#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c4b s ILE 4 N 0.00 3.62 0.00 2.52 1.01 -1.26 -4.93 121.20 122.16 2c4b s ILE 4 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 60.65 59.51 2c4b s ILE 4 Cb 0.00 -3.04 0.00 0.00 0.01 0.00 0.00 42.46 39.43 2c4b s ILE 4 CO 0.00 -0.13 0.73 -0.46 0.00 0.00 0.00 174.94 175.08 2c4b n ASN 5 N 4.78 0.00 -4.94 3.58 6.94 -1.26 -4.79 115.26 119.57 2c4b n ASN 5 Ca -0.13 -1.52 -0.25 0.00 -0.02 0.00 0.00 54.58 52.67 2c4b n ASN 5 Cb 0.45 -0.10 -0.02 0.00 -2.36 0.00 0.00 39.78 37.75 2c4b n ASN 5 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2c4b s THR 6 N 0.00 5.12 0.12 5.53 -4.23 -1.26 -0.68 115.64 120.25 2c4b s THR 6 Ca 0.00 -0.44 -0.22 0.00 -1.18 0.00 0.00 61.69 59.85 2c4b s THR 6 Cb 0.00 -3.83 -0.04 0.00 1.34 0.00 0.00 72.50 69.97 2c4b s THR 6 CO 0.00 -0.46 1.68 -0.26 -0.54 0.00 0.00 174.62 175.04 2c4b h PHE 7 N 1.07 -0.30 -0.34 3.99 0.04 -1.98 -0.18 116.94 119.23 2c4b h PHE 7 Ca -0.49 0.02 -0.15 0.00 2.80 0.00 0.00 57.97 60.14 2c4b h PHE 7 Cb 1.21 0.15 -0.01 0.00 2.20 0.00 0.00 35.95 39.51 2c4b h PHE 7 CO 0.52 -0.18 -0.39 -0.44 -0.60 0.00 0.00 178.31 177.22 2c4b h ASP 8 N -0.15 0.85 -0.37 2.17 3.32 -1.98 -0.46 116.42 119.80 2c4b h ASP 8 Ca 0.08 -0.39 -0.07 0.00 0.02 0.00 0.00 57.03 56.68 2c4b h ASP 8 Cb 0.27 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 2c4b h ASP 8 CO -0.20 1.14 -0.04 1.23 -1.72 0.00 0.00 179.24 179.66 2c4b h GLY 9 N 0.89 0.73 1.20 2.75 0.00 -1.89 -0.96 103.07 105.78 2c4b h GLY 9 Ca 0.06 -0.56 -0.17 0.00 0.00 0.00 0.00 47.33 46.65 2c4b h GLY 9 CO 0.09 0.52 -0.48 -2.08 0.00 0.00 0.00 176.54 174.59 2c4b h VAL 10 N 0.48 1.28 -0.49 4.60 2.07 -1.05 -1.44 116.25 121.70 2c4b h VAL 10 Ca 0.10 -1.66 0.02 0.00 0.82 0.00 0.00 66.70 65.98 2c4b h VAL 10 Cb 0.52 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.80 2c4b h VAL 10 CO 0.03 0.54 0.29 0.00 0.02 0.00 0.00 177.57 178.45 2c4b h ALA 11 N 0.77 0.63 -0.51 1.67 0.00 -0.96 0.74 119.26 121.60 2c4b h ALA 11 Ca 0.03 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2c4b h ALA 11 Cb 1.07 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 2c4b h ALA 11 CO 0.11 -0.01 0.14 -0.44 0.00 0.00 0.00 179.25 179.05 2c4b h ASP 12 N 0.59 0.76 -0.34 0.00 3.32 -1.09 -1.55 116.42 118.10 2c4b h ASP 12 Ca 0.20 -0.22 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 2c4b h ASP 12 Cb 0.02 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 2c4b h ASP 12 CO -0.09 0.78 0.12 0.22 -1.72 0.00 0.00 179.24 178.55 2c4b h TYR 13 N 0.70 0.54 -0.46 4.55 5.03 -0.89 -0.98 116.97 125.47 2c4b h TYR 13 Ca 0.16 -0.05 0.02 0.00 2.58 0.00 0.00 58.73 61.45 2c4b h TYR 13 Cb 0.31 -0.16 -0.03 0.00 1.55 0.00 0.00 36.73 38.40 2c4b h TYR 13 CO 0.02 0.52 0.26 -0.07 -1.32 0.00 0.00 178.16 177.57 2c4b h LEU 14 N 0.41 0.42 -1.26 2.82 3.38 -0.73 0.91 115.31 121.25 2c4b h LEU 14 Ca 0.11 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.02 2c4b h LEU 14 Cb 0.22 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2c4b h LEU 14 CO -0.01 0.30 -0.35 1.56 0.09 0.00 0.00 178.44 180.03 2c4b h GLN 15 N 0.53 0.03 0.01 1.13 4.20 -1.11 0.18 115.11 120.08 2c4b h GLN 15 Ca 0.19 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.88 2c4b h GLN 15 Cb 0.04 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.81 2c4b h GLN 15 CO -0.10 0.38 -0.03 1.15 -0.67 0.00 0.00 178.83 179.56 2c4b h THR 16 N 0.03 1.76 0.00 -0.54 2.02 -0.78 -3.41 112.91 111.99 2c4b h THR 16 Ca 0.00 -2.28 0.00 0.00 0.77 0.00 0.00 66.41 64.90 2c4b h THR 16 Cb 0.64 3.31 0.00 0.00 -1.74 0.00 0.00 68.15 70.36 2c4b h THR 16 CO 0.05 0.59 -0.87 -1.22 0.37 0.00 0.00 175.52 174.44 2c4b n TYR 17 N -4.61 0.00 -2.84 3.16 4.01 0.28 -4.59 117.16 112.58 2c4b n TYR 17 Ca -0.10 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.45 2c4b n TYR 17 Cb 0.48 -0.05 0.03 0.00 -0.31 0.00 0.00 39.34 39.49 2c4b n TYR 17 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2c4b n HIS 18 N -1.46 -1.56 -3.58 -0.72 8.25 0.64 -4.96 115.22 111.82 2c4b n HIS 18 Ca 0.02 0.40 -0.09 0.00 -0.26 0.00 0.00 57.72 57.79 2c4b n HIS 18 Cb 0.27 -3.89 -0.02 0.00 1.12 0.00 0.00 29.99 27.47 2c4b n HIS 18 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 2c4b s LYS 19 N -5.44 1.23 0.55 -0.41 -2.85 -1.26 -5.07 119.74 106.48 2c4b s LYS 19 Ca 0.23 -0.55 -0.17 0.00 -1.00 0.00 0.00 55.97 54.48 2c4b s LYS 19 Cb -0.10 0.50 -0.06 0.00 -2.06 0.00 0.00 37.83 36.11 2c4b s LYS 19 CO 0.28 -0.55 1.03 -0.51 0.10 0.00 0.00 175.35 175.71 2c4b s LEU 20 N -2.74 3.63 0.93 2.77 1.43 -1.26 -4.01 118.68 119.44 2c4b s LEU 20 Ca 0.06 1.79 -0.11 0.00 -1.03 0.00 0.00 54.13 54.84 2c4b s LEU 20 Cb -0.02 -4.54 0.12 0.00 0.03 0.00 0.00 46.19 41.79 2c4b s LEU 20 CO -0.06 -0.93 0.95 -2.65 0.23 0.00 0.00 176.35 173.90 2c4b n PRO 21 N -1.63 -0.48 0.00 1.29 -0.02 -1.26 -4.89 135.00 128.01 2c4b n PRO 21 Ca 0.08 -0.08 0.11 0.00 -2.02 0.00 0.00 63.50 61.59 2c4b n PRO 21 Cb 0.53 -2.24 0.53 0.00 -0.02 0.00 0.00 33.50 32.30 2c4b n PRO 21 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2c4b n ASP 22 N -3.53 0.00 0.00 2.55 5.68 -1.26 -2.31 116.55 117.68 2c4b n ASP 22 Ca 0.10 0.15 0.07 0.00 -0.50 0.00 0.00 54.79 54.62 2c4b n ASP 22 Cb 0.52 -0.36 0.43 0.00 -1.14 0.00 0.00 41.12 40.57 2c4b n ASP 22 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 2c4b n ASN 23 N -1.36 0.00 -4.83 -1.12 6.94 -1.26 -4.77 115.26 108.85 2c4b n ASN 23 Ca 0.09 -0.98 -0.35 0.00 -0.02 0.00 0.00 54.58 53.32 2c4b n ASN 23 Cb 0.21 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.56 2c4b n ASN 23 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 2c4b s TYR 24 N -2.00 3.44 0.04 -2.53 2.02 -0.98 -0.91 117.35 116.43 2c4b s TYR 24 Ca 0.22 0.36 0.02 0.00 -0.37 0.00 0.00 57.07 57.29 2c4b s TYR 24 Cb 0.10 -1.84 -0.02 0.00 -0.40 0.00 0.00 41.96 39.80 2c4b s TYR 24 CO 0.17 0.63 -0.07 0.96 -1.57 0.00 0.00 175.55 175.67 2c4b s ILE 25 N -1.13 0.47 0.83 2.71 -4.36 -0.31 -4.91 121.20 114.51 2c4b s ILE 25 Ca 0.20 -1.04 -0.11 0.00 -0.26 0.00 0.00 60.65 59.44 2c4b s ILE 25 Cb -0.12 -0.55 0.09 0.00 1.25 0.00 0.00 42.46 43.13 2c4b s ILE 25 CO 0.10 -0.39 1.09 0.42 0.24 0.00 0.00 174.94 176.41 2c4b s THR 26 N -1.37 2.95 0.25 8.37 -4.23 -1.18 -0.52 115.64 119.91 2c4b s THR 26 Ca -0.11 0.31 -0.04 0.00 -1.18 0.00 0.00 61.69 60.68 2c4b s THR 26 Cb -0.10 -2.95 0.23 0.00 1.34 0.00 0.00 72.50 71.02 2c4b s THR 26 CO 0.00 -0.40 1.84 0.11 -0.54 0.00 0.00 174.62 175.63 2c4b h LYS 27 N -1.24 0.93 -0.62 3.99 1.57 -1.95 -0.10 116.57 119.15 2c4b h LYS 27 Ca -0.48 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.18 2c4b h LYS 27 Cb 1.27 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 33.35 2c4b h LYS 27 CO 0.57 0.62 0.12 1.03 -0.57 0.00 0.00 179.45 181.22 2c4b h SER 28 N 0.96 0.97 -0.66 0.86 0.87 -1.99 0.32 113.55 114.89 2c4b h SER 28 Ca 0.41 -0.25 -0.04 0.00 -1.23 0.00 0.00 61.79 60.68 2c4b h SER 28 Cb 0.27 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 61.95 2c4b h SER 28 CO -0.21 0.97 0.25 -0.33 -0.53 0.00 0.00 176.83 176.98 2c4b h GLU 29 N 0.92 0.99 -0.36 2.24 5.08 -1.78 -1.28 114.58 120.39 2c4b h GLU 29 Ca 0.19 -0.19 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 2c4b h GLU 29 Cb 0.41 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 2c4b h GLU 29 CO 0.01 0.84 0.04 0.00 -1.00 0.00 0.00 179.01 178.90 2c4b h ALA 30 N 1.10 0.48 -0.97 3.43 0.00 -0.67 -2.63 119.26 120.00 2c4b h ALA 30 Ca 0.22 -0.22 0.08 0.00 0.00 0.00 0.00 54.91 54.99 2c4b h ALA 30 Cb 0.23 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.81 2c4b h ALA 30 CO -0.02 0.20 0.61 0.37 0.00 0.00 0.00 179.25 180.41 2c4b h GLN 31 N 0.43 1.03 0.00 0.00 4.15 -0.73 -0.68 115.11 119.31 2c4b h GLN 31 Ca 0.11 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.43 2c4b h GLN 31 Cb 0.38 -0.23 -0.00 0.00 0.21 0.00 0.00 27.48 27.84 2c4b h GLN 31 CO 0.01 0.68 -0.15 0.00 -1.93 0.00 0.00 178.83 177.44 2c4b h ALA 32 N 1.47 1.17 -0.00 3.38 0.00 -0.89 -1.44 119.26 122.94 2c4b h ALA 32 Ca 0.44 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2c4b h ALA 32 Cb 0.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2c4b h ALA 32 CO -0.21 0.19 -0.12 1.28 0.00 0.00 0.00 179.25 180.39 2c4b n LEU 33 N -3.51 0.60 0.00 0.00 4.77 -0.53 -4.92 117.00 113.40 2c4b n LEU 33 Ca -0.01 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 2c4b n LEU 33 Cb 0.30 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 2c4b n LEU 33 CO 0.31 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 2c4b n GLY 34 N 1.28 0.86 3.74 -0.72 0.00 -0.54 -4.83 105.19 104.97 2c4b n GLY 34 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2c4b n GLY 34 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2c4b s TRP 35 N -2.00 3.01 -0.09 1.61 -0.00 -0.38 -4.97 118.94 116.13 2c4b s TRP 35 Ca 0.00 0.99 0.00 0.00 -0.00 0.00 0.00 56.10 57.09 2c4b s TRP 35 Cb 0.00 -3.83 0.02 0.00 -0.00 0.00 0.00 33.47 29.66 2c4b s TRP 35 CO 0.00 -2.74 -0.07 0.08 -0.00 0.00 0.00 176.95 174.21 2c4b s VAL 36 N 0.08 0.91 0.21 5.86 1.01 -1.26 -4.28 120.40 122.94 2c4b s VAL 36 Ca 0.60 -0.25 -0.13 0.00 0.00 0.00 0.00 61.98 62.20 2c4b s VAL 36 Cb -0.42 -0.92 0.24 0.00 0.00 0.00 0.00 36.38 35.28 2c4b s VAL 36 CO 0.42 0.34 1.63 0.00 0.00 0.00 0.00 175.10 177.49 2c4b h ALA 37 N 7.83 0.45 0.00 5.51 0.00 -2.02 -0.35 119.26 130.69 2c4b h ALA 37 Ca -0.30 0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2c4b h ALA 37 Cb 1.14 0.48 0.00 0.00 0.00 0.00 0.00 17.79 19.41 2c4b h ALA 37 CO 0.41 -0.42 0.00 -1.13 0.00 0.00 0.00 179.25 178.11 2c4b n SER 38 N -5.42 0.00 -0.01 0.00 3.41 -1.26 -2.77 113.62 107.57 2c4b n SER 38 Ca 0.08 -0.09 0.10 0.00 -0.26 0.00 0.00 58.87 58.70 2c4b n SER 38 Cb 0.34 -0.16 -0.15 0.00 -0.26 0.00 0.00 64.21 63.99 2c4b n SER 38 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2c4b n LYS 39 N -1.16 0.60 -2.23 4.33 5.02 -0.14 -4.98 118.16 119.60 2c4b n LYS 39 Ca 0.07 -0.15 -0.17 0.00 -2.02 0.00 0.00 58.31 56.04 2c4b n LYS 39 Cb 0.07 -1.46 -0.02 0.00 -0.02 0.00 0.00 35.03 33.60 2c4b n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2c4b n GLY 40 N 1.38 -0.11 1.33 0.72 0.00 -1.11 -4.90 105.19 102.49 2c4b n GLY 40 Ca -0.02 -0.18 0.08 0.00 0.00 0.00 0.00 46.02 45.90 2c4b n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2c4b n ASN 41 N -1.19 4.62 -0.11 1.61 6.94 -1.26 -4.02 115.26 121.86 2c4b n ASN 41 Ca -0.20 -2.87 -0.06 0.00 -0.02 0.00 0.00 54.58 51.43 2c4b n ASN 41 Cb 0.64 -0.58 0.02 0.00 -2.36 0.00 0.00 39.78 37.50 2c4b n ASN 41 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 2c4b h LEU 42 N 2.88 0.14 -0.31 -4.53 5.85 -1.91 -1.82 115.31 115.61 2c4b h LEU 42 Ca 0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 2c4b h LEU 42 Cb 1.61 0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.66 2c4b h LEU 42 CO 0.31 0.11 0.00 0.00 -0.34 0.00 0.00 178.44 178.53 2c4b h ALA 43 N 1.24 1.00 -0.07 1.25 0.00 -1.84 0.15 119.26 120.99 2c4b h ALA 43 Ca 0.17 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 2c4b h ALA 43 Cb 0.15 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.95 2c4b h ALA 43 CO -0.17 0.00 -0.59 -0.44 0.00 0.00 0.00 179.25 178.04 2c4b h ASP 44 N 0.00 0.65 0.96 0.00 3.32 -1.69 -3.13 116.42 116.53 2c4b h ASP 44 Ca 0.00 -0.68 0.00 0.00 0.02 0.00 0.00 57.03 56.37 2c4b h ASP 44 Cb 0.60 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.96 2c4b h ASP 44 CO 0.00 1.23 -0.84 -0.37 -1.72 0.00 0.00 179.24 177.54 2c4b h VAL 45 N 0.11 0.00 -1.70 -1.35 -1.51 -1.11 -3.40 116.25 107.29 2c4b h VAL 45 Ca -0.05 -0.80 -0.50 0.00 -1.23 0.00 0.00 66.70 64.12 2c4b h VAL 45 Cb 1.26 1.33 -0.35 0.00 -2.13 0.00 0.00 31.29 31.40 2c4b h VAL 45 CO 0.12 0.00 -0.99 0.00 -1.23 0.00 0.00 177.57 175.47 2c4b n ALA 46 N -2.04 1.79 -1.67 5.19 0.00 0.48 -4.93 120.51 119.32 2c4b n ALA 46 Ca 0.01 -3.01 -0.45 0.00 0.00 0.00 0.00 53.44 49.99 2c4b n ALA 46 Cb 0.51 -0.90 -0.03 0.00 0.00 0.00 0.00 19.45 19.03 2c4b n ALA 46 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2c4b n PRO 47 N 1.62 2.04 -0.81 0.00 -0.02 -1.18 -1.57 135.00 135.07 2c4b n PRO 47 Ca 0.20 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.40 2c4b n PRO 47 Cb 0.54 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 2c4b n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c4b n GLY 48 N 2.21 1.00 3.87 -1.23 0.00 -1.26 -5.01 105.19 104.78 2c4b n GLY 48 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 2c4b n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c4b s LYS 49 N -0.16 3.70 0.15 1.61 -0.14 -0.61 -4.85 119.74 119.45 2c4b s LYS 49 Ca 0.00 0.09 0.11 0.00 -1.36 0.00 0.00 55.97 54.80 2c4b s LYS 49 Cb 0.00 -2.99 -0.04 0.00 -1.68 0.00 0.00 37.83 33.11 2c4b s LYS 49 CO 0.00 0.57 -0.25 -1.12 -0.76 0.00 0.00 175.35 173.79 2c4b s SER 50 N -1.84 3.44 -0.07 2.83 0.01 -0.09 -4.75 113.70 113.24 2c4b s SER 50 Ca 0.33 -0.77 -0.30 0.00 1.31 0.00 0.00 55.95 56.52 2c4b s SER 50 Cb -0.14 -0.28 -0.02 0.00 0.21 0.00 0.00 66.02 65.80 2c4b s SER 50 CO 0.18 0.16 1.02 -0.63 0.41 0.00 0.00 173.24 174.38 2c4b s ILE 51 N -1.30 4.74 0.03 1.44 1.01 -1.26 -1.16 121.20 124.71 2c4b s ILE 51 Ca 0.17 2.00 -0.27 0.00 0.00 0.00 0.00 60.65 62.54 2c4b s ILE 51 Cb -0.09 -4.28 0.09 0.00 0.01 0.00 0.00 42.46 38.19 2c4b s ILE 51 CO 0.08 0.05 0.82 -0.83 0.00 0.00 0.00 174.94 175.06 2c4b s GLY 52 N 1.10 -0.50 0.00 6.18 0.00 0.32 -0.63 107.32 113.79 2c4b s GLY 52 Ca 0.50 0.92 0.00 0.00 0.00 0.00 0.00 44.72 46.14 2c4b s GLY 52 CO 0.21 0.32 0.00 0.61 0.00 0.00 0.00 173.10 174.24 2c4b n GLY 53 N -0.23 0.55 3.84 0.20 0.00 0.41 -3.12 105.19 106.84 2c4b n GLY 53 Ca -0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.59 2c4b n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2c4b s ASP 54 N -2.13 6.60 0.26 1.61 1.01 -1.23 -4.76 116.67 118.04 2c4b s ASP 54 Ca 0.00 1.55 -0.30 0.00 0.71 0.00 0.00 52.55 54.51 2c4b s ASP 54 Cb 0.00 -2.50 -0.11 0.00 1.01 0.00 0.00 42.92 41.32 2c4b s ASP 54 CO 0.00 -0.60 1.51 -0.63 0.21 0.00 0.00 175.17 175.67 2c4b s ILE 55 N -2.65 2.39 -0.28 0.77 -1.09 -1.26 -1.29 121.20 117.79 2c4b s ILE 55 Ca 0.58 0.33 -0.08 0.00 -2.23 0.00 0.00 60.65 59.25 2c4b s ILE 55 Cb -0.10 -3.21 -0.01 0.00 -1.58 0.00 0.00 42.46 37.56 2c4b s ILE 55 CO 0.33 0.05 0.11 0.12 -1.23 0.00 0.00 174.94 174.32 2c4b s PHE 56 N 0.05 3.14 0.31 3.97 5.36 0.00 -4.83 117.98 125.99 2c4b s PHE 56 Ca 0.62 -0.57 0.27 0.00 -0.96 0.00 0.00 56.93 56.29 2c4b s PHE 56 Cb -0.45 -2.30 1.29 0.00 -0.34 0.00 0.00 43.02 41.23 2c4b s PHE 56 CO 0.45 -0.43 1.99 0.66 -1.46 0.00 0.00 175.22 176.43 2c4b h SER 57 N 8.29 0.00 -4.92 6.13 4.64 -1.95 -3.38 113.55 122.36 2c4b h SER 57 Ca -0.34 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 60.57 2c4b h SER 57 Cb 1.15 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.32 2c4b h SER 57 CO 0.60 0.15 -0.63 -3.20 -0.87 0.00 0.00 176.83 172.88 2c4b n ASN 58 N -3.52 -6.09 -0.26 4.97 5.15 -1.26 -4.86 115.26 109.39 2c4b n ASN 58 Ca -0.01 -0.37 0.07 0.00 -0.60 0.00 0.00 54.58 53.67 2c4b n ASN 58 Cb 0.30 -4.89 0.32 0.00 -0.53 0.00 0.00 39.78 34.98 2c4b n ASN 58 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 2c4b h ARG 59 N -1.74 0.82 0.00 1.20 2.47 -2.00 -0.78 114.38 114.34 2c4b h ARG 59 Ca -0.54 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.13 2c4b h ARG 59 Cb 1.37 -0.18 0.00 0.00 -1.65 0.00 0.00 29.97 29.50 2c4b h ARG 59 CO 0.57 0.54 0.00 0.39 0.56 0.00 0.00 179.97 182.03 2c4b n GLU 60 N -4.51 0.25 -1.65 0.04 1.02 -1.26 -4.90 120.64 109.63 2c4b n GLU 60 Ca 0.14 0.06 -0.13 0.00 -0.02 0.00 0.00 57.16 57.21 2c4b n GLU 60 Cb 0.29 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.17 2c4b n GLU 60 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2c4b n GLY 61 N 0.84 0.92 0.20 0.62 0.00 -0.30 -4.88 105.19 102.58 2c4b n GLY 61 Ca 0.10 -0.38 0.09 0.00 0.00 0.00 0.00 46.02 45.83 2c4b n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c4b h LYS 62 N 0.00 0.00 -5.99 1.61 1.57 -1.91 -3.43 116.57 108.42 2c4b h LYS 62 Ca -0.29 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 57.89 2c4b h LYS 62 Cb 0.98 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.25 2c4b h LYS 62 CO 0.39 0.22 -0.43 -0.51 -0.57 0.00 0.00 179.45 178.55 2c4b s LEU 63 N -6.38 4.33 0.30 2.94 1.43 -1.26 -4.93 118.68 115.11 2c4b s LEU 63 Ca 0.05 0.40 -0.29 0.00 -1.03 0.00 0.00 54.13 53.25 2c4b s LEU 63 Cb 0.07 -3.05 -0.10 0.00 0.03 0.00 0.00 46.19 43.14 2c4b s LEU 63 CO 0.68 0.14 1.31 -2.16 0.23 0.00 0.00 176.35 176.55 2c4b s PRO 64 N -2.50 4.37 0.20 1.29 0.04 -1.26 -5.01 135.00 132.14 2c4b s PRO 64 Ca 0.36 2.18 0.10 0.00 0.04 0.00 0.00 61.00 63.68 2c4b s PRO 64 Cb -0.13 -3.10 -0.04 0.00 0.04 0.00 0.00 34.50 31.27 2c4b s PRO 64 CO 0.26 -0.19 -0.16 0.20 0.04 0.00 0.00 177.00 177.15 2c4b s GLY 65 N -0.32 1.73 0.15 0.56 0.00 -1.26 -5.08 107.32 103.10 2c4b s GLY 65 Ca 0.51 -1.60 -0.20 0.00 0.00 0.00 0.00 44.72 43.42 2c4b s GLY 65 CO 0.49 -1.64 0.53 -1.59 0.00 0.00 0.00 173.10 170.90 2c4b s LYS 66 N -2.90 1.23 0.22 2.90 -2.85 -1.26 -5.08 119.74 112.00 2c4b s LYS 66 Ca 0.24 -0.58 -0.32 0.00 -1.00 0.00 0.00 55.97 54.32 2c4b s LYS 66 Cb -0.08 0.55 -0.13 0.00 -2.06 0.00 0.00 37.83 36.11 2c4b s LYS 66 CO 0.13 -0.52 1.55 0.43 0.10 0.00 0.00 175.35 177.04 2c4b n SER 67 N -0.33 3.29 0.00 0.03 7.64 -1.26 -1.37 113.62 121.62 2c4b n SER 67 Ca -0.16 1.11 0.00 0.00 1.01 0.00 0.00 58.87 60.83 2c4b n SER 67 Cb 0.64 -1.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.36 2c4b n SER 67 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2c4b n GLY 68 N 2.82 1.66 3.67 0.23 0.00 -1.26 -5.02 105.19 107.28 2c4b n GLY 68 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 2c4b n GLY 68 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2c4b s ARG 69 N -0.39 4.17 0.18 1.61 3.52 -0.47 -4.91 118.95 122.65 2c4b s ARG 69 Ca 0.00 0.15 0.08 0.00 -0.13 0.00 0.00 55.73 55.83 2c4b s ARG 69 Cb 0.00 -3.53 -0.04 0.00 -1.56 0.00 0.00 34.95 29.82 2c4b s ARG 69 CO 0.00 -0.02 -0.02 0.95 -0.81 0.00 0.00 175.30 175.40 2c4b s THR 70 N 1.25 3.57 0.02 4.11 -4.23 -1.26 -4.69 115.64 114.41 2c4b s THR 70 Ca 0.18 -1.52 0.06 0.00 -1.18 0.00 0.00 61.69 59.23 2c4b s THR 70 Cb -0.15 -2.80 -0.03 0.00 1.34 0.00 0.00 72.50 70.87 2c4b s THR 70 CO 0.07 -0.13 -0.16 0.26 -0.54 0.00 0.00 174.62 174.13 2c4b s TRP 71 N -1.77 2.63 0.21 3.99 0.52 -1.26 -0.72 118.94 122.54 2c4b s TRP 71 Ca 0.27 -0.21 0.05 0.00 0.02 0.00 0.00 56.10 56.23 2c4b s TRP 71 Cb -0.09 -1.51 -0.05 0.00 -1.15 0.00 0.00 33.47 30.67 2c4b s TRP 71 CO 0.18 0.26 -0.06 1.03 0.02 0.00 0.00 176.95 178.38 2c4b s ARG 72 N -1.35 1.30 0.15 4.98 0.52 0.28 -0.82 118.95 124.02 2c4b s ARG 72 Ca 0.15 -1.62 0.05 0.00 -0.52 0.00 0.00 55.73 53.79 2c4b s ARG 72 Cb -0.11 -0.81 -0.04 0.00 0.52 0.00 0.00 34.95 34.51 2c4b s ARG 72 CO 0.05 0.02 -0.11 -1.83 0.02 0.00 0.00 175.30 173.46 2c4b s GLU 73 N -3.77 1.09 -0.03 3.54 -1.05 -0.41 -0.93 118.70 117.15 2c4b s GLU 73 Ca 0.24 -1.46 -0.14 0.00 -0.15 0.00 0.00 54.97 53.46 2c4b s GLU 73 Cb 0.03 -0.69 0.02 0.00 -0.44 0.00 0.00 34.13 33.06 2c4b s GLU 73 CO 0.07 0.09 0.30 0.00 0.95 0.00 0.00 175.26 176.67 2c4b s ALA 74 N -3.26 -0.75 0.24 -0.84 0.00 -0.26 -0.44 121.76 116.45 2c4b s ALA 74 Ca 0.17 0.39 -0.30 0.00 0.00 0.00 0.00 51.96 52.22 2c4b s ALA 74 Cb 0.02 -0.02 -0.09 0.00 0.00 0.00 0.00 23.12 23.03 2c4b s ALA 74 CO 0.01 -0.24 1.14 -0.51 0.00 0.00 0.00 175.76 176.17 2c4b s ASP 75 N -1.08 7.19 0.04 0.00 1.11 0.19 -0.82 116.67 123.30 2c4b s ASP 75 Ca -0.11 2.26 0.08 0.00 0.18 0.00 0.00 52.55 54.96 2c4b s ASP 75 Cb -0.05 -2.62 -0.03 0.00 1.07 0.00 0.00 42.92 41.29 2c4b s ASP 75 CO 0.03 -0.24 -0.21 -0.63 1.18 0.00 0.00 175.17 175.31 2c4b s ILE 76 N -0.73 2.59 -1.60 0.77 -1.09 -0.67 -4.69 121.20 115.78 2c4b s ILE 76 Ca 0.48 -1.26 0.00 0.00 -2.23 0.00 0.00 60.65 57.64 2c4b s ILE 76 Cb -0.32 -2.07 0.00 0.00 -1.58 0.00 0.00 42.46 38.49 2c4b s ILE 76 CO 0.40 0.34 0.00 0.59 -1.23 0.00 0.00 174.94 175.04 2c4b n ASN 77 N 1.60 -4.94 -4.74 3.58 3.02 0.15 -4.55 115.26 109.37 2c4b n ASN 77 Ca -0.16 0.37 -0.40 0.00 -0.03 0.00 0.00 54.58 54.36 2c4b n ASN 77 Cb 0.52 -3.77 -0.05 0.00 -0.61 0.00 0.00 39.78 35.87 2c4b n ASN 77 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2c4b s TYR 78 N -2.52 3.75 0.07 3.10 5.04 -1.26 -4.94 117.35 120.58 2c4b s TYR 78 Ca 0.00 1.51 -0.01 0.00 -2.44 0.00 0.00 57.07 56.14 2c4b s TYR 78 Cb 0.00 -2.85 -0.00 0.00 0.35 0.00 0.00 41.96 39.46 2c4b s TYR 78 CO 0.00 0.26 -0.01 2.41 -1.34 0.00 0.00 175.55 176.87 2c4b n THR 79 N 2.81 1.04 -3.64 4.34 -1.04 -1.26 -4.91 114.28 111.62 2c4b n THR 79 Ca -0.02 0.33 -0.10 0.00 -2.04 0.00 0.00 64.05 62.22 2c4b n THR 79 Cb 0.50 -1.60 -0.02 0.00 -1.82 0.00 0.00 70.33 67.39 2c4b n THR 79 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 2c4b s SER 80 N -5.84 -0.41 0.00 8.00 1.04 -1.26 -4.75 113.70 110.48 2c4b s SER 80 Ca -0.01 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.11 2c4b s SER 80 Cb 0.00 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.78 2c4b s SER 80 CO 0.02 -1.14 0.00 0.61 0.98 0.00 0.00 173.24 173.70 2c4b n GLY 81 N -0.41 -0.81 3.77 7.32 0.00 -1.26 -4.89 105.19 108.92 2c4b n GLY 81 Ca -0.11 -1.43 -0.33 0.00 0.00 0.00 0.00 46.02 44.15 2c4b n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2c4b s PHE 82 N 0.00 2.65 0.59 1.61 0.08 -1.26 -4.45 117.98 117.21 2c4b s PHE 82 Ca 0.00 1.55 -0.18 0.00 0.12 0.00 0.00 56.93 58.41 2c4b s PHE 82 Cb 0.00 -3.16 -0.04 0.00 -0.57 0.00 0.00 43.02 39.25 2c4b s PHE 82 CO 0.00 -1.64 1.17 1.03 -0.10 0.00 0.00 175.22 175.68 2c4b s ARG 83 N -4.06 3.03 0.00 0.44 0.52 -1.26 -5.00 118.95 112.63 2c4b s ARG 83 Ca 0.67 1.70 0.00 0.00 -0.52 0.00 0.00 55.73 57.58 2c4b s ARG 83 Cb -0.20 -1.95 0.00 0.00 0.52 0.00 0.00 34.95 33.32 2c4b s ARG 83 CO 0.41 -1.13 0.00 0.27 0.02 0.00 0.00 175.30 174.87 2c4b n ASN 84 N -1.65 0.00 -1.16 0.23 0.23 -1.26 -5.04 115.26 106.62 2c4b n ASN 84 Ca 0.13 -0.94 0.10 0.00 -0.53 0.00 0.00 54.58 53.33 2c4b n ASN 84 Cb 0.50 0.00 0.28 0.00 -2.08 0.00 0.00 39.78 38.48 2c4b n ASN 84 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 2c4b n SER 85 N -2.83 3.75 -4.67 0.53 7.64 -1.26 -4.96 113.62 111.82 2c4b n SER 85 Ca 0.00 -2.08 -0.36 0.00 1.01 0.00 0.00 58.87 57.44 2c4b n SER 85 Cb 0.00 -0.43 -0.09 0.00 -1.01 0.00 0.00 64.21 62.68 2c4b n SER 85 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2c4b s ASP 86 N -1.01 6.13 -0.00 6.43 1.01 -1.26 -1.32 116.67 126.64 2c4b s ASP 86 Ca 0.41 0.14 -0.02 0.00 0.71 0.00 0.00 52.55 53.79 2c4b s ASP 86 Cb 0.23 -2.10 -0.01 0.00 1.01 0.00 0.00 42.92 42.05 2c4b s ASP 86 CO 0.26 0.09 0.03 -0.13 0.21 0.00 0.00 175.17 175.64 2c4b s ARG 87 N 0.89 0.20 -0.12 8.23 1.81 -0.20 -1.68 118.95 128.09 2c4b s ARG 87 Ca 0.08 -0.25 -0.07 0.00 -1.72 0.00 0.00 55.73 53.77 2c4b s ARG 87 Cb -0.13 0.08 -0.04 0.00 -0.45 0.00 0.00 34.95 34.41 2c4b s ARG 87 CO 0.03 -0.04 0.12 -1.50 -0.68 0.00 0.00 175.30 173.23 2c4b s ILE 88 N -0.71 5.32 -0.11 1.52 2.07 0.00 -1.23 121.20 128.06 2c4b s ILE 88 Ca -0.08 0.14 0.03 0.00 -1.41 0.00 0.00 60.65 59.33 2c4b s ILE 88 Cb -0.05 -3.32 0.00 0.00 0.13 0.00 0.00 42.46 39.23 2c4b s ILE 88 CO -0.00 0.60 -0.23 -0.76 -1.91 0.00 0.00 174.94 172.64 2c4b s LEU 89 N -0.84 2.08 -0.01 8.50 2.01 0.28 -1.10 118.68 129.60 2c4b s LEU 89 Ca 0.14 -0.57 0.02 0.00 0.01 0.00 0.00 54.13 53.73 2c4b s LEU 89 Cb -0.12 -1.41 0.00 0.00 0.01 0.00 0.00 46.19 44.67 2c4b s LEU 89 CO 0.03 0.13 -0.06 -0.72 1.01 0.00 0.00 176.35 176.73 2c4b s TYR 90 N 0.54 0.62 0.42 0.29 1.13 -0.10 -0.54 117.35 119.71 2c4b s TYR 90 Ca -0.14 -0.13 0.08 0.00 -1.41 0.00 0.00 57.07 55.47 2c4b s TYR 90 Cb -0.17 -0.44 0.00 0.00 -1.10 0.00 0.00 41.96 40.26 2c4b s TYR 90 CO 0.05 -0.04 0.54 -1.54 -2.51 0.00 0.00 175.55 172.04 2c4b s SER 91 N 0.05 5.57 0.48 -0.18 1.04 -0.70 -0.56 113.70 119.40 2c4b s SER 91 Ca -0.00 -0.47 0.32 0.00 0.48 0.00 0.00 55.95 56.28 2c4b s SER 91 Cb -0.05 -0.66 1.42 0.00 0.10 0.00 0.00 66.02 66.83 2c4b s SER 91 CO -0.00 -0.73 1.96 0.77 0.98 0.00 0.00 173.24 176.21 2c4b h SER 92 N 0.71 0.00 -0.69 7.02 4.64 -1.28 0.11 113.55 124.06 2c4b h SER 92 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 2c4b h SER 92 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2c4b h SER 92 CO 0.47 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.53 2c4b n ASP 93 N -2.83 4.37 -0.55 4.97 5.75 -1.26 -4.98 116.55 122.02 2c4b n ASP 93 Ca 0.00 -2.23 -0.05 0.00 -0.01 0.00 0.00 54.79 52.50 2c4b n ASP 93 Cb 0.24 -0.54 -0.01 0.00 -1.03 0.00 0.00 41.12 39.78 2c4b n ASP 93 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 2c4b n TRP 94 N 1.38 -0.18 -2.41 2.11 7.02 0.03 -4.22 117.44 121.18 2c4b n TRP 94 Ca 0.25 0.00 -0.35 0.00 -1.02 0.00 0.00 57.50 56.39 2c4b n TRP 94 Cb 0.76 -1.61 -0.02 0.00 -2.42 0.00 0.00 31.31 28.03 2c4b n TRP 94 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2c4b s LEU 95 N -1.43 3.82 -0.08 -0.99 1.43 -1.26 -3.43 118.68 116.74 2c4b s LEU 95 Ca 0.00 2.06 0.02 0.00 -1.03 0.00 0.00 54.13 55.18 2c4b s LEU 95 Cb 0.00 -4.54 0.02 0.00 0.03 0.00 0.00 46.19 41.69 2c4b s LEU 95 CO 0.00 -0.97 -0.12 -0.63 0.23 0.00 0.00 176.35 174.87 2c4b s ILE 96 N -1.86 1.14 0.30 -0.59 -1.09 -1.03 -1.73 121.20 116.34 2c4b s ILE 96 Ca 0.69 -0.45 0.07 0.00 -2.23 0.00 0.00 60.65 58.73 2c4b s ILE 96 Cb -0.20 -1.06 -0.06 0.00 -1.58 0.00 0.00 42.46 39.56 2c4b s ILE 96 CO 0.24 0.36 -0.05 -0.31 -1.23 0.00 0.00 174.94 173.95 2c4b s TYR 97 N 0.88 2.04 0.13 3.97 1.51 0.30 -0.61 117.35 125.56 2c4b s TYR 97 Ca -0.10 -0.68 0.05 0.00 -1.01 0.00 0.00 57.07 55.32 2c4b s TYR 97 Cb -0.15 -1.18 -0.04 0.00 -0.11 0.00 0.00 41.96 40.47 2c4b s TYR 97 CO 0.01 0.31 -0.11 -1.59 -1.11 0.00 0.00 175.55 173.07 2c4b s LYS 98 N -3.72 0.99 0.01 -0.62 -2.85 0.22 -0.55 119.74 113.21 2c4b s LYS 98 Ca 0.31 -1.32 0.02 0.00 -1.00 0.00 0.00 55.97 53.97 2c4b s LYS 98 Cb 0.04 -0.65 -0.01 0.00 -2.06 0.00 0.00 37.83 35.15 2c4b s LYS 98 CO 0.13 0.10 -0.05 -0.08 0.10 0.00 0.00 175.35 175.54 2c4b s THR 99 N -2.83 0.39 -0.20 3.79 -1.32 -0.36 -0.86 115.64 114.26 2c4b s THR 99 Ca 0.12 -0.38 0.03 0.00 -1.21 0.00 0.00 61.69 60.24 2c4b s THR 99 Cb -0.01 -0.36 0.07 0.00 -1.51 0.00 0.00 72.50 70.69 2c4b s THR 99 CO 0.01 -0.01 1.06 0.35 -2.21 0.00 0.00 174.62 173.82 2c4b n THR 100 N 2.64 1.03 -2.10 5.08 -2.24 -1.26 -1.03 114.28 116.41 2c4b n THR 100 Ca -0.15 -1.04 0.03 0.00 -2.27 0.00 0.00 64.05 60.62 2c4b n THR 100 Cb 0.58 0.48 0.10 0.00 -2.10 0.00 0.00 70.33 69.39 2c4b n THR 100 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2c4b n ASP 101 N -0.31 1.62 -3.53 3.42 5.68 -1.16 -4.58 116.55 117.68 2c4b n ASP 101 Ca 0.03 -2.95 -0.22 0.00 -0.50 0.00 0.00 54.79 51.15 2c4b n ASP 101 Cb 0.30 -0.41 0.05 0.00 -1.14 0.00 0.00 41.12 39.92 2c4b n ASP 101 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2c4b n ALA 102 N -0.36 -2.34 -1.00 2.12 0.00 -0.43 -3.19 120.51 115.31 2c4b n ALA 102 Ca 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2c4b n ALA 102 Cb 0.91 -3.94 0.00 0.00 0.00 0.00 0.00 19.45 16.43 2c4b n ALA 102 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2c4b n TYR 103 N -3.90 0.00 0.10 0.00 4.02 -1.26 -4.90 117.16 111.23 2c4b n TYR 103 Ca -0.16 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.53 2c4b n TYR 103 Cb 0.63 -0.14 -0.15 0.00 -0.02 0.00 0.00 39.34 39.66 2c4b n TYR 103 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 2c4b h GLN 104 N 1.15 0.37 -4.29 -0.72 1.08 -1.96 -3.47 115.11 107.27 2c4b h GLN 104 Ca 0.00 -0.63 -0.21 0.00 -1.45 0.00 0.00 58.65 56.36 2c4b h GLN 104 Cb 0.06 0.23 -0.20 0.00 -0.05 0.00 0.00 27.48 27.53 2c4b h GLN 104 CO 0.00 1.28 -0.71 0.95 -0.95 0.00 0.00 178.83 179.40 2c4b s THR 105 N -2.62 0.34 0.09 -0.54 -4.23 -1.26 -5.09 115.64 102.33 2c4b s THR 105 Ca -0.08 -1.13 0.05 0.00 -1.18 0.00 0.00 61.69 59.35 2c4b s THR 105 Cb 0.06 -0.61 -0.03 0.00 1.34 0.00 0.00 72.50 73.26 2c4b s THR 105 CO 0.89 -0.52 -0.13 -0.36 -0.54 0.00 0.00 174.62 173.96 2c4b s PHE 106 N -1.78 1.23 -0.08 3.99 0.40 -1.26 -4.44 117.98 116.04 2c4b s PHE 106 Ca -0.10 -0.52 0.03 0.00 -0.60 0.00 0.00 56.93 55.74 2c4b s PHE 106 Cb -0.07 -0.68 0.01 0.00 0.51 0.00 0.00 43.02 42.79 2c4b s PHE 106 CO -0.01 0.07 -0.18 0.99 0.70 0.00 0.00 175.22 176.79 2c4b s THR 107 N -1.72 1.56 0.06 0.64 2.01 -0.04 -4.95 115.64 113.20 2c4b s THR 107 Ca 0.02 -0.73 -0.31 0.00 0.31 0.00 0.00 61.69 60.99 2c4b s THR 107 Cb -0.07 -1.37 -0.06 0.00 0.01 0.00 0.00 72.50 71.00 2c4b s THR 107 CO 0.02 0.45 1.28 -0.75 -0.69 0.00 0.00 174.62 174.92 2c4b s LYS 108 N 0.48 4.38 0.00 4.92 2.20 -1.26 -0.61 119.74 129.84 2c4b s LYS 108 Ca -0.16 1.87 0.00 0.00 -0.36 0.00 0.00 55.97 57.32 2c4b s LYS 108 Cb -0.16 -3.36 0.00 0.00 -1.51 0.00 0.00 37.83 32.80 2c4b s LYS 108 CO 0.06 -0.36 0.01 0.44 -0.36 0.00 0.00 175.35 175.15 2c4b n ILE 109 N 4.06 0.00 -3.74 5.43 -5.35 0.22 -4.94 119.36 115.04 2c4b n ILE 109 Ca 0.10 -0.48 -0.13 0.00 -0.27 0.00 0.00 62.75 61.98 2c4b n ILE 109 Cb 0.45 1.00 -0.10 0.00 -1.74 0.00 0.00 39.64 39.25 2c4b n ILE 109 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 2c4b s ARG 110 N -0.92 0.45 0.88 6.28 1.81 -0.75 -4.98 118.95 121.73 2c4b s ARG 110 Ca 0.00 0.54 -0.11 0.00 -1.72 0.00 0.00 55.73 54.44 2c4b s ARG 110 Cb 0.00 0.22 0.12 0.00 -0.45 0.00 0.00 34.95 34.84 2c4b s ARG 110 CO 0.00 -0.05 1.09 -1.54 -0.68 0.00 0.00 175.30 174.12 2c4b s SER 111 N 0.21 3.57 0.14 0.23 1.04 -1.26 -2.46 113.70 115.18 2c4b s SER 111 Ca -0.00 1.53 -0.35 0.00 0.48 0.00 0.00 55.95 57.61 2c4b s SER 111 Cb -0.03 -2.21 -0.15 0.00 0.10 0.00 0.00 66.02 63.74 2c4b s SER 111 CO 0.00 -2.58 1.51 -0.24 0.98 0.00 0.00 173.24 172.91 2c4b n SER 112 N -3.85 2.69 -1.11 7.02 2.88 -1.26 -4.67 113.62 115.33 2c4b n SER 112 Ca 0.07 1.09 0.12 0.00 -1.33 0.00 0.00 58.87 58.82 2c4b n SER 112 Cb 0.55 -1.36 0.24 0.00 -0.75 0.00 0.00 64.21 62.89 2c4b n SER 112 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2c4b n SER 113 N 3.14 3.30 -4.70 -3.46 3.41 -1.22 -4.98 113.62 109.10 2c4b n SER 113 Ca 0.17 -1.97 -0.42 0.00 -0.26 0.00 0.00 58.87 56.39 2c4b n SER 113 Cb 0.26 -0.25 -0.03 0.00 -0.26 0.00 0.00 64.21 63.93 2c4b n SER 113 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 2c4b s MET 114 N -1.49 4.31 0.00 4.33 1.75 -1.26 -1.27 119.30 125.67 2c4b s MET 114 Ca 0.39 2.01 0.00 0.00 -1.25 0.00 0.00 55.69 56.84 2c4b s MET 114 Cb 0.22 -3.39 0.00 0.00 2.84 0.00 0.00 34.83 34.50 2c4b s MET 114 CO 0.31 -0.48 0.00 0.41 -0.65 0.00 0.00 175.02 174.61 2c4b n GLY 115 N 3.54 0.73 3.65 2.11 0.00 -1.26 -5.06 105.19 108.89 2c4b n GLY 115 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 2c4b n GLY 115 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c4b s VAL 116 N -2.89 4.75 -0.29 1.61 1.01 -0.40 -4.72 120.40 119.46 2c4b s VAL 116 Ca 0.00 -0.06 -0.22 0.00 0.00 0.00 0.00 61.98 61.71 2c4b s VAL 116 Cb 0.00 -3.11 -0.01 0.00 0.00 0.00 0.00 36.38 33.26 2c4b s VAL 116 CO 0.00 0.49 0.70 0.00 0.00 0.00 0.00 175.10 176.29 2c4b s PRO 118 N 2.73 4.18 -0.90 0.00 0.02 -1.26 -4.86 135.00 134.91 2c4b s PRO 118 Ca 0.28 2.47 -0.21 0.00 0.02 0.00 0.00 61.00 63.56 2c4b s PRO 118 Cb -0.15 -3.01 0.09 0.00 0.02 0.00 0.00 34.50 31.45 2c4b s PRO 118 CO 0.11 -0.45 1.22 0.15 -0.33 0.00 0.00 177.00 177.70 2c4b s LYS 119 N -1.73 3.49 -0.07 5.54 1.02 -1.26 -4.90 119.74 121.83 2c4b s LYS 119 Ca 0.53 -1.29 -0.02 0.00 0.02 0.00 0.00 55.97 55.21 2c4b s LYS 119 Cb -0.45 -4.90 0.03 0.00 -0.52 0.00 0.00 37.83 31.99 2c4b s LYS 119 CO 0.58 -1.95 0.02 0.42 -0.92 0.00 0.00 175.35 173.49 2c4b s ILE 120 N 3.88 0.26 0.00 2.17 1.01 -1.26 -5.12 121.20 122.15 2c4b s ILE 120 Ca 0.36 0.17 -0.30 0.00 0.00 0.00 0.00 60.65 60.87 2c4b s ILE 120 Cb -0.05 -0.46 -0.06 0.00 0.01 0.00 0.00 42.46 41.90 2c4b s ILE 120 CO -0.05 0.22 1.47 -0.22 0.00 0.00 0.00 174.94 176.36 2c4b s LEU 121 N 2.02 4.32 -0.16 2.97 2.96 -1.26 -4.91 118.68 124.63 2c4b s LEU 121 Ca 0.05 2.18 -0.08 0.00 -0.22 0.00 0.00 54.13 56.06 2c4b s LEU 121 Cb -0.12 -3.56 0.06 0.00 0.50 0.00 0.00 46.19 43.07 2c4b s LEU 121 CO -0.05 -0.78 0.37 -0.75 -1.32 0.00 0.00 176.35 173.83 2c4b s LYS 122 N 2.66 0.35 0.50 1.98 2.47 -1.26 -5.05 119.74 121.38 2c4b s LYS 122 Ca 0.66 0.73 -0.21 0.00 -1.56 0.00 0.00 55.97 55.60 2c4b s LYS 122 Cb -0.33 -0.04 -0.07 0.00 -1.46 0.00 0.00 37.83 35.92 2c4b s LYS 122 CO 0.27 -0.16 1.09 -1.59 0.16 0.00 0.00 175.35 175.12 2c4b s LYS 123 N 1.39 3.67 0.06 4.03 -2.85 -1.26 -0.90 119.74 123.88 2c4b s LYS 123 Ca -0.09 1.51 -0.15 0.00 -1.00 0.00 0.00 55.97 56.24 2c4b s LYS 123 Cb -0.09 -2.14 0.03 0.00 -2.06 0.00 0.00 37.83 33.57 2c4b s LYS 123 CO -0.12 -0.57 0.34 0.00 0.10 0.00 0.00 175.35 175.10 2c4b n ARG 125 N 0.34 0.65 -3.89 0.00 0.63 -1.26 -4.48 116.66 108.65 2c4b n ARG 125 Ca -0.18 -0.08 -0.08 0.00 -0.92 0.00 0.00 57.85 56.58 2c4b n ARG 125 Cb 0.61 -1.26 -0.04 0.00 0.45 0.00 0.00 32.46 32.22 2c4b n ARG 125 CO 0.00 0.00 0.00 -0.98 -2.51 0.00 0.00 177.63 174.14 2c4b s ARG 126 N -2.68 1.61 0.41 -0.14 1.70 -1.26 -5.02 118.95 113.56 2c4b s ARG 126 Ca -0.04 -1.06 0.08 0.00 -0.47 0.00 0.00 55.73 54.24 2c4b s ARG 126 Cb 0.06 0.54 0.85 0.00 -0.57 0.00 0.00 34.95 35.83 2c4b s ARG 126 CO 0.45 -0.70 2.01 -0.44 -1.08 0.00 0.00 175.30 175.54 2c4b h ASP 127 N 2.14 0.37 0.46 -2.89 3.32 -1.90 -1.72 116.42 116.20 2c4b h ASP 127 Ca -0.24 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.78 2c4b h ASP 127 Cb 1.25 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.71 2c4b h ASP 127 CO 0.31 0.35 0.00 -1.54 -1.72 0.00 0.00 179.24 176.64 2c4b n SER 128 N -4.41 0.00 0.00 6.45 3.41 -1.26 -1.32 113.62 116.49 2c4b n SER 128 Ca 0.01 0.30 0.11 0.00 -0.26 0.00 0.00 58.87 59.04 2c4b n SER 128 Cb 0.14 -0.41 0.53 0.00 -0.26 0.00 0.00 64.21 64.21 2c4b n SER 128 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2c4b n ASP 129 N -1.41 0.00 -4.71 4.04 8.00 -0.64 -4.88 116.55 116.95 2c4b n ASP 129 Ca 0.06 0.36 -0.23 0.00 0.71 0.00 0.00 54.79 55.70 2c4b n ASP 129 Cb 0.17 -0.45 -0.06 0.00 -0.02 0.00 0.00 41.12 40.76 2c4b n ASP 129 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2c4b n LEU 131 N -0.98 1.78 -4.74 0.00 4.77 -1.26 -4.85 117.00 111.71 2c4b n LEU 131 Ca -0.07 0.27 -0.42 0.00 -0.03 0.00 0.00 56.01 55.77 2c4b n LEU 131 Cb 0.58 -1.39 -0.00 0.00 -2.33 0.00 0.00 43.42 40.28 2c4b n LEU 131 CO 0.41 -2.59 1.06 0.00 -1.33 0.00 0.00 177.39 174.94 2c4b n ALA 132 N -4.35 1.98 -0.15 -1.18 0.00 -1.26 -1.47 120.51 114.08 2c4b n ALA 132 Ca 0.09 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.89 2c4b n ALA 132 Cb 0.53 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.62 2c4b n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c4b n GLY 133 N 0.76 1.54 3.59 0.00 0.00 -1.26 -4.51 105.19 105.31 2c4b n GLY 133 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 2c4b n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c4b s VAL 135 N -1.22 2.04 -0.28 0.00 -7.23 0.18 -4.75 120.40 109.15 2c4b s VAL 135 Ca 0.22 -2.26 -0.23 0.00 -1.81 0.00 0.00 61.98 57.90 2c4b s VAL 135 Cb -0.11 -2.29 -0.01 0.00 0.56 0.00 0.00 36.38 34.53 2c4b s VAL 135 CO 0.14 -0.42 0.75 0.00 -0.31 0.00 0.00 175.10 175.26 2c4b s GLY 137 N 1.51 1.59 0.65 0.00 0.00 -0.22 -4.89 107.32 105.96 2c4b s GLY 137 Ca 0.31 -0.59 0.43 0.00 0.00 0.00 0.00 44.72 44.87 2c4b s GLY 137 CO 0.10 -0.02 2.30 -0.56 0.00 0.00 0.00 173.10 174.92 2c4b h PRO 138 N -1.46 0.00 -0.01 2.90 0.13 -1.96 -0.66 132.00 130.94 2c4b h PRO 138 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2c4b h PRO 138 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2c4b h PRO 138 CO 0.61 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.65 2c4b n ASN 139 N -3.09 0.73 -0.27 1.44 6.94 -1.26 -4.93 115.26 114.81 2c4b n ASN 139 Ca -0.02 -1.27 -0.03 0.00 -0.02 0.00 0.00 54.58 53.24 2c4b n ASN 139 Cb 0.11 -0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.52 2c4b n ASN 139 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2c4b n GLY 140 N 1.07 0.40 3.26 4.83 0.00 -0.25 -5.00 105.19 109.50 2c4b n GLY 140 Ca 0.21 -0.85 -0.20 0.00 0.00 0.00 0.00 46.02 45.18 2c4b n GLY 140 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2c4b s PHE 141 N -2.12 1.52 0.34 1.61 0.40 -1.26 -0.78 117.98 117.69 2c4b s PHE 141 Ca 0.00 -0.50 -0.27 0.00 -0.60 0.00 0.00 56.93 55.56 2c4b s PHE 141 Cb 0.00 -0.80 -0.09 0.00 0.51 0.00 0.00 43.02 42.64 2c4b s PHE 141 CO 0.00 0.18 1.06 0.00 0.70 0.00 0.00 175.22 177.16 2c4b n GLY 143 N 0.75 0.76 0.00 0.00 0.00 -0.08 -4.75 105.19 101.88 2c4b n GLY 143 Ca 0.02 -1.10 0.02 0.00 0.00 0.00 0.00 46.02 44.96 2c4b n GLY 143 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76