#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o68 s LEU 1 N 0.00 4.20 -0.27 2.46 1.43 -1.26 -4.85 118.68 120.39 1o68 s LEU 1 Ca 0.00 2.78 -0.20 0.00 -1.03 0.00 0.00 54.13 55.68 1o68 s LEU 1 Cb 0.00 -3.88 -0.02 0.00 0.03 0.00 0.00 46.19 42.33 1o68 s LEU 1 CO 0.00 -0.94 0.60 -0.63 0.23 0.00 0.00 176.35 175.61 1o68 s ILE 2 N -1.22 4.99 0.51 -0.59 -1.09 -0.18 -4.95 121.20 118.66 1o68 s ILE 2 Ca 0.57 0.98 0.01 0.00 -2.23 0.00 0.00 60.65 59.99 1o68 s ILE 2 Cb -0.41 -3.93 -0.01 0.00 -1.58 0.00 0.00 42.46 36.53 1o68 s ILE 2 CO 0.53 -0.02 0.03 0.42 -1.23 0.00 0.00 174.94 174.67 1o68 s THR 3 N 2.49 0.93 0.30 2.92 -4.23 -1.26 -4.93 115.64 111.86 1o68 s THR 3 Ca 0.25 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.77 1o68 s THR 3 Cb -0.15 -2.09 0.16 0.00 1.34 0.00 0.00 72.50 71.76 1o68 s THR 3 CO 0.10 0.00 1.85 0.58 -0.54 0.00 0.00 174.62 176.60 1o68 h VAL 4 N 1.38 1.21 -0.76 2.29 2.07 -1.97 -2.22 116.25 118.25 1o68 h VAL 4 Ca -0.42 -0.79 -0.06 0.00 0.82 0.00 0.00 66.70 66.25 1o68 h VAL 4 Cb 1.32 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 31.82 1o68 h VAL 4 CO 0.69 0.29 0.26 -1.13 0.02 0.00 0.00 177.57 177.70 1o68 h ASN 5 N 0.69 1.09 -0.33 0.57 -0.00 -1.99 -1.37 115.58 114.24 1o68 h ASN 5 Ca 0.15 -0.19 0.04 0.00 -0.00 0.00 0.00 56.30 56.30 1o68 h ASN 5 Cb 0.30 -0.28 -0.04 0.00 -0.00 0.00 0.00 38.32 38.30 1o68 h ASN 5 CO 0.00 0.99 0.10 0.74 -0.00 0.00 0.00 177.43 179.27 1o68 h THR 6 N 1.12 0.89 -0.86 -3.57 2.02 -1.78 -0.19 112.91 110.54 1o68 h THR 6 Ca 0.25 -0.08 -0.01 0.00 0.77 0.00 0.00 66.41 67.33 1o68 h THR 6 Cb 0.28 0.63 -0.04 0.00 -1.74 0.00 0.00 68.15 67.28 1o68 h THR 6 CO -0.01 0.04 0.48 -0.07 0.37 0.00 0.00 175.52 176.33 1o68 h LEU 7 N 0.24 1.06 -0.76 2.58 3.38 -1.00 -2.32 115.31 118.49 1o68 h LEU 7 Ca 0.15 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1o68 h LEU 7 Cb 0.13 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1o68 h LEU 7 CO -0.16 0.85 0.02 1.56 0.09 0.00 0.00 178.44 180.79 1o68 h GLN 8 N 1.19 0.97 -1.52 1.13 4.20 -0.86 -0.47 115.11 119.74 1o68 h GLN 8 Ca 0.30 -0.28 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1o68 h GLN 8 Cb 0.01 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.69 1o68 h GLN 8 CO -0.05 0.94 0.00 1.63 -0.67 0.00 0.00 178.83 180.68 1o68 n LYS 9 N -4.20 0.36 0.00 1.46 5.02 -0.12 -1.89 118.16 118.79 1o68 n LYS 9 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 1o68 n LYS 9 Cb 0.32 -1.31 0.00 0.00 -0.02 0.00 0.00 35.03 34.02 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 0.77 0.00 0.03 1.97 4.81 -0.19 -1.16 118.16 124.40 1o68 n LYS 11 Ca 0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.41 1o68 n LYS 11 Cb 0.17 0.00 0.20 0.00 0.02 0.00 0.00 35.03 35.42 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 1.09 0.00 3.14 0.00 -1.64 -2.90 119.26 118.95 1o68 h ALA 12 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1o68 h ALA 12 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1o68 h ALA 12 CO 0.00 0.56 -0.22 0.00 0.00 0.00 0.00 179.25 179.60 1o68 h ALA 13 N 1.31 0.87 0.00 0.00 0.00 -1.41 -3.47 119.26 116.56 1o68 h ALA 13 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1o68 h ALA 13 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1o68 h ALA 13 CO 0.05 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.71 1o68 n GLY 14 N 1.26 0.59 3.68 0.00 0.00 -1.10 -5.02 105.19 104.60 1o68 n GLY 14 Ca 0.04 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.61 4.36 0.22 1.61 2.12 -1.26 -5.01 118.70 120.12 1o68 s GLU 15 Ca 0.00 1.21 -0.30 0.00 0.36 0.00 0.00 54.97 56.24 1o68 s GLU 15 Cb 0.00 -3.56 -0.09 0.00 0.26 0.00 0.00 34.13 30.75 1o68 s GLU 15 CO 0.00 -0.33 1.17 0.15 -0.54 0.00 0.00 175.26 175.71 1o68 s LYS 16 N 2.11 4.53 -0.08 4.30 -0.14 -1.26 -4.48 119.74 124.73 1o68 s LYS 16 Ca 0.43 1.87 -0.22 0.00 -1.36 0.00 0.00 55.97 56.68 1o68 s LYS 16 Cb -0.17 -3.22 -0.04 0.00 -1.68 0.00 0.00 37.83 32.72 1o68 s LYS 16 CO 0.15 -0.00 0.66 0.42 -0.76 0.00 0.00 175.35 175.81 1o68 s ILE 17 N -0.42 5.07 0.32 2.17 1.01 -0.22 -4.69 121.20 124.43 1o68 s ILE 17 Ca 0.50 1.35 0.06 0.00 0.00 0.00 0.00 60.65 62.57 1o68 s ILE 17 Cb -0.33 -4.00 -0.01 0.00 0.01 0.00 0.00 42.46 38.13 1o68 s ILE 17 CO 0.39 0.26 0.44 0.00 0.00 0.00 0.00 174.94 176.03 1o68 s ALA 18 N 0.78 4.15 0.00 9.38 0.00 -1.26 -1.17 121.76 133.64 1o68 s ALA 18 Ca 0.35 -1.44 0.00 0.00 0.00 0.00 0.00 51.96 50.88 1o68 s ALA 18 Cb -0.17 -1.65 0.00 0.00 0.00 0.00 0.00 23.12 21.30 1o68 s ALA 18 CO 0.17 0.02 0.00 1.28 0.00 0.00 0.00 175.76 177.23 1o68 n LEU 20 N -1.58 0.00 -4.84 0.00 4.77 -1.26 -1.50 117.00 112.59 1o68 n LEU 20 Ca -0.02 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.64 1o68 n LEU 20 Cb 0.58 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.65 1o68 n LEU 20 CO 0.42 0.00 0.69 0.42 -1.33 0.00 0.00 177.39 177.60 1o68 s THR 21 N -1.98 4.46 -0.21 -5.08 -4.23 -0.95 -1.35 115.64 106.30 1o68 s THR 21 Ca 0.00 1.09 -0.12 0.00 -1.18 0.00 0.00 61.69 61.48 1o68 s THR 21 Cb 0.00 -3.70 0.07 0.00 1.34 0.00 0.00 72.50 70.21 1o68 s THR 21 CO 0.00 -0.76 0.51 0.00 -0.54 0.00 0.00 174.62 173.83 1o68 s ALA 22 N -2.73 -1.35 0.00 3.99 0.00 -0.59 -4.77 121.76 116.31 1o68 s ALA 22 Ca 0.59 1.84 0.00 0.00 0.00 0.00 0.00 51.96 54.39 1o68 s ALA 22 Cb -0.11 -1.10 0.00 0.00 0.00 0.00 0.00 23.12 21.91 1o68 s ALA 22 CO 0.37 -0.30 0.22 0.66 0.00 0.00 0.00 175.76 176.71 1o68 n TYR 23 N 4.21 0.00 -4.21 0.00 4.02 -1.26 -4.00 117.16 115.92 1o68 n TYR 23 Ca -0.22 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.55 1o68 n TYR 23 Cb 0.57 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.78 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 -0.35 0.93 0.06 -0.72 2.02 -1.26 -4.65 118.70 114.74 1o68 s GLU 24 Ca 0.00 -1.36 -0.18 0.00 0.02 0.00 0.00 54.97 53.45 1o68 s GLU 24 Cb 0.00 -0.44 -0.12 0.00 0.10 0.00 0.00 34.13 33.67 1o68 s GLU 24 CO 0.00 0.04 1.38 0.66 0.02 0.00 0.00 175.26 177.36 1o68 h SER 25 N 2.98 0.50 -0.62 -0.19 4.64 -1.88 -0.53 113.55 118.45 1o68 h SER 25 Ca -0.36 -0.47 -0.06 0.00 -0.47 0.00 0.00 61.79 60.43 1o68 h SER 25 Cb 1.18 -0.14 -0.03 0.00 -0.31 0.00 0.00 62.40 63.10 1o68 h SER 25 CO 0.62 0.87 0.17 0.77 -0.87 0.00 0.00 176.83 178.38 1o68 h SER 26 N 0.14 0.93 0.63 4.97 4.64 -1.95 -1.38 113.55 121.53 1o68 h SER 26 Ca 0.03 -0.22 -0.15 0.00 -0.47 0.00 0.00 61.79 60.97 1o68 h SER 26 Cb 0.72 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.55 1o68 h SER 26 CO 0.05 0.91 -0.71 -0.26 -0.87 0.00 0.00 176.83 175.95 1o68 h PHE 27 N 0.90 0.09 -0.20 4.77 -1.00 -1.98 -1.94 116.94 117.59 1o68 h PHE 27 Ca 0.20 -0.04 -0.01 0.00 2.81 0.00 0.00 57.97 60.92 1o68 h PHE 27 Cb 0.33 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 39.87 1o68 h PHE 27 CO 0.02 0.75 0.08 0.00 -1.61 0.00 0.00 178.31 177.56 1o68 h ALA 28 N 1.23 0.26 -0.69 2.45 0.00 -0.62 -2.88 119.26 119.01 1o68 h ALA 28 Ca -0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1o68 h ALA 28 Cb 1.26 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 1o68 h ALA 28 CO 0.10 -0.15 0.35 0.00 0.00 0.00 0.00 179.25 179.56 1o68 h ALA 29 N 0.93 1.32 0.00 0.00 0.00 -1.19 -0.64 119.26 119.67 1o68 h ALA 29 Ca 0.07 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1o68 h ALA 29 Cb 0.17 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1o68 h ALA 29 CO -0.01 0.54 0.00 -0.11 0.00 0.00 0.00 179.25 179.68 1o68 n LEU 30 N -4.35 0.20 0.00 0.00 0.00 -0.74 -1.62 117.00 110.49 1o68 n LEU 30 Ca 0.07 -0.10 0.00 0.00 0.00 0.00 0.00 56.01 55.98 1o68 n LEU 30 Cb 0.12 -0.10 0.00 0.00 0.00 0.00 0.00 43.42 43.44 1o68 n LEU 30 CO 0.38 0.05 0.00 -0.67 0.00 0.00 0.00 177.39 177.15 1o68 n ASP 32 N 0.41 0.00 0.22 1.96 2.03 -0.25 -1.13 116.55 119.80 1o68 n ASP 32 Ca 0.00 0.00 0.06 0.00 0.52 0.00 0.00 54.79 55.37 1o68 n ASP 32 Cb 0.05 0.00 0.51 0.00 -0.72 0.00 0.00 41.12 40.96 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 -0.07 1.67 1.82 -1.56 -1.63 116.42 116.65 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 0.21 0.00 0.00 -1.61 0.00 0.00 179.24 177.84 1o68 n ALA 34 N -2.46 2.58 -0.17 -0.78 0.00 -0.28 -4.90 120.51 114.49 1o68 n ALA 34 Ca -0.02 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1o68 n ALA 34 Cb 0.28 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.51 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 0.97 0.91 3.72 0.00 0.00 -0.61 -4.47 105.19 105.70 1o68 n GLY 35 Ca 0.16 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.00 3.47 -1.01 1.61 1.01 -1.25 -4.87 120.40 117.35 1o68 s VAL 36 Ca 0.00 1.07 0.07 0.00 0.00 0.00 0.00 61.98 63.13 1o68 s VAL 36 Cb 0.00 -3.69 0.36 0.00 0.00 0.00 0.00 36.38 33.05 1o68 s VAL 36 CO 0.00 0.09 1.12 -0.62 0.00 0.00 0.00 175.10 175.69 1o68 n GLU 37 N 3.79 2.53 -3.15 2.72 1.02 -0.56 -4.53 120.64 122.46 1o68 n GLU 37 Ca 0.10 -1.39 0.05 0.00 -0.02 0.00 0.00 57.16 55.90 1o68 n GLU 37 Cb 0.43 -1.70 -0.01 0.00 -0.02 0.00 0.00 31.44 30.14 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 -1.19 -0.74 -0.45 -4.62 1.43 -1.26 -4.53 118.68 107.31 1o68 s LEU 39 Ca 0.24 0.47 -0.21 0.00 -1.03 0.00 0.00 54.13 53.60 1o68 s LEU 39 Cb 0.17 1.62 0.03 0.00 0.03 0.00 0.00 46.19 48.04 1o68 s LEU 39 CO 0.09 -0.14 0.68 -0.22 0.23 0.00 0.00 176.35 176.99 1o68 s LEU 40 N 2.92 4.48 -1.14 1.79 2.96 -0.46 -0.28 118.68 128.95 1o68 s LEU 40 Ca 0.06 -0.35 -0.20 0.00 -0.22 0.00 0.00 54.13 53.43 1o68 s LEU 40 Cb -0.12 -2.75 0.08 0.00 0.50 0.00 0.00 46.19 43.90 1o68 s LEU 40 CO -0.14 -0.83 1.53 -0.69 -1.32 0.00 0.00 176.35 174.90 1o68 s VAL 41 N 2.93 4.20 0.44 1.68 1.01 0.17 -1.55 120.40 129.28 1o68 s VAL 41 Ca 0.24 -1.50 -0.06 0.00 0.00 0.00 0.00 61.98 60.66 1o68 s VAL 41 Cb -0.14 -5.07 -0.04 0.00 0.00 0.00 0.00 36.38 31.12 1o68 s VAL 41 CO 0.19 -1.90 0.75 -0.83 0.00 0.00 0.00 175.10 173.31 1o68 s GLY 42 N 4.32 1.61 0.00 4.51 0.00 -1.26 -1.54 107.32 114.96 1o68 s GLY 42 Ca 0.47 -0.48 0.18 0.00 0.00 0.00 0.00 44.72 44.90 1o68 s GLY 42 CO -0.02 -0.32 1.53 2.09 0.00 0.00 0.00 173.10 176.38 1o68 n ASP 43 N -1.91 0.00 0.32 1.64 5.75 -1.26 -1.85 116.55 119.24 1o68 n ASP 43 Ca 0.00 -0.01 0.18 0.00 -0.01 0.00 0.00 54.79 54.95 1o68 n ASP 43 Cb 0.55 -0.26 0.96 0.00 -1.03 0.00 0.00 41.12 41.34 1o68 n ASP 43 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 1o68 h SER 44 N 0.00 0.00 -0.01 -1.12 4.64 -1.93 0.35 113.55 115.48 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 0.15 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1o68 h SER 44 CO 0.00 0.00 0.01 0.17 -0.87 0.00 0.00 176.83 176.14 1o68 h LEU 45 N 0.00 0.00 -0.07 5.97 8.10 -1.77 -1.83 115.31 125.71 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 0.33 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.55 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 -1.24 0.00 0.00 0.17 0.00 0.12 -0.57 105.19 103.68 1o68 n GLY 46 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.41 0.00 -0.09 4.61 0.00 -0.69 -0.90 120.51 123.04 1o68 n ALA 48 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 1o68 n ALA 48 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 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 0.98 0.14 0.00 0.31 0.27 -4.68 118.33 115.35 1o68 n VAL 49 Ca 0.00 -0.29 0.05 0.00 -0.01 0.00 0.00 64.34 64.09 1o68 n VAL 49 Cb 0.00 -1.54 0.04 0.00 -0.91 0.00 0.00 33.84 31.43 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 -0.45 0.00 -0.16 5.55 4.20 -1.21 -3.48 115.11 119.56 1o68 h GLN 50 Ca -0.43 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.24 1o68 h GLN 50 Cb 1.46 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.22 1o68 h GLN 50 CO -0.21 0.32 -0.04 0.41 -0.67 0.00 0.00 178.83 178.64 1o68 n GLY 51 N 1.22 0.45 3.95 3.46 0.00 -1.06 -5.03 105.19 108.17 1o68 n GLY 51 Ca 0.01 -0.93 -0.25 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.84 2.13 0.26 1.61 0.52 -0.07 -5.01 118.95 115.56 1o68 s ARG 52 Ca 0.00 -0.47 0.25 0.00 -0.52 0.00 0.00 55.73 54.99 1o68 s ARG 52 Cb 0.00 -2.24 0.66 0.00 0.52 0.00 0.00 34.95 33.89 1o68 s ARG 52 CO 0.00 -1.21 1.70 0.87 0.02 0.00 0.00 175.30 176.68 1o68 h LYS 53 N -0.50 0.00 0.00 3.54 1.79 -1.96 -3.46 116.57 115.97 1o68 h LYS 53 Ca -0.43 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 57.82 1o68 h LYS 53 Cb 1.30 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.90 1o68 h LYS 53 CO 0.55 0.00 -0.07 -1.13 -1.08 0.00 0.00 179.45 177.72 1o68 n SER 54 N -2.47 -1.34 -0.77 0.86 3.41 -1.26 -5.04 113.62 107.01 1o68 n SER 54 Ca 0.05 -2.65 0.13 0.00 -0.26 0.00 0.00 58.87 56.13 1o68 n SER 54 Cb 0.46 2.45 0.29 0.00 -0.26 0.00 0.00 64.21 67.14 1o68 n SER 54 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1o68 n THR 55 N -0.51 0.07 -0.24 6.66 -2.24 -1.26 -4.55 114.28 112.21 1o68 n THR 55 Ca -0.01 -0.42 -0.07 0.00 -2.27 0.00 0.00 64.05 61.28 1o68 n THR 55 Cb 0.52 0.98 0.04 0.00 -2.10 0.00 0.00 70.33 69.78 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 3.61 0.90 -0.46 3.22 4.07 -1.91 -2.74 115.31 122.01 1o68 h LEU 56 Ca 0.00 -0.16 0.00 0.00 0.08 0.00 0.00 57.88 57.80 1o68 h LEU 56 Cb 0.77 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 42.28 1o68 h LEU 56 CO 0.00 0.81 0.00 -2.65 -1.08 0.00 0.00 178.44 175.52 1o68 n PRO 57 N -4.42 0.10 -1.85 1.13 -0.02 -1.26 -4.60 135.00 124.07 1o68 n PRO 57 Ca 0.05 0.40 -0.41 0.00 -2.02 0.00 0.00 63.50 61.51 1o68 n PRO 57 Cb 0.16 -1.71 -0.02 0.00 -0.02 0.00 0.00 33.50 31.92 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 -3.19 2.24 0.37 -1.45 1.01 -1.03 -5.01 120.40 113.34 1o68 s VAL 58 Ca 0.04 0.20 0.07 0.00 0.00 0.00 0.00 61.98 62.29 1o68 s VAL 58 Cb 0.08 -3.13 -0.01 0.00 0.00 0.00 0.00 36.38 33.32 1o68 s VAL 58 CO 0.28 0.03 0.43 -0.94 0.00 0.00 0.00 175.10 174.90 1o68 s SER 59 N 0.42 5.52 0.25 3.32 1.04 -1.26 -4.36 113.70 118.63 1o68 s SER 59 Ca 0.62 -0.45 -0.04 0.00 0.48 0.00 0.00 55.95 56.55 1o68 s SER 59 Cb -0.46 -0.87 0.29 0.00 0.10 0.00 0.00 66.02 65.07 1o68 s SER 59 CO 0.47 -0.55 1.81 0.25 0.98 0.00 0.00 173.24 176.21 1o68 h LEU 60 N 0.95 0.95 -0.82 2.42 5.85 -1.92 -1.88 115.31 120.85 1o68 h LEU 60 Ca -0.43 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.14 1o68 h LEU 60 Cb 1.26 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 42.01 1o68 h LEU 60 CO 0.53 0.86 0.52 -0.09 -0.34 0.00 0.00 178.44 179.92 1o68 h ARG 61 N 1.00 1.09 -0.57 1.25 2.43 -2.02 0.16 114.38 117.73 1o68 h ARG 61 Ca 0.23 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1o68 h ARG 61 Cb 0.23 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1o68 h ARG 61 CO -0.02 0.75 0.00 -0.25 -1.51 0.00 0.00 179.97 178.94 1o68 n ASP 62 N -4.49 0.14 0.00 -3.80 8.00 -0.71 -1.09 116.55 114.61 1o68 n ASP 62 Ca 0.08 -0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.40 1o68 n ASP 62 Cb 0.03 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.09 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 -0.31 -0.70 0.00 3.20 -1.36 -1.46 116.97 116.34 1o68 h TYR 65 Ca 0.00 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.80 1o68 h TYR 65 Cb 0.00 0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.34 1o68 h TYR 65 CO 0.00 -0.19 0.19 0.45 -1.64 0.00 0.00 178.16 176.97 1o68 h HIS 66 N -0.33 1.15 -0.27 -3.82 3.86 -1.63 -1.38 115.15 112.73 1o68 h HIS 66 Ca -0.03 -0.12 0.05 0.00 -1.16 0.00 0.00 60.37 59.11 1o68 h HIS 66 Cb 0.26 -0.33 -0.05 0.00 1.06 0.00 0.00 27.41 28.35 1o68 h HIS 66 CO -0.06 0.93 -0.05 1.15 0.86 0.00 0.00 177.93 180.75 1o68 h THR 67 N 1.06 0.74 -0.90 2.45 2.02 -1.78 0.23 112.91 116.73 1o68 h THR 67 Ca 0.22 -0.01 0.01 0.00 0.77 0.00 0.00 66.41 67.41 1o68 h THR 67 Cb 0.34 0.73 -0.04 0.00 -1.74 0.00 0.00 68.15 67.43 1o68 h THR 67 CO -0.00 0.00 0.59 -0.33 0.37 0.00 0.00 175.52 176.15 1o68 h GLU 68 N 0.02 1.19 0.06 6.66 5.08 -0.89 0.53 114.58 127.22 1o68 h GLU 68 Ca 0.13 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1o68 h GLU 68 Cb 0.19 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1o68 h GLU 68 CO -0.27 0.79 -0.03 0.00 -1.00 0.00 0.00 179.01 178.51 1o68 h VAL 70 N -0.14 1.22 -0.05 0.00 2.07 -0.69 -2.57 116.25 116.09 1o68 h VAL 70 Ca -0.01 -0.83 -0.01 0.00 0.82 0.00 0.00 66.70 66.67 1o68 h VAL 70 Cb 0.12 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 30.62 1o68 h VAL 70 CO 0.01 0.30 -0.03 0.00 0.02 0.00 0.00 177.57 177.88 1o68 h ALA 71 N 1.36 1.87 0.00 1.67 0.00 -0.79 -0.66 119.26 122.70 1o68 h ALA 71 Ca 0.16 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1o68 h ALA 71 Cb 0.32 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1o68 h ALA 71 CO 0.00 0.10 0.00 0.54 0.00 0.00 0.00 179.25 179.90 1o68 n ARG 72 N -4.46 0.48 -0.01 0.00 1.74 -0.97 -3.75 116.66 109.70 1o68 n ARG 72 Ca -0.02 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 1o68 n ARG 72 Cb 0.14 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.05 1o68 n ARG 72 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1o68 n GLY 73 N 1.15 -0.18 3.76 -0.13 0.00 -0.39 -5.04 105.19 104.37 1o68 n GLY 73 Ca 0.15 -0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.19 2.31 0.00 4.61 0.00 -0.41 -3.35 121.76 122.74 1o68 s ALA 74 Ca -0.02 0.53 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1o68 s ALA 74 Cb 0.02 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.80 1o68 s ALA 74 CO 0.16 -1.56 0.00 1.17 0.00 0.00 0.00 175.76 175.53 1o68 n LYS 75 N -2.82 0.00 -0.08 0.00 4.81 -1.26 -4.97 118.16 113.84 1o68 n LYS 75 Ca 0.11 0.00 -0.08 0.00 -0.87 0.00 0.00 58.31 57.46 1o68 n LYS 75 Cb 0.52 0.00 -0.16 0.00 0.02 0.00 0.00 35.03 35.41 1o68 n LYS 75 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1o68 n ASN 76 N -2.02 0.17 -1.60 3.14 3.02 -1.26 -4.96 115.26 111.74 1o68 n ASN 76 Ca 0.00 0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 1o68 n ASN 76 Cb 0.00 0.85 0.00 0.00 -0.61 0.00 0.00 39.78 40.02 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 -2.68 0.00 -3.66 5.41 0.00 -1.26 -1.01 120.51 117.30 1o68 n ALA 77 Ca -0.28 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.07 1o68 n ALA 77 Cb 1.10 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.46 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 -0.54 -0.16 0.00 1.01 -1.26 -4.82 121.20 115.43 1o68 s ILE 79 Ca 0.00 0.15 -0.02 0.00 0.00 0.00 0.00 60.65 60.78 1o68 s ILE 79 Cb 0.00 -0.66 -0.02 0.00 0.01 0.00 0.00 42.46 41.79 1o68 s ILE 79 CO 0.00 0.06 -0.08 -0.69 0.00 0.00 0.00 174.94 174.24 1o68 s VAL 80 N 2.40 3.37 -0.09 2.92 1.01 0.61 -1.21 120.40 129.41 1o68 s VAL 80 Ca -0.03 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.45 1o68 s VAL 80 Cb -0.11 -2.47 -0.02 0.00 0.00 0.00 0.00 36.38 33.78 1o68 s VAL 80 CO -0.13 0.49 -0.18 -0.44 0.00 0.00 0.00 175.10 174.84 1o68 s SER 81 N 0.69 3.67 0.21 3.32 0.01 -1.26 0.43 113.70 120.77 1o68 s SER 81 Ca -0.04 -0.36 -0.30 0.00 1.31 0.00 0.00 55.95 56.56 1o68 s SER 81 Cb -0.15 -1.18 -0.08 0.00 0.21 0.00 0.00 66.02 64.82 1o68 s SER 81 CO 0.02 0.23 1.05 -1.81 0.41 0.00 0.00 173.24 173.14 1o68 s ASP 82 N -0.07 7.38 -0.29 2.44 1.01 -0.59 -0.56 116.67 126.00 1o68 s ASP 82 Ca -0.04 2.07 -0.29 0.00 0.71 0.00 0.00 52.55 55.00 1o68 s ASP 82 Cb -0.14 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.19 1o68 s ASP 82 CO 0.04 -0.09 1.05 -0.76 0.21 0.00 0.00 175.17 175.62 1o68 s LEU 83 N -0.80 4.00 0.60 1.23 1.43 -0.45 -4.83 118.68 119.85 1o68 s LEU 83 Ca 0.46 1.14 -0.16 0.00 -1.03 0.00 0.00 54.13 54.54 1o68 s LEU 83 Cb -0.29 -3.51 -0.04 0.00 0.03 0.00 0.00 46.19 42.38 1o68 s LEU 83 CO 0.35 -0.79 1.06 -2.16 0.23 0.00 0.00 176.35 175.04 1o68 s PRO 84 N 3.46 3.31 0.11 1.29 0.04 -1.26 -4.86 135.00 137.10 1o68 s PRO 84 Ca 0.44 1.20 -0.36 0.00 0.04 0.00 0.00 61.00 62.32 1o68 s PRO 84 Cb -0.13 -2.03 -0.16 0.00 0.04 0.00 0.00 34.50 32.22 1o68 s PRO 84 CO 0.12 -0.82 1.38 0.34 0.04 0.00 0.00 177.00 178.06 1o68 n PHE 85 N -2.05 1.68 0.00 0.56 7.35 -1.26 -1.64 117.46 122.09 1o68 n PHE 85 Ca 0.09 0.55 0.00 0.00 -0.76 0.00 0.00 57.45 57.33 1o68 n PHE 85 Cb 0.53 -2.38 0.00 0.00 0.35 0.00 0.00 39.48 37.98 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 2.67 3.02 0.37 7.13 0.00 -1.26 -4.88 105.19 112.23 1o68 n GLY 86 Ca 0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.32 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 -0.86 3.00 -0.21 4.61 0.00 -0.65 -4.61 120.51 121.79 1o68 n ALA 87 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1o68 n ALA 87 Cb 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.37 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 -0.27 0.00 0.97 0.00 4.11 -1.26 -4.37 117.16 116.35 1o68 n TYR 88 Ca 0.13 0.00 0.14 0.00 -0.00 0.00 0.00 57.90 58.17 1o68 n TYR 88 Cb 0.38 0.00 0.60 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 0.02 -0.04 -3.48 3.00 -1.26 -3.77 117.38 111.85 1o68 n GLN 89 Ca 0.00 0.01 -0.05 0.00 -0.01 0.00 0.00 57.00 56.96 1o68 n GLN 89 Cb 0.00 -1.52 0.17 0.00 0.00 0.00 0.00 30.24 28.89 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 0.62 -1.53 -1.09 4.15 -1.90 -3.47 115.11 111.90 1o68 h GLN 90 Ca 0.00 -0.22 0.26 0.00 0.77 0.00 0.00 58.65 59.46 1o68 h GLN 90 Cb 0.52 -0.05 -0.17 0.00 0.21 0.00 0.00 27.48 27.99 1o68 h GLN 90 CO 0.00 0.77 0.79 -1.54 -1.93 0.00 0.00 178.83 176.93 1o68 s SER 91 N -6.76 -0.13 0.45 -0.69 1.04 -1.25 -4.99 113.70 101.37 1o68 s SER 91 Ca -0.08 -0.03 0.14 0.00 0.48 0.00 0.00 55.95 56.46 1o68 s SER 91 Cb 0.14 0.16 1.01 0.00 0.10 0.00 0.00 66.02 67.43 1o68 s SER 91 CO 0.81 -0.27 2.01 0.07 0.98 0.00 0.00 173.24 176.83 1o68 h LYS 92 N 2.00 0.03 -0.29 4.02 2.10 -1.92 -1.42 116.57 121.09 1o68 h LYS 92 Ca -0.14 -0.01 -0.10 0.00 -2.00 0.00 0.00 60.65 58.41 1o68 h LYS 92 Cb 1.18 -0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.50 1o68 h LYS 92 CO 0.24 0.18 -0.19 0.93 -2.00 0.00 0.00 179.45 178.61 1o68 h GLU 93 N 0.03 0.65 -0.55 0.07 3.07 -1.95 -0.63 114.58 115.27 1o68 h GLU 93 Ca 0.01 -0.31 -0.09 0.00 -0.50 0.00 0.00 59.36 58.47 1o68 h GLU 93 Cb 0.28 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 1o68 h GLU 93 CO 0.02 0.90 -0.00 0.37 -1.40 0.00 0.00 179.01 178.90 1o68 h GLN 94 N 0.40 0.96 -0.63 2.33 4.15 -1.77 -2.60 115.11 117.94 1o68 h GLN 94 Ca 0.06 -0.31 0.02 0.00 0.77 0.00 0.00 58.65 59.19 1o68 h GLN 94 Cb 0.74 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 28.30 1o68 h GLN 94 CO 0.05 0.97 0.41 0.00 -1.93 0.00 0.00 178.83 178.33 1o68 h ALA 95 N 0.96 0.81 -0.48 3.38 0.00 -1.16 -1.74 119.26 121.02 1o68 h ALA 95 Ca 0.15 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.06 1o68 h ALA 95 Cb 0.54 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 1o68 h ALA 95 CO 0.03 0.19 0.27 0.35 0.00 0.00 0.00 179.25 180.09 1o68 h PHE 96 N 0.82 0.50 -0.48 0.00 3.57 -0.94 0.90 116.94 121.30 1o68 h PHE 96 Ca 0.24 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.75 1o68 h PHE 96 Cb -0.05 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.51 1o68 h PHE 96 CO -0.04 0.27 0.28 0.00 -2.23 0.00 0.00 178.31 176.59 1o68 h ALA 97 N 1.23 0.61 -0.40 2.41 0.00 -1.11 0.25 119.26 122.25 1o68 h ALA 97 Ca 0.20 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1o68 h ALA 97 Cb 0.06 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1o68 h ALA 97 CO -0.11 0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1o68 h ALA 98 N 1.13 0.54 -0.42 0.00 0.00 -1.09 -2.29 119.26 117.13 1o68 h ALA 98 Ca 0.17 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1o68 h ALA 98 Cb 0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1o68 h ALA 98 CO -0.03 0.32 -0.02 0.00 0.00 0.00 0.00 179.25 179.51 1o68 h ALA 99 N 0.89 1.17 -0.45 0.00 0.00 -0.59 -2.38 119.26 117.90 1o68 h ALA 99 Ca 0.11 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 1o68 h ALA 99 Cb 0.47 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1o68 h ALA 99 CO 0.02 0.54 0.07 0.00 0.00 0.00 0.00 179.25 179.88 1o68 h ALA 100 N 1.32 1.29 -0.48 0.00 0.00 -0.22 -2.31 119.26 118.86 1o68 h ALA 100 Ca 0.13 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1o68 h ALA 100 Cb 0.44 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1o68 h ALA 100 CO 0.02 0.49 0.04 0.93 0.00 0.00 0.00 179.25 180.74 1o68 h GLU 101 N 0.66 0.82 -1.19 0.00 5.08 -0.94 -0.73 114.58 118.29 1o68 h GLU 101 Ca 0.15 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1o68 h GLU 101 Cb 0.31 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1o68 h GLU 101 CO 0.00 0.84 0.00 1.28 -1.00 0.00 0.00 179.01 180.13 1o68 n LEU 102 N -4.40 0.31 0.00 1.33 4.77 -0.87 -1.10 117.00 117.05 1o68 n LEU 102 Ca 0.01 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 1o68 n LEU 102 Cb 0.28 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1o68 n LEU 102 CO 0.41 0.06 0.00 0.00 -1.33 0.00 0.00 177.39 176.53 1o68 n ALA 104 N 0.73 0.00 0.67 -1.18 0.00 -0.28 -1.66 120.51 118.80 1o68 n ALA 104 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 1o68 n ALA 104 Cb 0.06 0.00 0.45 0.00 0.00 0.00 0.00 19.45 19.96 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 2.20 0.00 0.00 0.00 -0.26 -4.89 120.51 117.56 1o68 n ALA 105 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1o68 n ALA 105 Cb 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.00 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 1.15 0.29 3.80 0.00 0.00 -0.96 -3.36 105.19 106.11 1o68 n GLY 106 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.28 2.78 -1.01 4.61 0.00 -0.66 -4.83 121.76 121.37 1o68 s ALA 107 Ca 0.00 0.43 0.11 0.00 0.00 0.00 0.00 51.96 52.50 1o68 s ALA 107 Cb 0.00 -3.23 0.25 0.00 0.00 0.00 0.00 23.12 20.14 1o68 s ALA 107 CO 0.00 -0.68 1.16 0.72 0.00 0.00 0.00 175.76 176.95 1o68 n HIS 108 N -1.79 0.35 -3.98 0.00 8.25 -0.35 -4.82 115.22 112.88 1o68 n HIS 108 Ca 0.09 -0.38 -0.09 0.00 -0.26 0.00 0.00 57.72 57.07 1o68 n HIS 108 Cb 0.53 -0.02 -0.10 0.00 1.12 0.00 0.00 29.99 31.52 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 -0.98 0.14 -0.06 1.59 -7.23 -0.64 -4.48 120.40 108.75 1o68 s VAL 110 Ca 0.20 -1.18 0.05 0.00 -1.81 0.00 0.00 61.98 59.24 1o68 s VAL 110 Cb 0.11 -0.83 -0.02 0.00 0.56 0.00 0.00 36.38 36.21 1o68 s VAL 110 CO 0.15 -0.65 -0.20 -0.75 -0.31 0.00 0.00 175.10 173.34 1o68 s LYS 111 N -2.51 2.60 0.09 4.82 2.20 0.28 -0.38 119.74 126.83 1o68 s LYS 111 Ca -0.06 -0.81 0.05 0.00 -0.36 0.00 0.00 55.97 54.79 1o68 s LYS 111 Cb -0.02 -2.28 -0.03 0.00 -1.51 0.00 0.00 37.83 33.99 1o68 s LYS 111 CO -0.04 0.46 -0.13 -0.48 -0.36 0.00 0.00 175.35 174.80 1o68 s LEU 112 N -0.33 2.34 -0.10 5.43 0.05 -0.74 -1.34 118.68 124.00 1o68 s LEU 112 Ca 0.02 -0.71 -0.05 0.00 0.05 0.00 0.00 54.13 53.44 1o68 s LEU 112 Cb -0.13 -0.44 -0.04 0.00 -2.05 0.00 0.00 46.19 43.54 1o68 s LEU 112 CO 0.02 -0.15 0.09 -1.61 -0.55 0.00 0.00 176.35 174.15 1o68 s GLU 113 N -2.23 3.25 0.00 1.48 2.02 -1.26 -0.72 118.70 121.24 1o68 s GLU 113 Ca 0.02 -0.25 0.00 0.00 0.02 0.00 0.00 54.97 54.76 1o68 s GLU 113 Cb -0.07 -3.03 0.00 0.00 0.10 0.00 0.00 34.13 31.13 1o68 s GLU 113 CO 0.02 0.75 0.00 0.41 0.02 0.00 0.00 175.26 176.45 1o68 n GLY 114 N 2.01 4.62 0.00 -1.39 0.00 -0.76 -4.94 105.19 104.72 1o68 n GLY 114 Ca -0.19 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.58 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 -1.96 1.13 0.40 -0.02 0.00 -1.26 -4.67 105.19 98.80 1o68 n GLY 115 Ca 0.00 -1.51 0.19 0.00 0.00 0.00 0.00 46.02 44.71 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 0.65 0.00 1.61 2.07 -1.86 -3.24 116.25 115.48 1o68 h VAL 116 Ca 0.00 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1o68 h VAL 116 Cb 0.00 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 29.95 1o68 h VAL 116 CO 0.00 0.08 0.00 -2.67 0.02 0.00 0.00 177.57 175.00 1o68 n TRP 117 N -4.54 0.00 0.00 1.57 2.14 -1.26 -4.39 117.44 110.95 1o68 n TRP 117 Ca 0.21 -0.29 0.00 0.00 2.07 0.00 0.00 57.50 59.48 1o68 n TRP 117 Cb 0.73 -0.29 0.00 0.00 -0.81 0.00 0.00 31.31 30.94 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 1.61 0.00 0.05 -1.67 0.00 -1.22 -4.75 120.51 114.52 1o68 n ALA 119 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 1o68 n ALA 119 Cb 0.17 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.75 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 0.38 -0.19 0.00 4.81 -1.93 -0.70 114.58 116.95 1o68 h GLU 120 Ca 0.00 -0.22 -0.03 0.00 -0.13 0.00 0.00 59.36 58.99 1o68 h GLU 120 Cb 0.00 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 1o68 h GLU 120 CO 0.00 0.79 0.02 1.15 -0.73 0.00 0.00 179.01 180.24 1o68 h THR 121 N 0.31 1.24 -0.39 0.32 2.02 -1.94 -0.73 112.91 113.73 1o68 h THR 121 Ca 0.02 -0.79 0.08 0.00 0.77 0.00 0.00 66.41 66.49 1o68 h THR 121 Cb 0.97 1.38 -0.07 0.00 -1.74 0.00 0.00 68.15 68.69 1o68 h THR 121 CO 0.08 0.24 -0.05 0.74 0.37 0.00 0.00 175.52 176.90 1o68 h THR 122 N 0.11 0.65 -0.34 3.16 2.02 -1.85 -1.38 112.91 115.28 1o68 h THR 122 Ca 0.06 -0.02 0.02 0.00 0.77 0.00 0.00 66.41 67.24 1o68 h THR 122 Cb 0.34 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.33 1o68 h THR 122 CO 0.01 0.01 0.19 -0.08 0.37 0.00 0.00 175.52 176.02 1o68 h GLU 123 N 0.05 0.39 -0.66 6.66 4.81 -0.95 -1.31 114.58 123.56 1o68 h GLU 123 Ca 0.19 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.45 1o68 h GLU 123 Cb 0.29 -0.09 -0.05 0.00 0.63 0.00 0.00 28.75 29.53 1o68 h GLU 123 CO -0.37 0.26 0.37 0.35 -0.73 0.00 0.00 179.01 178.89 1o68 h PHE 124 N 0.40 0.69 -0.10 0.92 3.57 -0.61 -3.05 116.94 118.76 1o68 h PHE 124 Ca 0.14 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.61 1o68 h PHE 124 Cb 0.01 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 38.54 1o68 h PHE 124 CO -0.08 0.34 -0.15 -0.07 -2.23 0.00 0.00 178.31 176.12 1o68 h LEU 125 N 0.70 0.30 -3.05 0.59 4.07 -1.05 -3.13 115.31 113.74 1o68 h LEU 125 Ca 0.29 -0.53 0.00 0.00 0.08 0.00 0.00 57.88 57.72 1o68 h LEU 125 Cb 0.15 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 41.81 1o68 h LEU 125 CO -0.17 0.78 0.00 0.00 -1.08 0.00 0.00 178.44 177.97 1o68 n GLN 126 N -4.58 0.16 -0.01 1.13 -0.00 -0.51 -1.98 117.38 111.58 1o68 n GLN 126 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.93 1o68 n GLN 126 Cb 0.38 -1.42 0.00 0.00 -0.00 0.00 0.00 30.24 29.19 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 1.49 -0.01 -0.56 2.61 1.74 -1.18 -3.97 116.66 116.78 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 0.08 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.52 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 0.76 3.37 -0.13 0.00 -1.15 -5.03 105.19 103.00 1o68 n GLY 129 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.72 4.85 0.33 -0.61 1.01 -0.84 -5.06 121.20 118.16 1o68 s ILE 130 Ca 0.00 -1.03 -0.29 0.00 0.00 0.00 0.00 60.65 59.33 1o68 s ILE 130 Cb 0.00 -3.83 -0.11 0.00 0.01 0.00 0.00 42.46 38.53 1o68 s ILE 130 CO 0.00 -0.44 1.46 -2.84 0.00 0.00 0.00 174.94 173.12 1o68 s PRO 131 N 1.58 4.19 -0.06 2.79 0.02 -1.26 -3.09 135.00 139.17 1o68 s PRO 131 Ca 0.03 2.45 0.05 0.00 0.02 0.00 0.00 61.00 63.56 1o68 s PRO 131 Cb -0.22 -3.03 -0.01 0.00 0.02 0.00 0.00 34.50 31.26 1o68 s PRO 131 CO 0.06 -0.46 -0.24 0.08 -0.33 0.00 0.00 177.00 176.12 1o68 s VAL 132 N -0.71 2.18 -0.29 3.83 1.01 -1.26 -1.61 120.40 123.55 1o68 s VAL 132 Ca 0.55 -1.02 -0.08 0.00 0.00 0.00 0.00 61.98 61.44 1o68 s VAL 132 Cb -0.44 -1.80 -0.00 0.00 0.00 0.00 0.00 36.38 34.13 1o68 s VAL 132 CO 0.54 0.57 0.10 0.00 0.00 0.00 0.00 175.10 176.31 1o68 s ALA 134 N 1.56 3.44 -0.30 0.00 0.00 -0.04 -1.78 121.76 124.63 1o68 s ALA 134 Ca 0.04 -0.12 -0.07 0.00 0.00 0.00 0.00 51.96 51.82 1o68 s ALA 134 Cb -0.17 -2.71 0.02 0.00 0.00 0.00 0.00 23.12 20.26 1o68 s ALA 134 CO 0.04 -0.02 0.08 -1.58 0.00 0.00 0.00 175.76 174.28 1o68 s HIS 135 N 0.65 3.17 0.50 0.00 5.04 0.10 0.94 115.29 125.70 1o68 s HIS 135 Ca 0.29 -1.11 0.01 0.00 -1.54 0.00 0.00 55.06 52.71 1o68 s HIS 135 Cb -0.16 -2.25 -0.01 0.00 0.04 0.00 0.00 32.58 30.20 1o68 s HIS 135 CO 0.12 -0.62 0.01 0.96 -2.34 0.00 0.00 174.74 172.87 1o68 s ILE 136 N 1.47 1.13 0.00 0.89 -4.36 0.71 -1.84 121.20 119.20 1o68 s ILE 136 Ca 0.01 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.40 1o68 s ILE 136 Cb -0.18 -2.17 0.00 0.00 1.25 0.00 0.00 42.46 41.36 1o68 s ILE 136 CO 0.02 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.81 1o68 n GLY 137 N -1.24 1.22 3.54 6.27 0.00 -1.26 -2.40 105.19 111.31 1o68 n GLY 137 Ca -0.18 -0.73 -0.43 0.00 0.00 0.00 0.00 46.02 44.68 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 4.03 -0.46 0.99 2.96 -0.39 -4.95 118.68 120.87 1o68 s LEU 138 Ca 0.00 -0.17 -0.14 0.00 -0.22 0.00 0.00 54.13 53.60 1o68 s LEU 138 Cb 0.00 -2.97 0.07 0.00 0.50 0.00 0.00 46.19 43.79 1o68 s LEU 138 CO 0.00 -1.18 0.36 0.42 -1.32 0.00 0.00 176.35 174.63 1o68 s THR 139 N 3.94 5.00 0.66 3.68 -4.23 -1.26 -4.59 115.64 118.83 1o68 s THR 139 Ca 0.33 -1.11 0.31 0.00 -1.18 0.00 0.00 61.69 60.04 1o68 s THR 139 Cb -0.11 -3.99 0.32 0.00 1.34 0.00 0.00 72.50 70.06 1o68 s THR 139 CO 0.22 -0.54 1.97 -0.65 -0.54 0.00 0.00 174.62 175.07 1o68 h PRO 140 N 8.67 0.00 0.00 3.99 0.11 -1.98 0.14 132.00 142.93 1o68 h PRO 140 Ca -0.27 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.84 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 0.84 0.00 -0.01 1.96 -0.21 0.00 0.00 178.00 180.59 1o68 h GLN 141 N 0.00 0.00 -0.50 1.05 4.20 -1.96 -1.21 115.11 116.68 1o68 h GLN 141 Ca 0.02 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 1o68 h GLN 141 Cb 0.63 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.41 1o68 h GLN 141 CO -0.00 0.01 0.01 0.43 -0.67 0.00 0.00 178.83 178.60 1o68 n SER 142 N -3.10 5.27 -0.28 1.46 7.64 0.48 -4.65 113.62 120.45 1o68 n SER 142 Ca 0.01 -2.97 0.07 0.00 1.01 0.00 0.00 58.87 56.99 1o68 n SER 142 Cb 0.33 -0.66 0.22 0.00 -1.01 0.00 0.00 64.21 63.09 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 3.42 0.68 0.00 0.44 3.04 -1.28 0.11 116.25 122.67 1o68 h VAL 143 Ca 0.01 -0.19 -0.05 0.00 -1.01 0.00 0.00 66.70 65.46 1o68 h VAL 143 Cb 1.87 0.09 -0.01 0.00 -2.01 0.00 0.00 31.29 31.24 1o68 h VAL 143 CO 0.44 0.10 -0.25 -0.26 -1.01 0.00 0.00 177.57 176.59 1o68 h PHE 144 N 0.54 0.00 0.22 3.17 -1.00 -1.83 0.38 116.94 118.42 1o68 h PHE 144 Ca 0.45 0.00 -0.33 0.00 2.81 0.00 0.00 57.97 60.91 1o68 h PHE 144 Cb 0.68 0.00 0.04 0.00 3.61 0.00 0.00 35.95 40.28 1o68 h PHE 144 CO -0.12 0.25 -1.43 0.00 -1.61 0.00 0.00 178.31 175.40 1o68 h ALA 145 N 1.75 -0.12 -0.08 2.45 0.00 -1.22 -3.27 119.26 118.78 1o68 h ALA 145 Ca -0.00 -0.84 -0.13 0.00 0.00 0.00 0.00 54.91 53.93 1o68 h ALA 145 Cb 0.59 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1o68 h ALA 145 CO 0.03 0.70 -0.54 0.74 0.00 0.00 0.00 179.25 180.18 1o68 h PHE 146 N 0.17 0.29 0.00 0.00 -1.00 -0.65 -3.46 116.94 112.29 1o68 h PHE 146 Ca -0.24 -0.10 0.00 0.00 2.81 0.00 0.00 57.97 60.44 1o68 h PHE 146 Cb 2.12 -0.05 0.00 0.00 3.61 0.00 0.00 35.95 41.62 1o68 h PHE 146 CO 0.12 0.72 0.00 0.41 -1.61 0.00 0.00 178.31 177.96 1o68 n GLY 147 N 0.12 0.75 0.00 -1.45 0.00 0.13 -4.91 105.19 99.84 1o68 n GLY 147 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1o68 n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o68 n GLY 148 N -2.14 0.74 3.35 -0.02 0.00 -0.98 -5.01 105.19 101.13 1o68 n GLY 148 Ca 0.00 -1.76 -0.46 0.00 0.00 0.00 0.00 46.02 43.80 1o68 n GLY 148 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1o68 s TYR 149 N -2.94 3.87 0.10 1.61 1.51 -1.26 -4.87 117.35 115.38 1o68 s TYR 149 Ca 0.00 -2.19 0.03 0.00 -1.01 0.00 0.00 57.07 53.91 1o68 s TYR 149 Cb 0.00 -3.89 -0.04 0.00 -0.11 0.00 0.00 41.96 37.92 1o68 s TYR 149 CO 0.00 -1.04 0.09 0.15 -1.11 0.00 0.00 175.55 173.64 1o68 s LYS 150 N -0.03 2.89 0.23 -0.62 3.01 -1.26 -5.07 119.74 118.88 1o68 s LYS 150 Ca 0.25 -0.73 -0.30 0.00 -1.01 0.00 0.00 55.97 54.18 1o68 s LYS 150 Cb -0.09 -2.71 -0.09 0.00 -1.01 0.00 0.00 37.83 33.92 1o68 s LYS 150 CO -0.08 0.55 1.35 0.08 0.51 0.00 0.00 175.35 177.76 1o68 s VAL 151 N -1.47 2.98 0.17 3.17 1.01 -1.26 -4.77 120.40 120.23 1o68 s VAL 151 Ca 0.30 0.83 0.03 0.00 0.00 0.00 0.00 61.98 63.14 1o68 s VAL 151 Cb -0.12 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 1o68 s VAL 151 CO 0.22 0.13 0.28 -1.10 0.00 0.00 0.00 175.10 174.64 1o68 s GLN 152 N -0.37 3.36 0.00 2.72 -1.52 0.06 -4.58 119.66 119.34 1o68 s GLN 152 Ca 0.57 -0.68 0.00 0.00 -1.95 0.00 0.00 55.36 53.30 1o68 s GLN 152 Cb -0.39 -2.90 0.00 0.00 -0.22 0.00 0.00 33.01 29.50 1o68 s GLN 152 CO 0.41 0.49 0.00 0.41 -0.25 0.00 0.00 175.29 176.36 1o68 n GLY 153 N -0.73 0.77 3.74 3.09 0.00 -1.26 -2.55 105.19 108.24 1o68 n GLY 153 Ca -0.08 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 1o68 n GLY 153 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1o68 s ARG 154 N -0.63 4.57 6.37 1.61 3.00 -1.26 -3.44 118.95 129.16 1o68 s ARG 154 Ca 0.00 1.73 0.00 0.00 -1.00 0.00 0.00 55.73 56.46 1o68 s ARG 154 Cb 0.00 -3.29 0.00 0.00 0.00 0.00 0.00 34.95 31.66 1o68 s ARG 154 CO 0.00 0.03 0.00 0.41 0.00 0.00 0.00 175.30 175.74 1o68 n GLY 155 N 2.18 1.86 1.57 8.12 0.00 -1.26 -2.07 105.19 115.59 1o68 n GLY 155 Ca 0.03 0.26 0.06 0.00 0.00 0.00 0.00 46.02 46.37 1o68 n GLY 155 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o68 n GLY 156 N 0.00 2.60 0.00 -0.02 0.00 -1.26 -3.90 105.19 102.61 1o68 n GLY 156 Ca 0.00 -0.74 0.11 0.00 0.00 0.00 0.00 46.02 45.39 1o68 n GLY 156 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1o68 n LYS 157 N 0.61 0.04 -0.11 1.61 5.02 -0.88 -4.40 118.16 120.06 1o68 n LYS 157 Ca 0.22 -0.01 -0.07 0.00 -2.02 0.00 0.00 58.31 56.44 1o68 n LYS 157 Cb 0.96 -1.51 0.01 0.00 -0.02 0.00 0.00 35.03 34.47 1o68 n LYS 157 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1o68 h ALA 158 N 2.93 0.43 -0.54 7.82 0.00 -1.67 -2.78 119.26 125.46 1o68 h ALA 158 Ca 0.00 0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1o68 h ALA 158 Cb 0.53 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1o68 h ALA 158 CO 0.00 -0.23 0.31 0.37 0.00 0.00 0.00 179.25 179.70 1o68 h GLN 159 N 0.32 0.60 -0.76 0.00 5.75 -1.88 -1.11 115.11 118.03 1o68 h GLN 159 Ca 0.16 -0.04 0.02 0.00 -0.15 0.00 0.00 58.65 58.64 1o68 h GLN 159 Cb 0.10 -0.14 -0.04 0.00 1.07 0.00 0.00 27.48 28.48 1o68 h GLN 159 CO -0.14 0.40 0.50 0.00 -2.65 0.00 0.00 178.83 176.94 1o68 h ALA 160 N 1.25 0.98 -0.45 3.38 0.00 -1.76 0.18 119.26 122.84 1o68 h ALA 160 Ca 0.22 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1o68 h ALA 160 Cb 0.05 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1o68 h ALA 160 CO -0.11 0.35 0.07 1.25 0.00 0.00 0.00 179.25 180.81 1o68 h LEU 161 N 1.00 0.71 -0.84 0.00 5.85 -1.22 0.67 115.31 121.49 1o68 h LEU 161 Ca 0.29 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1o68 h LEU 161 Cb -0.07 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.72 1o68 h LEU 161 CO -0.08 0.79 0.53 0.25 -0.34 0.00 0.00 178.44 179.60 1o68 h LEU 162 N 0.60 0.98 -0.75 2.25 5.85 -0.72 -0.67 115.31 122.86 1o68 h LEU 162 Ca 0.14 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.74 1o68 h LEU 162 Cb 0.39 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 1o68 h LEU 162 CO 0.01 0.74 0.13 0.78 -0.34 0.00 0.00 178.44 179.75 1o68 h ASN 163 N 1.14 1.03 -0.45 1.25 2.35 -0.34 -1.15 115.58 119.41 1o68 h ASN 163 Ca 0.30 -0.23 -0.04 0.00 -0.55 0.00 0.00 56.30 55.79 1o68 h ASN 163 Cb -0.09 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 37.99 1o68 h ASN 163 CO -0.06 1.01 0.14 0.44 -1.65 0.00 0.00 177.43 177.31 1o68 h ASP 164 N 1.02 0.66 -0.42 5.81 3.32 0.08 -1.14 116.42 125.75 1o68 h ASP 164 Ca 0.21 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1o68 h ASP 164 Cb 0.41 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 1o68 h ASP 164 CO 0.01 0.69 0.22 0.00 -1.72 0.00 0.00 179.24 178.44 1o68 h ALA 165 N 1.00 0.54 -0.05 3.45 0.00 -0.90 -2.29 119.26 121.01 1o68 h ALA 165 Ca 0.15 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1o68 h ALA 165 Cb 0.27 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1o68 h ALA 165 CO -0.00 0.08 0.02 0.87 0.00 0.00 0.00 179.25 180.22 1o68 h LYS 166 N 0.54 0.07 -0.63 0.00 1.57 -1.04 -1.44 116.57 115.63 1o68 h LYS 166 Ca 0.15 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.98 1o68 h LYS 166 Cb 0.08 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.32 1o68 h LYS 166 CO -0.02 0.17 0.33 0.00 -0.57 0.00 0.00 179.45 179.35 1o68 h ALA 167 N 0.90 0.84 -0.44 3.86 0.00 -1.12 0.33 119.26 123.63 1o68 h ALA 167 Ca 0.02 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1o68 h ALA 167 Cb 0.12 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1o68 h ALA 167 CO -0.00 -0.03 0.10 0.45 0.00 0.00 0.00 179.25 179.77 1o68 h HIS 168 N 0.60 0.74 -0.73 0.00 3.86 -1.31 0.50 115.15 118.82 1o68 h HIS 168 Ca 0.29 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.39 1o68 h HIS 168 Cb 0.23 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.45 1o68 h HIS 168 CO -0.10 0.70 0.40 0.22 0.86 0.00 0.00 177.93 180.01 1o68 h ASP 169 N 0.58 0.92 0.12 2.45 -0.00 -0.57 0.14 116.42 120.06 1o68 h ASP 169 Ca 0.14 -0.10 -0.09 0.00 -0.00 0.00 0.00 57.03 56.97 1o68 h ASP 169 Cb 0.33 -0.23 -0.01 0.00 -0.00 0.00 0.00 39.33 39.42 1o68 h ASP 169 CO 0.00 0.75 -0.32 0.44 -0.00 0.00 0.00 179.24 180.11 1o68 h ASP 170 N 1.01 0.30 0.21 2.28 3.32 -0.18 -1.51 116.42 121.85 1o68 h ASP 170 Ca 0.26 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1o68 h ASP 170 Cb 0.04 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1o68 h ASP 170 CO -0.04 0.62 0.00 0.00 -1.72 0.00 0.00 179.24 178.09 1o68 n ALA 171 N -2.48 2.25 -0.49 3.45 0.00 0.15 -4.85 120.51 118.53 1o68 n ALA 171 Ca -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1o68 n ALA 171 Cb 0.42 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.51 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 0.52 1.00 3.76 0.00 0.00 -0.57 -3.65 105.19 106.24 1o68 n GLY 172 Ca 0.14 -0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.94 2.24 0.03 4.61 0.00 0.46 -4.79 120.51 122.11 1o68 n ALA 173 Ca 0.00 0.35 -0.13 0.00 0.00 0.00 0.00 53.44 53.66 1o68 n ALA 173 Cb 0.06 -2.40 -0.02 0.00 0.00 0.00 0.00 19.45 17.09 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 3.31 0.43 -2.96 0.00 0.00 -1.36 -3.45 119.26 115.22 1o68 h ALA 174 Ca -0.49 -0.63 -0.16 0.00 0.00 0.00 0.00 54.91 53.63 1o68 h ALA 174 Cb 1.24 -0.03 -0.23 0.00 0.00 0.00 0.00 17.79 18.77 1o68 h ALA 174 CO 0.67 0.74 -0.46 0.08 0.00 0.00 0.00 179.25 180.29 1o68 s VAL 175 N -3.57 0.04 -0.16 0.00 1.01 -1.08 -4.01 120.40 112.63 1o68 s VAL 175 Ca -0.07 -0.32 -0.00 0.00 0.00 0.00 0.00 61.98 61.58 1o68 s VAL 175 Cb 0.09 -0.39 -0.00 0.00 0.00 0.00 0.00 36.38 36.08 1o68 s VAL 175 CO 0.87 -0.18 -0.14 -0.69 0.00 0.00 0.00 175.10 174.96 1o68 s VAL 176 N -0.64 2.78 0.41 2.92 1.01 -0.92 -0.86 120.40 125.10 1o68 s VAL 176 Ca -0.07 -0.73 0.03 0.00 0.00 0.00 0.00 61.98 61.21 1o68 s VAL 176 Cb -0.04 -2.19 0.03 0.00 0.00 0.00 0.00 36.38 34.18 1o68 s VAL 176 CO 0.01 0.51 0.26 -0.11 0.00 0.00 0.00 175.10 175.77 1o68 n LEU 177 N 4.08 0.00 -3.65 3.92 0.00 0.27 -1.61 117.00 120.01 1o68 n LEU 177 Ca -0.19 -2.19 0.02 0.00 0.00 0.00 0.00 56.01 53.65 1o68 n LEU 177 Cb 0.52 0.02 -0.06 0.00 0.00 0.00 0.00 43.42 43.89 1o68 n LEU 177 CO 0.29 -0.48 1.07 -0.70 0.00 0.00 0.00 177.39 177.57 1o68 s GLU 179 N -3.64 0.01 -1.07 1.96 2.12 -1.01 -0.21 118.70 116.86 1o68 s GLU 179 Ca 0.20 0.02 -0.18 0.00 0.36 0.00 0.00 54.97 55.37 1o68 s GLU 179 Cb -0.02 0.00 -0.00 0.00 0.26 0.00 0.00 34.13 34.37 1o68 s GLU 179 CO 0.12 -0.00 0.76 0.00 -0.54 0.00 0.00 175.26 175.60 1o68 s VAL 181 N -3.37 1.72 -0.11 0.00 1.01 -0.86 -0.76 120.40 118.02 1o68 s VAL 181 Ca 0.39 -0.88 -0.40 0.00 0.00 0.00 0.00 61.98 61.09 1o68 s VAL 181 Cb -0.14 -1.46 -0.18 0.00 0.00 0.00 0.00 36.38 34.60 1o68 s VAL 181 CO 0.86 0.48 1.42 0.18 0.00 0.00 0.00 175.10 178.05 1o68 n LEU 182 N 3.04 1.42 -0.24 3.92 4.77 -1.06 -4.24 117.00 124.62 1o68 n LEU 182 Ca -0.18 1.13 0.04 0.00 -0.03 0.00 0.00 56.01 56.97 1o68 n LEU 182 Cb 0.52 -1.08 0.14 0.00 -2.33 0.00 0.00 43.42 40.68 1o68 n LEU 182 CO 0.25 -1.04 0.83 0.00 -1.33 0.00 0.00 177.39 176.10 1o68 h ALA 183 N 4.98 0.73 -0.48 -1.18 0.00 -1.68 -0.05 119.26 121.58 1o68 h ALA 183 Ca -0.48 0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 1o68 h ALA 183 Cb 1.36 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 19.50 1o68 h ALA 183 CO 0.83 -0.41 0.20 1.49 0.00 0.00 0.00 179.25 181.36 1o68 h GLU 184 N 0.12 0.69 -0.33 0.00 4.81 -1.87 -0.71 114.58 117.28 1o68 h GLU 184 Ca 0.38 -0.09 -0.08 0.00 -0.13 0.00 0.00 59.36 59.44 1o68 h GLU 184 Cb 0.66 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 1o68 h GLU 184 CO -0.61 0.57 -0.10 1.25 -0.73 0.00 0.00 179.01 179.39 1o68 h LEU 185 N 0.68 0.66 -0.96 1.64 6.46 -1.40 -2.50 115.31 119.89 1o68 h LEU 185 Ca 0.17 -0.37 0.01 0.00 -0.12 0.00 0.00 57.88 57.56 1o68 h LEU 185 Cb 0.13 -0.18 -0.05 0.00 -0.73 0.00 0.00 40.66 39.83 1o68 h LEU 185 CO -0.02 0.89 0.64 0.00 -0.62 0.00 0.00 178.44 179.33 1o68 h ALA 186 N 0.80 1.22 -0.46 1.25 0.00 -0.74 0.16 119.26 121.49 1o68 h ALA 186 Ca 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1o68 h ALA 186 Cb 0.61 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1o68 h ALA 186 CO 0.04 0.61 0.31 -0.22 0.00 0.00 0.00 179.25 179.99 1o68 h LYS 187 N 1.30 0.61 -0.51 0.00 3.64 -1.07 -0.96 116.57 119.58 1o68 h LYS 187 Ca 0.35 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.71 1o68 h LYS 187 Cb -0.15 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.50 1o68 h LYS 187 CO -0.08 0.40 0.33 0.87 -2.27 0.00 0.00 179.45 178.70 1o68 h LYS 188 N 0.63 0.64 -0.11 1.90 1.57 -0.87 -1.32 116.57 119.01 1o68 h LYS 188 Ca 0.17 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1o68 h LYS 188 Cb -0.07 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.09 1o68 h LYS 188 CO -0.04 0.42 0.06 0.28 -0.57 0.00 0.00 179.45 179.61 1o68 h VAL 189 N 0.66 1.06 -0.80 0.50 2.07 -0.93 -0.07 116.25 118.74 1o68 h VAL 189 Ca 0.19 -0.14 0.04 0.00 0.82 0.00 0.00 66.70 67.61 1o68 h VAL 189 Cb -0.04 0.96 -0.05 0.00 -1.52 0.00 0.00 31.29 30.64 1o68 h VAL 189 CO -0.06 0.05 0.53 0.74 0.02 0.00 0.00 177.57 178.85 1o68 h THR 190 N 0.11 1.11 0.00 2.57 2.02 -0.96 0.89 112.91 118.65 1o68 h THR 190 Ca 0.04 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 66.89 1o68 h THR 190 Cb 0.03 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.49 1o68 h THR 190 CO -0.01 0.18 0.00 -0.33 0.37 0.00 0.00 175.52 175.73 1o68 h GLU 191 N 0.97 0.00 0.05 6.66 5.08 -0.79 -3.34 114.58 123.20 1o68 h GLU 191 Ca 0.33 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 58.32 1o68 h GLU 191 Cb 0.08 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 1o68 h GLU 191 CO -0.10 0.00 -2.13 2.41 -1.00 0.00 0.00 179.01 178.19 1o68 n THR 192 N -2.80 1.62 -2.54 1.13 -1.04 -0.08 -4.96 114.28 105.61 1o68 n THR 192 Ca 0.04 -0.50 -0.33 0.00 -2.04 0.00 0.00 64.05 61.22 1o68 n THR 192 Cb 0.44 -1.69 -0.04 0.00 -1.82 0.00 0.00 70.33 67.21 1o68 n THR 192 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 1o68 s VAL 193 N -2.51 4.33 0.20 12.58 -7.23 0.16 -4.96 120.40 122.96 1o68 s VAL 193 Ca -0.30 1.27 0.09 0.00 -1.81 0.00 0.00 61.98 61.24 1o68 s VAL 193 Cb 0.08 -3.61 -0.10 0.00 0.56 0.00 0.00 36.38 33.31 1o68 s VAL 193 CO 0.65 -0.48 1.47 0.77 -0.31 0.00 0.00 175.10 177.19 1o68 h SER 194 N 1.32 0.00 -3.92 4.85 4.64 -1.91 -3.45 113.55 115.08 1o68 h SER 194 Ca -0.48 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.35 1o68 h SER 194 Cb 1.19 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.31 1o68 h SER 194 CO 0.61 0.78 0.24 0.00 -0.87 0.00 0.00 176.83 177.58 1o68 s PRO 196 N -4.57 2.73 0.20 0.00 0.02 -1.26 -4.82 135.00 127.31 1o68 s PRO 196 Ca 0.52 1.96 0.11 0.00 0.02 0.00 0.00 61.00 63.61 1o68 s PRO 196 Cb -0.10 -1.88 -0.04 0.00 0.02 0.00 0.00 34.50 32.49 1o68 s PRO 196 CO 0.43 -1.43 -0.20 0.95 -0.33 0.00 0.00 177.00 176.42 1o68 s THR 197 N -1.49 2.58 -0.02 0.99 -4.23 -1.26 -2.17 115.64 110.05 1o68 s THR 197 Ca 0.80 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 59.34 1o68 s THR 197 Cb -0.34 -2.27 0.00 0.00 1.34 0.00 0.00 72.50 71.23 1o68 s THR 197 CO 0.37 -0.16 -0.07 -0.63 -0.54 0.00 0.00 174.62 173.59 1o68 s ILE 198 N -1.81 0.58 0.20 2.99 -1.09 -0.63 -1.64 121.20 119.80 1o68 s ILE 198 Ca 0.23 -0.27 0.06 0.00 -2.23 0.00 0.00 60.65 58.45 1o68 s ILE 198 Cb -0.08 -0.52 -0.05 0.00 -1.58 0.00 0.00 42.46 40.24 1o68 s ILE 198 CO 0.12 0.18 -0.11 -0.83 -1.23 0.00 0.00 174.94 173.07 1o68 s GLY 199 N 0.12 1.38 -0.18 6.18 0.00 0.56 -4.26 107.32 111.12 1o68 s GLY 199 Ca -0.01 -1.65 -0.04 0.00 0.00 0.00 0.00 44.72 43.02 1o68 s GLY 199 CO -0.00 -1.72 0.22 -1.50 0.00 0.00 0.00 173.10 170.10 1o68 s ILE 200 N -3.10 -0.33 -1.14 0.90 2.07 -1.26 -1.67 121.20 116.67 1o68 s ILE 200 Ca 0.22 -0.01 0.00 0.00 -1.41 0.00 0.00 60.65 59.45 1o68 s ILE 200 Cb 0.01 -0.60 0.00 0.00 0.13 0.00 0.00 42.46 42.00 1o68 s ILE 200 CO 0.06 -0.12 0.00 0.61 -1.91 0.00 0.00 174.94 173.58 1o68 n GLY 201 N 5.32 0.62 0.14 1.50 0.00 -1.26 -1.08 105.19 110.44 1o68 n GLY 201 Ca -0.05 -0.44 0.01 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.10 2.09 0.00 4.61 0.00 -1.26 -2.04 120.51 123.81 1o68 n ALA 202 Ca -0.13 -0.98 0.00 0.00 0.00 0.00 0.00 53.44 52.33 1o68 n ALA 202 Cb 0.49 -0.10 0.00 0.00 0.00 0.00 0.00 19.45 19.84 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 -0.22 -0.55 0.52 0.00 0.00 -1.26 -4.34 105.19 99.34 1o68 n GLY 203 Ca 0.03 -1.74 0.13 0.00 0.00 0.00 0.00 46.02 44.44 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 -0.41 2.56 0.02 4.61 0.00 -1.26 -4.13 120.51 121.90 1o68 n ALA 204 Ca 0.00 -0.47 0.04 0.00 0.00 0.00 0.00 53.44 53.01 1o68 n ALA 204 Cb 0.00 -1.13 0.22 0.00 0.00 0.00 0.00 19.45 18.54 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 0.27 3.50 -4.95 0.00 8.00 -1.26 -4.85 116.55 117.26 1o68 n ASP 205 Ca 0.18 -2.46 -0.24 0.00 0.71 0.00 0.00 54.79 52.98 1o68 n ASP 205 Cb 0.37 -0.57 0.04 0.00 -0.02 0.00 0.00 41.12 40.94 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 -2.51 0.00 -3.62 0.00 8.00 -0.65 -4.90 116.55 112.87 1o68 n ASP 207 Ca 0.06 -0.28 -0.00 0.00 0.71 0.00 0.00 54.79 55.28 1o68 n ASP 207 Cb 0.59 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.46 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 -2.46 -0.19 0.15 0.44 0.00 -0.73 -1.06 107.32 103.47 1o68 s GLY 208 Ca 0.31 0.18 0.06 0.00 0.00 0.00 0.00 44.72 45.27 1o68 s GLY 208 CO 0.42 1.73 -0.14 1.20 0.00 0.00 0.00 173.10 176.32 1o68 s GLN 209 N -2.47 1.11 0.01 2.90 -1.52 -0.32 -0.32 119.66 119.05 1o68 s GLN 209 Ca 0.19 -1.37 -0.02 0.00 -1.95 0.00 0.00 55.36 52.21 1o68 s GLN 209 Cb 0.01 -0.92 -0.01 0.00 -0.22 0.00 0.00 33.01 31.87 1o68 s GLN 209 CO 0.00 0.16 0.02 0.54 -0.25 0.00 0.00 175.29 175.76 1o68 s VAL 210 N -2.56 0.08 0.01 1.09 0.11 -0.67 -4.57 120.40 113.89 1o68 s VAL 210 Ca 0.14 -0.63 -0.05 0.00 -2.93 0.00 0.00 61.98 58.51 1o68 s VAL 210 Cb -0.02 -0.24 -0.00 0.00 -1.53 0.00 0.00 36.38 34.58 1o68 s VAL 210 CO 0.03 -0.34 0.08 -0.76 -3.33 0.00 0.00 175.10 170.78 1o68 s LEU 211 N -1.05 1.77 0.00 2.54 1.43 -1.26 -4.54 118.68 117.57 1o68 s LEU 211 Ca -0.11 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 52.71 1o68 s LEU 211 Cb -0.07 0.48 0.00 0.00 0.03 0.00 0.00 46.19 46.63 1o68 s LEU 211 CO -0.00 -0.33 0.00 0.52 0.23 0.00 0.00 176.35 176.77 1o68 n VAL 212 N 1.58 0.00 0.00 -1.59 0.31 -1.26 -2.23 118.33 115.14 1o68 n VAL 212 Ca -0.23 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 1o68 n VAL 212 Cb 0.56 -0.55 0.00 0.00 -0.91 0.00 0.00 33.84 32.94 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 -0.09 0.00 0.31 3.52 8.25 -1.26 -4.69 115.22 121.25 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 0.35 0.00 0.41 8.00 -1.26 -1.41 116.55 122.65 1o68 n ASP 215 Ca 0.00 -0.61 0.00 0.00 0.71 0.00 0.00 54.79 54.89 1o68 n ASP 215 Cb 0.00 -0.15 0.00 0.00 -0.02 0.00 0.00 41.12 40.95 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 0.39 0.00 -3.38 0.64 4.77 -1.26 -4.43 117.00 113.73 1o68 n LEU 217 Ca 0.00 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.74 1o68 n LEU 217 Cb 0.08 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.22 1o68 n LEU 217 CO 0.00 0.00 0.12 0.61 -1.33 0.00 0.00 177.39 176.79 1o68 n GLY 218 N 0.00 -0.53 0.18 -0.72 0.00 -1.07 -4.86 105.19 98.19 1o68 n GLY 218 Ca 0.00 0.19 0.03 0.00 0.00 0.00 0.00 46.02 46.24 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 -2.02 1.15 -3.47 -0.61 1.08 -1.45 -3.43 117.51 108.76 1o68 h ILE 219 Ca -0.55 -1.55 -0.50 0.00 -0.39 0.00 0.00 64.86 61.87 1o68 h ILE 219 Cb 1.37 1.87 -0.00 0.00 -3.07 0.00 0.00 36.82 36.99 1o68 h ILE 219 CO 0.57 0.42 -0.00 -0.36 -0.69 0.00 0.00 178.15 178.09 1o68 s PHE 220 N -3.83 3.47 0.52 1.37 0.40 -1.26 -5.07 117.98 113.58 1o68 s PHE 220 Ca -0.01 0.85 -0.17 0.00 -0.60 0.00 0.00 56.93 57.00 1o68 s PHE 220 Cb 0.13 -2.28 -0.08 0.00 0.51 0.00 0.00 43.02 41.30 1o68 s PHE 220 CO 0.71 0.02 0.99 -1.25 0.70 0.00 0.00 175.22 176.39 1o68 s PRO 221 N -3.74 3.90 0.96 0.24 0.04 -1.26 -4.89 135.00 130.25 1o68 s PRO 221 Ca 0.48 0.99 0.00 0.00 0.04 0.00 0.00 61.00 62.51 1o68 s PRO 221 Cb -0.10 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.31 1o68 s PRO 221 CO 0.31 -0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.45 1o68 n GLY 222 N -1.48 -0.59 3.79 0.56 0.00 -1.26 -4.94 105.19 101.27 1o68 n GLY 222 Ca 0.07 -1.63 -0.32 0.00 0.00 0.00 0.00 46.02 44.14 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 0.00 3.04 0.75 1.61 3.01 -1.26 -5.11 119.74 121.78 1o68 s LYS 223 Ca 0.00 -0.53 -0.11 0.00 -1.01 0.00 0.00 55.97 54.32 1o68 s LYS 223 Cb 0.00 -2.83 0.04 0.00 -1.01 0.00 0.00 37.83 34.03 1o68 s LYS 223 CO 0.00 0.63 1.08 -0.08 0.51 0.00 0.00 175.35 177.48 1o68 s THR 224 N -1.25 3.56 1.10 2.17 -1.32 -1.26 -5.02 115.64 113.61 1o68 s THR 224 Ca 0.25 0.51 -0.12 0.00 -1.21 0.00 0.00 61.69 61.11 1o68 s THR 224 Cb -0.12 -3.21 0.24 0.00 -1.51 0.00 0.00 72.50 67.90 1o68 s THR 224 CO 0.16 -0.66 1.02 0.00 -2.21 0.00 0.00 174.62 172.94 1o68 n ALA 225 N -3.32 -2.33 0.11 11.08 0.00 -1.26 -4.89 120.51 119.91 1o68 n ALA 225 Ca 0.07 -1.00 0.03 0.00 0.00 0.00 0.00 53.44 52.55 1o68 n ALA 225 Cb 0.54 -2.04 0.42 0.00 0.00 0.00 0.00 19.45 18.37 1o68 n ALA 225 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1o68 h LYS 226 N -2.44 0.27 -0.32 0.00 3.64 -1.95 -2.70 116.57 113.07 1o68 h LYS 226 Ca -0.56 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.78 1o68 h LYS 226 Cb 1.31 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 1o68 h LYS 226 CO 0.46 0.33 0.00 1.97 -2.27 0.00 0.00 179.45 179.95 1o68 n PHE 227 N -4.34 0.42 -4.75 1.91 1.16 -1.26 -3.96 117.46 106.64 1o68 n PHE 227 Ca -0.00 -0.21 -0.33 0.00 -1.87 0.00 0.00 57.45 55.04 1o68 n PHE 227 Cb 0.21 0.00 -0.13 0.00 -1.61 0.00 0.00 39.48 37.95 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 -1.58 3.27 -0.06 1.97 1.01 -1.02 -4.50 120.40 119.49 1o68 s VAL 228 Ca 0.31 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.69 1o68 s VAL 228 Cb 0.17 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 1o68 s VAL 228 CO 0.23 0.56 -0.08 -0.75 0.00 0.00 0.00 175.10 175.06 1o68 s LYS 229 N -0.22 2.69 -0.52 2.72 2.20 -1.26 -4.64 119.74 120.70 1o68 s LYS 229 Ca 0.01 -0.58 -0.24 0.00 -0.36 0.00 0.00 55.97 54.80 1o68 s LYS 229 Cb -0.13 -2.54 0.04 0.00 -1.51 0.00 0.00 37.83 33.68 1o68 s LYS 229 CO 0.03 0.65 0.92 1.21 -0.36 0.00 0.00 175.35 177.80 1o68 s ASN 230 N -0.83 6.38 -0.37 1.43 3.84 -1.26 -4.77 114.94 119.37 1o68 s ASN 230 Ca 0.12 -0.23 -0.04 0.00 0.21 0.00 0.00 52.86 52.92 1o68 s ASN 230 Cb -0.11 -2.43 -0.01 0.00 -0.55 0.00 0.00 41.25 38.15 1o68 s ASN 230 CO 0.02 -1.15 2.95 0.49 -2.79 0.00 0.00 177.10 176.61 1o68 n PHE 231 N 7.31 1.27 -0.93 0.43 3.01 -1.26 -4.89 117.46 122.40 1o68 n PHE 231 Ca 0.03 -1.85 0.00 0.00 1.01 0.00 0.00 57.45 56.63 1o68 n PHE 231 Cb 0.48 -1.43 0.00 0.00 -0.01 0.00 0.00 39.48 38.52 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 1.22 0.00 -0.96 -1.08 7.27 -1.26 -4.37 117.38 118.20 1o68 n GLN 233 Ca 0.48 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.55 1o68 n GLN 233 Cb 0.63 -0.31 0.00 0.00 2.41 0.00 0.00 30.24 32.97 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 0.60 0.48 3.16 1.69 0.00 -1.26 -5.03 105.19 104.83 1o68 n GLY 234 Ca 0.00 -0.31 -0.15 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.00 1.03 -1.21 1.61 3.76 -1.26 -5.09 115.29 112.13 1o68 s HIS 235 Ca 0.00 -0.58 0.26 0.00 -0.15 0.00 0.00 55.06 54.59 1o68 s HIS 235 Cb 0.00 -0.58 0.70 0.00 1.11 0.00 0.00 32.58 33.82 1o68 s HIS 235 CO 0.00 0.00 1.54 -0.40 -0.85 0.00 0.00 174.74 175.03 1o68 n ASP 236 N 0.89 0.55 -3.86 1.40 5.75 -1.26 -4.94 116.55 115.07 1o68 n ASP 236 Ca -0.18 -0.33 -0.07 0.00 -0.01 0.00 0.00 54.79 54.20 1o68 n ASP 236 Cb 0.56 0.11 -0.02 0.00 -1.03 0.00 0.00 41.12 40.75 1o68 n ASP 236 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1o68 s SER 237 N -2.85 -0.26 0.22 -1.12 1.04 -1.26 -4.98 113.70 104.49 1o68 s SER 237 Ca 0.16 -0.62 -0.04 0.00 0.48 0.00 0.00 55.95 55.93 1o68 s SER 237 Cb 0.18 0.72 0.21 0.00 0.10 0.00 0.00 66.02 67.24 1o68 s SER 237 CO 0.62 -1.34 1.66 0.58 0.98 0.00 0.00 173.24 175.75 1o68 h VAL 238 N 2.01 1.26 -0.90 5.02 2.07 -1.99 -1.49 116.25 122.23 1o68 h VAL 238 Ca -0.19 -1.23 -0.00 0.00 0.82 0.00 0.00 66.70 66.09 1o68 h VAL 238 Cb 1.25 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 32.05 1o68 h VAL 238 CO 0.24 0.42 0.55 1.56 0.02 0.00 0.00 177.57 180.35 1o68 h GLN 239 N 0.73 1.22 -0.16 1.57 7.50 -1.95 -1.90 115.11 122.12 1o68 h GLN 239 Ca 0.12 -0.11 -0.15 0.00 0.50 0.00 0.00 58.65 59.00 1o68 h GLN 239 Cb 0.64 -0.26 -0.01 0.00 0.05 0.00 0.00 27.48 27.90 1o68 h GLN 239 CO 0.04 0.85 -0.55 0.00 -1.50 0.00 0.00 178.83 177.68 1o68 h ALA 240 N 1.30 0.75 -0.65 3.87 0.00 -1.85 -2.02 119.26 120.66 1o68 h ALA 240 Ca 0.32 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1o68 h ALA 240 Cb -0.06 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1o68 h ALA 240 CO -0.06 0.69 0.34 0.00 0.00 0.00 0.00 179.25 180.21 1o68 h ALA 241 N 1.04 0.84 -0.28 0.00 0.00 -0.89 -0.69 119.26 119.27 1o68 h ALA 241 Ca 0.01 -0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.63 1o68 h ALA 241 Cb 1.08 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1o68 h ALA 241 CO 0.10 0.38 -0.50 0.28 0.00 0.00 0.00 179.25 179.50 1o68 h VAL 242 N 0.89 1.29 -0.45 0.00 2.07 -1.26 -2.32 116.25 116.48 1o68 h VAL 242 Ca 0.23 -1.70 -0.05 0.00 0.82 0.00 0.00 66.70 66.00 1o68 h VAL 242 Cb 0.08 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.43 1o68 h VAL 242 CO -0.03 0.55 0.06 0.03 0.02 0.00 0.00 177.57 178.19 1o68 h ARG 243 N 0.61 0.70 -0.10 1.57 3.08 -1.13 -1.79 114.38 117.32 1o68 h ARG 243 Ca 0.03 -0.15 -0.13 0.00 0.07 0.00 0.00 59.98 59.79 1o68 h ARG 243 Cb 1.08 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.02 1o68 h ARG 243 CO 0.11 0.68 -0.53 0.00 -1.07 0.00 0.00 179.97 179.15 1o68 h ALA 244 N 1.40 0.92 0.28 0.04 0.00 -0.98 -1.78 119.26 119.13 1o68 h ALA 244 Ca 0.14 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 1o68 h ALA 244 Cb 0.33 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1o68 h ALA 244 CO 0.01 0.68 -0.14 -0.92 0.00 0.00 0.00 179.25 178.88 1o68 h TYR 245 N 0.22 -0.35 -1.00 0.00 3.20 -1.03 -0.23 116.97 117.78 1o68 h TYR 245 Ca 0.01 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 61.96 1o68 h TYR 245 Cb 1.00 0.12 -0.07 0.00 1.54 0.00 0.00 36.73 39.32 1o68 h TYR 245 CO 0.02 -0.05 0.64 0.28 -1.64 0.00 0.00 178.16 177.42 1o68 h VAL 246 N -0.66 1.01 -0.32 1.81 2.07 -1.30 -1.00 116.25 117.87 1o68 h VAL 246 Ca -0.04 -0.37 -0.11 0.00 0.82 0.00 0.00 66.70 67.00 1o68 h VAL 246 Cb 0.46 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.05 1o68 h VAL 246 CO 0.06 0.20 -0.23 0.00 0.02 0.00 0.00 177.57 177.62 1o68 h ALA 247 N 1.50 0.46 0.00 1.67 0.00 -1.20 -1.79 119.26 119.90 1o68 h ALA 247 Ca 0.46 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1o68 h ALA 247 Cb 0.32 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1o68 h ALA 247 CO -0.21 0.44 -0.50 0.93 0.00 0.00 0.00 179.25 179.90 1o68 h GLU 248 N 0.49 0.00 -0.27 0.00 5.08 -0.67 -0.57 114.58 118.65 1o68 h GLU 248 Ca 0.06 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.34 1o68 h GLU 248 Cb 0.79 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 1o68 h GLU 248 CO 0.06 0.50 -0.16 0.28 -1.00 0.00 0.00 179.01 178.69 1o68 h VAL 249 N 0.00 1.30 0.00 3.13 2.07 -1.10 0.13 116.25 121.78 1o68 h VAL 249 Ca -0.01 -1.27 -0.09 0.00 0.82 0.00 0.00 66.70 66.15 1o68 h VAL 249 Cb 0.90 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 1o68 h VAL 249 CO 0.07 0.40 -0.45 0.11 0.02 0.00 0.00 177.57 177.72 1o68 h LYS 250 N 0.32 0.00 -0.01 1.57 1.57 -1.14 -2.69 116.57 116.19 1o68 h LYS 250 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1o68 h LYS 250 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 1o68 h LYS 250 CO 0.05 0.45 -0.16 0.00 -0.57 0.00 0.00 179.45 179.21 1o68 n ALA 251 N -2.35 2.88 -2.60 3.86 0.00 -0.24 -4.69 120.51 117.38 1o68 n ALA 251 Ca -0.01 -0.33 -0.19 0.00 0.00 0.00 0.00 53.44 52.91 1o68 n ALA 251 Cb 0.53 -1.24 0.01 0.00 0.00 0.00 0.00 19.45 18.74 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 -0.76 -2.70 0.00 0.00 4.01 -0.75 -4.89 118.16 113.07 1o68 n LYS 252 Ca 0.14 0.88 0.07 0.00 -0.51 0.00 0.00 58.31 58.89 1o68 n LYS 252 Cb 0.31 -5.48 -0.13 0.00 -0.51 0.00 0.00 35.03 29.22 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 -4.17 0.40 -5.14 -0.18 -2.24 0.36 -4.83 114.28 98.49 1o68 n THR 253 Ca -0.18 -0.57 -0.32 0.00 -2.27 0.00 0.00 64.05 60.71 1o68 n THR 253 Cb 0.65 -0.19 -0.16 0.00 -2.10 0.00 0.00 70.33 68.52 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 2.59 0.30 4.78 5.36 -0.68 -2.95 117.98 124.07 1o68 s PHE 254 Ca -0.06 -0.90 -0.28 0.00 -0.96 0.00 0.00 56.93 54.73 1o68 s PHE 254 Cb 0.12 -1.71 -0.09 0.00 -0.34 0.00 0.00 43.02 40.99 1o68 s PHE 254 CO 0.87 -0.33 1.01 -1.25 -1.46 0.00 0.00 175.22 174.05 1o68 s PRO 255 N 0.23 4.60 0.94 10.12 0.04 -1.26 -4.23 135.00 145.44 1o68 s PRO 255 Ca -0.14 1.54 -0.16 0.00 0.04 0.00 0.00 61.00 62.28 1o68 s PRO 255 Cb -0.17 -3.00 0.22 0.00 0.04 0.00 0.00 34.50 31.59 1o68 s PRO 255 CO 0.07 0.25 1.22 0.00 0.04 0.00 0.00 177.00 178.59 1o68 n ALA 256 N 0.89 -1.62 -0.10 8.56 0.00 -1.15 -4.58 120.51 122.50 1o68 n ALA 256 Ca 0.00 -1.61 0.02 0.00 0.00 0.00 0.00 53.44 51.85 1o68 n ALA 256 Cb 0.48 -0.08 0.33 0.00 0.00 0.00 0.00 19.45 20.17 1o68 n ALA 256 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o68 h ALA 257 N -1.90 1.56 0.00 0.00 0.00 -1.95 0.46 119.26 117.43 1o68 h ALA 257 Ca -0.40 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 1o68 h ALA 257 Cb 1.12 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 1o68 h ALA 257 CO 0.28 0.39 -0.14 0.93 0.00 0.00 0.00 179.25 180.71 1o68 h GLU 258 N 0.77 0.00 -0.34 0.00 5.08 -1.93 -2.92 114.58 115.24 1o68 h GLU 258 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1o68 h GLU 258 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1o68 h GLU 258 CO -0.04 0.14 0.00 0.72 -1.00 0.00 0.00 179.01 178.83 1o68 n HIS 259 N -3.60 0.44 -4.49 4.33 8.25 0.15 -4.70 115.22 115.59 1o68 n HIS 259 Ca -0.01 -0.22 -0.31 0.00 -0.26 0.00 0.00 57.72 56.92 1o68 n HIS 259 Cb 0.27 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.27 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 -1.56 3.15 -2.74 1.59 1.01 -1.11 -4.20 121.20 117.36 1o68 s ILE 260 Ca 0.36 -1.11 0.26 0.00 0.00 0.00 0.00 60.65 60.17 1o68 s ILE 260 Cb 0.21 -2.38 0.38 0.00 0.01 0.00 0.00 42.46 40.67 1o68 s ILE 260 CO 0.29 0.29 1.52 0.49 0.00 0.00 0.00 174.94 177.53