#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 0.45 -4.74 2.46 4.77 -1.26 -4.90 117.00 113.78 2q5c n LEU 1 Ca 0.00 0.05 -0.41 0.00 -0.03 0.00 0.00 56.01 55.62 2q5c n LEU 1 Cb 0.00 -0.28 -0.04 0.00 -2.33 0.00 0.00 43.42 40.78 2q5c n LEU 1 CO 0.00 0.11 0.83 -0.44 -1.33 0.00 0.00 177.39 176.56 2q5c s SER 2 N -3.00 7.18 0.17 -1.43 0.01 -1.26 -5.03 113.70 110.35 2q5c s SER 2 Ca 0.11 2.19 -0.15 0.00 1.31 0.00 0.00 55.95 59.42 2q5c s SER 2 Cb 0.18 -2.61 -0.07 0.00 0.21 0.00 0.00 66.02 63.73 2q5c s SER 2 CO 0.68 -0.27 0.58 -0.76 0.41 0.00 0.00 173.24 173.88 2q5c s LEU 3 N -0.52 4.31 -0.08 2.44 1.43 -1.26 -4.99 118.68 120.01 2q5c s LEU 3 Ca 0.50 1.11 0.01 0.00 -1.03 0.00 0.00 54.13 54.72 2q5c s LEU 3 Cb -0.31 -3.38 0.02 0.00 0.03 0.00 0.00 46.19 42.55 2q5c s LEU 3 CO 0.37 0.07 -0.09 -0.54 0.23 0.00 0.00 176.35 176.39 2q5c s LYS 4 N -2.08 1.50 -0.05 1.70 1.02 -1.26 -0.40 119.74 120.18 2q5c s LYS 4 Ca 0.40 -0.30 0.02 0.00 0.02 0.00 0.00 55.97 56.12 2q5c s LYS 4 Cb -0.15 -1.41 0.01 0.00 -0.52 0.00 0.00 37.83 35.76 2q5c s LYS 4 CO 0.19 -0.12 -0.12 0.42 -0.92 0.00 0.00 175.35 174.81 2q5c s ILE 5 N 1.19 1.05 -0.16 2.17 1.01 -0.70 -0.42 121.20 125.33 2q5c s ILE 5 Ca -0.05 -0.45 -0.09 0.00 0.00 0.00 0.00 60.65 60.06 2q5c s ILE 5 Cb -0.14 -0.96 -0.05 0.00 0.01 0.00 0.00 42.46 41.32 2q5c s ILE 5 CO -0.02 0.33 0.15 0.00 0.00 0.00 0.00 174.94 175.40 2q5c s ALA 6 N 0.55 3.76 -0.18 9.38 0.00 -0.74 -1.63 121.76 132.89 2q5c s ALA 6 Ca -0.11 -0.65 -0.05 0.00 0.00 0.00 0.00 51.96 51.15 2q5c s ALA 6 Cb -0.14 -2.11 -0.03 0.00 0.00 0.00 0.00 23.12 20.84 2q5c s ALA 6 CO 0.03 0.35 0.00 -1.17 0.00 0.00 0.00 175.76 174.97 2q5c s LEU 7 N -0.22 3.37 -0.23 0.00 2.96 0.46 0.01 118.68 125.03 2q5c s LEU 7 Ca 0.12 -0.12 0.02 0.00 -0.22 0.00 0.00 54.13 53.92 2q5c s LEU 7 Cb -0.12 -1.84 0.04 0.00 0.50 0.00 0.00 46.19 44.77 2q5c s LEU 7 CO 0.01 0.11 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.39 2q5c s ILE 8 N 0.70 2.23 0.19 6.68 1.01 -0.47 -1.58 121.20 129.97 2q5c s ILE 8 Ca 0.00 -1.32 -0.19 0.00 0.00 0.00 0.00 60.65 59.14 2q5c s ILE 8 Cb -0.14 -2.17 0.04 0.00 0.01 0.00 0.00 42.46 40.20 2q5c s ILE 8 CO 0.02 0.19 0.55 -0.55 0.00 0.00 0.00 174.94 175.15 2q5c s SER 9 N 1.20 -0.33 0.00 3.58 0.15 -0.77 -4.39 113.70 113.14 2q5c s SER 9 Ca -0.03 -0.37 0.11 0.00 0.70 0.00 0.00 55.95 56.37 2q5c s SER 9 Cb -0.17 0.59 0.29 0.00 -1.71 0.00 0.00 66.02 65.01 2q5c s SER 9 CO -0.08 -1.04 1.21 0.00 1.20 0.00 0.00 173.24 174.53 2q5c n GLN 10 N -0.35 2.50 -3.05 5.44 6.02 -1.26 -2.63 117.38 124.05 2q5c n GLN 10 Ca -0.12 -1.94 -0.43 0.00 -0.01 0.00 0.00 57.00 54.50 2q5c n GLN 10 Cb 0.63 -1.28 -0.06 0.00 1.02 0.00 0.00 30.24 30.55 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 -1.00 6.31 0.40 1.08 3.84 -1.26 -4.92 114.94 119.39 2q5c s ASN 11 Ca 0.23 -0.46 0.06 0.00 0.21 0.00 0.00 52.86 52.90 2q5c s ASN 11 Cb 0.12 -2.34 0.81 0.00 -0.55 0.00 0.00 41.25 39.30 2q5c s ASN 11 CO 0.16 -0.91 2.05 -0.33 -2.79 0.00 0.00 177.10 175.29 2q5c h GLU 12 N 9.00 0.60 -0.46 0.43 4.39 -1.99 -0.68 114.58 125.87 2q5c h GLU 12 Ca -0.26 -0.04 -0.08 0.00 0.34 0.00 0.00 59.36 59.32 2q5c h GLU 12 Cb 1.09 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 29.59 2q5c h GLU 12 CO 0.96 0.40 -0.04 -0.91 -1.16 0.00 0.00 179.01 178.25 2q5c h ASN 13 N 0.62 0.83 -0.47 1.42 2.35 -1.96 -0.72 115.58 117.66 2q5c h ASN 13 Ca 0.17 -0.33 -0.06 0.00 -0.55 0.00 0.00 56.30 55.54 2q5c h ASN 13 Cb -0.05 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.07 2q5c h ASN 13 CO -0.04 0.96 0.07 -0.07 -1.65 0.00 0.00 177.43 176.71 2q5c h LEU 14 N 0.69 0.76 -0.98 1.61 3.38 -1.73 -1.50 115.31 117.54 2q5c h LEU 14 Ca 0.13 -0.26 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 2q5c h LEU 14 Cb 0.56 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 2q5c h LEU 14 CO 0.03 0.83 0.05 -0.07 0.09 0.00 0.00 178.44 179.37 2q5c h LEU 15 N 0.65 0.75 -0.37 1.67 3.38 -0.93 -1.52 115.31 118.95 2q5c h LEU 15 Ca 0.14 -0.16 -0.18 0.00 0.09 0.00 0.00 57.88 57.77 2q5c h LEU 15 Cb 0.40 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2q5c h LEU 15 CO 0.01 0.79 -0.81 0.78 0.09 0.00 0.00 178.44 179.29 2q5c h ASN 16 N 0.75 0.23 -0.08 -0.43 -0.26 -1.04 -3.27 115.58 111.48 2q5c h ASN 16 Ca 0.15 -0.18 -0.15 0.00 -0.56 0.00 0.00 56.30 55.56 2q5c h ASN 16 Cb 0.39 -0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 37.57 2q5c h ASN 16 CO 0.01 0.95 -0.48 0.25 -1.06 0.00 0.00 177.43 177.10 2q5c h LEU 17 N 0.11 0.70 -0.45 1.61 5.85 -1.02 -3.37 115.31 118.74 2q5c h LEU 17 Ca -0.03 -0.34 0.07 0.00 0.84 0.00 0.00 57.88 58.41 2q5c h LEU 17 Cb 1.41 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 42.19 2q5c h LEU 17 CO 0.12 1.06 0.12 0.15 -0.34 0.00 0.00 178.44 179.55 2q5c h PHE 18 N 0.51 0.20 0.00 1.25 3.57 -1.33 0.13 116.94 121.27 2q5c h PHE 18 Ca 0.03 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 2q5c h PHE 18 Cb 1.02 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.74 2q5c h PHE 18 CO 0.05 0.04 -0.07 -1.35 -2.23 0.00 0.00 178.31 174.75 2q5c h PRO 19 N 0.27 0.00 -0.28 6.41 0.11 -1.75 -0.52 132.00 136.24 2q5c h PRO 19 Ca 0.22 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 66.14 2q5c h PRO 19 Cb 0.25 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.36 2q5c h PRO 19 CO -0.26 0.07 -0.55 0.87 -0.21 0.00 0.00 178.00 177.92 2q5c h LYS 20 N 0.00 0.84 -0.03 1.05 1.57 -1.19 -2.96 116.57 115.85 2q5c h LYS 20 Ca -0.00 -0.53 -0.10 0.00 -1.87 0.00 0.00 60.65 58.14 2q5c h LYS 20 Cb 0.21 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 2q5c h LYS 20 CO 0.01 1.17 -0.47 -0.07 -0.57 0.00 0.00 179.45 179.52 2q5c h LEU 21 N 0.64 0.07 -1.42 2.94 3.38 -0.70 -2.89 115.31 117.34 2q5c h LEU 21 Ca 0.01 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 2q5c h LEU 21 Cb 1.15 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 2q5c h LEU 21 CO 0.12 0.53 0.12 0.00 0.09 0.00 0.00 178.44 179.30 2q5c h ALA 22 N 1.48 1.54 -0.46 1.53 0.00 -1.00 -1.06 119.26 121.29 2q5c h ALA 22 Ca 0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 2q5c h ALA 22 Cb 0.85 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2q5c h ALA 22 CO 0.06 0.35 0.07 -0.07 0.00 0.00 0.00 179.25 179.67 2q5c h LEU 23 N 0.51 0.73 -0.49 0.00 3.38 -1.35 0.12 115.31 118.20 2q5c h LEU 23 Ca 0.12 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 2q5c h LEU 23 Cb 0.14 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2q5c h LEU 23 CO -0.01 0.80 0.27 -0.33 0.09 0.00 0.00 178.44 179.26 2q5c h GLU 24 N 0.63 0.69 -0.51 1.13 5.08 -1.40 -3.18 114.58 117.02 2q5c h GLU 24 Ca 0.14 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2q5c h GLU 24 Cb 0.39 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2q5c h GLU 24 CO 0.01 0.55 0.00 1.63 -1.00 0.00 0.00 179.01 180.20 2q5c n LYS 25 N -4.65 2.52 -3.64 2.33 4.76 -0.44 -4.99 118.16 114.05 2q5c n LYS 25 Ca 0.02 -2.33 -0.26 0.00 -2.87 0.00 0.00 58.31 52.87 2q5c n LYS 25 Cb 0.09 -1.52 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 1.46 -4.12 -4.23 4.39 5.15 0.36 -5.02 115.26 113.25 2q5c n ASN 26 Ca 0.21 -0.92 -0.13 0.00 -0.60 0.00 0.00 54.58 53.14 2q5c n ASN 26 Cb 0.59 -3.82 -0.10 0.00 -0.53 0.00 0.00 39.78 35.91 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 -3.54 1.15 -0.19 1.20 -0.12 -0.86 -4.64 117.98 110.97 2q5c s PHE 27 Ca 0.32 -0.91 -0.24 0.00 -0.05 0.00 0.00 56.93 56.06 2q5c s PHE 27 Cb -0.10 -0.64 -0.02 0.00 -0.63 0.00 0.00 43.02 41.64 2q5c s PHE 27 CO 0.83 -0.10 0.76 0.42 -0.05 0.00 0.00 175.22 177.08 2q5c s ILE 28 N -3.54 4.92 0.18 -4.49 1.01 0.47 -4.55 121.20 115.20 2q5c s ILE 28 Ca 0.19 1.46 -0.16 0.00 0.00 0.00 0.00 60.65 62.14 2q5c s ILE 28 Cb 0.05 -4.07 -0.07 0.00 0.01 0.00 0.00 42.46 38.38 2q5c s ILE 28 CO 0.01 0.04 0.62 -2.16 0.00 0.00 0.00 174.94 173.44 2q5c s PRO 29 N 2.20 4.07 -0.07 2.79 0.04 -1.26 -1.73 135.00 141.05 2q5c s PRO 29 Ca 0.34 0.63 0.03 0.00 0.04 0.00 0.00 61.00 62.04 2q5c s PRO 29 Cb -0.16 -2.88 0.01 0.00 0.04 0.00 0.00 34.50 31.51 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 -1.52 1.44 -0.03 0.56 1.09 -0.64 -4.94 121.20 117.14 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 -0.15 -1.27 -0.01 0.00 -1.06 0.00 0.00 42.46 39.96 2q5c s ILE 30 CO 0.20 0.42 -0.24 0.42 -0.10 0.00 0.00 174.94 175.64 2q5c s THR 31 N 0.46 1.89 -0.00 2.92 -4.23 -1.26 -0.40 115.64 115.01 2q5c s THR 31 Ca -0.14 -1.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.38 2q5c s THR 31 Cb -0.16 -1.58 -0.00 0.00 1.34 0.00 0.00 72.50 72.10 2q5c s THR 31 CO 0.05 0.53 -0.03 -0.54 -0.54 0.00 0.00 174.62 174.09 2q5c s LYS 32 N -0.36 0.25 -0.44 3.99 -0.14 -0.61 -4.98 119.74 117.46 2q5c s LYS 32 Ca 0.04 -0.10 -0.17 0.00 -1.36 0.00 0.00 55.97 54.37 2q5c s LYS 32 Cb -0.11 -0.25 0.03 0.00 -1.68 0.00 0.00 37.83 35.82 2q5c s LYS 32 CO 0.01 0.06 0.43 0.99 -0.76 0.00 0.00 175.35 176.07 2q5c s THR 33 N -0.02 5.12 0.01 2.17 2.01 -1.25 -1.85 115.64 121.82 2q5c s THR 33 Ca 0.01 -0.52 -0.29 0.00 0.31 0.00 0.00 61.69 61.19 2q5c s THR 33 Cb -0.02 -4.06 0.10 0.00 0.01 0.00 0.00 72.50 68.53 2q5c s THR 33 CO -0.00 -0.47 1.09 0.00 -0.69 0.00 0.00 174.62 174.55 2q5c s ALA 34 N 2.04 -1.95 0.13 7.40 0.00 -1.08 -4.94 121.76 123.36 2q5c s ALA 34 Ca 0.10 0.75 -0.06 0.00 0.00 0.00 0.00 51.96 52.75 2q5c s ALA 34 Cb -0.19 0.37 -0.02 0.00 0.00 0.00 0.00 23.12 23.28 2q5c s ALA 34 CO 0.12 -0.89 0.17 -1.54 0.00 0.00 0.00 175.76 173.61 2q5c s SER 35 N -2.72 0.18 0.99 0.00 1.04 -1.26 -3.75 113.70 108.18 2q5c s SER 35 Ca 0.11 -0.96 0.00 0.00 0.48 0.00 0.00 55.95 55.58 2q5c s SER 35 Cb 0.01 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.48 2q5c s SER 35 CO -0.03 -0.79 0.00 0.18 0.98 0.00 0.00 173.24 173.58 2q5c n LEU 36 N -0.12 0.00 -0.22 2.42 4.77 -1.26 -1.56 117.00 121.02 2q5c n LEU 36 Ca -0.08 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.83 2q5c n LEU 36 Cb 0.63 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.75 2q5c n LEU 36 CO 0.26 0.00 1.02 0.74 -1.33 0.00 0.00 177.39 178.08 2q5c h THR 37 N 0.00 1.22 -0.82 -5.08 2.02 -1.97 -1.42 112.91 106.86 2q5c h THR 37 Ca 0.00 -0.63 -0.00 0.00 0.77 0.00 0.00 66.41 66.55 2q5c h THR 37 Cb 0.00 0.50 -0.04 0.00 -1.74 0.00 0.00 68.15 66.87 2q5c h THR 37 CO 0.00 0.26 0.50 -0.09 0.37 0.00 0.00 175.52 176.56 2q5c h ARG 38 N 0.84 1.10 -0.88 6.66 2.43 -1.94 -1.15 114.38 121.44 2q5c h ARG 38 Ca 0.21 -0.09 0.04 0.00 -0.81 0.00 0.00 59.98 59.33 2q5c h ARG 38 Cb 0.14 -0.24 -0.05 0.00 -0.42 0.00 0.00 29.97 29.40 2q5c h ARG 38 CO -0.02 0.76 0.58 0.00 -1.51 0.00 0.00 179.97 179.78 2q5c h ALA 39 N 1.27 1.46 -0.31 2.80 0.00 -0.75 -2.04 119.26 121.70 2q5c h ALA 39 Ca 0.29 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.07 2q5c h ALA 39 Cb -0.06 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 2q5c h ALA 39 CO -0.06 0.44 -0.20 0.66 0.00 0.00 0.00 179.25 180.09 2q5c h SER 40 N 1.08 0.58 -0.37 0.00 4.64 -0.18 0.32 113.55 119.61 2q5c h SER 40 Ca 0.36 -0.19 -0.01 0.00 -0.47 0.00 0.00 61.79 61.48 2q5c h SER 40 Cb 0.06 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 61.98 2q5c h SER 40 CO -0.11 0.78 0.18 0.50 -0.87 0.00 0.00 176.83 177.31 2q5c h LYS 41 N 0.52 0.53 -0.41 4.77 3.64 -0.81 0.14 116.57 124.95 2q5c h LYS 41 Ca 0.08 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 2q5c h LYS 41 Cb 0.64 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.35 2q5c h LYS 41 CO 0.05 0.48 0.06 0.82 -2.27 0.00 0.00 179.45 178.59 2q5c h ILE 42 N 0.46 1.24 -0.66 2.00 2.04 -1.08 -1.54 117.51 119.97 2q5c h ILE 42 Ca 0.13 -0.88 0.02 0.00 1.00 0.00 0.00 64.86 65.13 2q5c h ILE 42 Cb 0.12 1.02 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 2q5c h ILE 42 CO -0.02 0.30 0.42 0.00 0.00 0.00 0.00 178.15 178.86 2q5c h ALA 43 N 0.93 0.86 -0.97 1.87 0.00 -0.79 -1.53 119.26 119.62 2q5c h ALA 43 Ca 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2q5c h ALA 43 Cb 0.38 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 2q5c h ALA 43 CO 0.01 0.21 0.63 0.35 0.00 0.00 0.00 179.25 180.45 2q5c h PHE 44 N 0.85 1.24 -0.07 0.00 3.57 -0.75 -1.58 116.94 120.19 2q5c h PHE 44 Ca 0.26 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.70 2q5c h PHE 44 Cb -0.03 -0.42 -0.01 0.00 2.79 0.00 0.00 35.95 38.28 2q5c h PHE 44 CO -0.04 0.80 -0.32 0.78 -2.23 0.00 0.00 178.31 177.30 2q5c h GLY 45 N 1.33 0.15 1.00 2.40 0.00 -0.72 -3.07 103.07 104.16 2q5c h GLY 45 Ca 0.35 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.56 2q5c h GLY 45 CO -0.07 0.11 -0.55 1.04 0.00 0.00 0.00 176.54 177.07 2q5c n LEU 46 N -4.12 0.53 0.25 3.11 4.77 -0.63 -4.57 117.00 116.35 2q5c n LEU 46 Ca -0.01 0.04 0.13 0.00 -0.03 0.00 0.00 56.01 56.13 2q5c n LEU 46 Cb 0.39 -0.23 0.66 0.00 -2.33 0.00 0.00 43.42 41.91 2q5c n LEU 46 CO 0.40 0.09 0.93 0.06 -1.33 0.00 0.00 177.39 177.54 2q5c h GLN 47 N 0.00 0.00 -0.01 3.23 3.07 -1.21 0.17 115.11 120.36 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 0.55 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.11 2q5c h GLN 47 CO 0.00 0.14 -0.04 -0.25 0.09 0.00 0.00 178.83 178.77 2q5c n ASP 48 N -3.49 1.16 -0.17 0.06 8.00 -1.26 -3.96 116.55 116.89 2q5c n ASP 48 Ca -0.01 -1.30 0.04 0.00 0.71 0.00 0.00 54.79 54.23 2q5c n ASP 48 Cb 0.30 0.01 -0.01 0.00 -0.02 0.00 0.00 41.12 41.40 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 -0.16 2.44 -4.20 -1.24 1.02 0.57 -5.03 120.64 114.02 2q5c n GLU 49 Ca 0.19 -0.49 -0.12 0.00 -0.02 0.00 0.00 57.16 56.72 2q5c n GLU 49 Cb 0.31 -1.01 -0.10 0.00 -0.02 0.00 0.00 31.44 30.62 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 -1.28 0.73 -0.10 2.62 -7.23 -0.97 -4.93 120.40 109.24 2q5c s VAL 50 Ca 0.07 -1.97 0.15 0.00 -1.81 0.00 0.00 61.98 58.42 2q5c s VAL 50 Cb 0.07 -1.87 -0.14 0.00 0.56 0.00 0.00 36.38 35.00 2q5c s VAL 50 CO 0.23 -0.70 0.86 0.44 -0.31 0.00 0.00 175.10 175.61 2q5c h ASP 51 N 2.84 0.00 -4.98 4.85 3.32 -1.06 -3.46 116.42 117.92 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 1.18 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.62 2q5c h ASP 51 CO 0.64 0.67 0.23 0.00 -1.72 0.00 0.00 179.24 179.06 2q5c s ALA 52 N -2.86 -1.55 -0.04 3.45 0.00 -1.18 -4.24 121.76 115.34 2q5c s ALA 52 Ca -0.03 0.37 0.05 0.00 0.00 0.00 0.00 51.96 52.36 2q5c s ALA 52 Cb 0.08 0.85 -0.01 0.00 0.00 0.00 0.00 23.12 24.05 2q5c s ALA 52 CO 0.81 -0.82 -0.18 0.42 0.00 0.00 0.00 175.76 175.99 2q5c s ILE 53 N -3.74 1.52 -0.05 0.00 1.01 -0.40 -1.80 121.20 117.74 2q5c s ILE 53 Ca 0.03 -0.78 0.04 0.00 0.00 0.00 0.00 60.65 59.95 2q5c s ILE 53 Cb -0.02 -1.30 -0.02 0.00 0.01 0.00 0.00 42.46 41.13 2q5c s ILE 53 CO -0.09 0.43 -0.16 -0.63 0.00 0.00 0.00 174.94 174.49 2q5c s ILE 54 N -0.05 2.90 0.37 2.92 1.01 0.10 -0.50 121.20 127.95 2q5c s ILE 54 Ca -0.02 -0.78 -0.12 0.00 0.00 0.00 0.00 60.65 59.72 2q5c s ILE 54 Cb -0.11 -2.13 0.05 0.00 0.01 0.00 0.00 42.46 40.28 2q5c s ILE 54 CO 0.02 0.58 0.72 -1.54 0.00 0.00 0.00 174.94 174.72 2q5c n SER 55 N 2.46 -2.09 -4.22 3.58 3.41 -0.70 -1.37 113.62 114.69 2q5c n SER 55 Ca -0.17 -2.58 -0.20 0.00 -0.26 0.00 0.00 58.87 55.66 2q5c n SER 55 Cb 0.52 3.51 -0.12 0.00 -0.26 0.00 0.00 64.21 67.86 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 -2.19 0.95 4.94 4.33 3.52 -1.26 -0.17 118.95 129.08 2q5c s ARG 56 Ca 0.17 -1.06 0.00 0.00 -0.13 0.00 0.00 55.73 54.72 2q5c s ARG 56 Cb -0.04 -1.04 0.00 0.00 -1.56 0.00 0.00 34.95 32.31 2q5c s ARG 56 CO 0.13 0.23 0.00 0.41 -0.81 0.00 0.00 175.30 175.26 2q5c n GLY 57 N 1.14 3.00 0.37 8.12 0.00 -1.19 -2.45 105.19 114.18 2q5c n GLY 57 Ca -0.20 -0.15 -0.00 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.67 1.37 -0.93 4.61 0.00 -1.96 -1.48 119.26 120.20 2q5c h ALA 58 Ca 0.00 -0.06 0.09 0.00 0.00 0.00 0.00 54.91 54.95 2q5c h ALA 58 Cb 0.00 -0.35 -0.07 0.00 0.00 0.00 0.00 17.79 17.37 2q5c h ALA 58 CO 0.00 0.56 0.60 1.15 0.00 0.00 0.00 179.25 181.57 2q5c h THR 59 N 1.20 0.99 -0.69 0.00 2.02 -1.85 -0.87 112.91 113.72 2q5c h THR 59 Ca 0.34 -0.33 0.02 0.00 0.77 0.00 0.00 66.41 67.21 2q5c h THR 59 Cb -0.09 -0.07 -0.04 0.00 -1.74 0.00 0.00 68.15 66.21 2q5c h THR 59 CO -0.09 0.18 0.44 0.28 0.37 0.00 0.00 175.52 176.70 2q5c h SER 60 N 0.97 0.73 -0.44 4.18 0.02 -1.14 -0.35 113.55 117.51 2q5c h SER 60 Ca 0.43 -0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.39 2q5c h SER 60 Cb 0.36 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.71 2q5c h SER 60 CO -0.19 0.51 0.28 -0.78 -1.14 0.00 0.00 176.83 175.51 2q5c h ASP 61 N 0.87 0.46 -0.92 3.07 1.82 -1.12 0.25 116.42 120.85 2q5c h ASP 61 Ca 0.27 -0.00 0.02 0.00 -0.39 0.00 0.00 57.03 56.93 2q5c h ASP 61 Cb -0.01 -0.10 -0.05 0.00 0.68 0.00 0.00 39.33 39.84 2q5c h ASP 61 CO -0.09 0.33 0.60 1.88 -1.61 0.00 0.00 179.24 180.35 2q5c h TYR 62 N 0.56 1.13 -0.10 0.28 -1.99 -0.88 -2.36 116.97 113.61 2q5c h TYR 62 Ca 0.17 0.03 -0.07 0.00 2.00 0.00 0.00 58.73 60.86 2q5c h TYR 62 Cb -0.02 -0.38 0.00 0.00 2.00 0.00 0.00 36.73 38.33 2q5c h TYR 62 CO -0.06 0.68 -0.20 0.82 -0.00 0.00 0.00 178.16 179.40 2q5c h ILE 63 N 1.19 1.39 -0.65 -2.88 2.04 -0.45 -3.20 117.51 114.95 2q5c h ILE 63 Ca 0.35 -1.49 0.02 0.00 1.00 0.00 0.00 64.86 64.74 2q5c h ILE 63 Cb -0.06 2.12 -0.03 0.00 -0.74 0.00 0.00 36.82 38.11 2q5c h ILE 63 CO -0.10 0.43 0.43 0.50 0.00 0.00 0.00 178.15 179.41 2q5c h LYS 64 N -0.14 0.82 0.00 2.37 3.64 -0.38 -1.15 116.57 121.72 2q5c h LYS 64 Ca 0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2q5c h LYS 64 Cb 0.79 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2q5c h LYS 64 CO 0.04 0.54 0.00 1.63 -2.27 0.00 0.00 179.45 179.40 2q5c n LYS 65 N -4.45 0.18 0.00 1.90 5.02 -0.90 -3.88 118.16 116.03 2q5c n LYS 65 Ca 0.07 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.43 2q5c n LYS 65 Cb 0.07 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.58 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 -1.39 0.14 -4.57 4.39 3.41 -0.50 -5.05 113.62 110.05 2q5c n SER 66 Ca 0.09 -0.54 -0.25 0.00 -0.26 0.00 0.00 58.87 57.91 2q5c n SER 66 Cb 0.24 0.76 -0.09 0.00 -0.26 0.00 0.00 64.21 64.86 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 -0.76 3.13 -1.83 -3.33 -7.23 -0.81 -4.84 120.40 104.73 2q5c s VAL 67 Ca 0.00 -1.85 0.16 0.00 -1.81 0.00 0.00 61.98 58.49 2q5c s VAL 67 Cb 0.00 -2.59 0.25 0.00 0.56 0.00 0.00 36.38 34.60 2q5c s VAL 67 CO 0.00 -0.22 1.16 -1.54 -0.31 0.00 0.00 175.10 174.18 2q5c n SER 68 N -0.30 2.75 -4.96 4.85 3.41 -1.26 -4.90 113.62 113.21 2q5c n SER 68 Ca -0.09 -1.80 -0.19 0.00 -0.26 0.00 0.00 58.87 56.53 2q5c n SER 68 Cb 0.57 -0.13 -0.01 0.00 -0.26 0.00 0.00 64.21 64.39 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 -1.25 3.57 0.19 -1.33 -4.36 -1.26 -5.04 121.20 111.71 2q5c s ILE 69 Ca 0.25 -1.10 -0.33 0.00 -0.26 0.00 0.00 60.65 59.21 2q5c s ILE 69 Cb 0.15 -3.22 -0.13 0.00 1.25 0.00 0.00 42.46 40.51 2q5c s ILE 69 CO 0.22 -0.10 1.60 -2.65 0.24 0.00 0.00 174.94 174.25 2q5c n PRO 70 N -1.64 2.34 -4.00 0.37 -0.02 -1.26 -4.90 135.00 125.89 2q5c n PRO 70 Ca 0.02 0.84 -0.30 0.00 -2.02 0.00 0.00 63.50 62.04 2q5c n PRO 70 Cb 0.59 -2.62 -0.16 0.00 -0.02 0.00 0.00 33.50 31.29 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 0.90 3.28 -0.12 2.55 0.15 -1.26 -1.27 113.70 117.93 2q5c s SER 71 Ca 0.76 -0.82 -0.03 0.00 0.70 0.00 0.00 55.95 56.56 2q5c s SER 71 Cb -0.62 -1.23 -0.03 0.00 -1.71 0.00 0.00 66.02 62.42 2q5c s SER 71 CO 0.38 -0.13 0.00 -0.63 1.20 0.00 0.00 173.24 174.07 2q5c s ILE 72 N 1.41 4.30 -0.21 6.45 1.09 0.34 -4.97 121.20 129.61 2q5c s ILE 72 Ca -0.00 -0.23 -0.08 0.00 -1.10 0.00 0.00 60.65 59.24 2q5c s ILE 72 Cb -0.16 -2.85 -0.04 0.00 -1.06 0.00 0.00 42.46 38.35 2q5c s ILE 72 CO -0.09 0.55 0.08 -0.55 -0.10 0.00 0.00 174.94 174.83 2q5c s SER 73 N -0.31 5.56 -0.15 3.58 0.15 -1.26 -1.72 113.70 119.54 2q5c s SER 73 Ca 0.07 0.00 -0.29 0.00 0.70 0.00 0.00 55.95 56.43 2q5c s SER 73 Cb -0.12 -1.97 -0.01 0.00 -1.71 0.00 0.00 66.02 62.21 2q5c s SER 73 CO 0.02 0.10 1.12 -0.63 1.20 0.00 0.00 173.24 175.05 2q5c s ILE 74 N 0.81 4.52 0.17 6.45 1.01 0.77 -4.94 121.20 129.98 2q5c s ILE 74 Ca 0.04 1.83 -0.27 0.00 0.00 0.00 0.00 60.65 62.25 2q5c s ILE 74 Cb -0.13 -4.18 -0.08 0.00 0.01 0.00 0.00 42.46 38.08 2q5c s ILE 74 CO 0.02 -0.09 0.83 -0.54 0.00 0.00 0.00 174.94 175.16 2q5c s LYS 75 N 2.82 4.64 0.00 2.79 -0.14 -1.26 -3.14 119.74 125.46 2q5c s LYS 75 Ca 0.50 1.25 -0.30 0.00 -1.36 0.00 0.00 55.97 56.06 2q5c s LYS 75 Cb -0.19 -3.28 -0.06 0.00 -1.68 0.00 0.00 37.83 32.62 2q5c s LYS 75 CO 0.14 0.51 1.41 0.08 -0.76 0.00 0.00 175.35 176.73 2q5c s VAL 76 N -0.98 3.67 0.38 3.17 1.01 -1.26 -5.00 120.40 121.39 2q5c s VAL 76 Ca 0.38 1.06 0.05 0.00 0.00 0.00 0.00 61.98 63.47 2q5c s VAL 76 Cb -0.24 -3.68 -0.00 0.00 0.00 0.00 0.00 36.38 32.46 2q5c s VAL 76 CO 0.28 -0.00 0.54 0.42 0.00 0.00 0.00 175.10 176.33 2q5c s THR 77 N 2.41 3.93 0.19 3.92 -4.23 -1.26 -4.99 115.64 115.60 2q5c s THR 77 Ca 0.64 -0.86 -0.10 0.00 -1.18 0.00 0.00 61.69 60.19 2q5c s THR 77 Cb -0.32 -3.38 0.10 0.00 1.34 0.00 0.00 72.50 70.24 2q5c s THR 77 CO 0.27 -0.18 1.75 0.03 -0.54 0.00 0.00 174.62 175.94 2q5c h ARG 78 N 0.72 1.00 -0.31 3.99 3.08 -1.96 -2.00 114.38 118.90 2q5c h ARG 78 Ca -0.45 -0.18 -0.13 0.00 0.07 0.00 0.00 59.98 59.29 2q5c h ARG 78 Cb 1.26 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 2q5c h ARG 78 CO 0.53 0.83 -0.34 0.35 -1.07 0.00 0.00 179.97 180.27 2q5c h PHE 79 N 0.94 0.80 -0.64 3.04 3.57 -1.98 -0.45 116.94 122.23 2q5c h PHE 79 Ca 0.22 -0.21 0.06 0.00 3.53 0.00 0.00 57.97 61.57 2q5c h PHE 79 Cb 0.20 -0.18 -0.06 0.00 2.79 0.00 0.00 35.95 38.70 2q5c h PHE 79 CO 0.01 0.93 0.34 -0.44 -2.23 0.00 0.00 178.31 176.92 2q5c h ASP 80 N 0.58 0.48 -0.33 0.41 3.32 -1.83 0.34 116.42 119.39 2q5c h ASP 80 Ca 0.06 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.11 2q5c h ASP 80 Cb 0.85 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.33 2q5c h ASP 80 CO 0.07 0.31 0.07 0.74 -1.72 0.00 0.00 179.24 178.72 2q5c h THR 81 N 0.62 1.23 -0.92 0.35 2.02 -0.86 -2.48 112.91 112.87 2q5c h THR 81 Ca 0.29 -0.77 0.00 0.00 0.77 0.00 0.00 66.41 66.70 2q5c h THR 81 Cb 0.21 1.10 -0.04 0.00 -1.74 0.00 0.00 68.15 67.67 2q5c h THR 81 CO -0.20 0.26 0.58 -0.03 0.37 0.00 0.00 175.52 176.50 2q5c h MET 82 N 0.38 1.23 -0.53 6.66 1.85 -0.70 -0.70 114.93 123.11 2q5c h MET 82 Ca 0.10 -0.09 0.01 0.00 -0.61 0.00 0.00 59.70 59.11 2q5c h MET 82 Cb 0.31 -0.27 -0.03 0.00 0.43 0.00 0.00 31.60 32.05 2q5c h MET 82 CO 0.00 0.84 0.34 0.00 -0.40 0.00 0.00 176.91 177.70 2q5c h ARG 83 N 1.26 0.68 -0.43 0.39 3.08 -0.81 -0.45 114.38 118.10 2q5c h ARG 83 Ca 0.33 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 60.26 2q5c h ARG 83 Cb -0.10 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.78 2q5c h ARG 83 CO -0.07 0.45 -0.06 0.00 -1.07 0.00 0.00 179.97 179.22 2q5c h ALA 84 N 1.20 0.59 -0.49 0.04 0.00 -0.92 -1.71 119.26 117.96 2q5c h ALA 84 Ca 0.20 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2q5c h ALA 84 Cb -0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2q5c h ALA 84 CO -0.05 0.43 0.16 0.28 0.00 0.00 0.00 179.25 180.08 2q5c h VAL 85 N 0.63 1.22 -0.66 0.00 2.07 -0.98 -0.43 116.25 118.11 2q5c h VAL 85 Ca 0.11 -0.74 0.08 0.00 0.82 0.00 0.00 66.70 66.98 2q5c h VAL 85 Cb 0.58 0.78 -0.07 0.00 -1.52 0.00 0.00 31.29 31.07 2q5c h VAL 85 CO 0.03 0.27 0.32 0.22 0.02 0.00 0.00 177.57 178.43 2q5c h TYR 86 N 0.65 0.57 -0.43 1.57 3.20 -0.96 -2.05 116.97 119.52 2q5c h TYR 86 Ca 0.16 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.95 2q5c h TYR 86 Cb 0.25 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 2q5c h TYR 86 CO 0.01 0.21 -0.17 -0.91 -1.64 0.00 0.00 178.16 175.66 2q5c h ASN 87 N 0.56 0.83 0.74 -2.11 2.35 -1.01 -3.05 115.58 113.88 2q5c h ASN 87 Ca 0.32 -0.28 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 2q5c h ASN 87 Cb 0.32 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.47 2q5c h ASN 87 CO -0.25 1.00 0.00 0.00 -1.65 0.00 0.00 177.43 176.52 2q5c h ALA 88 N 1.07 1.00 0.00 -0.83 0.00 -0.39 -2.66 119.26 117.45 2q5c h ALA 88 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2q5c h ALA 88 Cb 0.69 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2q5c h ALA 88 CO 0.05 0.00 0.00 0.87 0.00 0.00 0.00 179.25 180.17 2q5c h LYS 89 N 0.00 0.00 0.00 0.00 1.57 -1.32 -1.41 116.57 115.41 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 0.37 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.68 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 -1.67 -2.61 114.38 113.36 2q5c h ARG 90 Ca 0.00 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 60.01 2q5c h ARG 90 Cb 0.22 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.29 2q5c h ARG 90 CO 0.00 0.05 -0.96 0.74 0.10 0.00 0.00 179.97 179.90 2q5c h PHE 91 N 0.00 0.00 0.00 4.08 0.04 -1.50 -3.50 116.94 116.06 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 0.28 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.43 2q5c h PHE 91 CO 0.00 0.25 0.00 0.41 -0.60 0.00 0.00 178.31 178.37 2q5c n GLY 92 N 1.25 -0.54 0.44 -1.45 0.00 -0.98 -5.03 105.19 98.88 2q5c n GLY 92 Ca -0.02 -1.39 0.05 0.00 0.00 0.00 0.00 46.02 44.66 2q5c n GLY 92 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2q5c n ASN 93 N 0.00 2.05 -4.27 1.61 0.23 -1.26 -4.20 115.26 109.43 2q5c n ASN 93 Ca 0.00 -1.54 -0.34 0.00 -0.53 0.00 0.00 54.58 52.16 2q5c n ASN 93 Cb 0.00 -0.04 -0.14 0.00 -2.08 0.00 0.00 39.78 37.51 2q5c n ASN 93 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 2q5c s GLU 94 N -0.88 3.29 0.10 -3.83 2.12 -1.26 -0.17 118.70 118.06 2q5c s GLU 94 Ca 0.14 -0.68 0.05 0.00 0.36 0.00 0.00 54.97 54.84 2q5c s GLU 94 Cb 0.09 -2.89 -0.04 0.00 0.26 0.00 0.00 34.13 31.56 2q5c s GLU 94 CO 0.13 -0.18 -0.12 -0.51 -0.54 0.00 0.00 175.26 174.04 2q5c s LEU 95 N 1.38 2.38 -0.22 2.70 1.43 0.04 -4.36 118.68 122.04 2q5c s LEU 95 Ca 0.05 -0.78 -0.09 0.00 -1.03 0.00 0.00 54.13 52.28 2q5c s LEU 95 Cb -0.14 -0.42 -0.05 0.00 0.03 0.00 0.00 46.19 45.61 2q5c s LEU 95 CO -0.05 -0.19 0.12 0.00 0.23 0.00 0.00 176.35 176.46 2q5c s ALA 96 N -2.15 3.54 -0.24 4.21 0.00 0.16 -1.12 121.76 126.17 2q5c s ALA 96 Ca 0.05 -0.84 -0.07 0.00 0.00 0.00 0.00 51.96 51.11 2q5c s ALA 96 Cb -0.05 -2.18 -0.03 0.00 0.00 0.00 0.00 23.12 20.87 2q5c s ALA 96 CO 0.01 -0.07 0.05 -1.17 0.00 0.00 0.00 175.76 174.59 2q5c s LEU 97 N 0.81 3.36 -0.19 0.00 2.96 -0.20 -0.56 118.68 124.87 2q5c s LEU 97 Ca 0.06 -0.23 -0.02 0.00 -0.22 0.00 0.00 54.13 53.73 2q5c s LEU 97 Cb -0.13 -1.89 -0.00 0.00 0.50 0.00 0.00 46.19 44.66 2q5c s LEU 97 CO 0.02 -0.02 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.30 2q5c s ILE 98 N 1.54 3.01 0.12 6.68 1.01 -0.60 -1.11 121.20 131.85 2q5c s ILE 98 Ca 0.06 -0.63 0.09 0.00 0.00 0.00 0.00 60.65 60.17 2q5c s ILE 98 Cb -0.15 -2.33 -0.04 0.00 0.01 0.00 0.00 42.46 39.96 2q5c s ILE 98 CO 0.03 0.47 -0.21 0.00 0.00 0.00 0.00 174.94 175.22 2q5c s ALA 99 N 1.22 1.93 -0.28 9.38 0.00 -0.51 -4.45 121.76 129.06 2q5c s ALA 99 Ca 0.02 -1.33 -0.26 0.00 0.00 0.00 0.00 51.96 50.39 2q5c s ALA 99 Cb -0.14 -0.25 0.01 0.00 0.00 0.00 0.00 23.12 22.73 2q5c s ALA 99 CO -0.04 0.36 0.93 -0.47 0.00 0.00 0.00 175.76 176.54 2q5c s TYR 100 N -1.35 3.24 0.00 0.00 5.04 -1.26 -1.47 117.35 121.56 2q5c s TYR 100 Ca 0.10 1.14 0.00 0.00 -2.44 0.00 0.00 57.07 55.86 2q5c s TYR 100 Cb -0.09 -3.32 0.00 0.00 0.35 0.00 0.00 41.96 38.90 2q5c s TYR 100 CO 0.05 -0.56 0.00 1.63 -1.34 0.00 0.00 175.55 175.33 2q5c n LYS 101 N 6.37 0.00 -3.86 4.97 5.02 0.11 -4.76 118.16 126.01 2q5c n LYS 101 Ca 0.08 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.27 2q5c n LYS 101 Cb 0.47 0.00 -0.09 0.00 -0.02 0.00 0.00 35.03 35.39 2q5c n LYS 101 CO 0.00 0.00 0.00 -3.38 -0.52 0.00 0.00 177.40 173.50 2q5c s HIS 102 N 0.00 0.08 0.50 2.13 -3.43 -1.26 -4.89 115.29 108.43 2q5c s HIS 102 Ca 0.00 -0.30 -0.22 0.00 -0.80 0.00 0.00 55.06 53.74 2q5c s HIS 102 Cb 0.00 -0.05 -0.06 0.00 -1.43 0.00 0.00 32.58 31.03 2q5c s HIS 102 CO 0.00 -0.40 1.21 -1.54 -2.00 0.00 0.00 174.74 172.01 2q5c s SER 103 N -2.01 5.80 -0.20 7.38 1.04 -1.26 -4.88 113.70 119.57 2q5c s SER 103 Ca -0.06 2.41 0.00 0.00 0.48 0.00 0.00 55.95 58.77 2q5c s SER 103 Cb -0.02 -2.61 -0.21 0.00 0.10 0.00 0.00 66.02 63.29 2q5c s SER 103 CO -0.03 -1.18 0.01 -0.38 0.98 0.00 0.00 173.24 172.64 2q5c n ILE 104 N -0.83 1.59 -4.37 -1.02 2.08 -1.26 -4.94 119.36 110.61 2q5c n ILE 104 Ca 0.09 -0.62 -0.29 0.00 0.56 0.00 0.00 62.75 62.49 2q5c n ILE 104 Cb 0.48 -1.47 -0.12 0.00 -0.75 0.00 0.00 39.64 37.77 2q5c n ILE 104 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 2q5c s VAL 105 N -2.53 2.56 -0.05 1.39 0.11 -1.26 -4.75 120.40 115.87 2q5c s VAL 105 Ca -0.29 -1.61 -0.30 0.00 -2.93 0.00 0.00 61.98 56.85 2q5c s VAL 105 Cb 0.08 -2.15 -0.05 0.00 -1.53 0.00 0.00 36.38 32.73 2q5c s VAL 105 CO 0.67 0.11 1.49 -0.62 -3.33 0.00 0.00 175.10 173.42 2q5c s ASP 106 N -2.06 6.78 0.33 3.54 -1.08 -1.26 -4.89 116.67 118.03 2q5c s ASP 106 Ca 0.16 2.11 0.12 0.00 -0.52 0.00 0.00 52.55 54.42 2q5c s ASP 106 Cb -0.10 -2.55 0.58 0.00 -1.46 0.00 0.00 42.92 39.39 2q5c s ASP 106 CO 0.08 -0.81 1.74 0.07 0.52 0.00 0.00 175.17 176.76 2q5c h LYS 107 N 8.56 0.00 -0.58 4.34 5.09 -1.98 -1.51 116.57 130.49 2q5c h LYS 107 Ca -0.37 0.00 -0.02 0.00 0.09 0.00 0.00 60.65 60.35 2q5c h LYS 107 Cb 1.17 0.00 -0.03 0.00 0.10 0.00 0.00 32.23 33.47 2q5c h LYS 107 CO 0.94 0.47 0.26 0.45 -2.09 0.00 0.00 179.45 179.48 2q5c h HIS 108 N 0.00 0.81 -0.58 0.07 3.86 -1.94 -1.55 115.15 115.82 2q5c h HIS 108 Ca -0.00 -0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.12 2q5c h HIS 108 Cb 0.84 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 29.03 2q5c h HIS 108 CO 0.00 0.61 0.13 1.49 0.86 0.00 0.00 177.93 181.01 2q5c h GLU 109 N 0.82 0.93 -0.31 2.45 4.81 -1.69 -1.91 114.58 119.68 2q5c h GLU 109 Ca 0.20 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2q5c h GLU 109 Cb 0.11 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 2q5c h GLU 109 CO -0.02 0.87 0.18 0.82 -0.73 0.00 0.00 179.01 180.12 2q5c h ILE 110 N 0.84 1.12 -0.58 2.32 1.08 -1.08 -1.11 117.51 120.10 2q5c h ILE 110 Ca 0.18 -0.32 0.07 0.00 -0.39 0.00 0.00 64.86 64.40 2q5c h ILE 110 Cb 0.37 0.77 -0.06 0.00 -3.07 0.00 0.00 36.82 34.82 2q5c h ILE 110 CO 0.00 0.13 0.26 -0.33 -0.69 0.00 0.00 178.15 177.52 2q5c h GLU 111 N 0.39 0.47 -0.47 2.37 5.08 -1.16 0.79 114.58 122.05 2q5c h GLU 111 Ca 0.11 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.39 2q5c h GLU 111 Cb 0.04 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 2q5c h GLU 111 CO -0.02 0.31 0.07 0.00 -1.00 0.00 0.00 179.01 178.38 2q5c h ALA 112 N 1.35 0.63 0.06 3.43 0.00 -1.15 -0.28 119.26 123.30 2q5c h ALA 112 Ca 0.28 -0.23 -0.24 0.00 0.00 0.00 0.00 54.91 54.71 2q5c h ALA 112 Cb 0.26 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2q5c h ALA 112 CO -0.23 0.36 -1.07 0.52 0.00 0.00 0.00 179.25 178.83 2q5c h MET 113 N 0.66 0.24 -0.01 0.00 2.86 -0.56 -3.35 114.93 114.77 2q5c h MET 113 Ca 0.14 -0.34 0.00 0.00 -2.06 0.00 0.00 59.70 57.44 2q5c h MET 113 Cb 0.40 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.17 2q5c h MET 113 CO 0.01 1.11 -0.10 1.28 1.06 0.00 0.00 176.91 180.27 2q5c n LEU 114 N -3.58 1.62 -2.86 1.22 4.77 0.21 -5.02 117.00 113.37 2q5c n LEU 114 Ca -0.06 -0.89 -0.14 0.00 -0.03 0.00 0.00 56.01 54.89 2q5c n LEU 114 Cb 0.93 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 42.09 2q5c n LEU 114 CO 0.51 0.31 0.11 0.61 -1.33 0.00 0.00 177.39 177.60 2q5c n GLY 115 N 0.76 -0.18 3.40 -0.72 0.00 -0.13 -5.03 105.19 103.29 2q5c n GLY 115 Ca 0.06 -0.02 -0.20 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 -3.27 1.45 -0.16 1.61 -7.23 -1.15 -4.99 120.40 106.66 2q5c s VAL 116 Ca 0.10 -2.09 -0.04 0.00 -1.81 0.00 0.00 61.98 58.14 2q5c s VAL 116 Cb -0.04 -2.43 -0.02 0.00 0.56 0.00 0.00 36.38 34.44 2q5c s VAL 116 CO 0.56 -0.30 -0.04 -0.75 -0.31 0.00 0.00 175.10 174.26 2q5c s LYS 117 N -3.77 3.62 -0.09 4.82 2.20 0.75 -4.48 119.74 122.80 2q5c s LYS 117 Ca 0.29 -0.54 0.03 0.00 -0.36 0.00 0.00 55.97 55.39 2q5c s LYS 117 Cb 0.05 -2.93 0.01 0.00 -1.51 0.00 0.00 37.83 33.45 2q5c s LYS 117 CO 0.11 0.18 -0.17 0.42 -0.36 0.00 0.00 175.35 175.53 2q5c s ILE 118 N 0.53 1.55 -0.24 5.43 1.01 -1.26 -0.78 121.20 127.44 2q5c s ILE 118 Ca -0.03 -0.70 -0.08 0.00 0.00 0.00 0.00 60.65 59.83 2q5c s ILE 118 Cb -0.14 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 40.91 2q5c s ILE 118 CO 0.03 0.45 0.10 -0.75 0.00 0.00 0.00 174.94 174.77 2q5c s LYS 119 N 0.66 3.85 -0.07 2.79 2.20 -0.27 -4.98 119.74 123.91 2q5c s LYS 119 Ca -0.13 -0.38 -0.16 0.00 -0.36 0.00 0.00 55.97 54.93 2q5c s LYS 119 Cb -0.16 -3.39 -0.05 0.00 -1.51 0.00 0.00 37.83 32.72 2q5c s LYS 119 CO 0.04 -0.03 0.41 -2.00 -0.36 0.00 0.00 175.35 173.40 2q5c s GLU 120 N 1.24 4.12 -0.03 4.03 2.12 -1.26 -1.03 118.70 127.89 2q5c s GLU 120 Ca 0.06 0.36 0.04 0.00 0.36 0.00 0.00 54.97 55.79 2q5c s GLU 120 Cb -0.14 -3.33 -0.00 0.00 0.26 0.00 0.00 34.13 30.91 2q5c s GLU 120 CO 0.05 0.42 -0.16 -0.06 -0.54 0.00 0.00 175.26 174.97 2q5c s PHE 121 N -0.20 1.55 -0.04 5.30 0.08 -0.27 -4.95 117.98 119.46 2q5c s PHE 121 Ca 0.23 -0.41 0.01 0.00 0.12 0.00 0.00 56.93 56.89 2q5c s PHE 121 Cb -0.15 -1.04 -0.03 0.00 -0.57 0.00 0.00 43.02 41.22 2q5c s PHE 121 CO 0.10 -0.12 -0.06 -0.51 -0.10 0.00 0.00 175.22 174.53 2q5c s LEU 122 N -0.03 3.23 0.12 -0.37 1.43 -1.26 -1.42 118.68 120.37 2q5c s LEU 122 Ca -0.01 -0.05 0.06 0.00 -1.03 0.00 0.00 54.13 53.10 2q5c s LEU 122 Cb -0.10 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 2q5c s LEU 122 CO 0.01 0.33 -0.14 0.72 0.23 0.00 0.00 176.35 177.51 2q5c s PHE 123 N -0.90 1.36 0.00 0.29 -0.12 -0.54 -4.92 117.98 113.15 2q5c s PHE 123 Ca 0.15 -0.55 0.00 0.00 -0.05 0.00 0.00 56.93 56.47 2q5c s PHE 123 Cb -0.11 -0.72 0.00 0.00 -0.63 0.00 0.00 43.02 41.56 2q5c s PHE 123 CO 0.04 0.12 0.29 0.43 -0.05 0.00 0.00 175.22 176.06 2q5c n SER 124 N 0.61 0.58 -3.64 1.98 7.64 -1.26 0.07 113.62 119.60 2q5c n SER 124 Ca -0.16 -0.83 -0.15 0.00 1.01 0.00 0.00 58.87 58.74 2q5c n SER 124 Cb 0.57 0.24 -0.08 0.00 -1.01 0.00 0.00 64.21 63.93 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 -0.24 -0.53 0.44 6.43 0.15 -1.26 -4.96 113.70 113.72 2q5c s SER 125 Ca 0.00 0.77 0.20 0.00 0.70 0.00 0.00 55.95 57.61 2q5c s SER 125 Cb 0.00 0.76 1.14 0.00 -1.71 0.00 0.00 66.02 66.21 2q5c s SER 125 CO 0.00 -0.40 1.87 -0.08 1.20 0.00 0.00 173.24 175.82 2q5c h GLU 126 N 4.13 0.33 0.00 5.44 4.81 -2.00 -1.63 114.58 125.66 2q5c h GLU 126 Ca -0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 2q5c h GLU 126 Cb 1.16 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.47 2q5c h GLU 126 CO 0.29 0.22 0.00 -0.25 -0.73 0.00 0.00 179.01 178.54 2q5c n ASP 127 N -4.48 0.00 0.02 1.04 8.00 -1.26 -2.36 116.55 117.51 2q5c n ASP 127 Ca 0.19 -0.64 0.11 0.00 0.71 0.00 0.00 54.79 55.16 2q5c n ASP 127 Cb 0.72 -0.06 0.03 0.00 -0.02 0.00 0.00 41.12 41.79 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 -1.06 0.21 -0.02 -1.24 1.02 -0.61 -4.63 120.64 114.30 2q5c n GLU 128 Ca 0.18 -0.01 -0.12 0.00 -0.02 0.00 0.00 57.16 57.19 2q5c n GLU 128 Cb 0.11 -1.57 -0.06 0.00 -0.02 0.00 0.00 31.44 29.90 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 1.17 -0.86 -3.67 2.04 -1.60 -0.88 117.51 113.72 2q5c h ILE 129 Ca 0.00 -0.53 -0.02 0.00 1.00 0.00 0.00 64.86 65.31 2q5c h ILE 129 Cb 0.67 1.33 -0.04 0.00 -0.74 0.00 0.00 36.82 38.04 2q5c h ILE 129 CO 0.00 0.16 0.45 0.71 0.00 0.00 0.00 178.15 179.47 2q5c h THR 130 N -0.02 1.26 -0.47 -0.27 1.35 -1.82 -1.50 112.91 111.44 2q5c h THR 130 Ca 0.03 -0.66 -0.12 0.00 -0.55 0.00 0.00 66.41 65.11 2q5c h THR 130 Cb 0.21 0.11 -0.01 0.00 -1.73 0.00 0.00 68.15 66.74 2q5c h THR 130 CO -0.00 0.29 -0.16 0.74 -0.25 0.00 0.00 175.52 176.14 2q5c h THR 131 N 1.21 1.27 -0.74 6.82 2.02 -1.80 -2.02 112.91 119.66 2q5c h THR 131 Ca 0.30 -1.31 -0.03 0.00 0.77 0.00 0.00 66.41 66.15 2q5c h THR 131 Cb 0.06 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.55 2q5c h THR 131 CO -0.04 0.45 0.36 0.25 0.37 0.00 0.00 175.52 176.91 2q5c h LEU 132 N 0.79 0.97 -0.69 2.58 5.85 -0.78 -0.14 115.31 123.90 2q5c h LEU 132 Ca 0.11 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.70 2q5c h LEU 132 Cb 0.72 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 2q5c h LEU 132 CO 0.06 0.83 0.44 0.40 -0.34 0.00 0.00 178.44 179.82 2q5c h ILE 133 N 1.04 1.19 -0.97 4.05 1.08 -1.14 -1.11 117.51 121.65 2q5c h ILE 133 Ca 0.26 -0.38 0.03 0.00 -0.39 0.00 0.00 64.86 64.38 2q5c h ILE 133 Cb 0.12 0.20 -0.06 0.00 -3.07 0.00 0.00 36.82 34.01 2q5c h ILE 133 CO -0.03 0.19 0.64 0.28 -0.69 0.00 0.00 178.15 178.53 2q5c h SER 134 N 0.93 1.07 -0.59 1.72 0.02 -0.90 -2.15 113.55 113.66 2q5c h SER 134 Ca 0.25 -0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.20 2q5c h SER 134 Cb -0.07 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.19 2q5c h SER 134 CO -0.05 0.74 0.38 0.50 -1.14 0.00 0.00 176.83 177.26 2q5c h LYS 135 N 1.24 0.75 -0.65 3.45 3.64 -0.31 -2.13 116.57 122.56 2q5c h LYS 135 Ca 0.38 -0.05 0.12 0.00 -1.27 0.00 0.00 60.65 59.84 2q5c h LYS 135 Cb -0.02 -0.17 -0.09 0.00 -0.41 0.00 0.00 32.23 31.54 2q5c h LYS 135 CO -0.12 0.50 0.19 0.28 -2.27 0.00 0.00 179.45 178.03 2q5c h VAL 136 N 0.78 0.65 -0.78 2.00 2.07 -0.60 -1.31 116.25 119.06 2q5c h VAL 136 Ca 0.22 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.62 2q5c h VAL 136 Cb -0.07 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 29.96 2q5c h VAL 136 CO -0.06 0.06 0.45 0.11 0.02 0.00 0.00 177.57 178.15 2q5c h LYS 137 N 0.32 1.07 0.00 1.57 1.57 -0.97 -1.28 116.57 118.85 2q5c h LYS 137 Ca 0.35 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 2q5c h LYS 137 Cb 0.52 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.61 2q5c h LYS 137 CO -0.40 0.77 0.00 1.79 -0.57 0.00 0.00 179.45 181.04 2q5c h THR 138 N 1.07 0.00 -0.12 -0.16 1.35 -0.67 -0.35 112.91 114.02 2q5c h THR 138 Ca 0.28 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.73 2q5c h THR 138 Cb -0.01 1.38 0.00 0.00 -1.73 0.00 0.00 68.15 67.79 2q5c h THR 138 CO -0.05 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 174.60 2q5c n GLU 139 N -3.02 1.49 -2.38 4.72 -0.58 -0.50 -4.91 120.64 115.46 2q5c n GLU 139 Ca 0.00 -0.74 -0.15 0.00 -0.42 0.00 0.00 57.16 55.85 2q5c n GLU 139 Cb 0.26 -1.34 -0.00 0.00 -0.57 0.00 0.00 31.44 29.79 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 -0.03 -4.65 -4.72 1.62 5.15 -0.14 -5.01 115.26 107.48 2q5c n ASN 140 Ca 0.14 -0.05 -0.35 0.00 -0.60 0.00 0.00 54.58 53.72 2q5c n ASN 140 Cb 0.23 -3.74 -0.08 0.00 -0.53 0.00 0.00 39.78 35.66 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 -2.80 4.93 -1.16 -1.44 1.01 -1.11 -5.00 121.20 115.62 2q5c s ILE 141 Ca 0.04 0.00 0.10 0.00 0.00 0.00 0.00 60.65 60.79 2q5c s ILE 141 Cb -0.02 -3.17 0.05 0.00 0.01 0.00 0.00 42.46 39.33 2q5c s ILE 141 CO 0.05 0.54 0.75 0.29 0.00 0.00 0.00 174.94 176.56 2q5c n LYS 142 N 2.77 1.19 -4.16 2.79 5.02 -1.26 -4.36 118.16 120.17 2q5c n LYS 142 Ca -0.18 -0.90 -0.22 0.00 -2.02 0.00 0.00 58.31 54.99 2q5c n LYS 142 Cb 0.53 -1.15 -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 -1.11 0.68 -0.10 -0.18 1.01 -1.26 -0.56 121.20 119.69 2q5c s ILE 143 Ca 0.11 -0.17 0.04 0.00 0.00 0.00 0.00 60.65 60.62 2q5c s ILE 143 Cb 0.09 -0.70 0.00 0.00 0.01 0.00 0.00 42.46 41.86 2q5c s ILE 143 CO 0.19 0.27 -0.23 -0.69 0.00 0.00 0.00 174.94 174.47 2q5c s VAL 144 N 1.11 2.01 -0.21 2.92 1.01 0.11 -0.66 120.40 126.69 2q5c s VAL 144 Ca -0.08 -0.99 -0.02 0.00 0.00 0.00 0.00 61.98 60.89 2q5c s VAL 144 Cb -0.14 -1.74 0.00 0.00 0.00 0.00 0.00 36.38 34.50 2q5c s VAL 144 CO -0.01 0.55 -0.09 -0.69 0.00 0.00 0.00 175.10 174.86 2q5c s VAL 145 N 0.36 2.97 0.01 2.92 1.01 0.28 -1.00 120.40 126.95 2q5c s VAL 145 Ca -0.19 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.15 2q5c s VAL 145 Cb -0.18 -2.33 0.00 0.00 0.00 0.00 0.00 36.38 33.88 2q5c s VAL 145 CO 0.09 0.46 0.06 -0.24 0.00 0.00 0.00 175.10 175.46 2q5c n SER 146 N 4.73 -0.09 -4.73 3.32 2.88 -1.09 -1.55 113.62 117.09 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 0.51 0.15 0.15 0.00 -0.75 0.00 0.00 64.21 64.27 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 -2.00 1.57 0.26 0.46 0.00 -1.26 -0.59 107.32 105.76 2q5c s GLY 147 Ca 0.01 -0.41 -0.04 0.00 0.00 0.00 0.00 44.72 44.28 2q5c s GLY 147 CO 0.00 0.17 1.84 1.70 0.00 0.00 0.00 173.10 176.82 2q5c h LYS 148 N -1.68 1.07 -0.71 2.90 1.63 -1.96 0.49 116.57 118.31 2q5c h LYS 148 Ca -0.52 -0.16 -0.03 0.00 -0.85 0.00 0.00 60.65 59.08 2q5c h LYS 148 Cb 1.33 -0.19 -0.03 0.00 -0.60 0.00 0.00 32.23 32.73 2q5c h LYS 148 CO 0.59 0.84 0.31 1.15 -3.45 0.00 0.00 179.45 178.89 2q5c h THR 149 N 1.06 1.24 -0.15 1.00 2.02 -1.99 -0.41 112.91 115.68 2q5c h THR 149 Ca 0.25 -0.72 -0.05 0.00 0.77 0.00 0.00 66.41 66.67 2q5c h THR 149 Cb 0.14 0.40 -0.00 0.00 -1.74 0.00 0.00 68.15 66.95 2q5c h THR 149 CO -0.03 0.29 -0.09 0.58 0.37 0.00 0.00 175.52 176.65 2q5c h VAL 150 N 1.00 1.32 -0.13 3.16 2.07 -1.77 -2.44 116.25 119.46 2q5c h VAL 150 Ca 0.24 -1.16 -0.08 0.00 0.82 0.00 0.00 66.70 66.52 2q5c h VAL 150 Cb 0.17 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 2q5c h VAL 150 CO -0.02 0.34 -0.28 0.71 0.02 0.00 0.00 177.57 178.34 2q5c h THR 151 N -0.03 1.25 -0.83 2.57 1.35 -0.81 -0.89 112.91 115.53 2q5c h THR 151 Ca 0.03 -1.17 -0.00 0.00 -0.55 0.00 0.00 66.41 64.72 2q5c h THR 151 Cb 0.58 1.46 -0.04 0.00 -1.73 0.00 0.00 68.15 68.42 2q5c h THR 151 CO 0.03 0.35 0.51 0.44 -0.25 0.00 0.00 175.52 176.60 2q5c h ASP 152 N 0.21 0.99 -0.08 5.36 3.32 -1.03 -1.41 116.42 123.77 2q5c h ASP 152 Ca 0.03 -0.06 -0.11 0.00 0.02 0.00 0.00 57.03 56.91 2q5c h ASP 152 Cb 0.61 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 2q5c h ASP 152 CO 0.04 0.75 -0.31 -0.08 -1.72 0.00 0.00 179.24 177.92 2q5c h GLU 153 N 1.13 0.56 -0.21 3.56 4.57 -0.89 -1.31 114.58 121.99 2q5c h GLU 153 Ca 0.30 -0.25 0.02 0.00 -1.18 0.00 0.00 59.36 58.26 2q5c h GLU 153 Cb -0.06 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.49 2q5c h GLU 153 CO -0.06 0.81 0.06 0.00 -1.18 0.00 0.00 179.01 178.64 2q5c h ALA 154 N 1.18 0.22 -0.67 2.92 0.00 -0.72 -1.23 119.26 120.94 2q5c h ALA 154 Ca 0.06 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2q5c h ALA 154 Cb 0.78 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 2q5c h ALA 154 CO 0.06 -0.37 0.21 0.82 0.00 0.00 0.00 179.25 179.97 2q5c h ILE 155 N 0.15 1.25 -0.99 0.00 2.04 -1.15 0.11 117.51 118.92 2q5c h ILE 155 Ca 0.09 -0.88 0.08 0.00 1.00 0.00 0.00 64.86 65.16 2q5c h ILE 155 Cb 0.07 0.55 -0.07 0.00 -0.74 0.00 0.00 36.82 36.63 2q5c h ILE 155 CO -0.11 0.34 0.63 0.50 0.00 0.00 0.00 178.15 179.52 2q5c h LYS 156 N 0.99 1.06 -0.55 2.37 3.64 -0.82 -0.02 116.57 123.23 2q5c h LYS 156 Ca 0.22 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2q5c h LYS 156 Cb 0.30 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 2q5c h LYS 156 CO -0.01 0.70 0.00 1.04 -2.27 0.00 0.00 179.45 178.92 2q5c n GLN 157 N -4.53 2.04 -0.89 1.90 6.02 -0.50 -4.89 117.38 116.52 2q5c n GLN 157 Ca 0.16 -1.08 0.00 0.00 -0.01 0.00 0.00 57.00 56.07 2q5c n GLN 157 Cb 0.24 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.01 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 0.59 0.45 4.00 1.08 0.00 -0.02 -5.06 105.19 106.24 2q5c n GLY 158 Ca 0.10 -0.94 -0.18 0.00 0.00 0.00 0.00 46.02 45.00 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 3.77 0.20 0.99 1.43 0.34 -4.98 118.68 120.42 2q5c s LEU 159 Ca 0.00 -0.32 -0.22 0.00 -1.03 0.00 0.00 54.13 52.55 2q5c s LEU 159 Cb 0.00 -2.70 -0.08 0.00 0.03 0.00 0.00 46.19 43.44 2q5c s LEU 159 CO 0.00 -0.65 0.75 -0.31 0.23 0.00 0.00 176.35 176.37 2q5c s TYR 160 N -2.30 3.76 -0.05 0.29 2.02 0.28 -3.84 117.35 117.51 2q5c s TYR 160 Ca 0.51 1.50 0.03 0.00 -0.37 0.00 0.00 57.07 58.75 2q5c s TYR 160 Cb -0.10 -2.69 0.00 0.00 -0.40 0.00 0.00 41.96 38.78 2q5c s TYR 160 CO 0.32 0.41 -0.15 0.20 -1.57 0.00 0.00 175.55 174.77 2q5c s GLY 161 N -1.42 0.87 -0.18 0.71 0.00 -1.26 -0.71 107.32 105.33 2q5c s GLY 161 Ca 0.40 -0.58 -0.00 0.00 0.00 0.00 0.00 44.72 44.54 2q5c s GLY 161 CO 0.23 -0.15 -0.07 1.85 0.00 0.00 0.00 173.10 174.96 2q5c s GLU 162 N 0.31 1.64 0.16 2.90 2.56 -0.17 -4.97 118.70 121.12 2q5c s GLU 162 Ca -0.09 -0.64 -0.28 0.00 0.00 0.00 0.00 54.97 53.96 2q5c s GLU 162 Cb -0.13 -2.17 -0.07 0.00 2.00 0.00 0.00 34.13 33.76 2q5c s GLU 162 CO 0.03 -0.44 0.89 0.99 -0.56 0.00 0.00 175.26 176.17 2q5c s THR 163 N 1.55 4.34 -0.22 -1.70 2.01 -1.26 -2.67 115.64 117.69 2q5c s THR 163 Ca -0.00 1.95 -0.28 0.00 0.31 0.00 0.00 61.69 63.67 2q5c s THR 163 Cb -0.16 -4.26 0.00 0.00 0.01 0.00 0.00 72.50 68.10 2q5c s THR 163 CO -0.08 0.43 0.98 -0.63 -0.69 0.00 0.00 174.62 174.63 2q5c s ILE 164 N -0.68 4.73 0.60 1.82 1.01 0.24 -4.83 121.20 124.09 2q5c s ILE 164 Ca 0.41 1.91 0.10 0.00 0.00 0.00 0.00 60.65 63.07 2q5c s ILE 164 Cb -0.24 -4.26 0.10 0.00 0.01 0.00 0.00 42.46 38.07 2q5c s ILE 164 CO 0.29 -0.13 0.82 0.59 0.00 0.00 0.00 174.94 176.51 2q5c n ASN 165 N 6.09 2.19 -3.98 3.58 3.02 -1.26 -4.75 115.26 120.15 2q5c n ASN 165 Ca 0.10 -2.60 -0.09 0.00 -0.03 0.00 0.00 54.58 51.96 2q5c n ASN 165 Cb 0.47 -0.43 -0.11 0.00 -0.61 0.00 0.00 39.78 39.10 2q5c n ASN 165 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2q5c s SER 166 N -4.70 0.24 0.05 6.41 0.15 -1.26 -4.82 113.70 109.78 2q5c s SER 166 Ca 0.62 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.77 2q5c s SER 166 Cb -0.05 0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.36 2q5c s SER 166 CO 0.39 -0.30 0.02 0.61 1.20 0.00 0.00 173.24 175.16 2q5c n GLY 167 N 1.60 3.69 0.18 9.45 0.00 -1.26 -4.79 105.19 114.06 2q5c n GLY 167 Ca -0.24 -2.21 -0.10 0.00 0.00 0.00 0.00 46.02 43.47 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 -0.62 1.61 4.81 -1.99 -2.50 114.58 116.43 2q5c h GLU 168 Ca -0.04 -0.13 -0.02 0.00 -0.13 0.00 0.00 59.36 59.05 2q5c h GLU 168 Cb 0.13 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 2q5c h GLU 168 CO 0.07 0.59 0.32 1.49 -0.73 0.00 0.00 179.01 180.74 2q5c h GLU 169 N 0.39 0.87 -0.71 1.92 4.57 -1.99 0.26 114.58 119.90 2q5c h GLU 169 Ca 0.11 -0.12 -0.00 0.00 -1.18 0.00 0.00 59.36 58.17 2q5c h GLU 169 Cb 0.29 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.68 2q5c h GLU 169 CO 0.00 0.68 0.43 0.66 -1.18 0.00 0.00 179.01 179.60 2q5c h SER 170 N 0.84 0.85 -0.59 1.04 4.64 -1.95 -1.00 113.55 117.38 2q5c h SER 170 Ca 0.21 -0.06 -0.10 0.00 -0.47 0.00 0.00 61.79 61.37 2q5c h SER 170 Cb 0.08 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 61.94 2q5c h SER 170 CO -0.03 0.66 -0.03 0.25 -0.87 0.00 0.00 176.83 176.81 2q5c h LEU 171 N 0.96 1.05 -0.90 5.97 5.85 -0.96 -0.74 115.31 126.55 2q5c h LEU 171 Ca 0.25 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.66 2q5c h LEU 171 Cb -0.03 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.67 2q5c h LEU 171 CO -0.05 1.11 0.57 0.03 -0.34 0.00 0.00 178.44 179.77 2q5c h ARG 172 N 0.96 1.19 -0.63 1.25 3.08 -0.69 -1.39 114.38 118.15 2q5c h ARG 172 Ca 0.16 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 60.05 2q5c h ARG 172 Cb 0.59 -0.26 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 2q5c h ARG 172 CO 0.04 0.81 0.08 0.00 -1.07 0.00 0.00 179.97 179.82 2q5c h ARG 173 N 1.22 1.04 -0.49 0.04 3.08 -0.73 -1.12 114.38 117.43 2q5c h ARG 173 Ca 0.33 -0.28 -0.09 0.00 0.07 0.00 0.00 59.98 60.00 2q5c h ARG 173 Cb -0.11 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 29.80 2q5c h ARG 173 CO -0.07 0.97 -0.07 0.00 -1.07 0.00 0.00 179.97 179.73 2q5c h ALA 174 N 1.10 0.95 -0.35 0.04 0.00 -0.77 -1.29 119.26 118.94 2q5c h ALA 174 Ca 0.19 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2q5c h ALA 174 Cb 0.46 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2q5c h ALA 174 CO 0.02 0.62 0.15 0.82 0.00 0.00 0.00 179.25 180.85 2q5c h ILE 175 N 0.79 1.18 -0.58 0.00 2.04 -0.98 -0.31 117.51 119.65 2q5c h ILE 175 Ca 0.14 -0.56 0.04 0.00 1.00 0.00 0.00 64.86 65.48 2q5c h ILE 175 Cb 0.57 0.90 -0.05 0.00 -0.74 0.00 0.00 36.82 37.51 2q5c h ILE 175 CO 0.04 0.20 0.32 -0.08 0.00 0.00 0.00 178.15 178.63 2q5c h GLU 176 N 0.42 0.60 -0.67 2.37 4.81 -0.98 0.14 114.58 121.28 2q5c h GLU 176 Ca 0.12 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 2q5c h GLU 176 Cb 0.18 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.39 2q5c h GLU 176 CO -0.01 0.39 0.36 1.49 -0.73 0.00 0.00 179.01 180.52 2q5c h GLU 177 N 0.61 0.93 -0.36 1.92 4.81 -1.00 -1.59 114.58 119.90 2q5c h GLU 177 Ca 0.25 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 59.34 2q5c h GLU 177 Cb 0.12 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 2q5c h GLU 177 CO -0.15 0.70 0.11 0.00 -0.73 0.00 0.00 179.01 178.95 2q5c h ALA 178 N 1.18 0.48 -0.76 2.92 0.00 -0.38 -0.70 119.26 121.99 2q5c h ALA 178 Ca 0.23 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2q5c h ALA 178 Cb 0.04 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2q5c h ALA 178 CO -0.04 0.12 0.32 -0.07 0.00 0.00 0.00 179.25 179.58 2q5c h LEU 179 N 0.44 1.02 -0.58 0.00 3.38 -0.81 0.20 115.31 118.96 2q5c h LEU 179 Ca 0.12 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 2q5c h LEU 179 Cb 0.25 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2q5c h LEU 179 CO -0.00 0.89 0.03 0.78 0.09 0.00 0.00 178.44 180.23 2q5c h ASN 180 N 1.09 0.98 -0.77 -0.43 2.35 -0.97 -2.00 115.58 115.83 2q5c h ASN 180 Ca 0.26 -0.29 -0.06 0.00 -0.55 0.00 0.00 56.30 55.66 2q5c h ASN 180 Cb 0.18 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.26 2q5c h ASN 180 CO -0.02 1.03 0.26 -0.07 -1.65 0.00 0.00 177.43 176.97 2q5c h LEU 181 N 0.90 1.10 -0.30 1.61 4.07 -0.58 -1.37 115.31 120.73 2q5c h LEU 181 Ca 0.17 -0.20 -0.03 0.00 0.08 0.00 0.00 57.88 57.90 2q5c h LEU 181 Cb 0.51 -0.29 -0.01 0.00 1.08 0.00 0.00 40.66 41.95 2q5c h LEU 181 CO 0.02 1.00 0.07 0.40 -1.08 0.00 0.00 178.44 178.86 2q5c h ILE 182 N 1.13 1.22 -0.75 1.22 2.04 -0.76 -0.87 117.51 120.75 2q5c h ILE 182 Ca 0.25 -0.73 -0.04 0.00 1.00 0.00 0.00 64.86 65.34 2q5c h ILE 182 Cb 0.28 1.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 2q5c h ILE 182 CO -0.01 0.24 0.31 -0.08 0.00 0.00 0.00 178.15 178.61 2q5c h GLU 183 N 0.33 1.10 -0.10 2.37 4.81 -1.17 -1.84 114.58 120.08 2q5c h GLU 183 Ca 0.10 -0.18 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 2q5c h GLU 183 Cb 0.29 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.48 2q5c h GLU 183 CO 0.00 0.88 0.04 0.28 -0.73 0.00 0.00 179.01 179.48 2q5c h VAL 184 N 1.08 1.13 -0.68 0.32 2.07 -1.03 -2.79 116.25 116.35 2q5c h VAL 184 Ca 0.25 -0.38 0.09 0.00 0.82 0.00 0.00 66.70 67.48 2q5c h VAL 184 Cb 0.18 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 2q5c h VAL 184 CO -0.02 0.11 0.45 -0.09 0.02 0.00 0.00 177.57 178.04 2q5c h ARG 185 N 0.02 0.57 -0.01 1.57 2.43 -0.88 -3.51 114.38 114.57 2q5c h ARG 185 Ca 0.03 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2q5c h ARG 185 Cb 0.14 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 2q5c h ARG 185 CO -0.00 0.38 0.00 0.09 -1.51 0.00 0.00 179.97 178.92