#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o68 s ILE 2 N 0.00 4.87 0.47 -0.08 -1.09 0.34 -4.97 121.20 120.75 1o68 s ILE 2 Ca 0.00 1.39 0.04 0.00 -2.23 0.00 0.00 60.65 59.85 1o68 s ILE 2 Cb 0.00 -4.07 -0.04 0.00 -1.58 0.00 0.00 42.46 36.77 1o68 s ILE 2 CO 0.00 -0.07 0.05 0.42 -1.23 0.00 0.00 174.94 174.11 1o68 s THR 3 N 2.76 1.59 0.28 2.92 -4.23 -1.26 -4.93 115.64 112.77 1o68 s THR 3 Ca 0.32 -1.94 -0.03 0.00 -1.18 0.00 0.00 61.69 58.85 1o68 s THR 3 Cb -0.15 -2.53 0.26 0.00 1.34 0.00 0.00 72.50 71.42 1o68 s THR 3 CO 0.08 0.00 1.95 0.58 -0.54 0.00 0.00 174.62 176.70 1o68 h VAL 4 N 1.47 1.22 -0.82 2.29 2.07 -1.97 -1.25 116.25 119.26 1o68 h VAL 4 Ca -0.43 -0.41 -0.03 0.00 0.82 0.00 0.00 66.70 66.64 1o68 h VAL 4 Cb 1.28 -0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 1o68 h VAL 4 CO 0.75 0.22 0.39 -1.13 0.02 0.00 0.00 177.57 177.82 1o68 h ASN 5 N 1.21 1.08 -0.56 0.57 -0.00 -1.99 -0.86 115.58 115.03 1o68 h ASN 5 Ca 0.33 -0.14 0.05 0.00 -0.00 0.00 0.00 56.30 56.54 1o68 h ASN 5 Cb -0.13 -0.28 -0.05 0.00 -0.00 0.00 0.00 38.32 37.87 1o68 h ASN 5 CO -0.07 0.92 0.29 0.74 -0.00 0.00 0.00 177.43 179.30 1o68 h THR 6 N 1.16 0.95 -0.78 -3.57 2.02 -1.63 -0.01 112.91 111.05 1o68 h THR 6 Ca 0.28 -0.19 -0.04 0.00 0.77 0.00 0.00 66.41 67.24 1o68 h THR 6 Cb 0.13 0.36 -0.04 0.00 -1.74 0.00 0.00 68.15 66.86 1o68 h THR 6 CO -0.03 0.10 0.34 -0.07 0.37 0.00 0.00 175.52 176.23 1o68 h LEU 7 N 0.54 1.05 -0.39 2.58 3.38 -0.83 -2.67 115.31 118.98 1o68 h LEU 7 Ca 0.25 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 1o68 h LEU 7 Cb 0.16 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1o68 h LEU 7 CO -0.17 0.92 0.10 1.56 0.09 0.00 0.00 178.44 180.94 1o68 h GLN 8 N 1.12 0.62 -1.29 1.13 4.20 -0.40 -0.86 115.11 119.63 1o68 h GLN 8 Ca 0.26 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1o68 h GLN 8 Cb 0.17 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.87 1o68 h GLN 8 CO -0.03 0.64 0.00 1.63 -0.67 0.00 0.00 178.83 180.41 1o68 n LYS 9 N -4.58 0.04 0.00 1.46 5.02 -0.09 -1.62 118.16 118.39 1o68 n LYS 9 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 1o68 n LYS 9 Cb 0.20 -1.32 0.00 0.00 -0.02 0.00 0.00 35.03 33.89 1o68 n LYS 9 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1o68 n LYS 11 N 0.81 0.00 -0.23 1.97 4.81 -0.33 -0.68 118.16 124.51 1o68 n LYS 11 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.42 1o68 n LYS 11 Cb 0.02 0.00 0.18 0.00 0.02 0.00 0.00 35.03 35.25 1o68 n LYS 11 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1o68 h ALA 12 N 0.00 1.30 0.00 3.14 0.00 -1.58 -2.65 119.26 119.48 1o68 h ALA 12 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1o68 h ALA 12 Cb 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.49 1o68 h ALA 12 CO 0.00 0.56 -0.16 0.00 0.00 0.00 0.00 179.25 179.65 1o68 n ALA 13 N -2.43 2.52 -0.77 0.00 0.00 0.15 -4.94 120.51 115.05 1o68 n ALA 13 Ca 0.07 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1o68 n ALA 13 Cb 0.11 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.17 1o68 n ALA 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o68 n GLY 14 N 1.38 0.61 3.63 0.00 0.00 -1.00 -5.01 105.19 104.81 1o68 n GLY 14 Ca 0.06 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1o68 n GLY 14 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1o68 s GLU 15 N -0.30 4.07 0.29 1.61 2.12 -1.26 -5.01 118.70 120.22 1o68 s GLU 15 Ca 0.00 0.83 -0.29 0.00 0.36 0.00 0.00 54.97 55.87 1o68 s GLU 15 Cb 0.00 -3.70 -0.10 0.00 0.26 0.00 0.00 34.13 30.59 1o68 s GLU 15 CO 0.00 -0.66 1.35 0.15 -0.54 0.00 0.00 175.26 175.56 1o68 s LYS 16 N 3.05 4.33 -0.10 4.30 -0.14 -1.26 -4.47 119.74 125.45 1o68 s LYS 16 Ca 0.36 2.23 -0.17 0.00 -1.36 0.00 0.00 55.97 57.03 1o68 s LYS 16 Cb -0.14 -3.09 -0.05 0.00 -1.68 0.00 0.00 37.83 32.87 1o68 s LYS 16 CO 0.11 -0.27 0.45 0.42 -0.76 0.00 0.00 175.35 175.30 1o68 s ILE 17 N -0.66 5.16 0.35 2.17 1.01 -0.35 -4.67 121.20 124.21 1o68 s ILE 17 Ca 0.53 0.90 0.04 0.00 0.00 0.00 0.00 60.65 62.13 1o68 s ILE 17 Cb -0.40 -3.79 -0.01 0.00 0.01 0.00 0.00 42.46 38.27 1o68 s ILE 17 CO 0.49 0.38 0.50 0.00 0.00 0.00 0.00 174.94 176.31 1o68 s ALA 18 N 0.30 4.03 0.00 9.38 0.00 -1.26 -1.66 121.76 132.55 1o68 s ALA 18 Ca 0.25 -1.29 0.00 0.00 0.00 0.00 0.00 51.96 50.92 1o68 s ALA 18 Cb -0.15 -1.83 0.00 0.00 0.00 0.00 0.00 23.12 21.14 1o68 s ALA 18 CO 0.10 -0.07 0.00 1.28 0.00 0.00 0.00 175.76 177.08 1o68 n LEU 20 N -1.72 0.00 -4.80 0.00 4.77 -1.26 -0.84 117.00 113.15 1o68 n LEU 20 Ca -0.02 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.65 1o68 n LEU 20 Cb 0.58 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.72 1o68 n LEU 20 CO 0.44 0.00 0.71 0.42 -1.33 0.00 0.00 177.39 177.63 1o68 s THR 21 N -1.85 3.79 -0.27 -5.08 -4.23 -1.02 -0.74 115.64 106.25 1o68 s THR 21 Ca 0.00 0.65 -0.16 0.00 -1.18 0.00 0.00 61.69 61.01 1o68 s THR 21 Cb 0.00 -3.28 0.08 0.00 1.34 0.00 0.00 72.50 70.64 1o68 s THR 21 CO 0.00 -0.69 0.67 0.00 -0.54 0.00 0.00 174.62 174.05 1o68 s ALA 22 N -2.85 -1.81 0.00 3.99 0.00 -0.18 -4.71 121.76 116.19 1o68 s ALA 22 Ca 0.60 2.35 0.00 0.00 0.00 0.00 0.00 51.96 54.92 1o68 s ALA 22 Cb -0.15 -1.39 0.00 0.00 0.00 0.00 0.00 23.12 21.58 1o68 s ALA 22 CO 0.51 -0.37 0.46 0.66 0.00 0.00 0.00 175.76 177.02 1o68 n TYR 23 N 4.31 0.00 -4.02 0.00 4.02 -1.26 -3.91 117.16 116.30 1o68 n TYR 23 Ca -0.20 -0.10 -0.08 0.00 -0.01 0.00 0.00 57.90 57.50 1o68 n TYR 23 Cb 0.59 -0.01 -0.10 0.00 -0.02 0.00 0.00 39.34 39.80 1o68 n TYR 23 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 1o68 s GLU 24 N -0.21 0.54 0.12 -0.72 2.02 -1.26 -4.69 118.70 114.49 1o68 s GLU 24 Ca 0.00 -0.95 -0.15 0.00 0.02 0.00 0.00 54.97 53.88 1o68 s GLU 24 Cb 0.00 0.19 -0.03 0.00 0.10 0.00 0.00 34.13 34.39 1o68 s GLU 24 CO 0.00 -0.11 1.55 0.66 0.02 0.00 0.00 175.26 177.38 1o68 h SER 25 N 3.63 0.66 0.12 -0.19 4.64 -1.86 -1.13 113.55 119.42 1o68 h SER 25 Ca -0.33 -0.32 -0.01 0.00 -0.47 0.00 0.00 61.79 60.66 1o68 h SER 25 Cb 1.17 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 1o68 h SER 25 CO 0.56 0.82 -0.06 0.28 -0.87 0.00 0.00 176.83 177.56 1o68 h SER 26 N 0.48 -0.14 -0.78 4.97 0.02 -1.95 -1.25 113.55 114.90 1o68 h SER 26 Ca 0.10 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 60.96 1o68 h SER 26 Cb 0.49 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 63.03 1o68 h SER 26 CO 0.02 -0.01 0.42 -0.26 -1.14 0.00 0.00 176.83 175.87 1o68 h PHE 27 N -0.27 1.08 -0.78 3.45 -1.00 -1.99 -2.42 116.94 115.01 1o68 h PHE 27 Ca -0.02 -0.03 0.02 0.00 2.81 0.00 0.00 57.97 60.75 1o68 h PHE 27 Cb 0.21 -0.34 -0.04 0.00 3.61 0.00 0.00 35.95 39.39 1o68 h PHE 27 CO -0.04 0.76 0.51 0.00 -1.61 0.00 0.00 178.31 177.93 1o68 h ALA 28 N 1.22 1.01 -0.46 2.45 0.00 -1.05 -2.95 119.26 119.48 1o68 h ALA 28 Ca 0.27 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.05 1o68 h ALA 28 Cb 0.04 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1o68 h ALA 28 CO -0.04 0.35 -0.08 0.00 0.00 0.00 0.00 179.25 179.48 1o68 h ALA 29 N 1.31 0.99 0.00 0.00 0.00 -0.96 -1.52 119.26 119.09 1o68 h ALA 29 Ca 0.30 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1o68 h ALA 29 Cb -0.05 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1o68 h ALA 29 CO -0.09 0.60 0.00 -0.11 0.00 0.00 0.00 179.25 179.65 1o68 n LEU 30 N -4.17 0.18 0.00 0.00 0.00 -0.94 -0.77 117.00 111.31 1o68 n LEU 30 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 56.01 55.93 1o68 n LEU 30 Cb 0.35 -0.09 0.00 0.00 0.00 0.00 0.00 43.42 43.68 1o68 n LEU 30 CO 0.43 0.05 0.00 -0.67 0.00 0.00 0.00 177.39 177.19 1o68 n ASP 32 N 0.19 0.00 0.25 1.96 2.03 -0.57 -0.44 116.55 119.97 1o68 n ASP 32 Ca 0.00 0.00 0.12 0.00 0.52 0.00 0.00 54.79 55.43 1o68 n ASP 32 Cb 0.05 0.00 0.64 0.00 -0.72 0.00 0.00 41.12 41.09 1o68 n ASP 32 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 1o68 h ASP 33 N 0.00 0.00 -0.31 1.67 1.82 -1.20 -2.50 116.42 115.90 1o68 h ASP 33 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1o68 h ASP 33 Cb 0.00 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.01 1o68 h ASP 33 CO 0.00 0.16 0.00 0.00 -1.61 0.00 0.00 179.24 177.79 1o68 n ALA 34 N -2.26 2.46 -0.34 -0.78 0.00 0.42 -4.90 120.51 115.11 1o68 n ALA 34 Ca -0.01 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 52.84 1o68 n ALA 34 Cb 0.30 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1o68 n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o68 n GLY 35 N 1.07 0.76 3.73 0.00 0.00 -0.94 -4.37 105.19 105.43 1o68 n GLY 35 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1o68 n GLY 35 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1o68 s VAL 36 N -2.31 2.91 -0.51 1.61 1.01 -1.26 -4.84 120.40 117.00 1o68 s VAL 36 Ca 0.00 0.70 0.08 0.00 0.00 0.00 0.00 61.98 62.76 1o68 s VAL 36 Cb 0.00 -3.45 0.49 0.00 0.00 0.00 0.00 36.38 33.42 1o68 s VAL 36 CO 0.00 0.08 1.29 -0.62 0.00 0.00 0.00 175.10 175.85 1o68 n GLU 37 N 3.19 3.22 -3.59 2.72 1.02 -0.02 -4.57 120.64 122.61 1o68 n GLU 37 Ca 0.10 -1.91 -0.02 0.00 -0.02 0.00 0.00 57.16 55.31 1o68 n GLU 37 Cb 0.41 -1.94 -0.04 0.00 -0.02 0.00 0.00 31.44 29.84 1o68 n GLU 37 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1o68 s LEU 39 N -1.71 -1.10 -0.44 -4.62 1.43 -1.26 -4.62 118.68 106.37 1o68 s LEU 39 Ca 0.33 1.39 -0.16 0.00 -1.03 0.00 0.00 54.13 54.66 1o68 s LEU 39 Cb 0.26 2.14 0.04 0.00 0.03 0.00 0.00 46.19 48.66 1o68 s LEU 39 CO 0.09 -0.23 0.41 -0.22 0.23 0.00 0.00 176.35 176.63 1o68 s LEU 40 N 2.85 5.12 -1.07 1.79 2.96 0.08 -0.16 118.68 130.24 1o68 s LEU 40 Ca -0.02 -0.91 -0.20 0.00 -0.22 0.00 0.00 54.13 52.78 1o68 s LEU 40 Cb -0.12 -2.28 0.09 0.00 0.50 0.00 0.00 46.19 44.38 1o68 s LEU 40 CO -0.18 -0.59 1.41 -0.69 -1.32 0.00 0.00 176.35 174.98 1o68 s VAL 41 N 1.94 4.34 0.39 1.68 1.01 0.13 -1.01 120.40 128.88 1o68 s VAL 41 Ca 0.08 -1.47 -0.00 0.00 0.00 0.00 0.00 61.98 60.60 1o68 s VAL 41 Cb -0.19 -4.99 -0.03 0.00 0.00 0.00 0.00 36.38 31.17 1o68 s VAL 41 CO 0.11 -1.79 0.61 -0.83 0.00 0.00 0.00 175.10 173.20 1o68 s GLY 42 N 4.16 1.41 0.00 4.51 0.00 -1.26 -1.77 107.32 114.37 1o68 s GLY 42 Ca 0.43 -0.88 0.22 0.00 0.00 0.00 0.00 44.72 44.49 1o68 s GLY 42 CO -0.05 -0.78 1.69 2.09 0.00 0.00 0.00 173.10 176.05 1o68 n ASP 43 N -1.92 0.00 0.26 1.64 5.68 -1.26 -1.71 116.55 119.24 1o68 n ASP 43 Ca -0.03 -0.11 0.13 0.00 -0.50 0.00 0.00 54.79 54.28 1o68 n ASP 43 Cb 0.56 -0.25 0.68 0.00 -1.14 0.00 0.00 41.12 40.97 1o68 n ASP 43 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1o68 h SER 44 N 0.00 0.00 0.25 -1.12 4.64 -1.94 0.10 113.55 115.48 1o68 h SER 44 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1o68 h SER 44 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1o68 h SER 44 CO 0.00 0.00 0.00 0.17 -0.87 0.00 0.00 176.83 176.13 1o68 h LEU 45 N 0.00 0.00 -0.00 5.97 8.10 -1.74 -1.93 115.31 125.71 1o68 h LEU 45 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.99 1o68 h LEU 45 Cb 0.51 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.73 1o68 h LEU 45 CO 0.00 0.00 0.00 0.61 -4.11 0.00 0.00 178.44 174.94 1o68 n GLY 46 N -0.83 -0.20 0.00 0.17 0.00 0.35 -0.41 105.19 104.27 1o68 n GLY 46 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1o68 n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o68 n ALA 48 N -0.50 0.00 -0.13 4.61 0.00 -0.72 -0.15 120.51 123.62 1o68 n ALA 48 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.17 1o68 n ALA 48 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 1o68 n ALA 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1o68 n VAL 49 N 0.00 1.53 0.13 0.00 0.31 0.24 -4.65 118.33 115.88 1o68 n VAL 49 Ca 0.00 -0.42 0.04 0.00 -0.01 0.00 0.00 64.34 63.95 1o68 n VAL 49 Cb 0.00 -1.78 0.02 0.00 -0.91 0.00 0.00 33.84 31.17 1o68 n VAL 49 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1o68 h GLN 50 N -0.74 0.00 0.00 5.55 4.20 -0.79 -3.48 115.11 119.85 1o68 h GLN 50 Ca -0.65 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.06 1o68 h GLN 50 Cb 1.68 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.46 1o68 h GLN 50 CO -0.33 0.36 0.00 0.41 -0.67 0.00 0.00 178.83 178.61 1o68 n GLY 51 N 1.24 0.40 3.92 3.46 0.00 -0.75 -5.05 105.19 108.40 1o68 n GLY 51 Ca -0.00 -1.07 -0.30 0.00 0.00 0.00 0.00 46.02 44.65 1o68 n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1o68 s ARG 52 N -1.95 0.78 0.00 1.61 0.52 0.79 -4.99 118.95 115.72 1o68 s ARG 52 Ca 0.00 -0.34 0.24 0.00 -0.52 0.00 0.00 55.73 55.12 1o68 s ARG 52 Cb 0.00 -1.86 0.36 0.00 0.52 0.00 0.00 34.95 33.97 1o68 s ARG 52 CO 0.00 -2.33 1.31 1.63 0.02 0.00 0.00 175.30 175.93 1o68 n LYS 53 N -3.73 0.11 -3.93 3.54 4.01 -1.26 -4.89 118.16 112.01 1o68 n LYS 53 Ca 0.14 -0.07 -0.09 0.00 -0.51 0.00 0.00 58.31 57.78 1o68 n LYS 53 Cb 0.60 -1.50 -0.03 0.00 -0.51 0.00 0.00 35.03 33.59 1o68 n LYS 53 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1o68 s SER 54 N -2.94 -0.08 0.00 4.39 1.04 -1.26 -5.05 113.70 109.80 1o68 s SER 54 Ca 0.12 -0.87 0.25 0.00 0.48 0.00 0.00 55.95 55.93 1o68 s SER 54 Cb 0.17 0.68 0.71 0.00 0.10 0.00 0.00 66.02 67.69 1o68 s SER 54 CO 0.72 -1.30 1.55 0.35 0.98 0.00 0.00 173.24 175.53 1o68 n THR 55 N -0.44 0.12 -0.05 2.02 -2.24 -1.26 -4.45 114.28 107.98 1o68 n THR 55 Ca -0.03 -0.39 -0.05 0.00 -2.27 0.00 0.00 64.05 61.31 1o68 n THR 55 Cb 0.60 0.72 0.15 0.00 -2.10 0.00 0.00 70.33 69.71 1o68 n THR 55 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1o68 h LEU 56 N 3.06 0.65 0.00 3.22 4.07 -1.91 -2.79 115.31 121.61 1o68 h LEU 56 Ca 0.00 -0.21 0.00 0.00 0.08 0.00 0.00 57.88 57.75 1o68 h LEU 56 Cb 0.66 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 42.22 1o68 h LEU 56 CO 0.00 0.84 0.00 -2.65 -1.08 0.00 0.00 178.44 175.55 1o68 n PRO 57 N -4.14 0.20 -2.10 1.13 -0.02 -1.26 -4.64 135.00 124.17 1o68 n PRO 57 Ca 0.00 0.13 -0.42 0.00 -2.02 0.00 0.00 63.50 61.19 1o68 n PRO 57 Cb 0.39 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.34 1o68 n PRO 57 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1o68 s VAL 58 N -2.68 3.13 0.52 -1.45 1.01 -1.06 -5.01 120.40 114.87 1o68 s VAL 58 Ca 0.16 0.80 0.03 0.00 0.00 0.00 0.00 61.98 62.97 1o68 s VAL 58 Cb 0.12 -3.51 0.03 0.00 0.00 0.00 0.00 36.38 33.02 1o68 s VAL 58 CO 0.30 0.06 0.73 -0.94 0.00 0.00 0.00 175.10 175.25 1o68 s SER 59 N 1.15 5.33 0.21 3.32 1.04 -1.26 -4.35 113.70 119.14 1o68 s SER 59 Ca 0.66 -0.19 -0.05 0.00 0.48 0.00 0.00 55.95 56.86 1o68 s SER 59 Cb -0.39 -0.71 0.19 0.00 0.10 0.00 0.00 66.02 65.21 1o68 s SER 59 CO 0.30 -1.08 1.64 0.25 0.98 0.00 0.00 173.24 175.33 1o68 h LEU 60 N 0.21 0.80 -0.66 2.42 5.85 -1.92 -2.38 115.31 119.62 1o68 h LEU 60 Ca -0.41 -0.28 0.05 0.00 0.84 0.00 0.00 57.88 58.09 1o68 h LEU 60 Cb 1.29 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 42.05 1o68 h LEU 60 CO 0.49 0.98 0.38 -0.09 -0.34 0.00 0.00 178.44 179.86 1o68 h ARG 61 N 0.70 0.68 -0.93 1.25 2.43 -2.02 -1.26 114.38 115.24 1o68 h ARG 61 Ca 0.10 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1o68 h ARG 61 Cb 0.70 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1o68 h ARG 61 CO 0.05 0.45 0.00 -0.25 -1.51 0.00 0.00 179.97 178.71 1o68 n ASP 62 N -4.77 0.12 0.00 -3.80 8.00 -0.90 -1.51 116.55 113.69 1o68 n ASP 62 Ca 0.08 -0.13 0.00 0.00 0.71 0.00 0.00 54.79 55.45 1o68 n ASP 62 Cb 0.16 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.23 1o68 n ASP 62 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1o68 h TYR 65 N 0.00 -0.44 -0.59 0.00 3.20 -1.52 -0.20 116.97 117.43 1o68 h TYR 65 Ca 0.00 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.84 1o68 h TYR 65 Cb 0.00 0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.39 1o68 h TYR 65 CO 0.00 -0.21 0.29 0.45 -1.64 0.00 0.00 178.16 177.05 1o68 h HIS 66 N -0.58 0.81 -0.59 -3.82 3.86 -1.47 -1.79 115.15 111.57 1o68 h HIS 66 Ca -0.05 -0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.12 1o68 h HIS 66 Cb 0.43 -0.26 -0.03 0.00 1.06 0.00 0.00 27.41 28.61 1o68 h HIS 66 CO -0.03 0.60 0.29 1.15 0.86 0.00 0.00 177.93 180.80 1o68 h THR 67 N 0.83 1.21 -0.80 2.45 2.02 -1.76 -1.18 112.91 115.69 1o68 h THR 67 Ca 0.21 -0.59 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 1o68 h THR 67 Cb 0.08 0.51 -0.04 0.00 -1.74 0.00 0.00 68.15 66.96 1o68 h THR 67 CO -0.03 0.24 0.45 -0.33 0.37 0.00 0.00 175.52 176.22 1o68 h GLU 68 N 0.81 1.10 -0.05 6.66 5.08 -0.52 -0.83 114.58 126.82 1o68 h GLU 68 Ca 0.20 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1o68 h GLU 68 Cb 0.12 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 1o68 h GLU 68 CO -0.03 0.80 0.03 0.00 -1.00 0.00 0.00 179.01 178.82 1o68 h VAL 70 N -0.00 1.20 -0.03 0.00 2.07 -1.08 -2.42 116.25 115.99 1o68 h VAL 70 Ca 0.02 -0.54 -0.06 0.00 0.82 0.00 0.00 66.70 66.94 1o68 h VAL 70 Cb 0.08 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 1o68 h VAL 70 CO -0.00 0.23 -0.26 0.00 0.02 0.00 0.00 177.57 177.56 1o68 h ALA 71 N 1.46 1.52 0.00 1.67 0.00 -0.97 0.73 119.26 123.68 1o68 h ALA 71 Ca 0.23 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1o68 h ALA 71 Cb 0.06 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1o68 h ALA 71 CO -0.03 0.35 -0.24 0.00 0.00 0.00 0.00 179.25 179.32 1o68 h ARG 72 N 0.04 0.00 0.00 0.00 3.08 -1.10 -3.30 114.38 113.10 1o68 h ARG 72 Ca 0.00 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.74 1o68 h ARG 72 Cb 0.48 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.47 1o68 h ARG 72 CO 0.03 0.24 -2.17 0.41 -1.07 0.00 0.00 179.97 177.42 1o68 n GLY 73 N 0.43 -1.01 3.76 0.04 0.00 0.06 -5.01 105.19 103.46 1o68 n GLY 73 Ca 0.01 -0.28 -0.34 0.00 0.00 0.00 0.00 46.02 45.40 1o68 n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o68 s ALA 74 N -2.61 2.50 0.01 4.61 0.00 -0.10 -3.52 121.76 122.66 1o68 s ALA 74 Ca -0.08 0.77 0.00 0.00 0.00 0.00 0.00 51.96 52.65 1o68 s ALA 74 Cb 0.07 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.81 1o68 s ALA 74 CO 0.83 -1.19 0.00 1.63 0.00 0.00 0.00 175.76 177.04 1o68 n LYS 75 N -1.95 0.00 -0.04 0.00 5.02 -1.26 -4.95 118.16 114.98 1o68 n LYS 75 Ca 0.12 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.36 1o68 n LYS 75 Cb 0.51 -0.01 -0.14 0.00 -0.02 0.00 0.00 35.03 35.37 1o68 n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1o68 n ASN 76 N -2.53 0.38 -0.28 4.39 3.02 -1.26 -4.92 115.26 114.06 1o68 n ASN 76 Ca 0.00 0.17 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 1o68 n ASN 76 Cb 0.00 0.73 0.00 0.00 -0.61 0.00 0.00 39.78 39.90 1o68 n ASN 76 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1o68 n ALA 77 N -2.56 0.00 -3.67 5.41 0.00 -1.26 -0.50 120.51 117.93 1o68 n ALA 77 Ca -0.20 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.14 1o68 n ALA 77 Cb 0.98 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.33 1o68 n ALA 77 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1o68 s ILE 79 N 0.00 -0.39 -0.17 0.00 1.01 -1.26 -4.82 121.20 115.57 1o68 s ILE 79 Ca 0.00 0.14 -0.02 0.00 0.00 0.00 0.00 60.65 60.77 1o68 s ILE 79 Cb 0.00 -0.64 -0.01 0.00 0.01 0.00 0.00 42.46 41.82 1o68 s ILE 79 CO 0.00 0.06 -0.08 -0.69 0.00 0.00 0.00 174.94 174.22 1o68 s VAL 80 N 2.13 3.28 -0.09 2.92 1.01 0.77 -0.24 120.40 130.18 1o68 s VAL 80 Ca -0.05 -0.56 0.03 0.00 0.00 0.00 0.00 61.98 61.41 1o68 s VAL 80 Cb -0.11 -2.43 -0.01 0.00 0.00 0.00 0.00 36.38 33.83 1o68 s VAL 80 CO -0.13 0.48 -0.20 -0.44 0.00 0.00 0.00 175.10 174.82 1o68 s SER 81 N 0.78 3.48 0.31 3.32 0.01 -1.26 0.20 113.70 120.54 1o68 s SER 81 Ca -0.03 -0.44 -0.28 0.00 1.31 0.00 0.00 55.95 56.51 1o68 s SER 81 Cb -0.15 -1.28 -0.09 0.00 0.21 0.00 0.00 66.02 64.70 1o68 s SER 81 CO 0.01 0.20 1.13 -1.81 0.41 0.00 0.00 173.24 173.18 1o68 s ASP 82 N 0.12 7.06 -0.25 2.44 1.01 -0.73 -0.60 116.67 125.71 1o68 s ASP 82 Ca -0.10 2.31 -0.25 0.00 0.71 0.00 0.00 52.55 55.22 1o68 s ASP 82 Cb -0.16 -2.62 -0.00 0.00 1.01 0.00 0.00 42.92 41.15 1o68 s ASP 82 CO 0.06 -0.29 0.86 -0.76 0.21 0.00 0.00 175.17 175.24 1o68 s LEU 83 N -1.74 4.08 0.54 1.23 1.43 -0.19 -4.85 118.68 119.18 1o68 s LEU 83 Ca 0.48 1.03 -0.17 0.00 -1.03 0.00 0.00 54.13 54.43 1o68 s LEU 83 Cb -0.32 -3.23 -0.06 0.00 0.03 0.00 0.00 46.19 42.62 1o68 s LEU 83 CO 0.41 -0.56 1.03 -2.16 0.23 0.00 0.00 176.35 175.30 1o68 s PRO 84 N 2.93 3.61 -0.06 1.29 0.04 -1.26 -4.83 135.00 136.72 1o68 s PRO 84 Ca 0.36 1.18 -0.39 0.00 0.04 0.00 0.00 61.00 62.19 1o68 s PRO 84 Cb -0.15 -2.08 -0.17 0.00 0.04 0.00 0.00 34.50 32.14 1o68 s PRO 84 CO 0.08 -0.57 1.42 0.34 0.04 0.00 0.00 177.00 178.31 1o68 n PHE 85 N -1.64 1.53 0.00 0.56 7.35 -1.26 -1.60 117.46 122.40 1o68 n PHE 85 Ca 0.08 0.71 0.00 0.00 -0.76 0.00 0.00 57.45 57.48 1o68 n PHE 85 Cb 0.53 -2.32 0.00 0.00 0.35 0.00 0.00 39.48 38.04 1o68 n PHE 85 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1o68 n GLY 86 N 2.88 2.52 0.36 7.13 0.00 -1.26 -4.90 105.19 111.92 1o68 n GLY 86 Ca 0.21 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.36 1o68 n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o68 n ALA 87 N -1.26 3.11 -0.12 4.61 0.00 -0.63 -4.60 120.51 121.62 1o68 n ALA 87 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.96 1o68 n ALA 87 Cb 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1o68 n ALA 87 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1o68 n TYR 88 N -0.33 0.00 0.98 0.00 4.11 -1.26 -4.35 117.16 116.31 1o68 n TYR 88 Ca 0.12 0.00 0.14 0.00 -0.00 0.00 0.00 57.90 58.16 1o68 n TYR 88 Cb 0.39 0.00 0.59 0.00 -0.00 0.00 0.00 39.34 40.32 1o68 n TYR 88 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.86 177.90 1o68 n GLN 89 N 0.00 0.01 -0.19 -3.48 3.00 -1.26 -3.74 117.38 111.73 1o68 n GLN 89 Ca 0.00 0.01 -0.06 0.00 -0.01 0.00 0.00 57.00 56.94 1o68 n GLN 89 Cb 0.00 -1.51 0.10 0.00 0.00 0.00 0.00 30.24 28.83 1o68 n GLN 89 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.06 177.43 1o68 h GLN 90 N 0.00 0.98 -1.49 -1.09 4.15 -1.90 -3.47 115.11 112.29 1o68 h GLN 90 Ca 0.00 -0.24 0.29 0.00 0.77 0.00 0.00 58.65 59.46 1o68 h GLN 90 Cb 0.51 -0.12 -0.15 0.00 0.21 0.00 0.00 27.48 27.92 1o68 h GLN 90 CO 0.00 0.90 0.81 -1.54 -1.93 0.00 0.00 178.83 177.07 1o68 s SER 91 N -6.55 -0.10 0.30 -0.69 1.04 -1.24 -4.99 113.70 101.46 1o68 s SER 91 Ca -0.11 -0.08 0.02 0.00 0.48 0.00 0.00 55.95 56.26 1o68 s SER 91 Cb 0.15 0.16 0.47 0.00 0.10 0.00 0.00 66.02 66.90 1o68 s SER 91 CO 0.83 -0.29 1.79 0.07 0.98 0.00 0.00 173.24 176.63 1o68 h LYS 92 N 2.00 0.58 -0.46 4.02 2.10 -1.91 -0.95 116.57 121.95 1o68 h LYS 92 Ca -0.20 -0.16 -0.04 0.00 -2.00 0.00 0.00 60.65 58.25 1o68 h LYS 92 Cb 1.19 -0.06 -0.02 0.00 -0.90 0.00 0.00 32.23 32.43 1o68 h LYS 92 CO 0.26 0.67 0.13 0.93 -2.00 0.00 0.00 179.45 179.43 1o68 h GLU 93 N 0.54 0.72 -0.57 0.07 3.07 -1.96 0.13 114.58 116.59 1o68 h GLU 93 Ca 0.10 -0.16 -0.10 0.00 -0.50 0.00 0.00 59.36 58.70 1o68 h GLU 93 Cb 0.47 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.26 1o68 h GLU 93 CO 0.03 0.70 -0.04 0.37 -1.40 0.00 0.00 179.01 178.67 1o68 h GLN 94 N 0.61 1.02 -0.73 2.33 4.15 -1.75 -2.21 115.11 118.52 1o68 h GLN 94 Ca 0.15 -0.33 -0.05 0.00 0.77 0.00 0.00 58.65 59.18 1o68 h GLN 94 Cb 0.29 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.87 1o68 h GLN 94 CO -0.00 1.02 0.24 0.00 -1.93 0.00 0.00 178.83 178.16 1o68 h ALA 95 N 1.02 1.04 -0.39 3.38 0.00 -0.98 -1.52 119.26 121.80 1o68 h ALA 95 Ca 0.16 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1o68 h ALA 95 Cb 0.59 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1o68 h ALA 95 CO 0.04 0.65 0.12 0.35 0.00 0.00 0.00 179.25 180.41 1o68 h PHE 96 N 1.08 0.64 -0.23 0.00 3.57 -0.82 0.88 116.94 122.06 1o68 h PHE 96 Ca 0.24 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.68 1o68 h PHE 96 Cb 0.28 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 1o68 h PHE 96 CO 0.02 0.60 0.14 0.00 -2.23 0.00 0.00 178.31 176.84 1o68 h ALA 97 N 0.97 0.29 -0.28 2.41 0.00 -1.14 0.17 119.26 121.68 1o68 h ALA 97 Ca 0.13 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1o68 h ALA 97 Cb 0.26 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1o68 h ALA 97 CO -0.00 -0.22 0.15 0.00 0.00 0.00 0.00 179.25 179.17 1o68 h ALA 98 N 1.06 0.36 -0.64 0.00 0.00 -1.12 -2.26 119.26 116.67 1o68 h ALA 98 Ca 0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1o68 h ALA 98 Cb -0.01 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1o68 h ALA 98 CO -0.02 -0.10 0.29 0.00 0.00 0.00 0.00 179.25 179.42 1o68 h ALA 99 N 1.02 1.31 -0.72 0.00 0.00 -0.68 -2.08 119.26 118.11 1o68 h ALA 99 Ca 0.10 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1o68 h ALA 99 Cb 0.08 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1o68 h ALA 99 CO -0.01 0.53 0.37 0.00 0.00 0.00 0.00 179.25 180.14 1o68 h ALA 100 N 1.41 1.31 -0.60 0.00 0.00 -0.36 -2.19 119.26 118.84 1o68 h ALA 100 Ca 0.22 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 1o68 h ALA 100 Cb 0.12 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1o68 h ALA 100 CO -0.03 0.55 -0.02 0.93 0.00 0.00 0.00 179.25 180.68 1o68 h GLU 101 N 1.01 1.07 -1.56 0.00 5.08 -0.81 -0.18 114.58 119.18 1o68 h GLU 101 Ca 0.25 -0.35 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1o68 h GLU 101 Cb 0.05 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1o68 h GLU 101 CO -0.04 1.06 0.00 1.28 -1.00 0.00 0.00 179.01 180.31 1o68 n LEU 102 N -4.17 0.71 0.00 1.33 4.77 -0.82 -1.04 117.00 117.78 1o68 n LEU 102 Ca 0.03 -0.36 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 1o68 n LEU 102 Cb 0.36 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1o68 n LEU 102 CO 0.45 0.12 0.00 0.00 -1.33 0.00 0.00 177.39 176.63 1o68 n ALA 104 N 0.81 0.00 0.74 -1.18 0.00 -0.08 -1.56 120.51 119.24 1o68 n ALA 104 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1o68 n ALA 104 Cb 0.12 0.00 0.49 0.00 0.00 0.00 0.00 19.45 20.06 1o68 n ALA 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o68 n ALA 105 N 0.00 2.13 0.00 0.00 0.00 -0.21 -4.89 120.51 117.55 1o68 n ALA 105 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1o68 n ALA 105 Cb 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.03 1o68 n ALA 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o68 n GLY 106 N 1.03 0.46 3.77 0.00 0.00 -1.07 -3.41 105.19 105.96 1o68 n GLY 106 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 1o68 n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o68 s ALA 107 N -1.19 2.81 -1.43 4.61 0.00 -0.60 -4.80 121.76 121.16 1o68 s ALA 107 Ca 0.00 0.88 0.16 0.00 0.00 0.00 0.00 51.96 53.00 1o68 s ALA 107 Cb 0.00 -3.37 0.40 0.00 0.00 0.00 0.00 23.12 20.15 1o68 s ALA 107 CO 0.00 -0.74 1.33 0.72 0.00 0.00 0.00 175.76 177.07 1o68 n HIS 108 N -0.95 0.59 -4.05 0.00 8.25 0.67 -4.82 115.22 114.90 1o68 n HIS 108 Ca 0.10 -0.44 -0.09 0.00 -0.26 0.00 0.00 57.72 57.03 1o68 n HIS 108 Cb 0.50 -0.01 -0.11 0.00 1.12 0.00 0.00 29.99 31.49 1o68 n HIS 108 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1o68 s VAL 110 N -1.04 0.24 -0.02 1.59 -7.23 -0.56 -4.51 120.40 108.87 1o68 s VAL 110 Ca 0.32 -1.40 0.07 0.00 -1.81 0.00 0.00 61.98 59.15 1o68 s VAL 110 Cb 0.17 -0.96 -0.02 0.00 0.56 0.00 0.00 36.38 36.13 1o68 s VAL 110 CO 0.23 -0.74 -0.23 -0.75 -0.31 0.00 0.00 175.10 173.29 1o68 s LYS 111 N -2.75 2.18 0.02 4.82 2.20 0.23 -0.54 119.74 125.89 1o68 s LYS 111 Ca -0.03 -0.89 0.01 0.00 -0.36 0.00 0.00 55.97 54.70 1o68 s LYS 111 Cb -0.01 -2.12 -0.01 0.00 -1.51 0.00 0.00 37.83 34.18 1o68 s LYS 111 CO -0.05 0.57 -0.05 -0.48 -0.36 0.00 0.00 175.35 174.98 1o68 s LEU 112 N -0.70 2.14 -0.11 5.43 0.05 -0.85 -1.02 118.68 123.62 1o68 s LEU 112 Ca 0.11 -0.32 -0.10 0.00 0.05 0.00 0.00 54.13 53.87 1o68 s LEU 112 Cb -0.10 -0.12 -0.05 0.00 -2.05 0.00 0.00 46.19 43.88 1o68 s LEU 112 CO -0.00 -0.11 0.20 -1.61 -0.55 0.00 0.00 176.35 174.28 1o68 s GLU 113 N -0.89 3.71 0.00 1.48 2.02 -1.26 -1.30 118.70 122.46 1o68 s GLU 113 Ca -0.06 -0.02 0.00 0.00 0.02 0.00 0.00 54.97 54.91 1o68 s GLU 113 Cb -0.06 -3.25 0.00 0.00 0.10 0.00 0.00 34.13 30.92 1o68 s GLU 113 CO -0.00 0.65 0.00 0.41 0.02 0.00 0.00 175.26 176.34 1o68 n GLY 114 N 2.28 3.86 0.00 -1.39 0.00 -1.04 -4.98 105.19 103.93 1o68 n GLY 114 Ca -0.18 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1o68 n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o68 n GLY 115 N -1.50 1.58 0.37 -0.02 0.00 -1.26 -4.66 105.19 99.70 1o68 n GLY 115 Ca 0.00 -1.48 0.13 0.00 0.00 0.00 0.00 46.02 44.67 1o68 n GLY 115 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1o68 h VAL 116 N 0.00 0.80 0.00 1.61 2.07 -1.87 -3.17 116.25 115.69 1o68 h VAL 116 Ca 0.00 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.28 1o68 h VAL 116 Cb 0.00 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 29.79 1o68 h VAL 116 CO 0.00 0.13 0.00 -2.67 0.02 0.00 0.00 177.57 175.05 1o68 n TRP 117 N -4.60 0.00 0.00 1.57 2.14 -1.26 -4.36 117.44 110.93 1o68 n TRP 117 Ca 0.19 -0.06 0.00 0.00 2.07 0.00 0.00 57.50 59.70 1o68 n TRP 117 Cb 0.51 -0.19 0.00 0.00 -0.81 0.00 0.00 31.31 30.82 1o68 n TRP 117 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1o68 n ALA 119 N 1.43 0.00 0.03 -1.67 0.00 -1.20 -4.72 120.51 114.37 1o68 n ALA 119 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 1o68 n ALA 119 Cb 0.04 0.00 0.41 0.00 0.00 0.00 0.00 19.45 19.90 1o68 n ALA 119 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1o68 h GLU 120 N 0.00 0.47 -0.27 0.00 4.81 -1.93 -1.57 114.58 116.09 1o68 h GLU 120 Ca 0.00 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.05 1o68 h GLU 120 Cb 0.00 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.28 1o68 h GLU 120 CO 0.00 0.37 -0.34 1.15 -0.73 0.00 0.00 179.01 179.46 1o68 h THR 121 N 0.48 1.30 -0.35 0.32 2.02 -1.94 -1.67 112.91 113.07 1o68 h THR 121 Ca 0.12 -1.53 0.06 0.00 0.77 0.00 0.00 66.41 65.83 1o68 h THR 121 Cb 0.06 1.64 -0.06 0.00 -1.74 0.00 0.00 68.15 68.06 1o68 h THR 121 CO -0.02 0.49 0.00 0.74 0.37 0.00 0.00 175.52 177.11 1o68 h THR 122 N 0.45 0.74 -0.45 3.16 2.02 -1.82 -1.91 112.91 115.10 1o68 h THR 122 Ca 0.03 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 1o68 h THR 122 Cb 0.93 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 1o68 h THR 122 CO 0.08 0.02 0.27 -0.08 0.37 0.00 0.00 175.52 176.19 1o68 h GLU 123 N 0.10 0.60 -0.87 6.66 4.81 -1.22 -0.64 114.58 124.02 1o68 h GLU 123 Ca 0.17 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.38 1o68 h GLU 123 Cb 0.23 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.43 1o68 h GLU 123 CO -0.28 0.44 0.57 0.35 -0.73 0.00 0.00 179.01 179.35 1o68 h PHE 124 N 0.60 1.06 -0.05 0.92 3.57 -0.97 -3.00 116.94 119.07 1o68 h PHE 124 Ca 0.16 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.62 1o68 h PHE 124 Cb -0.02 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.37 1o68 h PHE 124 CO -0.03 0.62 -0.23 -0.07 -2.23 0.00 0.00 178.31 176.37 1o68 h LEU 125 N 1.11 0.29 -2.69 0.59 4.07 -1.07 -3.18 115.31 114.44 1o68 h LEU 125 Ca 0.34 -0.65 0.00 0.00 0.08 0.00 0.00 57.88 57.66 1o68 h LEU 125 Cb -0.02 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 41.64 1o68 h LEU 125 CO -0.11 0.89 0.00 0.00 -1.08 0.00 0.00 178.44 178.14 1o68 n GLN 126 N -4.52 0.06 -0.05 1.13 -0.00 -0.27 -1.75 117.38 111.98 1o68 n GLN 126 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.92 1o68 n GLN 126 Cb 0.45 -1.47 0.00 0.00 -0.00 0.00 0.00 30.24 29.22 1o68 n GLN 126 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1o68 n ARG 128 N 1.32 -0.09 -0.81 2.61 1.74 -1.20 -3.98 116.66 116.25 1o68 n ARG 128 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1o68 n ARG 128 Cb 0.03 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.47 1o68 n ARG 128 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1o68 n GLY 129 N 0.00 0.69 3.30 -0.13 0.00 -1.17 -5.01 105.19 102.87 1o68 n GLY 129 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1o68 n GLY 129 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1o68 s ILE 130 N -2.50 4.72 0.34 -0.61 1.01 -0.72 -5.06 121.20 118.39 1o68 s ILE 130 Ca 0.00 -1.38 -0.29 0.00 0.00 0.00 0.00 60.65 58.98 1o68 s ILE 130 Cb 0.00 -3.93 -0.11 0.00 0.01 0.00 0.00 42.46 38.43 1o68 s ILE 130 CO 0.00 -0.64 1.52 -2.84 0.00 0.00 0.00 174.94 172.98 1o68 s PRO 131 N 1.51 4.13 -0.05 2.79 0.02 -1.26 -2.98 135.00 139.15 1o68 s PRO 131 Ca 0.04 2.56 0.05 0.00 0.02 0.00 0.00 61.00 63.67 1o68 s PRO 131 Cb -0.25 -3.00 -0.01 0.00 0.02 0.00 0.00 34.50 31.27 1o68 s PRO 131 CO 0.03 -0.56 -0.21 0.08 -0.33 0.00 0.00 177.00 176.01 1o68 s VAL 132 N -0.65 1.73 -0.37 3.83 1.01 -1.26 -1.49 120.40 123.20 1o68 s VAL 132 Ca 0.57 -0.88 -0.09 0.00 0.00 0.00 0.00 61.98 61.58 1o68 s VAL 132 Cb -0.47 -1.48 0.04 0.00 0.00 0.00 0.00 36.38 34.47 1o68 s VAL 132 CO 0.56 0.49 0.17 0.00 0.00 0.00 0.00 175.10 176.33 1o68 s ALA 134 N 1.49 3.62 -0.38 0.00 0.00 0.01 -2.01 121.76 124.49 1o68 s ALA 134 Ca 0.01 -0.23 -0.16 0.00 0.00 0.00 0.00 51.96 51.57 1o68 s ALA 134 Cb -0.20 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.75 1o68 s ALA 134 CO 0.05 -0.85 0.41 -1.58 0.00 0.00 0.00 175.76 173.79 1o68 s HIS 135 N 2.63 3.19 0.47 0.00 5.04 -0.42 0.32 115.29 126.52 1o68 s HIS 135 Ca 0.32 -0.18 0.02 0.00 -1.54 0.00 0.00 55.06 53.68 1o68 s HIS 135 Cb -0.15 -2.79 -0.02 0.00 0.04 0.00 0.00 32.58 29.66 1o68 s HIS 135 CO 0.08 -0.56 0.03 0.96 -2.34 0.00 0.00 174.74 172.91 1o68 s ILE 136 N 2.09 1.10 0.00 0.89 -4.36 0.07 -2.50 121.20 118.50 1o68 s ILE 136 Ca 0.12 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.51 1o68 s ILE 136 Cb -0.17 -2.29 0.00 0.00 1.25 0.00 0.00 42.46 41.25 1o68 s ILE 136 CO 0.13 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.92 1o68 n GLY 137 N -1.14 1.61 3.55 6.27 0.00 -1.26 -2.67 105.19 111.55 1o68 n GLY 137 Ca -0.14 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 1o68 n GLY 137 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1o68 s LEU 138 N 0.00 3.61 -0.50 0.99 2.96 -0.46 -4.95 118.68 120.33 1o68 s LEU 138 Ca 0.00 -0.20 -0.15 0.00 -0.22 0.00 0.00 54.13 53.56 1o68 s LEU 138 Cb 0.00 -2.90 0.11 0.00 0.50 0.00 0.00 46.19 43.89 1o68 s LEU 138 CO 0.00 -1.50 0.44 0.42 -1.32 0.00 0.00 176.35 174.39 1o68 s THR 139 N 4.82 5.11 0.56 3.68 -4.23 -1.26 -4.62 115.64 119.70 1o68 s THR 139 Ca 0.37 -1.35 0.29 0.00 -1.18 0.00 0.00 61.69 59.82 1o68 s THR 139 Cb -0.09 -4.19 0.41 0.00 1.34 0.00 0.00 72.50 69.97 1o68 s THR 139 CO 0.21 -0.74 1.93 -0.65 -0.54 0.00 0.00 174.62 174.83 1o68 h PRO 140 N 8.79 0.00 0.00 3.99 0.11 -1.99 0.52 132.00 143.42 1o68 h PRO 140 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1o68 h PRO 140 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1o68 h PRO 140 CO 0.95 0.00 0.00 1.96 -0.21 0.00 0.00 178.00 180.70 1o68 h GLN 141 N 0.00 0.00 -0.52 1.05 4.20 -1.95 -2.26 115.11 115.62 1o68 h GLN 141 Ca 0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.98 1o68 h GLN 141 Cb 1.24 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.02 1o68 h GLN 141 CO -0.00 0.00 0.00 0.43 -0.67 0.00 0.00 178.83 178.59 1o68 n SER 142 N -2.99 5.24 -0.34 1.46 7.64 0.17 -4.66 113.62 120.14 1o68 n SER 142 Ca -0.01 -2.88 0.15 0.00 1.01 0.00 0.00 58.87 57.14 1o68 n SER 142 Cb 0.18 -0.64 0.36 0.00 -1.01 0.00 0.00 64.21 63.10 1o68 n SER 142 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 1o68 h VAL 143 N 3.57 0.66 0.00 0.44 3.04 -1.49 0.11 116.25 122.57 1o68 h VAL 143 Ca 0.00 -0.23 -0.09 0.00 -1.01 0.00 0.00 66.70 65.37 1o68 h VAL 143 Cb 1.80 -0.09 -0.01 0.00 -2.01 0.00 0.00 31.29 30.98 1o68 h VAL 143 CO 0.40 0.12 -0.41 -0.26 -1.01 0.00 0.00 177.57 176.42 1o68 h PHE 144 N 0.68 0.00 0.00 3.17 -1.00 -1.86 -3.52 116.94 114.41 1o68 h PHE 144 Ca 0.59 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.37 1o68 h PHE 144 Cb 1.03 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.59 1o68 h PHE 144 CO -0.00 0.41 0.00 0.00 -1.61 0.00 0.00 178.31 177.10 1o68 n ALA 145 N -2.29 0.00 0.00 2.45 0.00 0.37 -5.28 120.51 115.77 1o68 n ALA 145 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1o68 n ALA 145 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 1o68 n ALA 145 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1o68 n LYS 157 N 0.00 0.00 0.02 0.00 0.00 -1.26 -5.16 118.16 111.76 1o68 n LYS 157 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 58.31 58.13 1o68 n LYS 157 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 35.03 34.91 1o68 n LYS 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1o68 h ALA 158 N 0.00 0.04 -0.32 3.14 0.00 -2.06 -3.20 119.26 116.87 1o68 h ALA 158 Ca 0.00 -0.60 -0.10 0.00 0.00 0.00 0.00 54.91 54.21 1o68 h ALA 158 Cb 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1o68 h ALA 158 CO 0.00 0.38 -0.22 0.37 0.00 0.00 0.00 179.25 179.78 1o68 h GLN 159 N -0.12 0.61 -0.63 0.00 5.75 -2.05 -2.61 115.11 116.05 1o68 h GLN 159 Ca -0.09 -0.23 -0.00 0.00 -0.15 0.00 0.00 58.65 58.18 1o68 h GLN 159 Cb 1.41 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 29.89 1o68 h GLN 159 CO 0.13 0.78 0.38 0.00 -2.65 0.00 0.00 178.83 177.48 1o68 h ALA 160 N 1.22 0.81 -0.71 3.38 0.00 -1.99 0.22 119.26 122.20 1o68 h ALA 160 Ca 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1o68 h ALA 160 Cb 0.67 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1o68 h ALA 160 CO 0.05 0.29 0.45 1.25 0.00 0.00 0.00 179.25 181.28 1o68 h LEU 161 N 0.86 0.83 -0.58 0.00 5.85 -1.50 0.36 115.31 121.13 1o68 h LEU 161 Ca 0.23 -0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.84 1o68 h LEU 161 Cb -0.02 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1o68 h LEU 161 CO -0.04 0.63 0.11 0.25 -0.34 0.00 0.00 178.44 179.04 1o68 h LEU 162 N 0.96 0.91 -0.64 2.25 5.85 -1.03 -1.22 115.31 122.39 1o68 h LEU 162 Ca 0.26 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1o68 h LEU 162 Cb -0.07 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.69 1o68 h LEU 162 CO -0.05 0.93 0.39 0.78 -0.34 0.00 0.00 178.44 180.15 1o68 h ASN 163 N 0.86 0.76 -0.17 1.25 2.35 0.70 -1.00 115.58 120.33 1o68 h ASN 163 Ca 0.18 -0.05 0.03 0.00 -0.55 0.00 0.00 56.30 55.91 1o68 h ASN 163 Cb 0.40 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 1o68 h ASN 163 CO 0.01 0.59 -0.04 0.44 -1.65 0.00 0.00 177.43 176.78 1o68 h ASP 164 N 0.86 -0.15 -0.21 5.81 3.32 0.09 -0.55 116.42 125.60 1o68 h ASP 164 Ca 0.23 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.33 1o68 h ASP 164 Cb -0.04 0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1o68 h ASP 164 CO -0.04 -0.05 0.13 0.00 -1.72 0.00 0.00 179.24 177.56 1o68 h ALA 165 N 1.16 0.26 -0.48 3.45 0.00 -1.04 -2.17 119.26 120.44 1o68 h ALA 165 Ca 0.08 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1o68 h ALA 165 Cb 0.12 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1o68 h ALA 165 CO -0.17 -0.27 0.24 0.87 0.00 0.00 0.00 179.25 179.92 1o68 h LYS 166 N 0.27 0.69 -0.58 0.00 6.56 -0.88 -0.95 116.57 121.69 1o68 h LYS 166 Ca 0.08 -0.10 0.01 0.00 -1.06 0.00 0.00 60.65 59.58 1o68 h LYS 166 Cb -0.03 -0.13 -0.03 0.00 -0.57 0.00 0.00 32.23 31.48 1o68 h LYS 166 CO -0.02 0.58 0.38 0.00 -2.06 0.00 0.00 179.45 178.33 1o68 h ALA 167 N 1.08 0.74 -0.41 3.86 0.00 -0.99 0.65 119.26 124.19 1o68 h ALA 167 Ca 0.17 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1o68 h ALA 167 Cb 0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1o68 h ALA 167 CO -0.02 0.15 -0.07 0.45 0.00 0.00 0.00 179.25 179.76 1o68 h HIS 168 N 0.77 0.85 -0.27 0.00 3.86 -1.29 0.18 115.15 119.25 1o68 h HIS 168 Ca 0.22 -0.17 0.03 0.00 -1.16 0.00 0.00 60.37 59.28 1o68 h HIS 168 Cb -0.07 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.17 1o68 h HIS 168 CO -0.04 0.87 0.10 0.22 0.86 0.00 0.00 177.93 179.94 1o68 h ASP 169 N 0.58 0.12 -0.20 2.45 -0.00 -0.76 -0.12 116.42 118.48 1o68 h ASP 169 Ca 0.11 0.03 -0.06 0.00 -0.00 0.00 0.00 57.03 57.10 1o68 h ASP 169 Cb 0.58 0.01 -0.02 0.00 -0.00 0.00 0.00 39.33 39.90 1o68 h ASP 169 CO 0.03 0.10 -0.06 0.44 -0.00 0.00 0.00 179.24 179.76 1o68 h ASP 170 N 0.22 0.51 0.58 2.28 3.32 -0.76 -2.06 116.42 120.52 1o68 h ASP 170 Ca 0.12 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1o68 h ASP 170 Cb 0.08 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.49 1o68 h ASP 170 CO -0.12 0.62 0.00 0.00 -1.72 0.00 0.00 179.24 178.03 1o68 n ALA 171 N -2.48 1.81 0.00 3.45 0.00 0.04 -4.88 120.51 118.46 1o68 n ALA 171 Ca 0.01 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1o68 n ALA 171 Cb 0.29 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1o68 n ALA 171 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o68 n GLY 172 N 0.30 1.09 3.68 0.00 0.00 -0.78 -3.68 105.19 105.81 1o68 n GLY 172 Ca 0.05 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.63 1o68 n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o68 n ALA 173 N -1.80 1.20 0.05 4.61 0.00 -0.11 -4.84 120.51 119.63 1o68 n ALA 173 Ca 0.00 0.39 -0.12 0.00 0.00 0.00 0.00 53.44 53.71 1o68 n ALA 173 Cb 0.00 -2.27 -0.01 0.00 0.00 0.00 0.00 19.45 17.18 1o68 n ALA 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o68 h ALA 174 N 3.59 0.49 -2.80 0.00 0.00 -1.28 -3.44 119.26 115.81 1o68 h ALA 174 Ca -0.45 -0.65 -0.14 0.00 0.00 0.00 0.00 54.91 53.67 1o68 h ALA 174 Cb 1.28 -0.04 -0.22 0.00 0.00 0.00 0.00 17.79 18.80 1o68 h ALA 174 CO 0.71 0.78 -0.40 0.08 0.00 0.00 0.00 179.25 180.42 1o68 s VAL 175 N -3.49 0.05 -0.19 0.00 1.01 -1.06 -4.06 120.40 112.65 1o68 s VAL 175 Ca -0.06 -0.39 -0.01 0.00 0.00 0.00 0.00 61.98 61.53 1o68 s VAL 175 Cb 0.10 -0.46 0.01 0.00 0.00 0.00 0.00 36.38 36.02 1o68 s VAL 175 CO 0.85 -0.21 -0.14 -0.69 0.00 0.00 0.00 175.10 174.91 1o68 s VAL 176 N -0.85 2.54 0.20 2.92 1.01 -0.84 -0.81 120.40 124.56 1o68 s VAL 176 Ca -0.09 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.13 1o68 s VAL 176 Cb -0.05 -2.10 0.02 0.00 0.00 0.00 0.00 36.38 34.25 1o68 s VAL 176 CO 0.02 0.50 0.19 -0.11 0.00 0.00 0.00 175.10 175.70 1o68 n LEU 177 N 4.64 0.00 -3.55 3.92 0.00 0.15 -1.30 117.00 120.87 1o68 n LEU 177 Ca -0.20 -0.98 0.02 0.00 0.00 0.00 0.00 56.01 54.86 1o68 n LEU 177 Cb 0.50 -0.06 -0.06 0.00 0.00 0.00 0.00 43.42 43.81 1o68 n LEU 177 CO 0.27 -0.44 0.93 -0.70 0.00 0.00 0.00 177.39 177.45 1o68 s GLU 179 N -2.85 0.09 -1.02 1.96 2.12 -1.09 -0.75 118.70 117.16 1o68 s GLU 179 Ca 0.15 0.18 -0.14 0.00 0.36 0.00 0.00 54.97 55.51 1o68 s GLU 179 Cb -0.01 0.04 -0.01 0.00 0.26 0.00 0.00 34.13 34.41 1o68 s GLU 179 CO 0.09 -0.02 0.77 0.00 -0.54 0.00 0.00 175.26 175.56 1o68 s VAL 181 N -3.32 1.61 -0.09 0.00 1.01 -0.68 -4.55 120.40 114.38 1o68 s VAL 181 Ca 0.34 -0.89 -0.38 0.00 0.00 0.00 0.00 61.98 61.04 1o68 s VAL 181 Cb -0.11 -1.34 -0.16 0.00 0.00 0.00 0.00 36.38 34.77 1o68 s VAL 181 CO 0.84 0.44 1.53 0.00 0.00 0.00 0.00 175.10 177.91 1o68 n LEU 182 N 2.53 1.98 -0.26 3.92 -0.00 -1.26 -4.26 117.00 119.67 1o68 n LEU 182 Ca -0.15 1.10 0.01 0.00 -0.00 0.00 0.00 56.01 56.97 1o68 n LEU 182 Cb 0.53 -1.16 0.09 0.00 -0.00 0.00 0.00 43.42 42.87 1o68 n LEU 182 CO 0.24 -0.76 0.71 0.00 -0.00 0.00 0.00 177.39 177.58 1o68 h ALA 183 N 5.82 0.49 -0.42 1.47 0.00 -1.71 -0.70 119.26 124.22 1o68 h ALA 183 Ca -0.47 0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1o68 h ALA 183 Cb 1.33 0.57 -0.02 0.00 0.00 0.00 0.00 17.79 19.66 1o68 h ALA 183 CO 0.86 -0.41 0.05 1.05 0.00 0.00 0.00 179.25 180.80 1o68 h GLU 184 N -0.00 0.65 -0.27 0.00 9.09 -1.88 -1.10 114.58 121.06 1o68 h GLU 184 Ca 0.36 -0.14 -0.03 0.00 0.05 0.00 0.00 59.36 59.60 1o68 h GLU 184 Cb 0.54 -0.10 -0.01 0.00 -1.65 0.00 0.00 28.75 27.53 1o68 h GLU 184 CO -0.76 0.63 0.07 1.25 0.05 0.00 0.00 179.01 180.25 1o68 h LEU 185 N 0.63 0.41 -0.39 3.06 5.85 -1.57 -2.21 115.31 121.10 1o68 h LEU 185 Ca 0.14 -0.23 0.04 0.00 0.84 0.00 0.00 57.88 58.67 1o68 h LEU 185 Cb 0.32 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 1o68 h LEU 185 CO 0.01 0.54 0.16 0.00 -0.34 0.00 0.00 178.44 178.80 1o68 h ALA 186 N 0.89 0.46 -0.52 1.25 0.00 -0.58 -0.87 119.26 119.89 1o68 h ALA 186 Ca 0.09 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.09 1o68 h ALA 186 Cb 0.28 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 1o68 h ALA 186 CO 0.00 -0.22 0.21 -0.22 0.00 0.00 0.00 179.25 179.02 1o68 h LYS 187 N 0.33 0.39 -0.27 0.00 3.64 -1.12 -0.38 116.57 119.16 1o68 h LYS 187 Ca 0.17 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1o68 h LYS 187 Cb 0.12 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1o68 h LYS 187 CO -0.15 0.26 0.16 -0.22 -2.27 0.00 0.00 179.45 177.23 1o68 h LYS 188 N 0.40 0.37 -0.30 1.90 3.64 -0.71 -1.11 116.57 120.77 1o68 h LYS 188 Ca 0.25 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.64 1o68 h LYS 188 Cb 0.25 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.95 1o68 h LYS 188 CO -0.23 0.30 0.04 0.28 -2.27 0.00 0.00 179.45 177.57 1o68 h VAL 189 N 0.34 0.84 -0.92 2.00 2.07 -1.00 0.52 116.25 120.11 1o68 h VAL 189 Ca 0.10 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.59 1o68 h VAL 189 Cb 0.02 0.68 -0.05 0.00 -1.52 0.00 0.00 31.29 30.42 1o68 h VAL 189 CO -0.02 0.03 0.61 0.74 0.02 0.00 0.00 177.57 178.95 1o68 h THR 190 N 0.15 1.20 0.00 2.57 2.02 -0.84 0.39 112.91 118.39 1o68 h THR 190 Ca 0.14 -0.41 -0.03 0.00 0.77 0.00 0.00 66.41 66.87 1o68 h THR 190 Cb 0.16 -0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 66.46 1o68 h THR 190 CO -0.20 0.22 -0.16 -0.33 0.37 0.00 0.00 175.52 175.43 1o68 h GLU 191 N 1.20 0.00 0.11 6.66 5.08 -0.77 -3.34 114.58 123.51 1o68 h GLU 191 Ca 0.35 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.44 1o68 h GLU 191 Cb -0.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1o68 h GLU 191 CO -0.09 0.16 -1.40 1.15 -1.00 0.00 0.00 179.01 177.82 1o68 h THR 192 N 0.00 1.02 -4.06 1.13 2.02 0.74 -3.47 112.91 110.29 1o68 h THR 192 Ca -0.00 -2.39 -0.46 0.00 0.77 0.00 0.00 66.41 64.33 1o68 h THR 192 Cb 1.00 2.69 -0.00 0.00 -1.74 0.00 0.00 68.15 70.10 1o68 h THR 192 CO 0.02 0.69 0.32 0.68 0.37 0.00 0.00 175.52 177.60 1o68 s VAL 193 N -2.47 4.50 0.10 3.16 -7.23 -0.04 -4.99 120.40 113.43 1o68 s VAL 193 Ca -0.20 1.28 0.10 0.00 -1.81 0.00 0.00 61.98 61.35 1o68 s VAL 193 Cb 0.04 -3.66 -0.09 0.00 0.56 0.00 0.00 36.38 33.24 1o68 s VAL 193 CO 0.76 -0.47 1.42 0.77 -0.31 0.00 0.00 175.10 177.26 1o68 h SER 194 N 1.50 0.00 -3.96 4.85 4.64 -1.91 -3.46 113.55 115.21 1o68 h SER 194 Ca -0.48 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.35 1o68 h SER 194 Cb 1.18 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.30 1o68 h SER 194 CO 0.62 0.77 0.25 0.00 -0.87 0.00 0.00 176.83 177.60 1o68 s PRO 196 N -4.49 3.91 0.04 0.00 0.02 -1.26 -4.78 135.00 128.44 1o68 s PRO 196 Ca 0.53 2.18 0.04 0.00 0.02 0.00 0.00 61.00 63.77 1o68 s PRO 196 Cb -0.10 -2.72 -0.04 0.00 0.02 0.00 0.00 34.50 31.66 1o68 s PRO 196 CO 0.41 -0.55 -0.05 0.95 -0.33 0.00 0.00 177.00 177.43 1o68 s THR 197 N -1.26 3.72 -0.03 0.99 -4.23 -1.26 -1.99 115.64 111.57 1o68 s THR 197 Ca 0.58 -0.91 0.06 0.00 -1.18 0.00 0.00 61.69 60.24 1o68 s THR 197 Cb -0.38 -2.68 -0.01 0.00 1.34 0.00 0.00 72.50 70.76 1o68 s THR 197 CO 0.49 0.27 -0.22 -0.63 -0.54 0.00 0.00 174.62 174.00 1o68 s ILE 198 N -1.12 1.75 0.16 2.99 -1.09 -0.42 -1.15 121.20 122.32 1o68 s ILE 198 Ca 0.20 -0.92 0.07 0.00 -2.23 0.00 0.00 60.65 57.77 1o68 s ILE 198 Cb -0.11 -1.47 -0.04 0.00 -1.58 0.00 0.00 42.46 39.25 1o68 s ILE 198 CO 0.12 0.49 -0.15 -0.83 -1.23 0.00 0.00 174.94 173.34 1o68 s GLY 199 N -0.30 1.28 -0.21 6.18 0.00 -0.02 -4.25 107.32 110.01 1o68 s GLY 199 Ca 0.02 -1.49 -0.04 0.00 0.00 0.00 0.00 44.72 43.21 1o68 s GLY 199 CO 0.01 -1.57 0.18 -1.50 0.00 0.00 0.00 173.10 170.23 1o68 s ILE 200 N -2.51 -0.24 -0.85 0.90 2.07 -1.26 -1.55 121.20 117.76 1o68 s ILE 200 Ca 0.16 -0.22 0.00 0.00 -1.41 0.00 0.00 60.65 59.18 1o68 s ILE 200 Cb -0.03 -0.70 0.00 0.00 0.13 0.00 0.00 42.46 41.86 1o68 s ILE 200 CO 0.05 -0.30 0.00 0.61 -1.91 0.00 0.00 174.94 173.39 1o68 n GLY 201 N 5.30 0.42 0.04 1.50 0.00 -1.26 -0.62 105.19 110.57 1o68 n GLY 201 Ca -0.06 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1o68 n GLY 201 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o68 n ALA 202 N -0.41 2.34 0.00 4.61 0.00 -1.26 -1.69 120.51 124.10 1o68 n ALA 202 Ca -0.10 -0.68 0.00 0.00 0.00 0.00 0.00 53.44 52.66 1o68 n ALA 202 Cb 0.47 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.89 1o68 n ALA 202 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o68 n GLY 203 N -0.11 -3.90 0.04 0.00 0.00 -1.26 -4.28 105.19 95.69 1o68 n GLY 203 Ca 0.01 -2.03 0.11 0.00 0.00 0.00 0.00 46.02 44.11 1o68 n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o68 n ALA 204 N 0.64 3.91 0.44 4.61 0.00 -1.26 -4.25 120.51 124.60 1o68 n ALA 204 Ca 0.00 -0.45 0.01 0.00 0.00 0.00 0.00 53.44 53.00 1o68 n ALA 204 Cb 0.00 -0.99 0.11 0.00 0.00 0.00 0.00 19.45 18.57 1o68 n ALA 204 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1o68 n ASP 205 N -1.36 2.49 -4.97 0.00 8.00 -1.26 -4.84 116.55 114.61 1o68 n ASP 205 Ca 0.06 -2.30 -0.21 0.00 0.71 0.00 0.00 54.79 53.05 1o68 n ASP 205 Cb 0.34 -0.56 0.04 0.00 -0.02 0.00 0.00 41.12 40.92 1o68 n ASP 205 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1o68 n ASP 207 N -2.39 0.00 -3.44 0.00 8.00 -0.30 -4.91 116.55 113.50 1o68 n ASP 207 Ca 0.08 0.34 -0.03 0.00 0.71 0.00 0.00 54.79 55.89 1o68 n ASP 207 Cb 0.60 -0.44 0.01 0.00 -0.02 0.00 0.00 41.12 41.27 1o68 n ASP 207 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1o68 s GLY 208 N -2.89 0.04 0.09 0.44 0.00 -0.66 -1.21 107.32 103.14 1o68 s GLY 208 Ca 0.17 -0.23 0.02 0.00 0.00 0.00 0.00 44.72 44.68 1o68 s GLY 208 CO 0.48 2.29 -0.08 1.20 0.00 0.00 0.00 173.10 176.99 1o68 s GLN 209 N -2.29 0.79 0.03 2.90 -1.52 -0.66 -0.84 119.66 118.07 1o68 s GLN 209 Ca 0.21 -1.19 -0.02 0.00 -1.95 0.00 0.00 55.36 52.41 1o68 s GLN 209 Cb -0.02 -0.33 -0.02 0.00 -0.22 0.00 0.00 33.01 32.42 1o68 s GLN 209 CO 0.04 0.03 0.00 0.54 -0.25 0.00 0.00 175.29 175.65 1o68 s VAL 210 N -2.89 0.14 -0.01 1.09 0.11 -0.60 -4.60 120.40 113.64 1o68 s VAL 210 Ca 0.06 -1.13 -0.15 0.00 -2.93 0.00 0.00 61.98 57.84 1o68 s VAL 210 Cb 0.00 -0.67 0.02 0.00 -1.53 0.00 0.00 36.38 34.21 1o68 s VAL 210 CO -0.02 -0.62 0.31 -0.76 -3.33 0.00 0.00 175.10 170.67 1o68 s LEU 211 N -1.90 0.87 0.00 2.54 1.43 -1.26 -4.49 118.68 115.86 1o68 s LEU 211 Ca -0.09 0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 1o68 s LEU 211 Cb -0.04 1.26 0.00 0.00 0.03 0.00 0.00 46.19 47.44 1o68 s LEU 211 CO -0.03 -0.46 0.00 0.52 0.23 0.00 0.00 176.35 176.61 1o68 n VAL 212 N 1.23 0.00 0.00 -1.59 0.31 -1.26 -2.42 118.33 114.59 1o68 n VAL 212 Ca -0.21 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1o68 n VAL 212 Cb 0.56 -0.26 0.00 0.00 -0.91 0.00 0.00 33.84 33.23 1o68 n VAL 212 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1o68 n HIS 214 N -0.05 0.00 0.15 3.52 8.25 -1.26 -4.68 115.22 121.14 1o68 n HIS 214 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1o68 n HIS 214 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1o68 n HIS 214 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1o68 n ASP 215 N 0.00 0.14 0.00 0.41 8.00 -1.26 -0.93 116.55 122.91 1o68 n ASP 215 Ca 0.00 -0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.22 1o68 n ASP 215 Cb 0.00 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.03 1o68 n ASP 215 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1o68 n LEU 217 N 0.40 0.00 -1.42 0.64 4.77 -1.26 -4.44 117.00 115.69 1o68 n LEU 217 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 1o68 n LEU 217 Cb 0.03 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1o68 n LEU 217 CO 0.00 0.00 -0.11 0.61 -1.33 0.00 0.00 177.39 176.56 1o68 n GLY 218 N 0.00 -0.07 0.18 -0.72 0.00 -0.97 -4.89 105.19 98.72 1o68 n GLY 218 Ca 0.00 -0.37 0.01 0.00 0.00 0.00 0.00 46.02 45.66 1o68 n GLY 218 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1o68 h ILE 219 N -0.19 1.30 -3.28 -0.61 1.08 -1.25 -3.42 117.51 111.13 1o68 h ILE 219 Ca -0.28 -1.43 -0.57 0.00 -0.39 0.00 0.00 64.86 62.20 1o68 h ILE 219 Cb 1.20 1.74 -0.04 0.00 -3.07 0.00 0.00 36.82 36.65 1o68 h ILE 219 CO 0.32 0.41 -0.10 -0.36 -0.69 0.00 0.00 178.15 177.74 1o68 s PHE 220 N -4.12 3.64 0.88 1.37 0.40 -1.26 -5.07 117.98 113.82 1o68 s PHE 220 Ca -0.03 1.07 -0.12 0.00 -0.60 0.00 0.00 56.93 57.25 1o68 s PHE 220 Cb 0.14 -2.37 0.12 0.00 0.51 0.00 0.00 43.02 41.42 1o68 s PHE 220 CO 0.74 0.47 1.12 -1.25 0.70 0.00 0.00 175.22 177.00 1o68 s PRO 221 N -1.79 1.41 0.30 0.24 0.04 -1.26 -4.92 135.00 129.02 1o68 s PRO 221 Ca 0.35 0.43 0.00 0.00 0.04 0.00 0.00 61.00 61.82 1o68 s PRO 221 Cb -0.16 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.53 1o68 s PRO 221 CO 0.19 -2.04 0.00 0.41 0.04 0.00 0.00 177.00 175.60 1o68 n GLY 222 N -2.09 -2.44 3.75 0.56 0.00 -1.26 -4.93 105.19 98.77 1o68 n GLY 222 Ca 0.07 -1.62 -0.40 0.00 0.00 0.00 0.00 46.02 44.06 1o68 n GLY 222 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o68 s LYS 223 N -0.63 4.68 0.68 1.61 -0.14 -1.26 -5.03 119.74 119.66 1o68 s LYS 223 Ca 0.00 1.69 -0.16 0.00 -1.36 0.00 0.00 55.97 56.14 1o68 s LYS 223 Cb 0.00 -3.24 0.01 0.00 -1.68 0.00 0.00 37.83 32.92 1o68 s LYS 223 CO 0.00 0.25 1.22 0.95 -0.76 0.00 0.00 175.35 177.01 1o68 s THR 224 N -0.85 2.35 0.98 2.17 -4.23 -1.26 -4.96 115.64 109.85 1o68 s THR 224 Ca 0.45 0.19 -0.11 0.00 -1.18 0.00 0.00 61.69 61.04 1o68 s THR 224 Cb -0.29 -2.88 0.17 0.00 1.34 0.00 0.00 72.50 70.83 1o68 s THR 224 CO 0.37 -0.07 1.02 0.00 -0.54 0.00 0.00 174.62 175.39 1o68 n ALA 225 N -2.31 -1.54 -0.32 3.99 0.00 -1.26 -4.88 120.51 114.20 1o68 n ALA 225 Ca 0.14 -0.72 -0.01 0.00 0.00 0.00 0.00 53.44 52.85 1o68 n ALA 225 Cb 0.50 -2.10 0.17 0.00 0.00 0.00 0.00 19.45 18.02 1o68 n ALA 225 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1o68 h LYS 226 N -2.05 1.18 -0.08 0.00 6.56 -1.92 -2.48 116.57 117.78 1o68 h LYS 226 Ca -0.47 -0.07 0.00 0.00 -1.06 0.00 0.00 60.65 59.05 1o68 h LYS 226 Cb 1.29 -0.27 0.00 0.00 -0.57 0.00 0.00 32.23 32.68 1o68 h LYS 226 CO 0.42 0.78 0.00 1.97 -2.06 0.00 0.00 179.45 180.56 1o68 n PHE 227 N -4.40 0.10 -4.11 -1.35 1.16 -1.26 -4.17 117.46 103.42 1o68 n PHE 227 Ca 0.11 -0.05 -0.35 0.00 -1.87 0.00 0.00 57.45 55.29 1o68 n PHE 227 Cb 0.03 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 37.83 1o68 n PHE 227 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1o68 s VAL 228 N -1.90 4.91 -0.03 1.97 1.01 -0.93 -4.63 120.40 120.79 1o68 s VAL 228 Ca 0.35 -0.09 0.07 0.00 0.00 0.00 0.00 61.98 62.31 1o68 s VAL 228 Cb 0.18 -3.14 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 1o68 s VAL 228 CO 0.29 0.55 -0.24 -0.75 0.00 0.00 0.00 175.10 174.95 1o68 s LYS 229 N -1.14 2.28 -0.58 2.72 2.20 -1.26 -4.62 119.74 119.34 1o68 s LYS 229 Ca 0.16 -0.89 -0.27 0.00 -0.36 0.00 0.00 55.97 54.61 1o68 s LYS 229 Cb -0.12 -2.12 0.03 0.00 -1.51 0.00 0.00 37.83 34.12 1o68 s LYS 229 CO 0.06 0.52 1.16 1.21 -0.36 0.00 0.00 175.35 177.93 1o68 s ASN 230 N -0.51 6.42 -0.45 1.43 3.84 -1.26 -4.76 114.94 119.65 1o68 s ASN 230 Ca 0.07 0.01 -0.05 0.00 0.21 0.00 0.00 52.86 53.10 1o68 s ASN 230 Cb -0.11 -2.53 -0.01 0.00 -0.55 0.00 0.00 41.25 38.04 1o68 s ASN 230 CO 0.00 -1.46 2.95 0.49 -2.79 0.00 0.00 177.10 176.29 1o68 n PHE 231 N 8.32 1.32 -1.08 0.43 3.01 -1.26 -4.95 117.46 123.26 1o68 n PHE 231 Ca 0.07 -1.93 0.00 0.00 1.01 0.00 0.00 57.45 56.60 1o68 n PHE 231 Cb 0.49 -1.49 0.00 0.00 -0.01 0.00 0.00 39.48 38.46 1o68 n PHE 231 CO 0.00 0.00 0.00 0.94 1.01 0.00 0.00 176.76 178.71 1o68 n GLN 233 N 1.38 0.00 -0.29 -1.08 7.27 -1.26 -4.42 117.38 118.98 1o68 n GLN 233 Ca 0.49 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.56 1o68 n GLN 233 Cb 0.60 -0.36 0.00 0.00 2.41 0.00 0.00 30.24 32.90 1o68 n GLN 233 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1o68 n GLY 234 N 1.17 0.70 3.32 1.69 0.00 -1.26 -5.06 105.19 105.74 1o68 n GLY 234 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1o68 n GLY 234 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1o68 s HIS 235 N -2.44 1.80 -1.53 1.61 3.76 -1.26 -5.06 115.29 112.16 1o68 s HIS 235 Ca 0.00 -0.46 0.24 0.00 -0.15 0.00 0.00 55.06 54.69 1o68 s HIS 235 Cb 0.00 -0.93 0.28 0.00 1.11 0.00 0.00 32.58 33.04 1o68 s HIS 235 CO 0.00 0.29 1.26 -3.47 -0.85 0.00 0.00 174.74 171.97 1o68 n ASP 236 N 0.54 1.21 -3.90 1.40 4.64 -1.26 -4.97 116.55 114.21 1o68 n ASP 236 Ca -0.15 -0.97 -0.09 0.00 -1.38 0.00 0.00 54.79 52.19 1o68 n ASP 236 Cb 0.56 0.44 -0.06 0.00 -1.04 0.00 0.00 41.12 41.01 1o68 n ASP 236 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 1o68 s SER 237 N -2.70 -0.01 0.26 1.67 1.04 -1.26 -5.02 113.70 107.69 1o68 s SER 237 Ca 0.17 -0.76 -0.02 0.00 0.48 0.00 0.00 55.95 55.81 1o68 s SER 237 Cb 0.18 0.45 0.33 0.00 0.10 0.00 0.00 66.02 67.08 1o68 s SER 237 CO 0.64 -0.90 1.76 0.58 0.98 0.00 0.00 173.24 176.31 1o68 h VAL 238 N 2.51 1.24 -0.46 5.02 2.07 -1.99 -2.23 116.25 122.40 1o68 h VAL 238 Ca -0.32 -1.00 0.03 0.00 0.82 0.00 0.00 66.70 66.23 1o68 h VAL 238 Cb 1.23 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 31.84 1o68 h VAL 238 CO 0.47 0.35 0.26 1.56 0.02 0.00 0.00 177.57 180.24 1o68 h GLN 239 N 0.74 0.50 -0.26 1.57 7.50 -1.95 -1.55 115.11 121.67 1o68 h GLN 239 Ca 0.14 -0.03 -0.14 0.00 0.50 0.00 0.00 58.65 59.13 1o68 h GLN 239 Cb 0.45 -0.11 -0.01 0.00 0.05 0.00 0.00 27.48 27.85 1o68 h GLN 239 CO 0.02 0.33 -0.41 0.00 -1.50 0.00 0.00 178.83 177.27 1o68 h ALA 240 N 1.22 0.80 -0.39 3.87 0.00 -1.92 -1.79 119.26 121.05 1o68 h ALA 240 Ca 0.19 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1o68 h ALA 240 Cb 0.05 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1o68 h ALA 240 CO -0.10 0.65 0.26 0.00 0.00 0.00 0.00 179.25 180.06 1o68 h ALA 241 N 1.04 0.50 -0.40 0.00 0.00 -1.10 -0.91 119.26 118.39 1o68 h ALA 241 Ca 0.04 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1o68 h ALA 241 Cb 0.93 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1o68 h ALA 241 CO 0.08 -0.04 -0.04 0.28 0.00 0.00 0.00 179.25 179.53 1o68 h VAL 242 N 0.53 1.27 -0.74 0.00 2.07 -1.13 -1.85 116.25 116.39 1o68 h VAL 242 Ca 0.14 -1.08 0.01 0.00 0.82 0.00 0.00 66.70 66.59 1o68 h VAL 242 Cb -0.05 1.16 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1o68 h VAL 242 CO -0.03 0.37 0.49 0.03 0.02 0.00 0.00 177.57 178.45 1o68 h ARG 243 N 0.56 0.97 -0.43 1.57 3.08 -1.13 -1.17 114.38 117.83 1o68 h ARG 243 Ca 0.11 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 59.99 1o68 h ARG 243 Cb 0.54 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 1o68 h ARG 243 CO 0.03 0.64 -0.16 0.00 -1.07 0.00 0.00 179.97 179.41 1o68 h ALA 244 N 1.54 0.91 0.01 0.04 0.00 -1.00 -0.09 119.26 120.67 1o68 h ALA 244 Ca 0.27 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1o68 h ALA 244 Cb -0.10 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.52 1o68 h ALA 244 CO -0.06 0.62 -0.00 -0.92 0.00 0.00 0.00 179.25 178.89 1o68 h TYR 245 N 0.72 -0.01 -0.72 0.00 3.20 -0.44 -1.10 116.97 118.61 1o68 h TYR 245 Ca 0.11 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.03 1o68 h TYR 245 Cb 0.67 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 38.89 1o68 h TYR 245 CO 0.04 0.14 0.43 0.28 -1.64 0.00 0.00 178.16 177.40 1o68 h VAL 246 N -0.16 1.04 -0.44 1.81 2.07 -1.09 -1.60 116.25 117.88 1o68 h VAL 246 Ca -0.00 -0.28 -0.07 0.00 0.82 0.00 0.00 66.70 67.17 1o68 h VAL 246 Cb 0.15 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.05 1o68 h VAL 246 CO 0.00 0.15 -0.02 0.00 0.02 0.00 0.00 177.57 177.72 1o68 h ALA 247 N 1.34 1.14 -0.12 1.67 0.00 -0.81 -2.22 119.26 120.26 1o68 h ALA 247 Ca 0.31 -0.26 -0.18 0.00 0.00 0.00 0.00 54.91 54.78 1o68 h ALA 247 Cb 0.11 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.73 1o68 h ALA 247 CO -0.15 0.55 -0.61 0.93 0.00 0.00 0.00 179.25 179.97 1o68 h GLU 248 N 0.68 0.63 -0.61 0.00 5.08 -0.76 -0.13 114.58 119.47 1o68 h GLU 248 Ca 0.13 -0.52 0.05 0.00 -1.00 0.00 0.00 59.36 58.02 1o68 h GLU 248 Cb 0.45 0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.76 1o68 h GLU 248 CO 0.02 1.13 0.34 0.28 -1.00 0.00 0.00 179.01 179.79 1o68 h VAL 249 N 0.28 1.00 0.00 3.13 2.07 -1.20 0.14 116.25 121.66 1o68 h VAL 249 Ca -0.04 -0.22 -0.09 0.00 0.82 0.00 0.00 66.70 67.16 1o68 h VAL 249 Cb 1.25 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 1o68 h VAL 249 CO 0.13 0.12 -0.42 0.11 0.02 0.00 0.00 177.57 177.52 1o68 h LYS 250 N 0.65 0.00 0.00 1.57 1.57 -1.36 -2.66 116.57 116.35 1o68 h LYS 250 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 1o68 h LYS 250 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1o68 h LYS 250 CO -0.15 0.42 -0.31 0.00 -0.57 0.00 0.00 179.45 178.84 1o68 n ALA 251 N -2.32 2.99 -1.74 3.86 0.00 -0.07 -4.75 120.51 118.48 1o68 n ALA 251 Ca -0.00 -0.24 -0.08 0.00 0.00 0.00 0.00 53.44 53.12 1o68 n ALA 251 Cb 0.53 -1.27 -0.02 0.00 0.00 0.00 0.00 19.45 18.69 1o68 n ALA 251 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1o68 n LYS 252 N -1.59 -0.64 0.06 0.00 4.01 0.30 -4.90 118.16 115.42 1o68 n LYS 252 Ca 0.06 0.59 0.11 0.00 -0.51 0.00 0.00 58.31 58.56 1o68 n LYS 252 Cb 0.35 -4.51 0.02 0.00 -0.51 0.00 0.00 35.03 30.38 1o68 n LYS 252 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 1o68 n THR 253 N -3.42 0.39 -4.89 -0.18 -2.24 -0.20 -4.79 114.28 98.95 1o68 n THR 253 Ca -0.09 -0.41 -0.27 0.00 -2.27 0.00 0.00 64.05 61.00 1o68 n THR 253 Cb 0.44 -0.12 -0.16 0.00 -2.10 0.00 0.00 70.33 68.38 1o68 n THR 253 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1o68 s PHE 254 N -3.30 1.85 0.59 4.78 5.36 -1.06 -3.47 117.98 122.73 1o68 s PHE 254 Ca 0.01 -0.59 -0.14 0.00 -0.96 0.00 0.00 56.93 55.25 1o68 s PHE 254 Cb 0.12 -1.26 -0.04 0.00 -0.34 0.00 0.00 43.02 41.50 1o68 s PHE 254 CO 0.79 -0.22 1.03 -1.25 -1.46 0.00 0.00 175.22 174.11 1o68 s PRO 255 N 0.15 3.52 0.57 10.12 0.04 -1.26 -4.21 135.00 143.92 1o68 s PRO 255 Ca -0.07 0.99 0.08 0.00 0.04 0.00 0.00 61.00 62.04 1o68 s PRO 255 Cb -0.13 -2.07 0.08 0.00 0.04 0.00 0.00 34.50 32.42 1o68 s PRO 255 CO 0.03 -0.64 0.79 0.00 0.04 0.00 0.00 177.00 177.23 1o68 s ALA 256 N -2.75 4.52 0.31 8.56 0.00 -1.23 -4.64 121.76 126.54 1o68 s ALA 256 Ca 0.59 -2.00 0.08 0.00 0.00 0.00 0.00 51.96 50.64 1o68 s ALA 256 Cb -0.13 -1.58 0.85 0.00 0.00 0.00 0.00 23.12 22.27 1o68 s ALA 256 CO 0.41 -0.86 1.73 0.00 0.00 0.00 0.00 175.76 177.04 1o68 h ALA 257 N 0.14 1.74 0.00 0.00 0.00 -1.96 0.27 119.26 119.45 1o68 h ALA 257 Ca -0.33 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1o68 h ALA 257 Cb 1.28 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1o68 h ALA 257 CO 0.42 -0.26 0.00 1.05 0.00 0.00 0.00 179.25 180.46 1o68 h GLU 258 N 0.58 0.00 -0.64 0.00 4.11 -1.94 -2.80 114.58 113.88 1o68 h GLU 258 Ca 0.63 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.06 1o68 h GLU 258 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1o68 h GLU 258 CO -0.47 0.00 0.00 0.72 0.07 0.00 0.00 179.01 179.33 1o68 n HIS 259 N -3.01 1.17 -4.39 2.06 8.25 0.96 -4.73 115.22 115.53 1o68 n HIS 259 Ca -0.01 -0.57 -0.25 0.00 -0.26 0.00 0.00 57.72 56.64 1o68 n HIS 259 Cb 0.20 -0.13 -0.09 0.00 1.12 0.00 0.00 29.99 31.08 1o68 n HIS 259 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1o68 s ILE 260 N -1.46 2.83 -2.59 1.59 1.01 -1.06 -4.25 121.20 117.27 1o68 s ILE 260 Ca 0.48 -2.10 0.21 0.00 0.00 0.00 0.00 60.65 59.24 1o68 s ILE 260 Cb 0.28 -2.46 0.16 0.00 0.01 0.00 0.00 42.46 40.46 1o68 s ILE 260 CO 0.27 -0.30 1.16 0.49 0.00 0.00 0.00 174.94 176.55