97 114.94 116.71 2h3z s ASN 131 Ca 0.08 -0.08 0.00 0.00 -1.57 0.00 0.00 52.86 51.29 2h3z s ASN 131 Cb -0.16 -0.19 0.00 0.00 -0.02 0.00 0.00 41.25 40.89 2h3z s ASN 131 CO -0.13 -0.01 0.30 -1.22 -2.57 0.00 0.00 177.10 173.48