#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q5c n LEU 1 N 0.00 0.58 -4.75 2.46 4.77 -1.26 -4.89 117.00 113.91 2q5c n LEU 1 Ca 0.00 0.31 -0.41 0.00 -0.03 0.00 0.00 56.01 55.88 2q5c n LEU 1 Cb 0.00 -0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 40.79 2q5c n LEU 1 CO 0.00 -0.04 0.98 -0.44 -1.33 0.00 0.00 177.39 176.56 2q5c s SER 2 N -3.87 6.87 0.13 -1.43 0.01 -1.26 -5.02 113.70 109.14 2q5c s SER 2 Ca 0.09 2.48 -0.14 0.00 1.31 0.00 0.00 55.95 59.69 2q5c s SER 2 Cb 0.15 -2.62 -0.07 0.00 0.21 0.00 0.00 66.02 63.69 2q5c s SER 2 CO 0.66 -0.52 0.54 -0.76 0.41 0.00 0.00 173.24 173.57 2q5c s LEU 3 N -0.59 4.35 -0.09 2.44 1.43 -1.26 -4.99 118.68 119.97 2q5c s LEU 3 Ca 0.54 1.06 0.01 0.00 -1.03 0.00 0.00 54.13 54.71 2q5c s LEU 3 Cb -0.37 -3.21 0.02 0.00 0.03 0.00 0.00 46.19 42.65 2q5c s LEU 3 CO 0.42 0.12 -0.09 -0.54 0.23 0.00 0.00 176.35 176.49 2q5c s LYS 4 N -1.89 1.57 -0.07 1.70 1.02 -1.26 -0.31 119.74 120.50 2q5c s LYS 4 Ca 0.37 -0.31 0.02 0.00 0.02 0.00 0.00 55.97 56.07 2q5c s LYS 4 Cb -0.15 -1.48 0.01 0.00 -0.52 0.00 0.00 37.83 35.69 2q5c s LYS 4 CO 0.19 -0.14 -0.12 0.42 -0.92 0.00 0.00 175.35 174.78 2q5c s ILE 5 N 1.24 1.13 -0.15 2.17 1.01 -0.78 -0.22 121.20 125.61 2q5c s ILE 5 Ca -0.04 -0.47 -0.11 0.00 0.00 0.00 0.00 60.65 60.03 2q5c s ILE 5 Cb -0.14 -1.03 -0.05 0.00 0.01 0.00 0.00 42.46 41.25 2q5c s ILE 5 CO -0.03 0.35 0.22 0.00 0.00 0.00 0.00 174.94 175.48 2q5c s ALA 6 N 0.70 3.70 -0.20 9.38 0.00 -0.75 -1.61 121.76 132.97 2q5c s ALA 6 Ca -0.14 -0.55 -0.06 0.00 0.00 0.00 0.00 51.96 51.21 2q5c s ALA 6 Cb -0.16 -2.22 -0.03 0.00 0.00 0.00 0.00 23.12 20.71 2q5c s ALA 6 CO 0.03 0.27 0.03 -1.17 0.00 0.00 0.00 175.76 174.93 2q5c s LEU 7 N -0.07 3.46 -0.22 0.00 2.96 0.24 -0.27 118.68 124.78 2q5c s LEU 7 Ca 0.14 -0.11 0.01 0.00 -0.22 0.00 0.00 54.13 53.95 2q5c s LEU 7 Cb -0.13 -1.89 0.04 0.00 0.50 0.00 0.00 46.19 44.72 2q5c s LEU 7 CO 0.03 0.08 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.37 2q5c s ILE 8 N 0.91 2.22 0.18 6.68 1.01 -0.48 -1.61 121.20 130.11 2q5c s ILE 8 Ca 0.02 -1.21 -0.22 0.00 0.00 0.00 0.00 60.65 59.24 2q5c s ILE 8 Cb -0.14 -2.10 0.05 0.00 0.01 0.00 0.00 42.46 40.28 2q5c s ILE 8 CO 0.02 0.28 0.61 -0.55 0.00 0.00 0.00 174.94 175.30 2q5c s SER 9 N 1.22 -0.47 0.00 3.58 0.15 -0.72 -4.41 113.70 113.06 2q5c s SER 9 Ca -0.01 -0.18 0.15 0.00 0.70 0.00 0.00 55.95 56.62 2q5c s SER 9 Cb -0.16 0.62 0.28 0.00 -1.71 0.00 0.00 66.02 65.05 2q5c s SER 9 CO -0.09 -1.04 1.18 0.00 1.20 0.00 0.00 173.24 174.49 2q5c n GLN 10 N -0.38 2.04 -3.03 5.44 6.02 -1.25 -2.59 117.38 123.62 2q5c n GLN 10 Ca -0.14 -1.87 -0.43 0.00 -0.01 0.00 0.00 57.00 54.55 2q5c n GLN 10 Cb 0.64 -1.33 -0.06 0.00 1.02 0.00 0.00 30.24 30.50 2q5c n GLN 10 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2q5c s ASN 11 N -1.13 6.34 0.38 1.08 3.84 -1.26 -4.93 114.94 119.26 2q5c s ASN 11 Ca 0.25 -0.34 0.04 0.00 0.21 0.00 0.00 52.86 53.03 2q5c s ASN 11 Cb 0.15 -2.35 0.74 0.00 -0.55 0.00 0.00 41.25 39.23 2q5c s ASN 11 CO 0.21 -0.89 2.03 -0.33 -2.79 0.00 0.00 177.10 175.32 2q5c h GLU 12 N 8.98 0.71 -0.43 0.43 4.39 -1.98 -0.87 114.58 125.80 2q5c h GLU 12 Ca -0.26 -0.04 -0.07 0.00 0.34 0.00 0.00 59.36 59.33 2q5c h GLU 12 Cb 1.09 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 29.56 2q5c h GLU 12 CO 0.95 0.47 -0.00 -0.91 -1.16 0.00 0.00 179.01 178.35 2q5c h ASN 13 N 0.73 0.74 -0.47 1.42 2.35 -1.96 0.01 115.58 118.41 2q5c h ASN 13 Ca 0.20 -0.31 -0.04 0.00 -0.55 0.00 0.00 56.30 55.60 2q5c h ASN 13 Cb -0.07 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.08 2q5c h ASN 13 CO -0.04 0.87 0.13 -0.07 -1.65 0.00 0.00 177.43 176.67 2q5c h LEU 14 N 0.59 0.70 -0.99 1.61 3.38 -1.76 -1.21 115.31 117.64 2q5c h LEU 14 Ca 0.12 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 2q5c h LEU 14 Cb 0.49 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 2q5c h LEU 14 CO 0.02 0.74 0.18 -0.07 0.09 0.00 0.00 178.44 179.40 2q5c h LEU 15 N 0.63 0.84 -0.48 1.67 3.38 -0.91 -1.23 115.31 119.20 2q5c h LEU 15 Ca 0.15 -0.14 -0.17 0.00 0.09 0.00 0.00 57.88 57.81 2q5c h LEU 15 Cb 0.30 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2q5c h LEU 15 CO -0.00 0.80 -0.58 -1.13 0.09 0.00 0.00 178.44 177.61 2q5c h ASN 16 N 0.88 0.63 0.08 -0.43 -0.73 -0.85 -3.26 115.58 111.89 2q5c h ASN 16 Ca 0.20 -0.35 -0.16 0.00 1.87 0.00 0.00 56.30 57.85 2q5c h ASN 16 Cb 0.27 -0.18 -0.01 0.00 0.27 0.00 0.00 38.32 38.67 2q5c h ASN 16 CO -0.01 1.07 -0.59 0.25 -0.37 0.00 0.00 177.43 177.79 2q5c h LEU 17 N 0.42 0.58 -0.46 0.34 5.85 -0.89 -3.37 115.31 117.79 2q5c h LEU 17 Ca 0.00 -0.33 0.06 0.00 0.84 0.00 0.00 57.88 58.45 2q5c h LEU 17 Cb 1.14 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.95 2q5c h LEU 17 CO 0.11 1.04 0.17 0.15 -0.34 0.00 0.00 178.44 179.57 2q5c h PHE 18 N 0.39 0.31 0.00 1.25 3.57 -1.28 -0.14 116.94 121.05 2q5c h PHE 18 Ca -0.00 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 2q5c h PHE 18 Cb 1.13 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.80 2q5c h PHE 18 CO 0.04 0.12 -0.10 -1.35 -2.23 0.00 0.00 178.31 174.80 2q5c h PRO 19 N 0.35 0.00 -0.38 6.41 0.11 -1.75 -0.50 132.00 136.25 2q5c h PRO 19 Ca 0.22 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.18 2q5c h PRO 19 Cb 0.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.31 2q5c h PRO 19 CO -0.21 0.10 -0.34 0.87 -0.21 0.00 0.00 178.00 178.20 2q5c h LYS 20 N 0.00 0.90 -0.04 1.05 1.57 -1.24 -2.86 116.57 115.94 2q5c h LYS 20 Ca -0.00 -0.46 -0.10 0.00 -1.87 0.00 0.00 60.65 58.22 2q5c h LYS 20 Cb 0.24 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 2q5c h LYS 20 CO 0.01 1.11 -0.43 -0.07 -0.57 0.00 0.00 179.45 179.50 2q5c h LEU 21 N 0.71 0.10 -1.45 2.94 3.38 -0.67 -2.79 115.31 117.53 2q5c h LEU 21 Ca 0.06 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2q5c h LEU 21 Cb 0.93 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 2q5c h LEU 21 CO 0.09 0.52 0.00 0.00 0.09 0.00 0.00 178.44 179.14 2q5c h ALA 22 N 1.48 1.56 -0.49 1.53 0.00 -0.95 -1.08 119.26 121.31 2q5c h ALA 22 Ca 0.00 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 2q5c h ALA 22 Cb 0.80 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2q5c h ALA 22 CO 0.06 0.33 0.11 -0.07 0.00 0.00 0.00 179.25 179.68 2q5c h LEU 23 N 0.35 0.75 -0.31 0.00 3.38 -1.27 0.11 115.31 118.32 2q5c h LEU 23 Ca 0.08 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 2q5c h LEU 23 Cb 0.23 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2q5c h LEU 23 CO 0.01 0.80 0.18 -0.33 0.09 0.00 0.00 178.44 179.19 2q5c h GLU 24 N 0.68 0.43 -0.42 1.13 5.08 -1.36 -3.19 114.58 116.92 2q5c h GLU 24 Ca 0.15 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2q5c h GLU 24 Cb 0.34 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2q5c h GLU 24 CO 0.00 0.35 0.00 1.63 -1.00 0.00 0.00 179.01 179.99 2q5c n LYS 25 N -4.82 2.36 -3.66 2.33 4.76 -0.46 -4.99 118.16 113.69 2q5c n LYS 25 Ca -0.01 -2.08 -0.27 0.00 -2.87 0.00 0.00 58.31 53.08 2q5c n LYS 25 Cb 0.06 -1.49 0.04 0.00 -1.84 0.00 0.00 35.03 31.80 2q5c n LYS 25 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2q5c n ASN 26 N 1.25 -4.13 -4.24 4.39 5.15 0.33 -5.03 115.26 112.98 2q5c n ASN 26 Ca 0.19 -0.94 -0.13 0.00 -0.60 0.00 0.00 54.58 53.10 2q5c n ASN 26 Cb 0.54 -3.69 -0.10 0.00 -0.53 0.00 0.00 39.78 36.00 2q5c n ASN 26 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 2q5c s PHE 27 N -3.55 1.19 -0.20 1.20 -0.12 -0.84 -4.65 117.98 111.01 2q5c s PHE 27 Ca 0.33 -0.85 -0.24 0.00 -0.05 0.00 0.00 56.93 56.12 2q5c s PHE 27 Cb -0.11 -0.64 -0.02 0.00 -0.63 0.00 0.00 43.02 41.63 2q5c s PHE 27 CO 0.84 -0.03 0.77 0.42 -0.05 0.00 0.00 175.22 177.17 2q5c s ILE 28 N -3.46 4.91 0.19 -4.49 1.01 0.58 -4.55 121.20 115.39 2q5c s ILE 28 Ca 0.18 1.49 -0.18 0.00 0.00 0.00 0.00 60.65 62.14 2q5c s ILE 28 Cb 0.04 -4.08 -0.08 0.00 0.01 0.00 0.00 42.46 38.35 2q5c s ILE 28 CO 0.00 0.02 0.66 -2.16 0.00 0.00 0.00 174.94 173.47 2q5c s PRO 29 N 2.26 4.15 -0.07 2.79 0.04 -1.26 -1.86 135.00 141.04 2q5c s PRO 29 Ca 0.35 0.73 0.03 0.00 0.04 0.00 0.00 61.00 62.15 2q5c s PRO 29 Cb -0.16 -2.90 0.01 0.00 0.04 0.00 0.00 34.50 31.48 2q5c s PRO 29 CO 0.11 0.43 -0.16 0.42 0.04 0.00 0.00 177.00 177.83 2q5c s ILE 30 N -1.49 1.45 -0.02 0.56 1.09 -0.64 -4.94 121.20 117.21 2q5c s ILE 30 Ca 0.41 -0.67 0.07 0.00 -1.10 0.00 0.00 60.65 59.36 2q5c s ILE 30 Cb -0.16 -1.28 -0.02 0.00 -1.06 0.00 0.00 42.46 39.94 2q5c s ILE 30 CO 0.20 0.42 -0.23 0.42 -0.10 0.00 0.00 174.94 175.66 2q5c s THR 31 N 0.48 1.79 -0.01 2.92 -4.23 -1.26 -0.59 115.64 114.74 2q5c s THR 31 Ca -0.14 -0.97 -0.01 0.00 -1.18 0.00 0.00 61.69 59.39 2q5c s THR 31 Cb -0.16 -1.49 0.00 0.00 1.34 0.00 0.00 72.50 72.20 2q5c s THR 31 CO 0.05 0.51 0.02 -0.54 -0.54 0.00 0.00 174.62 174.12 2q5c s LYS 32 N -0.52 0.02 -0.45 3.99 -0.14 -0.63 -4.97 119.74 117.03 2q5c s LYS 32 Ca 0.08 0.03 -0.16 0.00 -1.36 0.00 0.00 55.97 54.56 2q5c s LYS 32 Cb -0.09 0.01 0.05 0.00 -1.68 0.00 0.00 37.83 36.12 2q5c s LYS 32 CO -0.01 -0.00 0.39 0.99 -0.76 0.00 0.00 175.35 175.96 2q5c s THR 33 N 0.02 5.21 0.03 2.17 2.01 -1.26 -1.75 115.64 122.07 2q5c s THR 33 Ca -0.00 -0.85 -0.28 0.00 0.31 0.00 0.00 61.69 60.86 2q5c s THR 33 Cb -0.00 -4.08 0.10 0.00 0.01 0.00 0.00 72.50 68.53 2q5c s THR 33 CO -0.00 -0.50 1.01 0.00 -0.69 0.00 0.00 174.62 174.44 2q5c s ALA 34 N 1.76 -1.86 0.13 7.40 0.00 -1.07 -4.94 121.76 123.19 2q5c s ALA 34 Ca 0.06 0.72 -0.04 0.00 0.00 0.00 0.00 51.96 52.69 2q5c s ALA 34 Cb -0.22 0.42 -0.03 0.00 0.00 0.00 0.00 23.12 23.30 2q5c s ALA 34 CO 0.09 -0.86 0.14 -1.54 0.00 0.00 0.00 175.76 173.58 2q5c s SER 35 N -2.68 0.22 1.04 0.00 1.04 -1.26 -3.70 113.70 108.36 2q5c s SER 35 Ca 0.10 -1.04 0.00 0.00 0.48 0.00 0.00 55.95 55.49 2q5c s SER 35 Cb -0.00 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.46 2q5c s SER 35 CO -0.04 -0.78 0.00 0.18 0.98 0.00 0.00 173.24 173.59 2q5c n LEU 36 N -0.12 0.00 -0.24 2.42 4.77 -1.26 -1.52 117.00 121.05 2q5c n LEU 36 Ca -0.07 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.85 2q5c n LEU 36 Cb 0.63 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.77 2q5c n LEU 36 CO 0.28 0.00 1.13 0.74 -1.33 0.00 0.00 177.39 178.21 2q5c h THR 37 N 0.00 1.19 -0.94 -5.08 2.02 -1.97 -1.25 112.91 106.88 2q5c h THR 37 Ca 0.00 -0.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 2q5c h THR 37 Cb 0.00 0.23 -0.05 0.00 -1.74 0.00 0.00 68.15 66.60 2q5c h THR 37 CO 0.00 0.19 0.56 -0.09 0.37 0.00 0.00 175.52 176.55 2q5c h ARG 38 N 0.92 1.28 -0.77 6.66 2.43 -1.93 -1.23 114.38 121.75 2q5c h ARG 38 Ca 0.24 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 2q5c h ARG 38 Cb -0.06 -0.27 -0.04 0.00 -0.42 0.00 0.00 29.97 29.19 2q5c h ARG 38 CO -0.05 0.90 0.48 0.00 -1.51 0.00 0.00 179.97 179.80 2q5c h ALA 39 N 1.31 1.41 -0.22 2.80 0.00 -0.65 -2.16 119.26 121.76 2q5c h ALA 39 Ca 0.34 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 55.07 2q5c h ALA 39 Cb -0.04 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 2q5c h ALA 39 CO -0.06 0.53 -0.32 0.66 0.00 0.00 0.00 179.25 180.05 2q5c h SER 40 N 1.05 0.46 -0.46 0.00 4.64 -0.12 0.35 113.55 119.46 2q5c h SER 40 Ca 0.28 -0.17 -0.07 0.00 -0.47 0.00 0.00 61.79 61.35 2q5c h SER 40 Cb -0.08 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 61.87 2q5c h SER 40 CO -0.06 0.76 0.02 0.50 -0.87 0.00 0.00 176.83 177.18 2q5c h LYS 41 N 0.38 0.81 -0.42 4.77 3.64 -0.94 0.24 116.57 125.04 2q5c h LYS 41 Ca 0.05 -0.25 -0.06 0.00 -1.27 0.00 0.00 60.65 59.12 2q5c h LYS 41 Cb 0.76 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.48 2q5c h LYS 41 CO 0.06 0.85 0.04 0.82 -2.27 0.00 0.00 179.45 178.95 2q5c h ILE 42 N 0.66 1.25 -0.64 2.00 2.04 -1.12 -1.54 117.51 120.16 2q5c h ILE 42 Ca 0.13 -0.95 0.01 0.00 1.00 0.00 0.00 64.86 65.06 2q5c h ILE 42 Cb 0.47 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 2q5c h ILE 42 CO 0.02 0.33 0.42 0.00 0.00 0.00 0.00 178.15 178.91 2q5c h ALA 43 N 0.92 0.82 -0.90 1.87 0.00 -0.79 -1.55 119.26 119.63 2q5c h ALA 43 Ca 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2q5c h ALA 43 Cb 0.43 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2q5c h ALA 43 CO 0.01 0.21 0.56 0.35 0.00 0.00 0.00 179.25 180.39 2q5c h PHE 44 N 0.84 1.16 0.00 0.00 3.57 -0.75 -1.67 116.94 120.08 2q5c h PHE 44 Ca 0.24 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.69 2q5c h PHE 44 Cb -0.06 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 38.29 2q5c h PHE 44 CO -0.04 0.75 -0.30 0.78 -2.23 0.00 0.00 178.31 177.28 2q5c h GLY 45 N 1.22 0.00 0.86 2.40 0.00 -0.72 -3.03 103.07 103.80 2q5c h GLY 45 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.65 2q5c h GLY 45 CO -0.07 0.00 -0.65 1.04 0.00 0.00 0.00 176.54 176.87 2q5c n LEU 46 N -3.74 0.59 0.22 3.11 4.77 -0.63 -4.59 117.00 116.73 2q5c n LEU 46 Ca -0.01 -0.03 0.08 0.00 -0.03 0.00 0.00 56.01 56.02 2q5c n LEU 46 Cb 0.40 -0.19 0.51 0.00 -2.33 0.00 0.00 43.42 41.80 2q5c n LEU 46 CO 0.35 0.10 0.83 0.06 -1.33 0.00 0.00 177.39 177.40 2q5c h GLN 47 N 0.00 0.00 -0.01 3.23 3.07 -1.20 0.14 115.11 120.34 2q5c h GLN 47 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2q5c h GLN 47 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.13 2q5c h GLN 47 CO 0.00 0.25 -0.06 -0.25 0.09 0.00 0.00 178.83 178.86 2q5c n ASP 48 N -3.75 0.73 -0.18 0.06 8.00 -1.26 -3.84 116.55 116.31 2q5c n ASP 48 Ca -0.01 -0.99 0.04 0.00 0.71 0.00 0.00 54.79 54.54 2q5c n ASP 48 Cb 0.36 -0.02 -0.00 0.00 -0.02 0.00 0.00 41.12 41.44 2q5c n ASP 48 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2q5c n GLU 49 N -0.59 2.33 -4.23 -1.24 1.02 0.45 -5.03 120.64 113.35 2q5c n GLU 49 Ca 0.18 -0.51 -0.13 0.00 -0.02 0.00 0.00 57.16 56.68 2q5c n GLU 49 Cb 0.27 -1.02 -0.10 0.00 -0.02 0.00 0.00 31.44 30.57 2q5c n GLU 49 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2q5c s VAL 50 N -1.23 0.77 -0.12 2.62 -7.23 -0.96 -4.93 120.40 109.33 2q5c s VAL 50 Ca 0.07 -1.98 0.16 0.00 -1.81 0.00 0.00 61.98 58.42 2q5c s VAL 50 Cb 0.07 -1.99 -0.13 0.00 0.56 0.00 0.00 36.38 34.88 2q5c s VAL 50 CO 0.21 -0.60 0.85 0.44 -0.31 0.00 0.00 175.10 175.69 2q5c h ASP 51 N 2.75 0.00 -4.92 4.85 3.32 -0.91 -3.46 116.42 118.05 2q5c h ASP 51 Ca -0.36 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.70 2q5c h ASP 51 Cb 1.19 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.62 2q5c h ASP 51 CO 0.63 0.59 0.28 0.00 -1.72 0.00 0.00 179.24 179.03 2q5c s ALA 52 N -2.91 -1.65 -0.04 3.45 0.00 -1.18 -4.24 121.76 115.20 2q5c s ALA 52 Ca -0.03 0.60 0.05 0.00 0.00 0.00 0.00 51.96 52.59 2q5c s ALA 52 Cb 0.09 0.78 -0.01 0.00 0.00 0.00 0.00 23.12 23.97 2q5c s ALA 52 CO 0.81 -0.75 -0.20 0.42 0.00 0.00 0.00 175.76 176.03 2q5c s ILE 53 N -3.60 1.64 -0.06 0.00 1.01 -0.38 -1.81 121.20 118.00 2q5c s ILE 53 Ca 0.02 -0.86 0.04 0.00 0.00 0.00 0.00 60.65 59.85 2q5c s ILE 53 Cb -0.01 -1.39 -0.02 0.00 0.01 0.00 0.00 42.46 41.05 2q5c s ILE 53 CO -0.12 0.47 -0.17 -0.63 0.00 0.00 0.00 174.94 174.49 2q5c s ILE 54 N -0.20 2.80 0.31 2.92 1.01 0.62 -0.36 121.20 128.30 2q5c s ILE 54 Ca 0.01 -0.81 -0.09 0.00 0.00 0.00 0.00 60.65 59.76 2q5c s ILE 54 Cb -0.11 -2.09 0.04 0.00 0.01 0.00 0.00 42.46 40.31 2q5c s ILE 54 CO 0.01 0.58 0.57 -1.54 0.00 0.00 0.00 174.94 174.56 2q5c n SER 55 N 2.58 -1.65 -4.18 3.58 3.41 -0.63 -1.38 113.62 115.36 2q5c n SER 55 Ca -0.17 -2.38 -0.19 0.00 -0.26 0.00 0.00 58.87 55.86 2q5c n SER 55 Cb 0.52 2.81 -0.12 0.00 -0.26 0.00 0.00 64.21 67.16 2q5c n SER 55 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2q5c s ARG 56 N -2.26 0.87 5.08 4.33 3.52 -1.26 -0.01 118.95 129.22 2q5c s ARG 56 Ca 0.16 -0.94 0.00 0.00 -0.13 0.00 0.00 55.73 54.82 2q5c s ARG 56 Cb -0.03 -0.90 0.00 0.00 -1.56 0.00 0.00 34.95 32.46 2q5c s ARG 56 CO 0.12 0.21 0.00 0.41 -0.81 0.00 0.00 175.30 175.23 2q5c n GLY 57 N 1.36 2.89 0.37 8.12 0.00 -1.19 -2.41 105.19 114.32 2q5c n GLY 57 Ca -0.21 -0.23 0.02 0.00 0.00 0.00 0.00 46.02 45.61 2q5c n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q5c h ALA 58 N -0.74 1.43 -0.95 4.61 0.00 -1.96 -1.27 119.26 120.38 2q5c h ALA 58 Ca 0.00 -0.04 0.10 0.00 0.00 0.00 0.00 54.91 54.97 2q5c h ALA 58 Cb 0.00 -0.31 -0.07 0.00 0.00 0.00 0.00 17.79 17.40 2q5c h ALA 58 CO 0.00 0.46 0.61 1.15 0.00 0.00 0.00 179.25 181.47 2q5c h THR 59 N 1.14 0.97 -0.14 0.00 2.02 -1.84 -1.20 112.91 113.85 2q5c h THR 59 Ca 0.38 -0.33 -0.05 0.00 0.77 0.00 0.00 66.41 67.18 2q5c h THR 59 Cb 0.07 -0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.38 2q5c h THR 59 CO -0.13 0.18 -0.13 0.77 0.37 0.00 0.00 175.52 176.58 2q5c h SER 60 N 0.97 0.21 -0.28 4.18 4.64 -1.08 -0.47 113.55 121.74 2q5c h SER 60 Ca 0.45 -0.04 -0.09 0.00 -0.47 0.00 0.00 61.79 61.64 2q5c h SER 60 Cb 0.40 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 2q5c h SER 60 CO -0.21 0.37 -0.16 -0.78 -0.87 0.00 0.00 176.83 175.19 2q5c h ASP 61 N 0.21 0.62 -0.87 4.97 1.82 -1.19 0.53 116.42 122.51 2q5c h ASP 61 Ca 0.04 -0.42 -0.00 0.00 -0.39 0.00 0.00 57.03 56.26 2q5c h ASP 61 Cb 0.37 -0.17 -0.04 0.00 0.68 0.00 0.00 39.33 40.17 2q5c h ASP 61 CO 0.02 0.91 0.54 1.88 -1.61 0.00 0.00 179.24 180.97 2q5c h TYR 62 N 0.33 1.14 -0.15 0.28 -1.99 -0.86 -2.53 116.97 113.19 2q5c h TYR 62 Ca 0.06 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.71 2q5c h TYR 62 Cb 0.69 -0.38 -0.00 0.00 2.00 0.00 0.00 36.73 39.04 2q5c h TYR 62 CO 0.06 0.75 -0.21 0.82 -0.00 0.00 0.00 178.16 179.59 2q5c h ILE 63 N 1.19 1.35 -0.57 -2.88 2.04 -1.00 -3.21 117.51 114.44 2q5c h ILE 63 Ca 0.31 -1.41 -0.01 0.00 1.00 0.00 0.00 64.86 64.75 2q5c h ILE 63 Cb -0.07 1.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.91 2q5c h ILE 63 CO -0.06 0.42 0.33 0.50 0.00 0.00 0.00 178.15 179.34 2q5c h LYS 64 N 0.03 0.77 0.00 2.37 3.64 -0.74 -1.34 116.57 121.30 2q5c h LYS 64 Ca 0.02 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2q5c h LYS 64 Cb 0.77 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2q5c h LYS 64 CO 0.05 0.55 0.00 1.63 -2.27 0.00 0.00 179.45 179.41 2q5c n LYS 65 N -4.41 0.13 0.00 1.90 5.02 -0.96 -3.87 118.16 115.97 2q5c n LYS 65 Ca 0.05 0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 2q5c n LYS 65 Cb 0.08 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.59 2q5c n LYS 65 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2q5c n SER 66 N -1.42 0.26 -4.59 4.39 3.41 -0.56 -5.05 113.62 110.06 2q5c n SER 66 Ca 0.08 -0.60 -0.24 0.00 -0.26 0.00 0.00 58.87 57.84 2q5c n SER 66 Cb 0.26 0.60 -0.08 0.00 -0.26 0.00 0.00 64.21 64.73 2q5c n SER 66 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2q5c s VAL 67 N -0.60 3.19 -1.90 -3.33 -7.23 -0.85 -4.84 120.40 104.83 2q5c s VAL 67 Ca 0.00 -1.91 0.18 0.00 -1.81 0.00 0.00 61.98 58.45 2q5c s VAL 67 Cb 0.00 -2.66 0.05 0.00 0.56 0.00 0.00 36.38 34.33 2q5c s VAL 67 CO 0.00 -0.29 0.99 -1.54 -0.31 0.00 0.00 175.10 173.95 2q5c n SER 68 N -0.52 2.04 -4.97 4.85 3.41 -1.26 -4.90 113.62 112.27 2q5c n SER 68 Ca -0.08 -1.52 -0.21 0.00 -0.26 0.00 0.00 58.87 56.80 2q5c n SER 68 Cb 0.58 0.31 0.02 0.00 -0.26 0.00 0.00 64.21 64.86 2q5c n SER 68 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2q5c s ILE 69 N -1.91 3.17 0.11 -1.33 -4.36 -1.26 -5.02 121.20 110.60 2q5c s ILE 69 Ca 0.17 -0.69 -0.34 0.00 -0.26 0.00 0.00 60.65 59.54 2q5c s ILE 69 Cb 0.15 -3.16 -0.14 0.00 1.25 0.00 0.00 42.46 40.57 2q5c s ILE 69 CO 0.38 -0.10 1.63 -2.65 0.24 0.00 0.00 174.94 174.44 2q5c n PRO 70 N -2.16 2.14 -4.06 0.37 -0.02 -1.26 -4.90 135.00 125.11 2q5c n PRO 70 Ca 0.06 0.78 -0.32 0.00 -2.02 0.00 0.00 63.50 61.99 2q5c n PRO 70 Cb 0.59 -2.56 -0.16 0.00 -0.02 0.00 0.00 33.50 31.35 2q5c n PRO 70 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2q5c s SER 71 N 1.48 3.36 -0.11 2.55 0.15 -1.26 -1.25 113.70 118.63 2q5c s SER 71 Ca 0.81 -0.82 -0.01 0.00 0.70 0.00 0.00 55.95 56.63 2q5c s SER 71 Cb -0.68 -1.38 -0.03 0.00 -1.71 0.00 0.00 66.02 62.22 2q5c s SER 71 CO 0.40 -0.08 -0.05 -0.63 1.20 0.00 0.00 173.24 174.08 2q5c s ILE 72 N 1.32 3.84 -0.22 6.45 1.09 0.51 -4.98 121.20 129.21 2q5c s ILE 72 Ca 0.01 -0.41 -0.08 0.00 -1.10 0.00 0.00 60.65 59.07 2q5c s ILE 72 Cb -0.15 -2.62 -0.04 0.00 -1.06 0.00 0.00 42.46 38.59 2q5c s ILE 72 CO -0.10 0.56 0.10 -0.55 -0.10 0.00 0.00 174.94 174.84 2q5c s SER 73 N -0.31 5.62 -0.12 3.58 0.15 -1.26 -1.60 113.70 119.76 2q5c s SER 73 Ca 0.05 -0.00 -0.29 0.00 0.70 0.00 0.00 55.95 56.40 2q5c s SER 73 Cb -0.12 -2.00 -0.02 0.00 -1.71 0.00 0.00 66.02 62.17 2q5c s SER 73 CO 0.02 0.07 1.21 -0.63 1.20 0.00 0.00 173.24 175.12 2q5c s ILE 74 N 1.00 4.32 0.14 6.45 1.01 0.98 -4.94 121.20 130.16 2q5c s ILE 74 Ca 0.05 1.61 -0.30 0.00 0.00 0.00 0.00 60.65 62.02 2q5c s ILE 74 Cb -0.14 -4.04 -0.07 0.00 0.01 0.00 0.00 42.46 38.23 2q5c s ILE 74 CO 0.03 -0.08 0.97 -0.54 0.00 0.00 0.00 174.94 175.32 2q5c s LYS 75 N 2.88 4.72 -0.01 2.79 -0.14 -1.26 -3.19 119.74 125.53 2q5c s LYS 75 Ca 0.54 1.48 -0.30 0.00 -1.36 0.00 0.00 55.97 56.33 2q5c s LYS 75 Cb -0.22 -3.35 -0.05 0.00 -1.68 0.00 0.00 37.83 32.53 2q5c s LYS 75 CO 0.17 0.26 1.33 0.08 -0.76 0.00 0.00 175.35 176.44 2q5c s VAL 76 N -0.24 3.87 0.38 3.17 1.01 -1.26 -5.01 120.40 122.32 2q5c s VAL 76 Ca 0.46 1.25 0.07 0.00 0.00 0.00 0.00 61.98 63.75 2q5c s VAL 76 Cb -0.24 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.34 2q5c s VAL 76 CO 0.31 0.00 0.53 0.42 0.00 0.00 0.00 175.10 176.36 2q5c s THR 77 N 2.27 3.60 0.17 3.92 -4.23 -1.26 -5.00 115.64 115.11 2q5c s THR 77 Ca 0.61 -0.96 -0.12 0.00 -1.18 0.00 0.00 61.69 60.05 2q5c s THR 77 Cb -0.29 -3.24 0.07 0.00 1.34 0.00 0.00 72.50 70.37 2q5c s THR 77 CO 0.25 -0.10 1.72 0.03 -0.54 0.00 0.00 174.62 175.98 2q5c h ARG 78 N 0.73 0.88 -0.14 3.99 3.08 -1.96 -1.84 114.38 119.13 2q5c h ARG 78 Ca -0.43 -0.17 -0.16 0.00 0.07 0.00 0.00 59.98 59.29 2q5c h ARG 78 Cb 1.27 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 31.17 2q5c h ARG 78 CO 0.50 0.77 -0.58 0.35 -1.07 0.00 0.00 179.97 179.94 2q5c h PHE 79 N 0.81 0.59 -0.65 3.04 3.57 -1.98 -0.62 116.94 121.70 2q5c h PHE 79 Ca 0.19 -0.22 0.07 0.00 3.53 0.00 0.00 57.97 61.54 2q5c h PHE 79 Cb 0.23 -0.11 -0.06 0.00 2.79 0.00 0.00 35.95 38.80 2q5c h PHE 79 CO 0.01 0.93 0.34 -0.44 -2.23 0.00 0.00 178.31 176.93 2q5c h ASP 80 N 0.35 0.48 -0.36 0.41 3.32 -1.82 0.16 116.42 118.97 2q5c h ASP 80 Ca -0.00 0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.04 2q5c h ASP 80 Cb 1.12 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 2q5c h ASP 80 CO 0.10 0.31 0.04 0.74 -1.72 0.00 0.00 179.24 178.71 2q5c h THR 81 N 0.62 1.25 -0.81 0.35 2.02 -0.90 -2.54 112.91 112.91 2q5c h THR 81 Ca 0.30 -0.90 -0.02 0.00 0.77 0.00 0.00 66.41 66.56 2q5c h THR 81 Cb 0.23 1.13 -0.04 0.00 -1.74 0.00 0.00 68.15 67.73 2q5c h THR 81 CO -0.20 0.30 0.43 -0.03 0.37 0.00 0.00 175.52 176.39 2q5c h MET 82 N 0.43 1.13 -0.72 6.66 1.85 -0.74 -0.91 114.93 122.63 2q5c h MET 82 Ca 0.11 -0.13 -0.01 0.00 -0.61 0.00 0.00 59.70 59.06 2q5c h MET 82 Cb 0.40 -0.22 -0.03 0.00 0.43 0.00 0.00 31.60 32.17 2q5c h MET 82 CO 0.01 0.84 0.43 0.00 -0.40 0.00 0.00 176.91 177.78 2q5c h ARG 83 N 1.13 0.99 -0.33 0.39 3.08 -0.87 -1.08 114.38 117.69 2q5c h ARG 83 Ca 0.28 -0.10 -0.11 0.00 0.07 0.00 0.00 59.98 60.13 2q5c h ARG 83 Cb 0.04 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 2q5c h ARG 83 CO -0.04 0.71 -0.21 0.00 -1.07 0.00 0.00 179.97 179.35 2q5c h ALA 84 N 1.22 0.47 -0.40 0.04 0.00 -0.95 -1.62 119.26 118.02 2q5c h ALA 84 Ca 0.26 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 2q5c h ALA 84 Cb -0.02 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2q5c h ALA 84 CO -0.05 0.43 0.12 0.28 0.00 0.00 0.00 179.25 180.03 2q5c h VAL 85 N 0.49 1.22 -0.63 0.00 2.07 -1.09 -0.15 116.25 118.16 2q5c h VAL 85 Ca 0.07 -0.72 0.09 0.00 0.82 0.00 0.00 66.70 66.96 2q5c h VAL 85 Cb 0.76 0.93 -0.07 0.00 -1.52 0.00 0.00 31.29 31.39 2q5c h VAL 85 CO 0.06 0.25 0.27 0.22 0.02 0.00 0.00 177.57 178.39 2q5c h TYR 86 N 0.51 0.48 -0.39 1.57 3.20 -1.10 -2.12 116.97 119.12 2q5c h TYR 86 Ca 0.13 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.91 2q5c h TYR 86 Cb 0.27 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 2q5c h TYR 86 CO 0.01 0.15 -0.22 -0.91 -1.64 0.00 0.00 178.16 175.55 2q5c h ASN 87 N 0.48 0.79 0.65 -2.11 2.35 -0.94 -3.02 115.58 113.78 2q5c h ASN 87 Ca 0.32 -0.28 -0.00 0.00 -0.55 0.00 0.00 56.30 55.78 2q5c h ASN 87 Cb 0.36 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.51 2q5c h ASN 87 CO -0.28 0.99 -0.00 0.00 -1.65 0.00 0.00 177.43 176.48 2q5c h ALA 88 N 1.07 1.00 0.00 -0.83 0.00 -0.39 -2.69 119.26 117.42 2q5c h ALA 88 Ca 0.09 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2q5c h ALA 88 Cb 0.73 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2q5c h ALA 88 CO 0.06 0.00 0.00 0.87 0.00 0.00 0.00 179.25 180.18 2q5c h LYS 89 N 0.00 0.00 0.00 0.00 1.57 -1.30 -0.72 116.57 116.12 2q5c h LYS 89 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2q5c h LYS 89 Cb 0.33 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 2q5c h LYS 89 CO 0.00 0.00 -0.05 0.07 -0.57 0.00 0.00 179.45 178.90 2q5c h ARG 90 N 0.00 0.00 0.00 3.15 0.11 -1.68 -2.57 114.38 113.39 2q5c h ARG 90 Ca 0.00 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.99 2q5c h ARG 90 Cb 0.17 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.24 2q5c h ARG 90 CO 0.00 0.05 -0.97 0.74 0.10 0.00 0.00 179.97 179.89 2q5c h PHE 91 N 0.00 0.00 0.00 4.08 0.04 -1.37 -3.50 116.94 116.19 2q5c h PHE 91 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2q5c h PHE 91 Cb 0.25 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.40 2q5c h PHE 91 CO 0.00 0.33 0.00 0.41 -0.60 0.00 0.00 178.31 178.45 2q5c n GLY 92 N 1.27 -0.34 0.59 -1.45 0.00 -0.97 -5.02 105.19 99.26 2q5c n GLY 92 Ca -0.03 -1.34 0.06 0.00 0.00 0.00 0.00 46.02 44.70 2q5c n GLY 92 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2q5c n ASN 93 N 0.00 2.97 -4.04 1.61 3.02 -1.26 -4.23 115.26 113.33 2q5c n ASN 93 Ca 0.00 -2.21 -0.31 0.00 -0.03 0.00 0.00 54.58 52.03 2q5c n ASN 93 Cb 0.00 -0.26 -0.16 0.00 -0.61 0.00 0.00 39.78 38.74 2q5c n ASN 93 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2q5c s GLU 94 N -1.38 2.39 0.11 3.52 2.12 -1.26 -0.42 118.70 123.79 2q5c s GLU 94 Ca 0.24 -0.68 0.05 0.00 0.36 0.00 0.00 54.97 54.94 2q5c s GLU 94 Cb 0.15 -2.27 -0.04 0.00 0.26 0.00 0.00 34.13 32.24 2q5c s GLU 94 CO 0.12 -0.27 -0.13 -0.51 -0.54 0.00 0.00 175.26 173.93 2q5c s LEU 95 N 1.42 2.40 -0.21 2.70 1.43 0.09 -4.36 118.68 122.16 2q5c s LEU 95 Ca 0.04 -0.80 -0.09 0.00 -1.03 0.00 0.00 54.13 52.25 2q5c s LEU 95 Cb -0.14 -0.47 -0.04 0.00 0.03 0.00 0.00 46.19 45.57 2q5c s LEU 95 CO -0.11 -0.18 0.10 0.00 0.23 0.00 0.00 176.35 176.40 2q5c s ALA 96 N -2.18 3.51 -0.25 4.21 0.00 0.14 -1.25 121.76 125.93 2q5c s ALA 96 Ca 0.07 -0.79 -0.07 0.00 0.00 0.00 0.00 51.96 51.17 2q5c s ALA 96 Cb -0.05 -2.09 -0.02 0.00 0.00 0.00 0.00 23.12 20.97 2q5c s ALA 96 CO 0.02 0.04 0.05 -1.17 0.00 0.00 0.00 175.76 174.70 2q5c s LEU 97 N 0.62 3.39 -0.21 0.00 2.96 -0.33 -0.59 118.68 124.51 2q5c s LEU 97 Ca 0.05 -0.30 -0.04 0.00 -0.22 0.00 0.00 54.13 53.63 2q5c s LEU 97 Cb -0.13 -1.89 -0.01 0.00 0.50 0.00 0.00 46.19 44.67 2q5c s LEU 97 CO 0.01 -0.05 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.32 2q5c s ILE 98 N 1.58 3.43 0.15 6.68 1.01 -0.50 -1.25 121.20 132.31 2q5c s ILE 98 Ca 0.06 -0.48 0.10 0.00 0.00 0.00 0.00 60.65 60.33 2q5c s ILE 98 Cb -0.15 -2.56 -0.04 0.00 0.01 0.00 0.00 42.46 39.72 2q5c s ILE 98 CO 0.02 0.43 -0.22 0.00 0.00 0.00 0.00 174.94 175.17 2q5c s ALA 99 N 1.38 2.19 -0.27 9.38 0.00 -0.42 -4.47 121.76 129.55 2q5c s ALA 99 Ca 0.05 -1.48 -0.27 0.00 0.00 0.00 0.00 51.96 50.25 2q5c s ALA 99 Cb -0.14 -0.28 0.01 0.00 0.00 0.00 0.00 23.12 22.71 2q5c s ALA 99 CO -0.02 0.38 0.97 -0.47 0.00 0.00 0.00 175.76 176.62 2q5c s TYR 100 N -1.56 3.26 0.00 0.00 5.04 -1.26 -1.59 117.35 121.24 2q5c s TYR 100 Ca 0.15 1.22 0.00 0.00 -2.44 0.00 0.00 57.07 56.00 2q5c s TYR 100 Cb -0.08 -3.35 0.00 0.00 0.35 0.00 0.00 41.96 38.88 2q5c s TYR 100 CO 0.07 -0.56 0.00 1.63 -1.34 0.00 0.00 175.55 175.35 2q5c n LYS 101 N 6.41 0.00 -3.94 4.97 5.02 0.11 -4.76 118.16 125.97 2q5c n LYS 101 Ca 0.09 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.29 2q5c n LYS 101 Cb 0.47 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.37 2q5c n LYS 101 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2q5c s HIS 102 N 0.00 0.18 0.47 2.13 3.76 -1.26 -4.88 115.29 115.68 2q5c s HIS 102 Ca 0.00 -0.37 -0.25 0.00 -0.15 0.00 0.00 55.06 54.29 2q5c s HIS 102 Cb 0.00 -0.14 -0.08 0.00 1.11 0.00 0.00 32.58 33.48 2q5c s HIS 102 CO 0.00 -0.19 1.40 0.43 -0.85 0.00 0.00 174.74 175.53 2q5c n SER 103 N 1.76 3.10 -0.09 1.40 7.64 -1.26 -4.87 113.62 121.30 2q5c n SER 103 Ca -0.22 1.09 -0.23 0.00 1.01 0.00 0.00 58.87 60.52 2q5c n SER 103 Cb 0.56 -1.59 -0.12 0.00 -1.01 0.00 0.00 64.21 62.05 2q5c n SER 103 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2q5c n ILE 104 N -0.37 1.59 -4.53 0.44 -0.00 -1.26 -4.96 119.36 110.27 2q5c n ILE 104 Ca 0.06 -0.28 -0.30 0.00 -0.00 0.00 0.00 62.75 62.24 2q5c n ILE 104 Cb 0.42 -1.90 -0.13 0.00 -0.00 0.00 0.00 39.64 38.03 2q5c n ILE 104 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 2q5c s VAL 105 N -2.45 2.42 0.01 1.39 0.11 -1.26 -4.75 120.40 115.88 2q5c s VAL 105 Ca -0.29 -1.54 -0.30 0.00 -2.93 0.00 0.00 61.98 56.91 2q5c s VAL 105 Cb 0.08 -2.05 -0.07 0.00 -1.53 0.00 0.00 36.38 32.81 2q5c s VAL 105 CO 0.62 0.19 1.65 -0.62 -3.33 0.00 0.00 175.10 173.61 2q5c s ASP 106 N -1.79 6.65 0.39 3.54 -1.08 -1.26 -4.89 116.67 118.22 2q5c s ASP 106 Ca 0.14 2.36 0.19 0.00 -0.52 0.00 0.00 52.55 54.73 2q5c s ASP 106 Cb -0.10 -2.55 0.75 0.00 -1.46 0.00 0.00 42.92 39.56 2q5c s ASP 106 CO 0.06 -0.89 1.77 0.07 0.52 0.00 0.00 175.17 176.69 2q5c h LYS 107 N 8.88 0.00 -0.32 4.34 5.09 -1.98 -1.63 116.57 130.94 2q5c h LYS 107 Ca -0.41 0.00 -0.09 0.00 0.09 0.00 0.00 60.65 60.24 2q5c h LYS 107 Cb 1.19 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 33.51 2q5c h LYS 107 CO 0.94 0.35 -0.17 0.45 -2.09 0.00 0.00 179.45 178.92 2q5c h HIS 108 N 0.00 0.64 -0.50 0.07 3.86 -1.94 -1.94 115.15 115.34 2q5c h HIS 108 Ca -0.00 -0.12 -0.04 0.00 -1.16 0.00 0.00 60.37 59.04 2q5c h HIS 108 Cb 0.83 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 29.12 2q5c h HIS 108 CO 0.00 0.72 0.14 1.49 0.86 0.00 0.00 177.93 181.14 2q5c h GLU 109 N 0.52 0.78 -0.02 2.45 4.81 -1.71 -1.68 114.58 119.73 2q5c h GLU 109 Ca 0.09 -0.18 0.02 0.00 -0.13 0.00 0.00 59.36 59.16 2q5c h GLU 109 Cb 0.60 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.84 2q5c h GLU 109 CO 0.04 0.74 -0.11 0.82 -0.73 0.00 0.00 179.01 179.77 2q5c h ILE 110 N 0.67 0.71 -0.50 2.32 2.04 -1.26 -1.06 117.51 120.43 2q5c h ILE 110 Ca 0.16 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.09 2q5c h ILE 110 Cb 0.29 0.71 -0.06 0.00 -0.74 0.00 0.00 36.82 37.02 2q5c h ILE 110 CO -0.00 0.00 0.15 -0.33 0.00 0.00 0.00 178.15 177.97 2q5c h GLU 111 N -0.18 0.31 -0.48 2.37 5.08 -1.21 0.77 114.58 121.23 2q5c h GLU 111 Ca 0.05 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 2q5c h GLU 111 Cb 0.25 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 2q5c h GLU 111 CO -0.13 0.20 0.21 0.00 -1.00 0.00 0.00 179.01 178.29 2q5c h ALA 112 N 1.35 0.62 -0.08 3.43 0.00 -1.10 -0.61 119.26 122.87 2q5c h ALA 112 Ca 0.25 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2q5c h ALA 112 Cb 0.29 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2q5c h ALA 112 CO -0.27 0.21 -0.17 0.52 0.00 0.00 0.00 179.25 179.54 2q5c h MET 113 N 0.63 0.26 -0.02 0.00 2.86 -0.49 -3.35 114.93 114.81 2q5c h MET 113 Ca 0.16 -0.17 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2q5c h MET 113 Cb 0.16 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.85 2q5c h MET 113 CO -0.02 0.76 -0.14 1.28 1.06 0.00 0.00 176.91 179.86 2q5c n LEU 114 N -4.57 2.64 -2.65 1.22 4.77 0.20 -4.98 117.00 113.63 2q5c n LEU 114 Ca -0.08 -0.93 -0.15 0.00 -0.03 0.00 0.00 56.01 54.83 2q5c n LEU 114 Cb 0.39 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.54 2q5c n LEU 114 CO 0.39 0.45 0.13 0.61 -1.33 0.00 0.00 177.39 177.64 2q5c n GLY 115 N 1.33 -0.09 3.49 -0.72 0.00 -0.25 -5.03 105.19 103.92 2q5c n GLY 115 Ca 0.12 -0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.85 2q5c n GLY 115 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2q5c s VAL 116 N -3.23 1.79 -0.15 1.61 -7.23 -1.16 -4.99 120.40 107.04 2q5c s VAL 116 Ca 0.24 -2.11 -0.03 0.00 -1.81 0.00 0.00 61.98 58.27 2q5c s VAL 116 Cb -0.11 -2.63 -0.03 0.00 0.56 0.00 0.00 36.38 34.18 2q5c s VAL 116 CO 0.50 -0.19 -0.05 -0.75 -0.31 0.00 0.00 175.10 174.31 2q5c s LYS 117 N -3.72 3.64 -0.08 4.82 2.20 0.44 -4.49 119.74 122.56 2q5c s LYS 117 Ca 0.32 -0.54 0.02 0.00 -0.36 0.00 0.00 55.97 55.42 2q5c s LYS 117 Cb 0.05 -2.89 0.01 0.00 -1.51 0.00 0.00 37.83 33.50 2q5c s LYS 117 CO 0.14 0.24 -0.14 0.42 -0.36 0.00 0.00 175.35 175.66 2q5c s ILE 118 N 0.36 1.27 -0.21 5.43 1.01 -1.26 -0.73 121.20 127.07 2q5c s ILE 118 Ca -0.05 -0.55 -0.07 0.00 0.00 0.00 0.00 60.65 59.99 2q5c s ILE 118 Cb -0.14 -1.16 -0.03 0.00 0.01 0.00 0.00 42.46 41.14 2q5c s ILE 118 CO 0.03 0.39 0.05 -0.75 0.00 0.00 0.00 174.94 174.66 2q5c s LYS 119 N 0.70 3.74 -0.08 2.79 2.20 -0.38 -4.99 119.74 123.72 2q5c s LYS 119 Ca -0.14 -0.45 -0.14 0.00 -0.36 0.00 0.00 55.97 54.89 2q5c s LYS 119 Cb -0.16 -3.22 -0.05 0.00 -1.51 0.00 0.00 37.83 32.90 2q5c s LYS 119 CO 0.03 0.01 0.33 -2.00 -0.36 0.00 0.00 175.35 173.37 2q5c s GLU 120 N 1.06 3.99 -0.03 4.03 2.12 -1.26 -1.19 118.70 127.42 2q5c s GLU 120 Ca 0.03 0.22 0.04 0.00 0.36 0.00 0.00 54.97 55.63 2q5c s GLU 120 Cb -0.14 -3.31 -0.00 0.00 0.26 0.00 0.00 34.13 30.94 2q5c s GLU 120 CO 0.03 0.50 -0.16 -0.06 -0.54 0.00 0.00 175.26 175.03 2q5c s PHE 121 N -0.39 1.51 -0.00 5.30 0.08 -0.38 -4.95 117.98 119.15 2q5c s PHE 121 Ca 0.20 -0.38 0.03 0.00 0.12 0.00 0.00 56.93 56.90 2q5c s PHE 121 Cb -0.15 -1.01 -0.03 0.00 -0.57 0.00 0.00 43.02 41.26 2q5c s PHE 121 CO 0.08 -0.11 -0.08 -0.51 -0.10 0.00 0.00 175.22 174.50 2q5c s LEU 122 N -0.06 3.12 0.07 -0.37 1.43 -1.26 -1.31 118.68 120.30 2q5c s LEU 122 Ca -0.01 -0.15 0.04 0.00 -1.03 0.00 0.00 54.13 52.98 2q5c s LEU 122 Cb -0.09 -1.78 -0.03 0.00 0.03 0.00 0.00 46.19 44.32 2q5c s LEU 122 CO 0.01 0.29 -0.12 0.72 0.23 0.00 0.00 176.35 177.48 2q5c s PHE 123 N -0.97 1.06 0.00 0.29 -0.12 -0.62 -4.92 117.98 112.70 2q5c s PHE 123 Ca 0.16 -0.52 0.00 0.00 -0.05 0.00 0.00 56.93 56.52 2q5c s PHE 123 Cb -0.11 -0.59 0.00 0.00 -0.63 0.00 0.00 43.02 41.69 2q5c s PHE 123 CO 0.07 0.01 0.31 0.43 -0.05 0.00 0.00 175.22 175.99 2q5c n SER 124 N 1.12 0.61 -3.65 1.98 7.64 -1.26 0.08 113.62 120.14 2q5c n SER 124 Ca -0.20 -0.82 -0.15 0.00 1.01 0.00 0.00 58.87 58.71 2q5c n SER 124 Cb 0.55 0.32 -0.08 0.00 -1.01 0.00 0.00 64.21 63.99 2q5c n SER 124 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2q5c s SER 125 N -0.32 -0.47 0.38 6.43 0.15 -1.26 -4.96 113.70 113.66 2q5c s SER 125 Ca 0.00 0.58 0.13 0.00 0.70 0.00 0.00 55.95 57.37 2q5c s SER 125 Cb 0.00 0.60 0.95 0.00 -1.71 0.00 0.00 66.02 65.86 2q5c s SER 125 CO 0.00 -0.45 1.85 -0.08 1.20 0.00 0.00 173.24 175.76 2q5c h GLU 126 N 3.85 0.53 0.00 5.44 4.81 -2.00 -1.75 114.58 125.46 2q5c h GLU 126 Ca -0.28 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.92 2q5c h GLU 126 Cb 1.16 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.42 2q5c h GLU 126 CO 0.34 0.35 0.00 -0.25 -0.73 0.00 0.00 179.01 178.72 2q5c n ASP 127 N -4.56 0.00 0.04 1.04 8.00 -1.26 -2.35 116.55 117.46 2q5c n ASP 127 Ca 0.19 0.20 0.12 0.00 0.71 0.00 0.00 54.79 56.01 2q5c n ASP 127 Cb 0.60 -0.35 0.09 0.00 -0.02 0.00 0.00 41.12 41.44 2q5c n ASP 127 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2q5c n GLU 128 N -1.35 0.27 -0.02 -1.24 1.02 -0.66 -4.60 120.64 114.06 2q5c n GLU 128 Ca 0.06 0.03 -0.11 0.00 -0.02 0.00 0.00 57.16 57.12 2q5c n GLU 128 Cb 0.14 -1.63 -0.06 0.00 -0.02 0.00 0.00 31.44 29.88 2q5c n GLU 128 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 2q5c h ILE 129 N 0.00 1.13 -0.80 -3.67 2.04 -1.60 -0.75 117.51 113.86 2q5c h ILE 129 Ca 0.00 -0.38 -0.04 0.00 1.00 0.00 0.00 64.86 65.45 2q5c h ILE 129 Cb 0.72 1.15 -0.04 0.00 -0.74 0.00 0.00 36.82 37.92 2q5c h ILE 129 CO 0.00 0.12 0.35 0.71 0.00 0.00 0.00 178.15 179.33 2q5c h THR 130 N 0.06 1.26 -0.44 -0.27 1.35 -1.81 -1.37 112.91 111.69 2q5c h THR 130 Ca 0.04 -0.76 -0.10 0.00 -0.55 0.00 0.00 66.41 65.05 2q5c h THR 130 Cb 0.13 0.27 -0.01 0.00 -1.73 0.00 0.00 68.15 66.81 2q5c h THR 130 CO -0.00 0.32 -0.10 0.74 -0.25 0.00 0.00 175.52 176.22 2q5c h THR 131 N 1.14 1.27 -0.90 6.82 2.02 -1.79 -2.07 112.91 119.40 2q5c h THR 131 Ca 0.27 -1.21 -0.01 0.00 0.77 0.00 0.00 66.41 66.24 2q5c h THR 131 Cb 0.16 1.15 -0.04 0.00 -1.74 0.00 0.00 68.15 67.68 2q5c h THR 131 CO -0.03 0.41 0.53 0.25 0.37 0.00 0.00 175.52 177.05 2q5c h LEU 132 N 0.67 1.09 -0.55 2.58 5.85 -0.68 -0.12 115.31 124.14 2q5c h LEU 132 Ca 0.11 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 2q5c h LEU 132 Cb 0.63 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 2q5c h LEU 132 CO 0.04 0.84 0.27 0.40 -0.34 0.00 0.00 178.44 179.66 2q5c h ILE 133 N 1.24 1.20 -0.92 4.05 1.08 -1.10 -1.37 117.51 121.70 2q5c h ILE 133 Ca 0.32 -0.55 0.05 0.00 -0.39 0.00 0.00 64.86 64.29 2q5c h ILE 133 Cb -0.04 0.55 -0.06 0.00 -3.07 0.00 0.00 36.82 34.21 2q5c h ILE 133 CO -0.06 0.22 0.59 0.28 -0.69 0.00 0.00 178.15 178.49 2q5c h SER 134 N 0.74 0.95 -0.48 1.72 0.02 -0.90 -2.02 113.55 113.59 2q5c h SER 134 Ca 0.19 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 61.16 2q5c h SER 134 Cb 0.11 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.41 2q5c h SER 134 CO -0.03 0.63 0.29 0.50 -1.14 0.00 0.00 176.83 177.09 2q5c h LYS 135 N 1.10 0.56 -0.64 3.45 3.64 -0.45 -2.24 116.57 121.99 2q5c h LYS 135 Ca 0.38 -0.03 0.13 0.00 -1.27 0.00 0.00 60.65 59.86 2q5c h LYS 135 Cb 0.09 -0.13 -0.10 0.00 -0.41 0.00 0.00 32.23 31.68 2q5c h LYS 135 CO -0.15 0.37 0.10 0.28 -2.27 0.00 0.00 179.45 177.78 2q5c h VAL 136 N 0.58 0.56 -0.82 2.00 2.07 -0.55 -1.55 116.25 118.53 2q5c h VAL 136 Ca 0.19 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.64 2q5c h VAL 136 Cb 0.02 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 30.08 2q5c h VAL 136 CO -0.09 0.04 0.52 0.11 0.02 0.00 0.00 177.57 178.17 2q5c h LYS 137 N 0.21 1.09 0.00 1.57 1.57 -1.00 -1.35 116.57 118.67 2q5c h LYS 137 Ca 0.34 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2q5c h LYS 137 Cb 0.54 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.61 2q5c h LYS 137 CO -0.47 0.75 0.00 1.79 -0.57 0.00 0.00 179.45 180.95 2q5c h THR 138 N 1.12 0.00 -0.20 -0.16 1.35 -0.74 -0.65 112.91 113.63 2q5c h THR 138 Ca 0.30 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 2q5c h THR 138 Cb -0.09 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 67.68 2q5c h THR 138 CO -0.06 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 174.59 2q5c n GLU 139 N -3.00 1.59 -2.67 4.72 -0.58 -0.53 -4.92 120.64 115.26 2q5c n GLU 139 Ca -0.00 -0.90 -0.19 0.00 -0.42 0.00 0.00 57.16 55.64 2q5c n GLU 139 Cb 0.25 -1.29 0.01 0.00 -0.57 0.00 0.00 31.44 29.84 2q5c n GLU 139 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2q5c n ASN 140 N 0.17 -5.52 -4.67 1.62 5.15 -0.25 -5.00 115.26 106.76 2q5c n ASN 140 Ca 0.13 -0.15 -0.35 0.00 -0.60 0.00 0.00 54.58 53.61 2q5c n ASN 140 Cb 0.25 -4.45 -0.10 0.00 -0.53 0.00 0.00 39.78 34.95 2q5c n ASN 140 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2q5c s ILE 141 N -3.03 4.49 -1.12 -1.44 1.01 -1.11 -5.00 121.20 115.00 2q5c s ILE 141 Ca 0.15 -0.17 0.10 0.00 0.00 0.00 0.00 60.65 60.73 2q5c s ILE 141 Cb -0.06 -2.94 0.06 0.00 0.01 0.00 0.00 42.46 39.53 2q5c s ILE 141 CO 0.18 0.56 0.76 0.29 0.00 0.00 0.00 174.94 176.73 2q5c n LYS 142 N 2.65 0.73 -4.17 2.79 5.02 -1.26 -4.34 118.16 119.57 2q5c n LYS 142 Ca -0.18 -0.97 -0.21 0.00 -2.02 0.00 0.00 58.31 54.93 2q5c n LYS 142 Cb 0.53 -1.16 -0.17 0.00 -0.02 0.00 0.00 35.03 34.22 2q5c n LYS 142 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2q5c s ILE 143 N -0.91 0.64 -0.09 -0.18 1.01 -1.26 -0.54 121.20 119.87 2q5c s ILE 143 Ca 0.10 -0.16 0.04 0.00 0.00 0.00 0.00 60.65 60.63 2q5c s ILE 143 Cb 0.08 -0.66 0.00 0.00 0.01 0.00 0.00 42.46 41.89 2q5c s ILE 143 CO 0.14 0.26 -0.22 -0.69 0.00 0.00 0.00 174.94 174.43 2q5c s VAL 144 N 1.03 1.89 -0.21 2.92 1.01 0.23 -0.69 120.40 126.58 2q5c s VAL 144 Ca -0.09 -0.92 -0.02 0.00 0.00 0.00 0.00 61.98 60.95 2q5c s VAL 144 Cb -0.14 -1.63 0.01 0.00 0.00 0.00 0.00 36.38 34.61 2q5c s VAL 144 CO -0.00 0.52 -0.10 -0.69 0.00 0.00 0.00 175.10 174.83 2q5c s VAL 145 N 0.34 2.84 0.01 2.92 1.01 0.25 -0.74 120.40 127.02 2q5c s VAL 145 Ca -0.16 -0.74 -0.01 0.00 0.00 0.00 0.00 61.98 61.07 2q5c s VAL 145 Cb -0.17 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 33.92 2q5c s VAL 145 CO 0.07 0.42 0.06 -0.24 0.00 0.00 0.00 175.10 175.42 2q5c n SER 146 N 4.71 -0.10 -4.70 3.32 2.88 -1.06 -1.40 113.62 117.27 2q5c n SER 146 Ca -0.19 -1.05 -0.29 0.00 -1.33 0.00 0.00 58.87 56.01 2q5c n SER 146 Cb 0.50 0.16 0.16 0.00 -0.75 0.00 0.00 64.21 64.28 2q5c n SER 146 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2q5c s GLY 147 N -2.01 1.58 0.23 0.46 0.00 -1.26 -0.57 107.32 105.75 2q5c s GLY 147 Ca 0.01 -0.32 -0.07 0.00 0.00 0.00 0.00 44.72 44.34 2q5c s GLY 147 CO 0.00 0.25 1.86 1.70 0.00 0.00 0.00 173.10 176.92 2q5c h LYS 148 N -1.75 1.23 -0.63 2.90 1.63 -1.96 0.28 116.57 118.27 2q5c h LYS 148 Ca -0.53 -0.13 -0.05 0.00 -0.85 0.00 0.00 60.65 59.09 2q5c h LYS 148 Cb 1.32 -0.25 -0.03 0.00 -0.60 0.00 0.00 32.23 32.67 2q5c h LYS 148 CO 0.58 0.89 0.20 1.15 -3.45 0.00 0.00 179.45 178.82 2q5c h THR 149 N 1.24 1.25 -0.24 1.00 2.02 -1.99 0.06 112.91 116.24 2q5c h THR 149 Ca 0.32 -0.84 -0.05 0.00 0.77 0.00 0.00 66.41 66.61 2q5c h THR 149 Cb -0.00 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 2q5c h THR 149 CO -0.05 0.32 -0.03 0.58 0.37 0.00 0.00 175.52 176.71 2q5c h VAL 150 N 0.91 1.27 -0.15 3.16 2.07 -1.78 -2.30 116.25 119.43 2q5c h VAL 150 Ca 0.21 -0.98 -0.09 0.00 0.82 0.00 0.00 66.70 66.66 2q5c h VAL 150 Cb 0.28 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 2q5c h VAL 150 CO -0.01 0.30 -0.32 0.71 0.02 0.00 0.00 177.57 178.28 2q5c h THR 151 N 0.21 1.27 -0.75 2.57 1.35 -0.79 -0.96 112.91 115.81 2q5c h THR 151 Ca 0.07 -1.32 0.00 0.00 -0.55 0.00 0.00 66.41 64.61 2q5c h THR 151 Cb 0.46 1.52 -0.04 0.00 -1.73 0.00 0.00 68.15 68.36 2q5c h THR 151 CO 0.02 0.40 0.47 0.44 -0.25 0.00 0.00 175.52 176.60 2q5c h ASP 152 N 0.25 0.88 -0.43 5.36 3.32 -0.92 -1.21 116.42 123.68 2q5c h ASP 152 Ca 0.03 -0.04 -0.09 0.00 0.02 0.00 0.00 57.03 56.95 2q5c h ASP 152 Cb 0.69 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.00 2q5c h ASP 152 CO 0.05 0.66 -0.06 -0.08 -1.72 0.00 0.00 179.24 178.10 2q5c h GLU 153 N 1.02 0.86 -0.19 3.56 4.57 -0.85 -1.12 114.58 122.43 2q5c h GLU 153 Ca 0.27 -0.27 0.04 0.00 -1.18 0.00 0.00 59.36 58.22 2q5c h GLU 153 Cb -0.08 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.39 2q5c h GLU 153 CO -0.05 0.90 -0.08 0.00 -1.18 0.00 0.00 179.01 178.59 2q5c h ALA 154 N 1.14 0.08 -0.54 2.92 0.00 -0.72 -1.19 119.26 120.95 2q5c h ALA 154 Ca 0.14 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 2q5c h ALA 154 Cb 0.55 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2q5c h ALA 154 CO 0.03 -0.51 0.02 0.82 0.00 0.00 0.00 179.25 179.61 2q5c h ILE 155 N -0.06 1.25 -0.83 0.00 2.04 -1.04 0.75 117.51 119.62 2q5c h ILE 155 Ca 0.10 -1.04 0.01 0.00 1.00 0.00 0.00 64.86 64.93 2q5c h ILE 155 Cb 0.21 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 37.06 2q5c h ILE 155 CO -0.23 0.38 0.55 0.50 0.00 0.00 0.00 178.15 179.34 2q5c h LYS 156 N 0.85 1.08 -0.45 2.37 3.64 -0.78 -0.71 116.57 122.57 2q5c h LYS 156 Ca 0.16 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2q5c h LYS 156 Cb 0.47 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 2q5c h LYS 156 CO 0.02 0.72 0.00 1.04 -2.27 0.00 0.00 179.45 178.96 2q5c n GLN 157 N -4.41 1.92 -0.86 1.90 6.02 -0.49 -4.90 117.38 116.56 2q5c n GLN 157 Ca 0.09 -1.08 0.00 0.00 -0.01 0.00 0.00 57.00 56.00 2q5c n GLN 157 Cb 0.03 -1.40 0.00 0.00 1.02 0.00 0.00 30.24 29.90 2q5c n GLN 157 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2q5c n GLY 158 N 0.74 0.49 4.00 1.08 0.00 -0.27 -5.05 105.19 106.17 2q5c n GLY 158 Ca 0.10 -0.90 -0.18 0.00 0.00 0.00 0.00 46.02 45.04 2q5c n GLY 158 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2q5c s LEU 159 N 0.00 3.76 0.22 0.99 1.43 0.21 -4.98 118.68 120.30 2q5c s LEU 159 Ca 0.00 -0.35 -0.22 0.00 -1.03 0.00 0.00 54.13 52.53 2q5c s LEU 159 Cb 0.00 -2.66 -0.08 0.00 0.03 0.00 0.00 46.19 43.47 2q5c s LEU 159 CO 0.00 -0.63 0.77 -0.31 0.23 0.00 0.00 176.35 176.41 2q5c s TYR 160 N -2.29 3.74 -0.05 0.29 2.02 0.30 -3.81 117.35 117.54 2q5c s TYR 160 Ca 0.51 1.52 0.03 0.00 -0.37 0.00 0.00 57.07 58.76 2q5c s TYR 160 Cb -0.10 -2.71 0.01 0.00 -0.40 0.00 0.00 41.96 38.77 2q5c s TYR 160 CO 0.32 0.38 -0.13 0.20 -1.57 0.00 0.00 175.55 174.75 2q5c s GLY 161 N -1.47 0.78 -0.17 0.71 0.00 -1.26 -0.60 107.32 105.31 2q5c s GLY 161 Ca 0.41 -0.46 -0.00 0.00 0.00 0.00 0.00 44.72 44.68 2q5c s GLY 161 CO 0.23 -0.01 -0.07 1.85 0.00 0.00 0.00 173.10 175.10 2q5c s GLU 162 N 0.47 1.64 0.17 2.90 2.56 0.08 -4.97 118.70 121.54 2q5c s GLU 162 Ca -0.11 -0.60 -0.29 0.00 0.00 0.00 0.00 54.97 53.98 2q5c s GLU 162 Cb -0.14 -2.11 -0.07 0.00 2.00 0.00 0.00 34.13 33.81 2q5c s GLU 162 CO 0.03 -0.42 0.91 0.99 -0.56 0.00 0.00 175.26 176.22 2q5c s THR 163 N 1.57 4.32 -0.20 -1.70 2.01 -1.26 -2.55 115.64 117.83 2q5c s THR 163 Ca 0.01 2.00 -0.27 0.00 0.31 0.00 0.00 61.69 63.73 2q5c s THR 163 Cb -0.15 -4.29 -0.00 0.00 0.01 0.00 0.00 72.50 68.07 2q5c s THR 163 CO -0.08 0.42 0.93 -0.63 -0.69 0.00 0.00 174.62 174.57 2q5c s ILE 164 N -0.63 4.78 0.49 1.82 1.01 0.27 -4.82 121.20 124.12 2q5c s ILE 164 Ca 0.42 1.82 0.08 0.00 0.00 0.00 0.00 60.65 62.98 2q5c s ILE 164 Cb -0.24 -4.22 0.04 0.00 0.01 0.00 0.00 42.46 38.05 2q5c s ILE 164 CO 0.30 -0.08 0.68 0.20 0.00 0.00 0.00 174.94 176.04 2q5c s ASN 165 N 1.21 5.39 0.03 3.58 0.01 -1.26 -4.75 114.94 119.15 2q5c s ASN 165 Ca 0.41 -0.57 0.04 0.00 -0.71 0.00 0.00 52.86 52.03 2q5c s ASN 165 Cb -0.16 -0.28 -0.02 0.00 0.41 0.00 0.00 41.25 41.20 2q5c s ASN 165 CO 0.10 -1.04 -0.11 -0.44 -1.51 0.00 0.00 177.10 174.10 2q5c s SER 166 N -4.49 1.28 0.27 -1.22 0.01 -1.26 -4.80 113.70 103.49 2q5c s SER 166 Ca 0.58 -0.43 0.02 0.00 1.31 0.00 0.00 55.95 57.43 2q5c s SER 166 Cb -0.08 -0.06 0.02 0.00 0.21 0.00 0.00 66.02 66.11 2q5c s SER 166 CO 0.36 -0.03 0.18 0.61 0.41 0.00 0.00 173.24 174.77 2q5c n GLY 167 N 1.92 3.01 0.18 3.44 0.00 -1.26 -4.76 105.19 107.72 2q5c n GLY 167 Ca -0.19 -2.24 -0.08 0.00 0.00 0.00 0.00 46.02 43.51 2q5c n GLY 167 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2q5c h GLU 168 N 0.00 0.54 -0.70 1.61 4.81 -1.99 -2.44 114.58 116.41 2q5c h GLU 168 Ca -0.18 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 58.96 2q5c h GLU 168 Cb 0.64 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.87 2q5c h GLU 168 CO 0.28 0.40 0.28 1.49 -0.73 0.00 0.00 179.01 180.73 2q5c h GLU 169 N 0.53 1.05 -0.87 1.92 4.57 -1.99 0.33 114.58 120.11 2q5c h GLU 169 Ca 0.14 -0.19 -0.00 0.00 -1.18 0.00 0.00 59.36 58.13 2q5c h GLU 169 Cb -0.00 -0.17 -0.04 0.00 -0.16 0.00 0.00 28.75 28.37 2q5c h GLU 169 CO -0.03 0.87 0.55 0.77 -1.18 0.00 0.00 179.01 179.99 2q5c h SER 170 N 1.01 1.04 -0.29 1.04 0.02 -1.93 -0.91 113.55 113.52 2q5c h SER 170 Ca 0.23 -0.05 -0.19 0.00 -0.84 0.00 0.00 61.79 60.94 2q5c h SER 170 Cb 0.21 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2q5c h SER 170 CO -0.02 0.78 -0.55 0.25 -1.14 0.00 0.00 176.83 176.16 2q5c h LEU 171 N 1.20 0.98 -0.80 5.07 5.85 -0.93 -1.63 115.31 125.05 2q5c h LEU 171 Ca 0.32 -0.53 0.03 0.00 0.84 0.00 0.00 57.88 58.54 2q5c h LEU 171 Cb -0.08 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 40.62 2q5c h LEU 171 CO -0.06 1.33 0.51 0.03 -0.34 0.00 0.00 178.44 179.91 2q5c h ARG 172 N 0.68 0.98 -0.78 1.25 3.08 -0.68 -1.21 114.38 117.71 2q5c h ARG 172 Ca 0.01 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 59.96 2q5c h ARG 172 Cb 1.16 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.95 2q5c h ARG 172 CO 0.12 0.65 0.29 0.00 -1.07 0.00 0.00 179.97 179.96 2q5c h ARG 173 N 1.01 1.18 -0.46 0.04 3.08 -1.02 -1.05 114.38 117.16 2q5c h ARG 173 Ca 0.31 -0.23 -0.09 0.00 0.07 0.00 0.00 59.98 60.05 2q5c h ARG 173 Cb -0.02 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 2q5c h ARG 173 CO -0.10 0.97 -0.08 0.00 -1.07 0.00 0.00 179.97 179.68 2q5c h ALA 174 N 1.15 0.99 -0.34 0.04 0.00 -0.84 -1.16 119.26 119.10 2q5c h ALA 174 Ca 0.26 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2q5c h ALA 174 Cb 0.24 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2q5c h ALA 174 CO -0.02 0.61 0.10 0.82 0.00 0.00 0.00 179.25 180.76 2q5c h ILE 175 N 0.74 1.21 -0.52 0.00 2.04 -0.92 -0.22 117.51 119.84 2q5c h ILE 175 Ca 0.13 -0.68 0.06 0.00 1.00 0.00 0.00 64.86 65.36 2q5c h ILE 175 Cb 0.57 1.01 -0.05 0.00 -0.74 0.00 0.00 36.82 37.61 2q5c h ILE 175 CO 0.03 0.23 0.23 -0.08 0.00 0.00 0.00 178.15 178.57 2q5c h GLU 176 N 0.40 0.43 -0.63 2.37 4.81 -0.97 0.54 114.58 121.53 2q5c h GLU 176 Ca 0.11 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 2q5c h GLU 176 Cb 0.26 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 2q5c h GLU 176 CO -0.00 0.29 0.35 1.49 -0.73 0.00 0.00 179.01 180.40 2q5c h GLU 177 N 0.44 0.87 -0.29 1.92 4.81 -0.92 -1.48 114.58 119.93 2q5c h GLU 177 Ca 0.24 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.36 2q5c h GLU 177 Cb 0.21 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 2q5c h GLU 177 CO -0.21 0.65 0.11 0.00 -0.73 0.00 0.00 179.01 178.84 2q5c h ALA 178 N 1.17 0.37 -0.70 2.92 0.00 -0.44 -1.02 119.26 121.56 2q5c h ALA 178 Ca 0.22 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2q5c h ALA 178 Cb 0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2q5c h ALA 178 CO -0.04 -0.03 0.36 -0.07 0.00 0.00 0.00 179.25 179.48 2q5c h LEU 179 N 0.31 0.87 -0.51 0.00 3.38 -0.67 -0.26 115.31 118.43 2q5c h LEU 179 Ca 0.10 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 2q5c h LEU 179 Cb 0.18 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 2q5c h LEU 179 CO -0.01 0.72 -0.03 0.78 0.09 0.00 0.00 178.44 179.99 2q5c h ASN 180 N 0.98 0.90 -0.62 -0.43 2.35 -0.89 -2.16 115.58 115.71 2q5c h ASN 180 Ca 0.24 -0.32 -0.09 0.00 -0.55 0.00 0.00 56.30 55.58 2q5c h ASN 180 Cb 0.06 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.16 2q5c h ASN 180 CO -0.04 1.01 0.03 -0.07 -1.65 0.00 0.00 177.43 176.71 2q5c h LEU 181 N 0.78 1.06 -0.34 1.61 4.07 -0.68 -1.58 115.31 120.23 2q5c h LEU 181 Ca 0.14 -0.29 -0.01 0.00 0.08 0.00 0.00 57.88 57.80 2q5c h LEU 181 Cb 0.56 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 42.00 2q5c h LEU 181 CO 0.03 1.09 0.16 0.40 -1.08 0.00 0.00 178.44 179.04 2q5c h ILE 182 N 1.00 1.16 -0.81 1.22 2.04 -0.96 -0.45 117.51 120.71 2q5c h ILE 182 Ca 0.18 -0.47 0.02 0.00 1.00 0.00 0.00 64.86 65.59 2q5c h ILE 182 Cb 0.53 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 2q5c h ILE 182 CO 0.03 0.17 0.53 -0.08 0.00 0.00 0.00 178.15 178.79 2q5c h GLU 183 N 0.41 1.02 -0.21 2.37 4.81 -1.15 -0.90 114.58 120.93 2q5c h GLU 183 Ca 0.12 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.26 2q5c h GLU 183 Cb 0.12 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 2q5c h GLU 183 CO -0.01 0.67 0.02 0.28 -0.73 0.00 0.00 179.01 179.24 2q5c h VAL 184 N 1.05 1.24 -0.68 0.32 2.07 -1.03 -2.95 116.25 116.27 2q5c h VAL 184 Ca 0.31 -0.80 0.02 0.00 0.82 0.00 0.00 66.70 67.05 2q5c h VAL 184 Cb -0.06 1.35 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 2q5c h VAL 184 CO -0.09 0.25 0.45 -0.09 0.02 0.00 0.00 177.57 178.11 2q5c h ARG 185 N 0.15 0.83 0.00 1.57 2.43 -0.75 -3.51 114.38 115.10 2q5c h ARG 185 Ca 0.06 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2q5c h ARG 185 Cb 0.35 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 2q5c h ARG 185 CO 0.01 0.55 0.00 0.09 -1.51 0.00 0.00 179.97 179.11