#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h3z n ALA 3 N 0.00 -0.39 -2.80 4.61 0.00 -1.26 -5.16 120.51 115.51 2h3z n ALA 3 Ca 0.00 -0.49 -0.35 0.00 0.00 0.00 0.00 53.44 52.60 2h3z n ALA 3 Cb 0.00 0.39 -0.09 0.00 0.00 0.00 0.00 19.45 19.76 2h3z n ALA 3 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2h3z s ARG 4 N -2.14 3.65 -0.64 0.00 1.70 -1.26 -5.06 118.95 115.19 2h3z s ARG 4 Ca 0.08 -0.32 -0.16 0.00 -0.47 0.00 0.00 55.73 54.85 2h3z s ARG 4 Cb -0.01 -3.11 0.14 0.00 -0.57 0.00 0.00 34.95 31.40 2h3z s ARG 4 CO 0.06 0.47 0.65 0.00 -1.08 0.00 0.00 175.30 175.39 2h3z s ALA 5 N -0.19 3.67 0.39 7.88 0.00 -1.26 -5.04 121.76 127.21 2h3z s ALA 5 Ca 0.08 -2.64 0.08 0.00 0.00 0.00 0.00 51.96 49.47 2h3z s ALA 5 Cb -0.12 -3.44 -0.05 0.00 0.00 0.00 0.00 23.12 19.51 2h3z s ALA 5 CO 0.01 -2.22 0.16 -1.54 0.00 0.00 0.00 175.76 172.17 2h3z s SER 6 N 3.29 4.45 -0.08 0.00 1.04 -1.26 -5.07 113.70 116.07 2h3z s SER 6 Ca 0.10 -1.01 -0.02 0.00 0.48 0.00 0.00 55.95 55.50 2h3z s SER 6 Cb -0.23 -0.53 -0.01 0.00 0.10 0.00 0.00 66.02 65.35 2h3z s SER 6 CO 0.01 -0.46 -0.04 0.58 0.98 0.00 0.00 173.24 174.30 2h3z h VAL 7 N 1.49 0.00 -3.65 5.02 2.07 -1.95 -3.39 116.25 115.84 2h3z h VAL 7 Ca -0.43 -0.71 -0.67 0.00 0.82 0.00 0.00 66.70 65.70 2h3z h VAL 7 Cb 1.25 0.00 -0.24 0.00 -1.52 0.00 0.00 31.29 30.78 2h3z h VAL 7 CO 0.68 0.00 -0.75 -0.76 0.02 0.00 0.00 177.57 176.76 2h3z s LEU 8 N -7.22 2.82 0.00 2.57 1.43 -1.26 -4.55 118.68 112.46 2h3z s LEU 8 Ca -0.03 -0.22 0.00 0.00 -1.03 0.00 0.00 54.13 52.84 2h3z s LEU 8 Cb 0.00 -1.61 0.00 0.00 0.03 0.00 0.00 46.19 44.62 2h3z s LEU 8 CO 0.05 0.26 0.00 -1.54 0.23 0.00 0.00 176.35 175.35 2h3z n SER 9 N 2.87 -0.14 0.38 2.29 3.41 -1.26 -4.62 113.62 116.55 2h3z n SER 9 Ca -0.18 -0.58 -0.15 0.00 -0.26 0.00 0.00 58.87 57.70 2h3z n SER 9 Cb 0.52 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.40 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 -0.07 -1.00 0.80 5.00 0.00 -2.00 0.12 103.07 105.91 2h3z h GLY 10 Ca 0.00 0.37 0.06 0.00 0.00 0.00 0.00 47.33 47.76 2h3z h GLY 10 CO 0.00 -0.36 0.63 -1.33 0.00 0.00 0.00 176.54 175.47 2h3z h GLY 11 N -1.02 1.44 1.13 4.60 0.00 -2.01 -1.98 103.07 105.23 2h3z h GLY 11 Ca -0.10 -0.45 -0.09 0.00 0.00 0.00 0.00 47.33 46.68 2h3z h GLY 11 CO 0.16 0.33 -0.00 0.83 0.00 0.00 0.00 176.54 177.86 2h3z h GLU 12 N 1.13 1.04 -0.14 4.80 5.08 -1.90 -2.89 114.58 121.70 2h3z h GLU 12 Ca 0.41 -0.32 0.04 0.00 -1.00 0.00 0.00 59.36 58.49 2h3z h GLU 12 Cb 0.16 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.27 2h3z h GLU 12 CO -0.16 1.01 -0.15 1.25 -1.00 0.00 0.00 179.01 179.97 2h3z h LEU 13 N 0.95 -0.46 0.34 1.33 5.85 0.01 0.31 115.31 123.63 2h3z h LEU 13 Ca 0.17 0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.98 2h3z h LEU 13 Cb 0.55 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 2h3z h LEU 13 CO 0.03 -0.19 -0.36 -0.78 -0.34 0.00 0.00 178.44 176.80 2h3z h ASP 14 N -0.18 -0.99 -0.37 1.25 1.82 -1.44 -0.73 116.42 115.78 2h3z h ASP 14 Ca 0.10 0.09 0.07 0.00 -0.39 0.00 0.00 57.03 56.89 2h3z h ASP 14 Cb 0.32 0.34 -0.02 0.00 0.68 0.00 0.00 39.33 40.65 2h3z h ASP 14 CO -0.25 -0.50 0.25 0.11 -1.61 0.00 0.00 179.24 177.25 2h3z h LYS 15 N -0.73 0.19 -0.16 0.28 6.56 -1.29 -1.97 116.57 119.45 2h3z h LYS 15 Ca -0.02 -0.01 -0.03 0.00 -1.06 0.00 0.00 60.65 59.53 2h3z h LYS 15 Cb 0.67 -0.04 -0.01 0.00 -0.57 0.00 0.00 32.23 32.28 2h3z h LYS 15 CO -0.08 0.13 -0.00 2.35 -2.06 0.00 0.00 179.45 179.79 2h3z h TRP 16 N 0.20 0.32 0.00 -1.35 2.91 0.49 -2.56 115.95 115.96 2h3z h TRP 16 Ca 0.17 -0.06 0.00 0.00 1.13 0.00 0.00 58.89 60.13 2h3z h TRP 16 Cb 0.41 -0.08 0.00 0.00 -0.51 0.00 0.00 29.16 28.98 2h3z h TRP 16 CO -0.00 0.51 0.00 0.93 -1.03 0.00 0.00 178.44 178.85 2h3z h GLU 17 N 0.03 0.00 0.09 2.65 5.08 -0.40 -3.16 114.58 118.87 2h3z h GLU 17 Ca 0.05 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2h3z h GLU 17 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2h3z h GLU 17 CO 0.01 0.00 -0.04 0.87 -1.00 0.00 0.00 179.01 178.85 2h3z h LYS 18 N 0.00 -0.11 -6.24 2.33 1.57 -1.10 -3.32 116.57 109.69 2h3z h LYS 18 Ca 0.00 0.01 -0.61 0.00 -1.87 0.00 0.00 60.65 58.17 2h3z h LYS 18 Cb 0.13 0.03 0.14 0.00 0.08 0.00 0.00 32.23 32.61 2h3z h LYS 18 CO 0.00 -0.08 -0.50 -0.89 -0.57 0.00 0.00 179.45 177.42 2h3z n ILE 19 N -2.64 1.58 -4.33 1.86 5.41 -1.16 -4.52 119.36 115.55 2h3z n ILE 19 Ca -0.01 -0.50 -0.23 0.00 1.00 0.00 0.00 62.75 63.00 2h3z n ILE 19 Cb 0.05 -0.41 -0.08 0.00 -0.71 0.00 0.00 39.64 38.49 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 -1.42 2.15 0.30 0.38 0.52 -1.26 0.02 118.95 119.64 2h3z s ARG 20 Ca 0.62 -1.49 -0.01 0.00 -0.52 0.00 0.00 55.73 54.34 2h3z s ARG 20 Cb -0.64 -2.08 0.45 0.00 0.52 0.00 0.00 34.95 33.20 2h3z s ARG 20 CO 0.59 0.36 1.88 -0.07 0.02 0.00 0.00 175.30 178.07 2h3z h LEU 21 N 2.01 0.78 -8.93 2.53 3.38 -1.70 -1.29 115.31 112.08 2h3z h LEU 21 Ca -0.43 -0.10 -0.52 0.00 0.09 0.00 0.00 57.88 56.92 2h3z h LEU 21 Cb 1.25 -0.20 -0.16 0.00 0.09 0.00 0.00 40.66 41.64 2h3z h LEU 21 CO 0.60 0.71 -0.76 -0.13 0.09 0.00 0.00 178.44 178.94 2h3z s ARG 22 N -5.37 1.38 0.11 1.13 0.52 -1.26 -3.94 118.95 111.51 2h3z s ARG 22 Ca -0.10 -1.55 -0.13 0.00 -0.52 0.00 0.00 55.73 53.43 2h3z s ARG 22 Cb 0.16 -1.35 -0.07 0.00 0.52 0.00 0.00 34.95 34.21 2h3z s ARG 22 CO 0.79 0.25 1.44 -1.00 0.02 0.00 0.00 175.30 176.81 2h3z h PRO 23 N 2.81 0.79 -0.64 3.54 0.13 -1.90 -3.23 132.00 133.50 2h3z h PRO 23 Ca -0.40 -0.41 -0.36 0.00 -0.87 0.00 0.00 66.00 63.95 2h3z h PRO 23 Cb 1.22 0.01 -0.21 0.00 0.13 0.00 0.00 31.00 32.16 2h3z h PRO 23 CO 0.57 1.04 0.19 0.41 -0.23 0.00 0.00 178.00 179.98 2h3z n GLY 24 N 0.15 4.97 3.90 1.56 0.00 -1.26 -4.99 105.19 109.51 2h3z n GLY 24 Ca -0.03 -1.37 -0.25 0.00 0.00 0.00 0.00 46.02 44.37 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 -2.16 2.28 0.00 -0.02 0.00 -1.22 -5.05 107.32 101.15 2h3z s GLY 25 Ca 0.51 -1.49 0.05 0.00 0.00 0.00 0.00 44.72 43.79 2h3z s GLY 25 CO 0.03 -1.88 0.40 0.28 0.00 0.00 0.00 173.10 171.94 2h3z n LYS 26 N -1.74 3.12 -2.79 2.90 5.02 -1.26 -4.93 118.16 118.48 2h3z n LYS 26 Ca 0.01 -0.34 -0.43 0.00 -2.02 0.00 0.00 58.31 55.53 2h3z n LYS 26 Cb 0.64 -0.89 -0.04 0.00 -0.02 0.00 0.00 35.03 34.72 2h3z n LYS 26 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2h3z s LYS 27 N -1.09 3.48 0.73 1.97 2.20 -1.26 -5.03 119.74 120.73 2h3z s LYS 27 Ca 0.04 0.06 -0.08 0.00 -0.36 0.00 0.00 55.97 55.63 2h3z s LYS 27 Cb 0.04 -3.97 0.06 0.00 -1.51 0.00 0.00 37.83 32.45 2h3z s LYS 27 CO 0.16 -1.35 1.06 -0.65 -0.36 0.00 0.00 175.35 174.20 2h3z s GLN 28 N 3.95 2.20 0.32 4.03 1.11 -1.26 -2.14 119.66 127.88 2h3z s GLN 28 Ca 0.36 -0.10 -0.28 0.00 0.01 0.00 0.00 55.36 55.35 2h3z s GLN 28 Cb -0.10 -2.11 -0.09 0.00 -1.01 0.00 0.00 33.01 29.70 2h3z s GLN 28 CO 0.24 -1.30 1.11 0.71 0.01 0.00 0.00 175.29 176.06 2h3z s TYR 29 N -3.33 3.43 0.18 0.91 2.02 0.10 -4.68 117.35 115.98 2h3z s TYR 29 Ca 0.60 1.66 -0.00 0.00 -0.37 0.00 0.00 57.07 58.96 2h3z s TYR 29 Cb -0.11 -3.28 -0.04 0.00 -0.40 0.00 0.00 41.96 38.13 2h3z s TYR 29 CO 0.46 -0.72 0.09 0.15 -1.57 0.00 0.00 175.55 173.97 2h3z s LYS 30 N -1.80 1.13 0.32 -0.62 1.02 -1.26 -4.02 119.74 114.51 2h3z s LYS 30 Ca 0.49 -1.58 0.09 0.00 0.02 0.00 0.00 55.97 54.99 2h3z s LYS 30 Cb -0.30 0.15 0.83 0.00 -0.52 0.00 0.00 37.83 37.98 2h3z s LYS 30 CO 0.38 -0.31 1.76 -0.07 -0.92 0.00 0.00 175.35 176.19 2h3z h LEU 31 N 2.67 0.71 -0.59 3.17 3.38 -1.98 -1.27 115.31 121.41 2h3z h LEU 31 Ca -0.36 0.11 0.11 0.00 0.09 0.00 0.00 57.88 57.83 2h3z h LEU 31 Cb 1.23 -0.02 -0.11 0.00 0.09 0.00 0.00 40.66 41.85 2h3z h LEU 31 CO 0.57 0.20 -0.28 0.11 0.09 0.00 0.00 178.44 179.13 2h3z h LYS 32 N 0.66 -0.12 -0.45 1.13 1.57 -1.99 0.37 116.57 117.74 2h3z h LYS 32 Ca 0.60 0.01 0.08 0.00 -1.87 0.00 0.00 60.65 59.46 2h3z h LYS 32 Cb 1.06 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.37 2h3z h LYS 32 CO -0.40 -0.08 0.31 0.45 -0.57 0.00 0.00 179.45 179.16 2h3z h HIS 33 N -0.13 0.28 0.04 -1.35 3.86 -1.64 0.54 115.15 116.75 2h3z h HIS 33 Ca 0.25 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.46 2h3z h HIS 33 Cb 0.53 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 28.91 2h3z h HIS 33 CO -0.59 0.14 -0.02 0.82 0.86 0.00 0.00 177.93 179.14 2h3z h ILE 34 N 0.27 0.00 -1.06 2.45 2.04 -0.32 -3.11 117.51 117.78 2h3z h ILE 34 Ca 0.20 -0.09 0.28 0.00 1.00 0.00 0.00 64.86 66.26 2h3z h ILE 34 Cb 0.46 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.46 2h3z h ILE 34 CO -0.04 0.00 0.71 0.58 0.00 0.00 0.00 178.15 179.40 2h3z h VAL 35 N -0.15 0.50 0.58 1.67 2.07 -1.21 -1.75 116.25 117.96 2h3z h VAL 35 Ca -0.01 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 2h3z h VAL 35 Cb 0.04 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.03 2h3z h VAL 35 CO 0.01 0.05 -0.41 -0.25 0.02 0.00 0.00 177.57 176.98 2h3z h TRP 36 N 0.25 -1.12 -0.91 1.57 7.01 -0.98 -1.91 115.95 119.87 2h3z h TRP 36 Ca 0.57 -0.00 0.22 0.00 2.11 0.00 0.00 58.89 61.78 2h3z h TRP 36 Cb 1.71 0.41 -0.06 0.00 -2.10 0.00 0.00 29.16 29.13 2h3z h TRP 36 CO -0.00 -0.59 0.61 0.00 -2.79 0.00 0.00 178.44 175.67 2h3z h ALA 37 N -1.22 2.38 -0.66 2.65 0.00 -1.26 0.15 119.26 121.30 2h3z h ALA 37 Ca -0.08 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 2h3z h ALA 37 Cb 0.78 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 2h3z h ALA 37 CO 0.04 -0.66 0.18 1.03 0.00 0.00 0.00 179.25 179.84 2h3z h SER 38 N 0.30 0.96 1.10 0.00 0.87 -1.06 0.10 113.55 115.82 2h3z h SER 38 Ca 0.47 -0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.85 2h3z h SER 38 Cb 1.34 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 2h3z h SER 38 CO -0.14 0.92 0.00 -0.09 -0.53 0.00 0.00 176.83 176.98 2h3z h ARG 39 N 0.99 0.00 0.07 2.24 2.43 0.05 -2.99 114.38 117.16 2h3z h ARG 39 Ca 0.21 0.00 -0.34 0.00 -0.81 0.00 0.00 59.98 59.04 2h3z h ARG 39 Cb 0.31 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 2h3z h ARG 39 CO -0.00 0.00 -1.92 -1.91 -1.51 0.00 0.00 179.97 174.63 2h3z n GLU 40 N -3.04 0.71 -0.32 0.20 4.07 -0.74 -4.20 120.64 117.32 2h3z n GLU 40 Ca 0.01 0.26 -0.03 0.00 -0.06 0.00 0.00 57.16 57.34 2h3z n GLU 40 Cb 0.32 -1.73 0.08 0.00 -0.06 0.00 0.00 31.44 30.06 2h3z n GLU 40 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 2h3z h LEU 41 N 0.04 1.01 -2.48 4.31 3.38 -0.72 -1.01 115.31 119.83 2h3z h LEU 41 Ca -0.38 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 57.57 2h3z h LEU 41 Cb 2.03 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 42.52 2h3z h LEU 41 CO 0.08 0.74 0.13 -0.08 0.09 0.00 0.00 178.44 179.40 2h3z h GLU 42 N 1.18 0.00 0.00 1.13 4.81 -1.31 0.26 114.58 120.65 2h3z h GLU 42 Ca 0.32 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.55 2h3z h GLU 42 Cb -0.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.26 2h3z h GLU 42 CO -0.07 0.00 -0.96 -2.13 -0.73 0.00 0.00 179.01 175.12 2h3z n ARG 43 N -3.36 0.54 -0.84 1.92 0.63 -0.41 -3.86 116.66 111.28 2h3z n ARG 43 Ca -0.01 0.11 -0.07 0.00 -0.92 0.00 0.00 57.85 56.96 2h3z n ARG 43 Cb 0.22 -1.79 0.23 0.00 0.45 0.00 0.00 32.46 31.56 2h3z n ARG 43 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 2h3z n PHE 44 N -2.55 2.03 -1.61 -0.14 3.72 0.79 -4.86 117.46 114.84 2h3z n PHE 44 Ca 0.01 -1.06 -0.18 0.00 -0.05 0.00 0.00 57.45 56.17 2h3z n PHE 44 Cb 0.53 -0.61 -0.07 0.00 -0.94 0.00 0.00 39.48 38.39 2h3z n PHE 44 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2h3z n ALA 45 N -0.15 -0.30 -3.83 4.37 0.00 -1.17 -4.97 120.51 114.47 2h3z n ALA 45 Ca 0.34 0.27 -0.33 0.00 0.00 0.00 0.00 53.44 53.72 2h3z n ALA 45 Cb 1.21 -1.83 -0.16 0.00 0.00 0.00 0.00 19.45 18.68 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 -2.68 2.27 0.32 0.00 1.01 -0.45 -5.03 120.40 115.84 2h3z s VAL 46 Ca 0.00 -0.89 -0.29 0.00 0.00 0.00 0.00 61.98 60.80 2h3z s VAL 46 Cb 0.00 -1.95 -0.11 0.00 0.00 0.00 0.00 36.38 34.33 2h3z s VAL 46 CO 0.00 0.53 1.43 0.20 0.00 0.00 0.00 175.10 177.26 2h3z s ASN 47 N 1.09 6.56 0.00 3.32 -0.87 -1.26 -2.24 114.94 121.53 2h3z s ASN 47 Ca -0.00 2.83 0.15 0.00 -1.57 0.00 0.00 52.86 54.26 2h3z s ASN 47 Cb -0.14 -2.65 0.72 0.00 -0.02 0.00 0.00 41.25 39.17 2h3z s ASN 47 CO -0.07 -0.73 1.42 -0.81 -2.57 0.00 0.00 177.10 174.34 2h3z n PRO 48 N 1.28 0.17 0.00 -0.60 -0.04 -1.26 -2.53 135.00 132.01 2h3z n PRO 48 Ca 0.03 0.17 0.14 0.00 -0.04 0.00 0.00 63.50 63.80 2h3z n PRO 48 Cb 0.40 -1.50 0.75 0.00 -0.04 0.00 0.00 33.50 33.11 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 -0.02 -1.20 0.12 0.55 0.00 -1.26 -3.15 105.19 100.24 2h3z n GLY 49 Ca 0.06 -0.14 0.07 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.24 0.36 -0.13 0.99 4.77 -1.05 -3.03 117.00 117.66 2h3z n LEU 50 Ca 0.15 -0.16 0.11 0.00 -0.03 0.00 0.00 56.01 56.08 2h3z n LEU 50 Cb 0.21 -0.03 -0.00 0.00 -2.33 0.00 0.00 43.42 41.27 2h3z n LEU 50 CO 0.21 0.08 0.16 0.18 -1.33 0.00 0.00 177.39 176.69 2h3z n LEU 51 N -0.47 1.16 -1.73 2.23 4.77 -1.19 -2.61 117.00 119.17 2h3z n LEU 51 Ca 0.10 -0.47 -0.03 0.00 -0.03 0.00 0.00 56.01 55.59 2h3z n LEU 51 Cb 0.10 -0.05 0.29 0.00 -2.33 0.00 0.00 43.42 41.43 2h3z n LEU 51 CO 0.08 0.26 0.94 -1.84 -1.33 0.00 0.00 177.39 175.50 2h3z n GLU 52 N -1.10 3.44 -3.30 3.23 0.28 -1.17 -4.63 120.64 117.38 2h3z n GLU 52 Ca 0.06 -3.07 0.03 0.00 -0.16 0.00 0.00 57.16 54.02 2h3z n GLU 52 Cb 0.36 -2.12 -0.02 0.00 1.43 0.00 0.00 31.44 31.10 2h3z n GLU 52 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 177.13 176.89 2h3z s THR 53 N -2.99 -0.95 0.32 3.84 -1.32 -1.26 -5.00 115.64 108.28 2h3z s THR 53 Ca 0.52 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 61.10 2h3z s THR 53 Cb 0.42 -1.00 0.31 0.00 -1.51 0.00 0.00 72.50 70.73 2h3z s THR 53 CO 0.11 0.00 1.68 -1.28 -2.21 0.00 0.00 174.62 172.93 2h3z h SER 54 N 7.98 0.46 -0.95 8.08 0.87 -1.88 0.52 113.55 128.64 2h3z h SER 54 Ca -0.21 0.17 0.16 0.00 -1.23 0.00 0.00 61.79 60.68 2h3z h SER 54 Cb 1.14 0.13 -0.08 0.00 -0.44 0.00 0.00 62.40 63.14 2h3z h SER 54 CO 0.19 -0.05 0.60 -0.33 -0.53 0.00 0.00 176.83 176.71 2h3z h GLU 55 N 0.39 0.70 0.11 2.24 4.39 -1.96 -1.83 114.58 118.62 2h3z h GLU 55 Ca 0.66 -0.04 -0.25 0.00 0.34 0.00 0.00 59.36 60.07 2h3z h GLU 55 Cb 1.37 -0.16 0.03 0.00 -0.10 0.00 0.00 28.75 29.89 2h3z h GLU 55 CO -0.56 0.46 -1.03 0.78 -1.16 0.00 0.00 179.01 177.50 2h3z h GLY 56 N 0.72 0.57 0.51 -3.84 0.00 -0.19 -3.27 103.07 97.57 2h3z h GLY 56 Ca 0.50 -1.21 0.19 0.00 0.00 0.00 0.00 47.33 46.81 2h3z h GLY 56 CO -0.26 1.06 0.54 0.00 0.00 0.00 0.00 176.54 177.88 2h3z h ARG 58 N 0.26 0.25 -0.02 0.00 2.43 -1.46 -2.87 114.38 112.97 2h3z h ARG 58 Ca 0.39 -0.10 -0.21 0.00 -0.81 0.00 0.00 59.98 59.26 2h3z h ARG 58 Cb 1.15 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.69 2h3z h ARG 58 CO -0.10 0.56 -0.87 0.37 -1.51 0.00 0.00 179.97 178.42 2h3z h GLN 59 N 0.22 0.36 -0.90 0.20 4.15 -0.60 -2.46 115.11 116.08 2h3z h GLN 59 Ca 0.03 -0.36 -0.01 0.00 0.77 0.00 0.00 58.65 59.08 2h3z h GLN 59 Cb 0.69 0.10 -0.04 0.00 0.21 0.00 0.00 27.48 28.43 2h3z h GLN 59 CO 0.05 1.03 0.51 0.82 -1.93 0.00 0.00 178.83 179.31 2h3z h ILE 60 N 0.21 1.26 -0.03 2.39 2.04 -1.16 0.42 117.51 122.64 2h3z h ILE 60 Ca -0.06 -0.61 -0.21 0.00 1.00 0.00 0.00 64.86 64.98 2h3z h ILE 60 Cb 1.48 0.03 0.02 0.00 -0.74 0.00 0.00 36.82 37.61 2h3z h ILE 60 CO 0.15 0.28 -0.81 -0.07 0.00 0.00 0.00 178.15 177.69 2h3z h LEU 61 N 1.25 0.76 -1.63 1.44 3.38 -1.54 -2.64 115.31 116.33 2h3z h LEU 61 Ca 0.32 -0.72 -0.02 0.00 0.09 0.00 0.00 57.88 57.54 2h3z h LEU 61 Cb 0.00 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.52 2h3z h LEU 61 CO -0.05 1.38 -0.09 1.23 0.09 0.00 0.00 178.44 181.00 2h3z h GLY 62 N 0.22 0.00 0.00 0.83 0.00 -1.22 0.52 103.07 103.42 2h3z h GLY 62 Ca -0.09 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.21 2h3z h GLY 62 CO 0.16 0.00 -0.16 1.46 0.00 0.00 0.00 176.54 178.01 2h3z h GLN 63 N 0.00 0.00 0.00 4.80 4.20 -0.91 -3.35 115.11 119.85 2h3z h GLN 63 Ca -0.00 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.63 2h3z h GLN 63 Cb 0.48 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 2h3z h GLN 63 CO 0.01 0.71 -0.39 -0.07 -0.67 0.00 0.00 178.83 178.43 2h3z h LEU 64 N -1.00 0.00 -0.31 1.46 3.38 -1.46 -3.28 115.31 114.10 2h3z h LEU 64 Ca -0.04 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.97 2h3z h LEU 64 Cb 0.77 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.46 2h3z h LEU 64 CO -0.02 0.39 -0.38 1.56 0.09 0.00 0.00 178.44 180.08 2h3z h GLN 65 N 0.00 -0.23 0.00 1.13 4.20 -1.02 0.63 115.11 119.82 2h3z h GLN 65 Ca -0.00 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2h3z h GLN 65 Cb 0.76 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.59 2h3z h GLN 65 CO 0.05 -0.15 0.00 -0.35 -0.67 0.00 0.00 178.83 177.71 2h3z n PRO 66 N -4.49 0.49 0.00 1.46 -0.04 -1.23 -1.76 135.00 129.42 2h3z n PRO 66 Ca -0.02 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.46 2h3z n PRO 66 Cb 0.22 -1.27 -0.02 0.00 -0.04 0.00 0.00 33.50 32.39 2h3z n PRO 66 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2h3z n SER 67 N -0.77 0.40 0.21 3.54 2.88 0.17 -4.70 113.62 115.34 2h3z n SER 67 Ca 0.06 -0.70 -0.15 0.00 -1.33 0.00 0.00 58.87 56.76 2h3z n SER 67 Cb 0.03 0.83 -0.08 0.00 -0.75 0.00 0.00 64.21 64.24 2h3z n SER 67 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2h3z h LEU 68 N 0.15 -0.45 -0.89 2.46 3.38 0.78 -2.64 115.31 118.11 2h3z h LEU 68 Ca 0.00 0.02 0.23 0.00 0.09 0.00 0.00 57.88 58.22 2h3z h LEU 68 Cb 0.11 0.12 -0.13 0.00 0.09 0.00 0.00 40.66 40.85 2h3z h LEU 68 CO 0.00 -0.31 0.34 -0.61 0.09 0.00 0.00 178.44 177.95 2h3z h GLN 69 N -0.50 0.31 -1.19 1.13 4.15 -1.84 0.37 115.11 117.55 2h3z h GLN 69 Ca -0.04 -0.02 -0.50 0.00 0.77 0.00 0.00 58.65 58.85 2h3z h GLN 69 Cb 0.40 -0.07 -0.23 0.00 0.21 0.00 0.00 27.48 27.79 2h3z h GLN 69 CO 0.06 0.21 0.65 2.41 -1.93 0.00 0.00 178.83 180.23 2h3z n THR 70 N -5.11 3.17 -3.95 2.39 -1.04 -1.02 -4.91 114.28 103.82 2h3z n THR 70 Ca 0.22 -2.22 -0.10 0.00 -2.04 0.00 0.00 64.05 59.91 2h3z n THR 70 Cb 0.67 -1.12 -0.10 0.00 -1.82 0.00 0.00 70.33 67.96 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 -0.93 0.18 0.00 3.41 0.00 0.13 -5.03 107.32 105.08 2h3z s GLY 71 Ca 0.49 -0.47 0.00 0.00 0.00 0.00 0.00 44.72 44.74 2h3z s GLY 71 CO 0.01 -0.57 0.00 -1.14 0.00 0.00 0.00 173.10 171.40 2h3z n SER 72 N 1.40 0.00 0.14 1.64 3.41 -1.26 -4.91 113.62 114.05 2h3z n SER 72 Ca -0.23 -0.40 0.04 0.00 -0.26 0.00 0.00 58.87 58.02 2h3z n SER 72 Cb 0.56 0.00 0.44 0.00 -0.26 0.00 0.00 64.21 64.95 2h3z n SER 72 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2h3z h GLU 73 N 0.00 0.20 -0.98 4.33 3.07 -2.00 -2.60 114.58 116.60 2h3z h GLU 73 Ca 0.00 -0.04 0.21 0.00 -0.50 0.00 0.00 59.36 59.04 2h3z h GLU 73 Cb 0.00 -0.03 -0.11 0.00 -0.84 0.00 0.00 28.75 27.76 2h3z h GLU 73 CO 0.00 0.29 0.56 0.93 -1.40 0.00 0.00 179.01 179.39 2h3z h GLU 74 N 0.19 0.62 0.00 2.33 5.08 -2.02 0.38 114.58 121.15 2h3z h GLU 74 Ca 0.04 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 2h3z h GLU 74 Cb 0.27 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2h3z h GLU 74 CO 0.01 0.41 -0.44 1.25 -1.00 0.00 0.00 179.01 179.24 2h3z h LEU 75 N 0.63 0.00 -0.25 1.33 5.85 -1.82 -3.31 115.31 117.75 2h3z h LEU 75 Ca 0.59 0.00 0.03 0.00 0.84 0.00 0.00 57.88 59.34 2h3z h LEU 75 Cb 1.02 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 2h3z h LEU 75 CO -0.44 0.44 0.06 -0.09 -0.34 0.00 0.00 178.44 178.07 2h3z h ARG 76 N 0.00 0.15 -0.11 1.25 2.43 -0.16 -1.74 114.38 116.20 2h3z h ARG 76 Ca -0.00 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.19 2h3z h ARG 76 Cb 1.31 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.79 2h3z h ARG 76 CO 0.06 0.10 -0.09 0.77 -1.51 0.00 0.00 179.97 179.30 2h3z h SER 77 N 0.16 -0.28 -0.17 -3.80 0.02 -1.57 -1.19 113.55 106.71 2h3z h SER 77 Ca 0.11 0.06 0.05 0.00 -0.84 0.00 0.00 61.79 61.17 2h3z h SER 77 Cb 0.11 0.14 -0.06 0.00 0.14 0.00 0.00 62.40 62.73 2h3z h SER 77 CO -0.14 -0.12 -0.21 -0.07 -1.14 0.00 0.00 176.83 175.14 2h3z h LEU 78 N -0.10 -0.66 -0.26 5.07 -0.00 -1.61 0.16 115.31 117.90 2h3z h LEU 78 Ca 0.07 0.12 0.06 0.00 -0.00 0.00 0.00 57.88 58.12 2h3z h LEU 78 Cb 0.21 0.31 -0.05 0.00 -0.00 0.00 0.00 40.66 41.12 2h3z h LEU 78 CO -0.17 -0.26 -0.09 0.22 -0.00 0.00 0.00 178.44 178.14 2h3z h TYR 79 N -0.25 -0.21 0.82 1.13 3.20 -1.02 0.31 116.97 120.95 2h3z h TYR 79 Ca 0.11 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.97 2h3z h TYR 79 Cb 0.42 0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.82 2h3z h TYR 79 CO -0.34 -0.15 -0.46 -0.91 -1.64 0.00 0.00 178.16 174.66 2h3z h ASN 80 N -0.04 -1.14 0.15 -2.11 4.21 -0.65 -0.47 115.58 115.52 2h3z h ASN 80 Ca 0.13 0.06 0.01 0.00 1.21 0.00 0.00 56.30 57.71 2h3z h ASN 80 Cb 0.24 0.32 -0.05 0.00 -1.12 0.00 0.00 38.32 37.72 2h3z h ASN 80 CO -0.29 -0.73 -0.48 0.74 -1.29 0.00 0.00 177.43 175.37 2h3z h THR 81 N -1.18 0.07 -0.86 2.81 2.02 -0.55 -1.79 112.91 113.43 2h3z h THR 81 Ca -0.11 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.27 2h3z h THR 81 Cb 0.93 0.07 -0.12 0.00 -1.74 0.00 0.00 68.15 67.29 2h3z h THR 81 CO 0.14 0.00 0.33 0.40 0.37 0.00 0.00 175.52 176.75 2h3z h ILE 82 N -0.74 0.47 -0.52 3.11 2.04 -0.40 0.73 117.51 122.20 2h3z h ILE 82 Ca 0.00 -0.12 0.09 0.00 1.00 0.00 0.00 64.86 65.83 2h3z h ILE 82 Cb 0.74 0.09 -0.07 0.00 -0.74 0.00 0.00 36.82 36.84 2h3z h ILE 82 CO -0.25 0.06 0.13 0.00 0.00 0.00 0.00 178.15 178.09 2h3z h ALA 83 N 1.69 0.61 -0.07 1.87 0.00 -0.22 0.20 119.26 123.34 2h3z h ALA 83 Ca 0.52 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.52 2h3z h ALA 83 Cb 0.97 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 2h3z h ALA 83 CO -0.53 -0.28 -0.00 0.28 0.00 0.00 0.00 179.25 178.71 2h3z h VAL 84 N 0.27 1.26 -0.81 0.00 2.07 -0.46 -2.53 116.25 116.05 2h3z h VAL 84 Ca 0.26 -0.82 0.07 0.00 0.82 0.00 0.00 66.70 67.03 2h3z h VAL 84 Cb 0.35 1.68 -0.06 0.00 -1.52 0.00 0.00 31.29 31.73 2h3z h VAL 84 CO -0.32 0.23 0.49 0.25 0.02 0.00 0.00 177.57 178.23 2h3z h LEU 85 N -0.18 0.73 -0.03 2.57 5.85 -0.73 -1.30 115.31 122.23 2h3z h LEU 85 Ca 0.02 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2h3z h LEU 85 Cb 0.36 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.27 2h3z h LEU 85 CO 0.00 0.45 0.01 0.22 -0.34 0.00 0.00 178.44 178.79 2h3z h TYR 86 N 0.86 0.02 -0.65 1.25 3.20 -0.54 -2.44 116.97 118.67 2h3z h TYR 86 Ca 0.37 0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.26 2h3z h TYR 86 Cb 0.24 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 2h3z h TYR 86 CO -0.05 0.01 0.43 0.00 -1.64 0.00 0.00 178.16 176.91 2h3z h VAL 88 N 0.81 0.96 0.03 0.00 2.07 -0.76 0.35 116.25 119.72 2h3z h VAL 88 Ca 0.25 -0.11 -0.24 0.00 0.82 0.00 0.00 66.70 67.42 2h3z h VAL 88 Cb 0.01 0.60 0.01 0.00 -1.52 0.00 0.00 31.29 30.39 2h3z h VAL 88 CO -0.07 0.06 -1.02 0.45 0.02 0.00 0.00 177.57 177.01 2h3z h HIS 89 N 0.33 0.64 -0.25 1.57 -0.00 -1.08 -3.18 115.15 113.18 2h3z h HIS 89 Ca 0.18 -0.37 -0.09 0.00 -0.00 0.00 0.00 60.37 60.08 2h3z h HIS 89 Cb 0.30 -0.06 -0.06 0.00 -0.00 0.00 0.00 27.41 27.59 2h3z h HIS 89 CO -0.00 1.21 0.12 0.94 -0.00 0.00 0.00 177.93 180.20 2h3z n GLN 90 N -3.72 1.72 -3.74 2.45 0.00 -0.71 -4.83 117.38 108.56 2h3z n GLN 90 Ca -0.08 -0.94 -0.26 0.00 -0.00 0.00 0.00 57.00 55.72 2h3z n GLN 90 Cb 0.88 -1.52 0.05 0.00 0.00 0.00 0.00 30.24 29.66 2h3z n GLN 90 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 2h3z n ARG 91 N 0.07 -6.52 -4.69 3.69 3.00 -1.12 -4.98 116.66 106.11 2h3z n ARG 91 Ca 0.14 0.71 -0.33 0.00 -0.00 0.00 0.00 57.85 58.37 2h3z n ARG 91 Cb 0.73 -5.64 -0.15 0.00 0.00 0.00 0.00 32.46 27.40 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 -3.35 2.97 -0.14 5.15 1.01 0.11 -5.02 121.20 121.95 2h3z s ILE 92 Ca 0.53 -0.68 0.00 0.00 0.00 0.00 0.00 60.65 60.50 2h3z s ILE 92 Cb -0.25 -2.25 -0.01 0.00 0.01 0.00 0.00 42.46 39.95 2h3z s ILE 92 CO 0.78 0.52 -0.14 1.51 0.00 0.00 0.00 174.94 177.61 2h3z s ASP 93 N 0.50 3.83 0.10 3.58 1.47 -1.26 -3.51 116.67 121.38 2h3z s ASP 93 Ca -0.09 -0.40 0.08 0.00 1.18 0.00 0.00 52.55 53.32 2h3z s ASP 93 Cb -0.16 -1.58 -0.04 0.00 -0.34 0.00 0.00 42.92 40.80 2h3z s ASP 93 CO 0.04 0.13 -0.13 0.68 0.68 0.00 0.00 175.17 176.57 2h3z s VAL 94 N 0.56 3.16 0.33 2.11 -7.23 -1.26 -5.01 120.40 113.05 2h3z s VAL 94 Ca -0.09 -1.33 0.26 0.00 -1.81 0.00 0.00 61.98 59.01 2h3z s VAL 94 Cb -0.16 -2.46 0.27 0.00 0.56 0.00 0.00 36.38 34.59 2h3z s VAL 94 CO 0.04 0.13 1.99 0.11 -0.31 0.00 0.00 175.10 177.05 2h3z h LYS 95 N 3.73 0.00 -2.15 4.82 1.57 -1.98 -3.42 116.57 119.14 2h3z h LYS 95 Ca -0.49 0.00 0.21 0.00 -1.87 0.00 0.00 60.65 58.50 2h3z h LYS 95 Cb 1.17 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.39 2h3z h LYS 95 CO 0.50 0.16 0.57 0.16 -0.57 0.00 0.00 179.45 180.27 2h3z s ASP 96 N -6.18 -0.14 0.39 0.86 1.47 -1.26 -4.23 116.67 107.58 2h3z s ASP 96 Ca -0.02 -0.36 0.27 0.00 1.18 0.00 0.00 52.55 53.62 2h3z s ASP 96 Cb 0.12 0.42 1.40 0.00 -0.34 0.00 0.00 42.92 44.51 2h3z s ASP 96 CO 0.60 -0.77 1.83 0.74 0.68 0.00 0.00 175.17 178.25 2h3z h THR 97 N 2.00 0.00 0.08 2.11 2.02 -1.35 -1.73 112.91 116.04 2h3z h THR 97 Ca -0.26 -0.08 -0.26 0.00 0.77 0.00 0.00 66.41 66.58 2h3z h THR 97 Cb 1.22 0.75 0.01 0.00 -1.74 0.00 0.00 68.15 68.39 2h3z h THR 97 CO 0.27 0.00 -1.13 0.11 0.37 0.00 0.00 175.52 175.13 2h3z h LYS 98 N 0.00 0.42 0.03 6.66 1.57 -1.85 -3.16 116.57 120.24 2h3z h LYS 98 Ca 0.00 -0.56 -0.00 0.00 -1.87 0.00 0.00 60.65 58.22 2h3z h LYS 98 Cb 0.11 0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2h3z h LYS 98 CO 0.00 1.22 -0.02 0.93 -0.57 0.00 0.00 179.45 181.01 2h3z h GLU 99 N 0.19 -0.04 -1.21 3.15 4.39 -1.71 0.23 114.58 119.58 2h3z h GLU 99 Ca -0.13 0.00 0.38 0.00 0.34 0.00 0.00 59.36 59.96 2h3z h GLU 99 Cb 1.81 0.01 -0.12 0.00 -0.10 0.00 0.00 28.75 30.34 2h3z h GLU 99 CO 0.20 -0.03 0.77 0.00 -1.16 0.00 0.00 179.01 178.79 2h3z h ALA 100 N -1.97 2.52 0.10 3.43 0.00 -1.73 0.15 119.26 121.76 2h3z h ALA 100 Ca -0.00 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2h3z h ALA 100 Cb 0.03 0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2h3z h ALA 100 CO 0.01 -1.10 -0.05 1.25 0.00 0.00 0.00 179.25 179.36 2h3z h LEU 101 N 0.18 -0.11 -1.50 0.00 7.12 -1.49 -2.48 115.31 117.02 2h3z h LEU 101 Ca 0.76 -0.44 0.23 0.00 0.13 0.00 0.00 57.88 58.56 2h3z h LEU 101 Cb 2.22 0.03 -0.07 0.00 -0.53 0.00 0.00 40.66 42.30 2h3z h LEU 101 CO -0.42 0.42 0.64 -0.78 -0.13 0.00 0.00 178.44 178.17 2h3z h ASP 102 N -0.69 0.39 0.00 1.25 3.58 0.22 0.26 116.42 121.43 2h3z h ASP 102 Ca -0.01 0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.49 2h3z h ASP 102 Cb 0.54 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.57 2h3z h ASP 102 CO 0.02 0.13 0.00 0.29 -2.88 0.00 0.00 179.24 176.80 2h3z n LYS 103 N -4.52 0.00 -0.36 0.28 4.76 -0.52 -0.55 118.16 117.24 2h3z n LYS 103 Ca 0.21 0.44 0.31 0.00 -2.87 0.00 0.00 58.31 56.40 2h3z n LYS 103 Cb 0.79 -1.15 0.62 0.00 -1.84 0.00 0.00 35.03 33.46 2h3z n LYS 103 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 2h3z h ILE 104 N 0.00 0.38 0.00 -0.18 2.04 -1.27 0.18 117.51 118.67 2h3z h ILE 104 Ca 0.00 -0.07 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 2h3z h ILE 104 Cb 0.00 0.17 0.00 0.00 -0.74 0.00 0.00 36.82 36.25 2h3z h ILE 104 CO 0.00 0.04 -0.00 -0.08 0.00 0.00 0.00 178.15 178.11 2h3z h GLU 105 N 0.20 -0.00 -0.96 2.37 4.81 -0.56 -3.28 114.58 117.16 2h3z h GLU 105 Ca 0.65 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.93 2h3z h GLU 105 Cb 2.04 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 31.36 2h3z h GLU 105 CO -0.23 0.72 0.63 1.49 -0.73 0.00 0.00 179.01 180.88 2h3z h GLU 106 N -0.72 1.13 -0.76 1.92 4.81 0.14 0.28 114.58 121.38 2h3z h GLU 106 Ca -0.00 -0.07 0.17 0.00 -0.13 0.00 0.00 59.36 59.33 2h3z h GLU 106 Cb 0.72 -0.25 -0.05 0.00 0.63 0.00 0.00 28.75 29.80 2h3z h GLU 106 CO 0.00 0.75 0.51 0.93 -0.73 0.00 0.00 179.01 180.47 2h3z h GLU 107 N 1.16 0.28 0.01 1.92 4.39 -0.81 0.25 114.58 121.77 2h3z h GLU 107 Ca 0.40 -0.02 -0.34 0.00 0.34 0.00 0.00 59.36 59.74 2h3z h GLU 107 Cb 0.09 -0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 28.62 2h3z h GLU 107 CO -0.14 0.18 -2.07 1.04 -1.16 0.00 0.00 179.01 176.86 2h3z n GLN 108 N -4.44 0.66 0.05 2.33 1.13 -0.47 -4.07 117.38 112.57 2h3z n GLN 108 Ca 0.15 0.15 0.11 0.00 -1.94 0.00 0.00 57.00 55.46 2h3z n GLN 108 Cb 0.63 -1.65 0.44 0.00 0.11 0.00 0.00 30.24 29.77 2h3z n GLN 108 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 2h3z n ASN 109 N -2.93 0.29 -1.79 1.08 2.85 0.86 -2.12 115.26 113.49 2h3z n ASN 109 Ca -0.26 0.55 -0.08 0.00 -0.11 0.00 0.00 54.58 54.68 2h3z n ASN 109 Cb 1.10 -0.62 0.22 0.00 1.24 0.00 0.00 39.78 41.71 2h3z n ASN 109 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 2h3z n LYS 110 N -1.80 2.86 0.02 1.20 4.81 0.76 -4.08 118.16 121.94 2h3z n LYS 110 Ca 0.04 -2.37 0.00 0.00 -0.87 0.00 0.00 58.31 55.11 2h3z n LYS 110 Cb 0.27 -1.99 0.00 0.00 0.02 0.00 0.00 35.03 33.32 2h3z n LYS 110 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2h3z n SER 111 N -0.22 -0.24 0.30 3.14 2.88 -1.11 -4.88 113.62 113.49 2h3z n SER 111 Ca 0.35 0.07 -0.12 0.00 -1.33 0.00 0.00 58.87 57.85 2h3z n SER 111 Cb 1.23 0.48 -0.05 0.00 -0.75 0.00 0.00 64.21 65.11 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 0.00 -0.73 -1.13 -1.46 3.64 -1.64 -2.77 116.57 112.49 2h3z h LYS 112 Ca 0.00 0.05 0.32 0.00 -1.27 0.00 0.00 60.65 59.75 2h3z h LYS 112 Cb 0.00 0.16 -0.08 0.00 -0.41 0.00 0.00 32.23 31.90 2h3z h LYS 112 CO 0.00 -0.48 0.76 0.87 -2.27 0.00 0.00 179.45 178.33 2h3z h LYS 113 N -0.76 0.21 -0.90 1.90 1.57 -1.80 0.25 116.57 117.05 2h3z h LYS 113 Ca -0.08 -0.01 0.15 0.00 -1.87 0.00 0.00 60.65 58.84 2h3z h LYS 113 Cb 0.58 -0.05 -0.09 0.00 0.08 0.00 0.00 32.23 32.74 2h3z h LYS 113 CO 0.13 0.14 0.50 0.87 -0.57 0.00 0.00 179.45 180.52 2h3z h LYS 114 N 0.22 0.69 -0.22 3.15 1.57 -1.73 0.41 116.57 120.65 2h3z h LYS 114 Ca 0.62 -0.04 0.06 0.00 -1.87 0.00 0.00 60.65 59.42 2h3z h LYS 114 Cb 1.91 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 34.06 2h3z h LYS 114 CO -0.21 0.46 0.39 0.00 -0.57 0.00 0.00 179.45 179.51 2h3z h ALA 115 N 1.57 1.76 -2.57 3.86 0.00 -0.47 -3.34 119.26 120.07 2h3z h ALA 115 Ca 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.39 2h3z h ALA 115 Cb 0.66 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2h3z h ALA 115 CO -0.35 -0.50 0.00 1.04 0.00 0.00 0.00 179.25 179.44 2h3z n GLN 116 N -3.35 0.00 -3.40 0.00 3.00 0.88 -4.96 117.38 109.54 2h3z n GLN 116 Ca 0.03 0.00 -0.20 0.00 -0.01 0.00 0.00 57.00 56.82 2h3z n GLN 116 Cb 0.51 -0.01 -0.03 0.00 0.00 0.00 0.00 30.24 30.70 2h3z n GLN 116 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.06 178.00 2h3z n GLN 117 N -1.30 -2.13 -2.29 -1.09 7.27 0.11 -4.62 117.38 113.33 2h3z n GLN 117 Ca 0.00 0.12 -0.03 0.00 0.07 0.00 0.00 57.00 57.17 2h3z n GLN 117 Cb 0.00 -4.68 0.04 0.00 2.41 0.00 0.00 30.24 28.01 2h3z n GLN 117 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2h3z n ALA 118 N -3.22 -0.73 -1.98 1.69 0.00 -1.26 -4.98 120.51 110.03 2h3z n ALA 118 Ca 0.04 -0.51 -0.02 0.00 0.00 0.00 0.00 53.44 52.95 2h3z n ALA 118 Cb 0.49 -0.81 -0.02 0.00 0.00 0.00 0.00 19.45 19.11 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 -0.57 2.46 -2.87 0.00 0.00 -1.26 -4.98 120.51 113.28 2h3z n ALA 119 Ca -0.13 -0.20 -0.12 0.00 0.00 0.00 0.00 53.44 52.98 2h3z n ALA 119 Cb 0.67 -0.10 0.02 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 0.00 2.31 -2.61 0.00 0.00 -1.26 -4.89 120.51 114.06 2h3z n ALA 120 Ca -0.08 -2.91 -0.01 0.00 0.00 0.00 0.00 53.44 50.44 2h3z n ALA 120 Cb 0.55 -0.96 0.06 0.00 0.00 0.00 0.00 19.45 19.10 2h3z n ALA 120 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2h3z n ASP 121 N 0.05 -0.17 -4.38 0.00 5.75 -1.26 -5.14 116.55 111.41 2h3z n ASP 121 Ca 0.14 -2.10 -0.32 0.00 -0.01 0.00 0.00 54.79 52.49 2h3z n ASP 121 Cb 0.75 0.15 0.15 0.00 -1.03 0.00 0.00 41.12 41.14 2h3z n ASP 121 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2h3z n THR 122 N -0.81 0.00 -1.58 2.12 -2.24 -1.26 -4.75 114.28 105.76 2h3z n THR 122 Ca -0.09 -0.23 -0.48 0.00 -2.27 0.00 0.00 64.05 60.98 2h3z n THR 122 Cb 0.86 -0.64 -0.05 0.00 -2.10 0.00 0.00 70.33 68.39 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 1.63 1.02 4.02 3.38 0.00 -1.26 -4.95 105.19 109.03 2h3z n GLY 123 Ca 0.05 0.87 -0.21 0.00 0.00 0.00 0.00 46.02 46.73 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 8.96 2.23 -0.07 1.61 4.13 -1.26 -5.01 115.26 125.86 2h3z n ASN 124 Ca 0.31 -2.62 0.14 0.00 1.68 0.00 0.00 54.58 54.09 2h3z n ASN 124 Cb 0.31 -0.40 0.60 0.00 -1.54 0.00 0.00 39.78 38.74 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 -2.27 0.32 -1.10 6.41 4.13 -1.26 -5.03 115.26 116.46 2h3z n ASN 125 Ca 0.15 -0.30 0.13 0.00 1.68 0.00 0.00 54.58 56.25 2h3z n ASN 125 Cb 0.62 -0.14 -0.03 0.00 -1.54 0.00 0.00 39.78 38.69 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 -1.15 -6.54 -3.50 6.41 2.88 -1.26 -4.91 113.62 105.55 2h3z n SER 126 Ca 0.12 1.04 -0.21 0.00 -1.33 0.00 0.00 58.87 58.48 2h3z n SER 126 Cb 0.29 -2.99 0.03 0.00 -0.75 0.00 0.00 64.21 60.79 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 -3.18 -1.44 -3.62 -1.46 6.02 -1.26 -5.01 117.38 107.44 2h3z n GLN 127 Ca 0.01 0.78 -0.09 0.00 -0.01 0.00 0.00 57.00 57.68 2h3z n GLN 127 Cb 0.44 -4.48 -0.06 0.00 1.02 0.00 0.00 30.24 27.15 2h3z n GLN 127 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2h3z s VAL 128 N -3.29 0.00 0.08 5.09 0.11 -1.26 -5.10 120.40 116.03 2h3z s VAL 128 Ca 0.31 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.36 2h3z s VAL 128 Cb -0.09 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.76 2h3z s VAL 128 CO 0.82 0.00 0.00 -0.24 -3.33 0.00 0.00 175.10 172.35 2h3z n SER 129 N 1.76 0.13 -3.96 3.54 2.88 -1.26 -5.13 113.62 111.58 2h3z n SER 129 Ca -0.12 0.14 -0.12 0.00 -1.33 0.00 0.00 58.87 57.44 2h3z n SER 129 Cb 0.56 0.04 -0.12 0.00 -0.75 0.00 0.00 64.21 63.94 2h3z n SER 129 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2h3z s GLN 130 N -1.38 0.29 0.08 -1.46 -2.07 -1.26 -5.16 119.66 108.70 2h3z s GLN 130 Ca 0.00 -0.41 -0.26 0.00 -1.82 0.00 0.00 55.36 52.88 2h3z s GLN 130 Cb 0.00 -0.09 0.08 0.00 -1.09 0.00 0.00 33.01 31.92 2h3z s GLN 130 CO 0.00 0.01 0.71 1.21 -1.32 0.00 0.00 175.29 175.90 2h3z s ASN 131 N -0.87 -0.51 0.00 12.60 2.47 -1.26 -5.30 114.94 122.07 2h3z s ASN 131 Ca -0.08 0.07 0.00 0.00 0.42 0.00 0.00 52.86 53.28 2h3z s ASN 131 Cb -0.06 0.52 0.00 0.00 -1.45 0.00 0.00 41.25 40.26 2h3z s ASN 131 CO -0.00 -0.81 0.00 0.00 -3.72 0.00 0.00 177.10 172.57