#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2diz s SER 2 N 0.00 6.34 0.68 1.61 0.15 -1.26 -5.06 113.70 116.17 2diz s SER 2 Ca 0.00 0.39 -0.17 0.00 0.70 0.00 0.00 55.95 56.87 2diz s SER 2 Cb 0.00 -2.13 -0.08 0.00 -1.71 0.00 0.00 66.02 62.10 2diz s SER 2 CO 0.00 0.17 0.24 -1.54 1.20 0.00 0.00 173.24 173.31 2diz n SER 3 N 3.34 -2.25 0.00 5.45 3.41 -1.26 -4.91 113.62 117.40 2diz n SER 3 Ca -0.15 0.58 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 2diz n SER 3 Cb 0.52 -1.08 0.00 0.00 -0.26 0.00 0.00 64.21 63.39 2diz n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2diz n GLY 4 N 2.05 -3.09 3.31 5.00 0.00 -1.26 -4.53 105.19 106.67 2diz n GLY 4 Ca 0.08 0.35 -0.35 0.00 0.00 0.00 0.00 46.02 46.10 2diz n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2diz s SER 5 N -2.50 4.30 0.07 1.61 0.15 -1.26 -5.00 113.70 111.07 2diz s SER 5 Ca 0.00 -0.41 -0.20 0.00 0.70 0.00 0.00 55.95 56.04 2diz s SER 5 Cb 0.00 -1.74 -0.11 0.00 -1.71 0.00 0.00 66.02 62.46 2diz s SER 5 CO 0.00 -0.03 1.50 0.77 1.20 0.00 0.00 173.24 176.68 2diz h SER 6 N 8.11 0.31 0.00 5.45 4.64 -1.84 -3.47 113.55 126.76 2diz h SER 6 Ca -0.41 -0.31 0.00 0.00 -0.47 0.00 0.00 61.79 60.60 2diz h SER 6 Cb 1.16 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2diz h SER 6 CO 0.60 0.55 0.00 0.61 -0.87 0.00 0.00 176.83 177.72 2diz n GLY 7 N -0.30 2.80 1.49 -0.77 0.00 -1.26 -4.62 105.19 102.53 2diz n GLY 7 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2diz n GLY 7 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2diz n THR 8 N -2.00 0.13 -3.62 2.61 -2.24 -1.26 -4.53 114.28 103.36 2diz n THR 8 Ca 0.00 0.04 -0.14 0.00 -2.27 0.00 0.00 64.05 61.68 2diz n THR 8 Cb 0.00 -1.02 -0.07 0.00 -2.10 0.00 0.00 70.33 67.14 2diz n THR 8 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2diz s VAL 9 N -2.00 0.00 -1.10 2.28 1.01 -1.26 -4.40 120.40 114.93 2diz s VAL 9 Ca 0.00 -0.00 -0.12 0.00 0.00 0.00 0.00 61.98 61.86 2diz s VAL 9 Cb 0.00 -0.97 0.22 0.00 0.00 0.00 0.00 36.38 35.63 2diz s VAL 9 CO 0.00 -0.00 1.18 -0.76 0.00 0.00 0.00 175.10 175.52 2diz s LEU 10 N 0.14 5.86 -0.75 3.92 1.02 0.15 -4.72 118.68 124.30 2diz s LEU 10 Ca -0.02 -3.18 -0.25 0.00 0.02 0.00 0.00 54.13 50.71 2diz s LEU 10 Cb -0.04 -2.29 -0.14 0.00 0.02 0.00 0.00 46.19 43.74 2diz s LEU 10 CO 0.02 -0.53 2.40 0.00 0.02 0.00 0.00 176.35 178.27 2diz n ALA 11 N 4.13 0.49 -1.66 4.21 0.00 -1.26 -3.01 120.51 123.40 2diz n ALA 11 Ca 0.27 -1.23 -0.33 0.00 0.00 0.00 0.00 53.44 52.15 2diz n ALA 11 Cb 0.42 -3.18 0.01 0.00 0.00 0.00 0.00 19.45 16.70 2diz n ALA 11 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2diz s LEU 12 N 13.04 3.53 0.21 0.00 1.43 -1.21 -4.96 118.68 130.72 2diz s LEU 12 Ca 0.98 1.88 0.06 0.00 -1.03 0.00 0.00 54.13 56.03 2diz s LEU 12 Cb -0.22 -4.54 -0.05 0.00 0.03 0.00 0.00 46.19 41.41 2diz s LEU 12 CO 0.17 -1.21 -0.10 0.42 0.23 0.00 0.00 176.35 175.86 2diz s THR 13 N -2.34 1.50 -0.26 5.49 -4.23 -1.26 -4.88 115.64 109.67 2diz s THR 13 Ca 0.65 -2.14 0.16 0.00 -1.18 0.00 0.00 61.69 59.18 2diz s THR 13 Cb -0.17 -2.11 0.16 0.00 1.34 0.00 0.00 72.50 71.72 2diz s THR 13 CO 0.35 -0.55 1.46 -0.62 -0.54 0.00 0.00 174.62 174.72 2diz n GLU 14 N -0.38 0.11 -0.05 3.99 4.71 -1.26 0.15 120.64 127.91 2diz n GLU 14 Ca -0.08 0.59 -0.11 0.00 -0.01 0.00 0.00 57.16 57.56 2diz n GLU 14 Cb 0.61 -1.93 -0.15 0.00 -1.01 0.00 0.00 31.44 28.97 2diz n GLU 14 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2diz n ASN 15 N -2.08 0.76 -2.47 1.62 3.02 -1.26 -4.46 115.26 110.39 2diz n ASN 15 Ca -0.01 0.24 -0.11 0.00 -0.03 0.00 0.00 54.58 54.67 2diz n ASN 15 Cb 0.10 0.18 0.04 0.00 -0.61 0.00 0.00 39.78 39.49 2diz n ASN 15 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2diz n ASN 16 N -3.00 3.10 -0.07 6.41 6.94 0.21 -4.82 115.26 124.03 2diz n ASN 16 Ca -0.25 -2.82 -0.22 0.00 -0.02 0.00 0.00 54.58 51.27 2diz n ASN 16 Cb 1.08 -0.42 -0.12 0.00 -2.36 0.00 0.00 39.78 37.96 2diz n ASN 16 CO 0.00 0.00 0.00 0.33 -1.03 0.00 0.00 177.26 176.56 2diz n PHE 17 N -0.64 0.94 -0.03 -2.53 -0.00 0.39 -4.03 117.46 111.57 2diz n PHE 17 Ca 0.24 0.32 -0.11 0.00 -0.00 0.00 0.00 57.45 57.90 2diz n PHE 17 Cb 0.88 -1.11 -0.09 0.00 -0.00 0.00 0.00 39.48 39.16 2diz n PHE 17 CO 0.00 0.00 0.00 0.38 -0.00 0.00 0.00 176.76 177.14 2diz h ASP 18 N -0.61 -0.05 -0.98 -2.13 2.03 -1.88 -3.23 116.42 109.56 2diz h ASP 18 Ca -0.42 -0.59 0.33 0.00 -0.73 0.00 0.00 57.03 55.62 2diz h ASP 18 Cb 1.60 0.01 -0.16 0.00 -0.83 0.00 0.00 39.33 39.95 2diz h ASP 18 CO -0.13 0.68 0.47 0.44 -1.03 0.00 0.00 179.24 179.67 2diz h ASP 19 N -0.91 0.32 0.00 4.15 3.32 -1.88 0.63 116.42 122.06 2diz h ASP 19 Ca -0.01 0.21 0.00 0.00 0.02 0.00 0.00 57.03 57.26 2diz h ASP 19 Cb 0.64 0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.40 2diz h ASP 19 CO 0.01 -0.23 0.00 0.41 -1.72 0.00 0.00 179.24 177.72 2diz n THR 20 N -5.16 0.00 0.27 0.35 -1.04 -1.24 -2.45 114.28 105.01 2diz n THR 20 Ca 0.31 1.42 0.10 0.00 -2.04 0.00 0.00 64.05 63.84 2diz n THR 20 Cb 0.99 -2.42 0.53 0.00 -1.82 0.00 0.00 70.33 67.61 2diz n THR 20 CO 0.00 0.00 0.00 0.16 -0.64 0.00 0.00 175.07 174.59 2diz h ILE 21 N 0.00 0.00 -0.20 12.58 3.07 -1.41 0.24 117.51 131.79 2diz h ILE 21 Ca 0.00 0.00 -0.03 0.00 1.55 0.00 0.00 64.86 66.38 2diz h ILE 21 Cb 0.00 0.43 -0.01 0.00 -0.27 0.00 0.00 36.82 36.97 2diz h ILE 21 CO 0.00 0.00 -0.02 0.00 -1.05 0.00 0.00 178.15 177.08 2diz h ALA 22 N 1.08 1.61 -3.05 0.16 0.00 -0.56 -2.85 119.26 115.64 2diz h ALA 22 Ca 0.00 -0.14 -0.67 0.00 0.00 0.00 0.00 54.91 54.10 2diz h ALA 22 Cb 0.83 -0.09 -0.11 0.00 0.00 0.00 0.00 17.79 18.41 2diz h ALA 22 CO 0.00 0.29 -0.57 -1.21 0.00 0.00 0.00 179.25 177.77 2diz s GLU 23 N -4.95 3.15 0.21 0.00 0.41 0.83 -4.29 118.70 114.07 2diz s GLU 23 Ca -0.06 -0.32 0.00 0.00 -0.41 0.00 0.00 54.97 54.18 2diz s GLU 23 Cb 0.16 -2.94 0.00 0.00 -1.78 0.00 0.00 34.13 29.57 2diz s GLU 23 CO 0.73 0.72 0.00 0.41 -0.49 0.00 0.00 175.26 176.63 2diz n GLY 24 N 1.94 0.55 3.81 -1.39 0.00 -1.26 -4.56 105.19 104.28 2diz n GLY 24 Ca -0.18 -0.87 -0.37 0.00 0.00 0.00 0.00 46.02 44.60 2diz n GLY 24 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2diz s ILE 25 N 0.00 5.35 -0.16 -0.61 1.01 -1.26 -3.84 121.20 121.69 2diz s ILE 25 Ca 0.00 0.42 -0.02 0.00 0.00 0.00 0.00 60.65 61.05 2diz s ILE 25 Cb 0.00 -3.53 0.05 0.00 0.01 0.00 0.00 42.46 38.99 2diz s ILE 25 CO 0.00 0.52 0.01 -0.89 0.00 0.00 0.00 174.94 174.58 2diz s THR 26 N -0.44 0.65 -0.42 2.92 2.01 -1.06 -0.45 115.64 118.85 2diz s THR 26 Ca 0.16 -0.44 -0.21 0.00 0.31 0.00 0.00 61.69 61.51 2diz s THR 26 Cb -0.13 -1.00 0.02 0.00 0.01 0.00 0.00 72.50 71.40 2diz s THR 26 CO 0.05 -0.03 0.66 0.12 -0.69 0.00 0.00 174.62 174.73 2diz s PHE 27 N 1.82 3.07 0.14 4.92 5.36 0.15 -3.16 117.98 130.28 2diz s PHE 27 Ca 0.01 0.05 0.04 0.00 -0.96 0.00 0.00 56.93 56.06 2diz s PHE 27 Cb -0.16 -3.34 -0.04 0.00 -0.34 0.00 0.00 43.02 39.14 2diz s PHE 27 CO -0.07 -0.84 0.17 0.42 -1.46 0.00 0.00 175.22 173.44 2diz s ILE 28 N 2.85 4.78 -0.14 3.12 1.01 -1.15 -1.29 121.20 130.39 2diz s ILE 28 Ca 0.24 -0.87 -0.02 0.00 0.00 0.00 0.00 60.65 60.00 2diz s ILE 28 Cb -0.14 -3.41 0.04 0.00 0.01 0.00 0.00 42.46 38.96 2diz s ILE 28 CO 0.19 -0.04 0.00 -0.75 0.00 0.00 0.00 174.94 174.34 2diz s LYS 29 N -2.95 0.79 -0.36 2.79 2.36 -1.20 -2.69 119.74 118.47 2diz s LYS 29 Ca 0.32 -0.21 -0.20 0.00 -2.55 0.00 0.00 55.97 53.33 2diz s LYS 29 Cb -0.11 -1.60 0.00 0.00 -1.05 0.00 0.00 37.83 35.07 2diz s LYS 29 CO 0.25 -0.45 0.62 -0.06 1.55 0.00 0.00 175.35 177.26 2diz s PHE 30 N 1.87 3.15 0.23 4.03 0.40 0.52 -1.55 117.98 126.62 2diz s PHE 30 Ca 0.02 0.28 0.03 0.00 -0.60 0.00 0.00 56.93 56.66 2diz s PHE 30 Cb -0.15 -3.13 -0.01 0.00 0.51 0.00 0.00 43.02 40.24 2diz s PHE 30 CO -0.07 -0.64 0.09 2.48 0.70 0.00 0.00 175.22 177.78 2diz n TYR 31 N 6.02 0.03 -4.32 0.36 4.11 -0.63 -1.25 117.16 121.48 2diz n TYR 31 Ca -0.02 -1.52 -0.21 0.00 -0.00 0.00 0.00 57.90 56.15 2diz n TYR 31 Cb 0.49 0.01 -0.16 0.00 -0.00 0.00 0.00 39.34 39.67 2diz n TYR 31 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2diz s ALA 32 N -2.65 0.88 -2.00 -3.48 0.00 -1.26 -0.39 121.76 112.86 2diz s ALA 32 Ca 0.13 -0.18 0.13 0.00 0.00 0.00 0.00 51.96 52.04 2diz s ALA 32 Cb 0.01 -0.46 0.77 0.00 0.00 0.00 0.00 23.12 23.44 2diz s ALA 32 CO 0.09 0.04 1.20 -0.35 0.00 0.00 0.00 175.76 176.74 2diz n PRO 33 N 3.93 0.49 -0.02 0.00 -0.04 -1.26 -2.17 135.00 135.93 2diz n PRO 33 Ca -0.25 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.23 2diz n PRO 33 Cb 0.51 -1.41 -0.07 0.00 -0.04 0.00 0.00 33.50 32.49 2diz n PRO 33 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2diz n TRP 34 N -0.91 0.00 -2.41 0.54 4.27 -1.26 -4.96 117.44 112.71 2diz n TRP 34 Ca 0.10 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.28 2diz n TRP 34 Cb 0.04 -0.27 -0.02 0.00 -1.36 0.00 0.00 31.31 29.70 2diz n TRP 34 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2diz h GLY 36 N 11.03 1.46 0.95 0.00 0.00 -1.93 -2.50 103.07 112.07 2diz h GLY 36 Ca -0.26 -0.49 0.01 0.00 0.00 0.00 0.00 47.33 46.59 2diz h GLY 36 CO 1.04 0.40 0.20 0.45 0.00 0.00 0.00 176.54 178.63 2diz h HIS 37 N 1.23 0.38 -0.24 5.60 3.86 -1.95 -1.50 115.15 122.53 2diz h HIS 37 Ca 0.40 0.01 0.07 0.00 -1.16 0.00 0.00 60.37 59.69 2diz h HIS 37 Cb 0.04 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.37 2diz h HIS 37 CO -0.00 0.23 0.24 0.00 0.86 0.00 0.00 177.93 179.26 2diz h LYS 39 N 0.00 0.00 0.00 0.00 1.57 -1.10 -1.48 116.57 115.56 2diz h LYS 39 Ca 0.12 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.86 2diz h LYS 39 Cb 0.59 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.90 2diz h LYS 39 CO -0.00 0.16 -0.16 0.00 -0.57 0.00 0.00 179.45 178.87 2diz h THR 40 N 0.00 0.44 -0.00 -0.16 1.03 -0.82 -2.66 112.91 110.73 2diz h THR 40 Ca -0.00 -0.90 0.00 0.00 -0.01 0.00 0.00 66.41 65.50 2diz h THR 40 Cb 0.33 1.64 0.00 0.00 -1.07 0.00 0.00 68.15 69.05 2diz h THR 40 CO 0.02 0.16 -0.91 -0.11 -0.01 0.00 0.00 175.52 174.67 2diz n LEU 41 N -3.36 1.18 -0.03 0.00 7.94 -0.63 -4.36 117.00 117.74 2diz n LEU 41 Ca -0.00 -0.54 -0.14 0.00 -1.11 0.00 0.00 56.01 54.21 2diz n LEU 41 Cb 0.37 -0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.23 2diz n LEU 41 CO 0.31 0.27 0.50 0.00 -1.11 0.00 0.00 177.39 177.37 2diz h ALA 42 N 3.16 -0.86 -0.33 1.96 0.00 -0.99 0.24 119.26 122.44 2diz h ALA 42 Ca 0.00 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 2diz h ALA 42 Cb 0.55 1.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.34 2diz h ALA 42 CO 0.00 -1.06 -0.32 -1.00 0.00 0.00 0.00 179.25 176.87 2diz h PRO 43 N -0.53 0.80 -0.48 0.00 0.13 -1.80 -3.08 132.00 127.04 2diz h PRO 43 Ca 0.04 -0.42 0.07 0.00 -0.87 0.00 0.00 66.00 64.82 2diz h PRO 43 Cb 0.64 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.75 2diz h PRO 43 CO -0.44 1.05 0.32 1.15 -0.23 0.00 0.00 178.00 179.85 2diz h THR 44 N 0.57 0.93 -0.16 1.56 2.02 -1.69 -1.99 112.91 114.16 2diz h THR 44 Ca 0.05 -0.12 -0.04 0.00 0.77 0.00 0.00 66.41 67.08 2diz h THR 44 Cb 0.90 0.57 -0.00 0.00 -1.74 0.00 0.00 68.15 67.87 2diz h THR 44 CO 0.08 0.06 -0.07 -0.25 0.37 0.00 0.00 175.52 175.71 2diz h TRP 45 N 0.34 0.37 -0.22 3.16 2.91 -0.45 -3.09 115.95 118.97 2diz h TRP 45 Ca 0.21 -0.09 0.04 0.00 1.13 0.00 0.00 58.89 60.19 2diz h TRP 45 Cb 0.41 -0.09 -0.04 0.00 -0.51 0.00 0.00 29.16 28.93 2diz h TRP 45 CO -0.00 0.64 -0.06 0.93 -1.03 0.00 0.00 178.44 178.91 2diz h GLU 46 N 0.00 -0.01 -0.63 2.65 5.08 -1.34 -2.35 114.58 117.98 2diz h GLU 46 Ca 0.04 0.00 0.13 0.00 -1.00 0.00 0.00 59.36 58.53 2diz h GLU 46 Cb 0.53 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.67 2diz h GLU 46 CO 0.02 -0.01 -0.04 0.93 -1.00 0.00 0.00 179.01 178.91 2diz h GLU 47 N -0.01 0.08 -0.93 2.33 4.39 -1.46 0.67 114.58 119.65 2diz h GLU 47 Ca 0.11 -0.00 0.26 0.00 0.34 0.00 0.00 59.36 60.06 2diz h GLU 47 Cb 0.17 -0.02 -0.14 0.00 -0.10 0.00 0.00 28.75 28.66 2diz h GLU 47 CO -0.23 0.05 0.39 1.25 -1.16 0.00 0.00 179.01 179.31 2diz h LEU 48 N 0.08 0.26 -1.14 1.33 5.85 -1.33 0.56 115.31 120.92 2diz h LEU 48 Ca 0.33 0.18 0.05 0.00 0.84 0.00 0.00 57.88 59.28 2diz h LEU 48 Cb 0.53 0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.69 2diz h LEU 48 CO -0.58 -0.11 0.59 0.77 -0.34 0.00 0.00 178.44 178.78 2diz h SER 49 N 0.30 0.94 0.17 1.25 4.64 -0.84 -1.05 113.55 118.96 2diz h SER 49 Ca 0.62 -0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.86 2diz h SER 49 Cb 1.28 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 63.16 2diz h SER 49 CO -0.61 0.63 -0.26 0.11 -0.87 0.00 0.00 176.83 175.83 2diz h LYS 50 N 1.08 0.15 -6.96 4.77 1.57 0.17 -3.45 116.57 113.91 2diz h LYS 50 Ca 0.37 -0.05 -0.53 0.00 -1.87 0.00 0.00 60.65 58.57 2diz h LYS 50 Cb 0.09 -0.01 0.21 0.00 0.08 0.00 0.00 32.23 32.60 2diz h LYS 50 CO -0.12 0.41 -0.29 1.63 -0.57 0.00 0.00 179.45 180.51 2diz n LYS 51 N -4.18 -0.35 -3.82 3.15 4.76 -0.40 -5.02 118.16 112.31 2diz n LYS 51 Ca -0.01 -0.05 -0.27 0.00 -2.87 0.00 0.00 58.31 55.10 2diz n LYS 51 Cb 0.35 -2.04 -0.17 0.00 -1.84 0.00 0.00 35.03 31.33 2diz n LYS 51 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2diz s GLU 52 N -3.99 1.04 -0.37 1.97 0.41 -1.26 -5.04 118.70 111.46 2diz s GLU 52 Ca 0.60 -0.39 -0.29 0.00 -0.41 0.00 0.00 54.97 54.49 2diz s GLU 52 Cb -0.22 -1.87 0.02 0.00 -1.78 0.00 0.00 34.13 30.28 2diz s GLU 52 CO 0.64 -0.48 1.07 -0.06 -0.49 0.00 0.00 175.26 175.94 2diz s PHE 53 N 1.76 3.04 0.59 1.61 0.40 -1.26 -5.02 117.98 119.10 2diz s PHE 53 Ca 0.01 0.99 -0.18 0.00 -0.60 0.00 0.00 56.93 57.15 2diz s PHE 53 Cb -0.15 -3.90 -0.04 0.00 0.51 0.00 0.00 43.02 39.44 2diz s PHE 53 CO -0.07 -0.92 1.12 -1.25 0.70 0.00 0.00 175.22 174.80 2diz s PRO 54 N 3.86 3.14 0.00 0.24 0.04 -1.26 -3.23 135.00 137.79 2diz s PRO 54 Ca 0.45 1.52 0.00 0.00 0.04 0.00 0.00 61.00 63.01 2diz s PRO 54 Cb -0.11 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.45 2diz s PRO 54 CO 0.21 -1.00 0.00 0.41 0.04 0.00 0.00 177.00 176.66 2diz n GLY 55 N -0.12 -0.34 3.35 0.56 0.00 -1.26 -4.84 105.19 102.53 2diz n GLY 55 Ca 0.11 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 2diz n GLY 55 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2diz s LEU 56 N -3.78 2.40 0.71 0.99 1.43 -1.20 -5.08 118.68 114.14 2diz s LEU 56 Ca 0.00 -0.82 -0.16 0.00 -1.03 0.00 0.00 54.13 52.12 2diz s LEU 56 Cb 0.00 -0.96 0.02 0.00 0.03 0.00 0.00 46.19 45.28 2diz s LEU 56 CO 0.00 0.04 1.23 0.00 0.23 0.00 0.00 176.35 177.85 2diz s ALA 57 N -1.71 2.19 -0.79 4.21 0.00 -1.26 -4.74 121.76 119.66 2diz s ALA 57 Ca 0.15 0.98 -0.19 0.00 0.00 0.00 0.00 51.96 52.91 2diz s ALA 57 Cb -0.07 -3.50 -0.18 0.00 0.00 0.00 0.00 23.12 19.37 2diz s ALA 57 CO 0.07 -1.80 2.02 0.41 0.00 0.00 0.00 175.76 176.46 2diz n GLY 58 N 0.56 -0.29 3.57 0.00 0.00 -1.26 -4.81 105.19 102.96 2diz n GLY 58 Ca 0.14 0.13 -0.40 0.00 0.00 0.00 0.00 46.02 45.89 2diz n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2diz s VAL 59 N 10.74 3.49 0.05 1.61 1.01 -1.26 -4.03 120.40 132.01 2diz s VAL 59 Ca 0.79 0.39 -0.28 0.00 0.00 0.00 0.00 61.98 62.88 2diz s VAL 59 Cb -0.20 -3.97 -0.05 0.00 0.00 0.00 0.00 36.38 32.17 2diz s VAL 59 CO 0.18 -0.83 0.87 -0.54 0.00 0.00 0.00 175.10 174.79 2diz s LYS 60 N 6.33 4.58 -0.35 2.72 1.02 0.40 -4.88 119.74 129.55 2diz s LYS 60 Ca 0.67 1.26 -0.11 0.00 0.02 0.00 0.00 55.97 57.81 2diz s LYS 60 Cb -0.15 -3.40 0.00 0.00 -0.52 0.00 0.00 37.83 33.77 2diz s LYS 60 CO 0.25 0.17 0.20 0.42 -0.92 0.00 0.00 175.35 175.47 2diz s ILE 61 N 0.27 4.81 0.52 2.17 -1.09 -1.26 0.34 121.20 126.96 2diz s ILE 61 Ca 0.44 -0.54 0.01 0.00 -2.23 0.00 0.00 60.65 58.33 2diz s ILE 61 Cb -0.21 -3.55 -0.01 0.00 -1.58 0.00 0.00 42.46 37.11 2diz s ILE 61 CO 0.26 -0.09 0.02 0.00 -1.23 0.00 0.00 174.94 173.90 2diz s ALA 62 N 1.63 4.20 -0.02 9.38 0.00 -0.41 0.33 121.76 136.86 2diz s ALA 62 Ca 0.04 -0.26 -0.18 0.00 0.00 0.00 0.00 51.96 51.56 2diz s ALA 62 Cb -0.18 -0.02 0.03 0.00 0.00 0.00 0.00 23.12 22.96 2diz s ALA 62 CO 0.08 -0.03 0.38 -1.83 0.00 0.00 0.00 175.76 174.36 2diz s GLU 63 N -3.91 0.75 -0.05 0.00 -1.05 -1.16 -3.23 118.70 110.05 2diz s GLU 63 Ca 0.05 -0.10 -0.02 0.00 -0.15 0.00 0.00 54.97 54.74 2diz s GLU 63 Cb 0.01 0.34 0.03 0.00 -0.44 0.00 0.00 34.13 34.06 2diz s GLU 63 CO 0.03 -0.21 0.11 0.08 0.95 0.00 0.00 175.26 176.21 2diz s VAL 64 N -1.31 -0.04 0.06 1.83 1.01 -0.60 -3.32 120.40 118.03 2diz s VAL 64 Ca -0.13 0.13 -0.12 0.00 0.00 0.00 0.00 61.98 61.86 2diz s VAL 64 Cb -0.04 -0.18 -0.06 0.00 0.00 0.00 0.00 36.38 36.10 2diz s VAL 64 CO 0.05 0.05 0.42 -1.81 0.00 0.00 0.00 175.10 173.82 2diz s ASP 65 N 0.82 6.73 -0.13 3.32 1.11 -1.26 -1.60 116.67 125.65 2diz s ASP 65 Ca -0.06 0.89 0.08 0.00 0.18 0.00 0.00 52.55 53.64 2diz s ASP 65 Cb -0.09 -2.22 0.45 0.00 1.07 0.00 0.00 42.92 42.14 2diz s ASP 65 CO -0.04 0.22 1.19 0.00 1.18 0.00 0.00 175.17 177.72 2diz n THR 67 N 0.34 0.11 -0.06 0.00 -2.24 -1.26 -4.43 114.28 106.73 2diz n THR 67 Ca 0.15 -0.07 -0.08 0.00 -2.27 0.00 0.00 64.05 61.79 2diz n THR 67 Cb 0.78 -0.94 -0.07 0.00 -2.10 0.00 0.00 70.33 68.00 2diz n THR 67 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2diz n ALA 68 N -2.05 1.73 -1.23 6.98 0.00 -1.25 -4.60 120.51 120.09 2diz n ALA 68 Ca -0.03 -0.59 -0.08 0.00 0.00 0.00 0.00 53.44 52.74 2diz n ALA 68 Cb 0.55 0.15 0.23 0.00 0.00 0.00 0.00 19.45 20.37 2diz n ALA 68 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2diz n GLU 69 N -2.71 2.55 -0.34 0.00 1.02 -0.95 -4.75 120.64 115.46 2diz n GLU 69 Ca -0.21 -3.07 0.02 0.00 -0.02 0.00 0.00 57.16 53.88 2diz n GLU 69 Cb 0.77 -2.02 0.08 0.00 -0.02 0.00 0.00 31.44 30.25 2diz n GLU 69 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2diz n ARG 70 N -0.82 -0.16 -0.24 3.49 1.74 -1.24 0.53 116.66 119.97 2diz n ARG 70 Ca 0.41 1.42 0.18 0.00 -0.77 0.00 0.00 57.85 59.09 2diz n ARG 70 Cb 1.28 -2.12 0.33 0.00 -1.02 0.00 0.00 32.46 30.94 2diz n ARG 70 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2diz n ASN 71 N -5.42 0.10 -0.05 0.55 3.02 -1.26 0.82 115.26 113.02 2diz n ASN 71 Ca 0.12 1.21 -0.14 0.00 -0.03 0.00 0.00 54.58 55.74 2diz n ASN 71 Cb 0.41 -0.52 -0.12 0.00 -0.61 0.00 0.00 39.78 38.93 2diz n ASN 71 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2diz h ILE 72 N 0.00 1.68 -0.35 2.41 2.04 -0.30 -3.09 117.51 119.90 2diz h ILE 72 Ca 0.53 -2.03 0.08 0.00 1.00 0.00 0.00 64.86 64.44 2diz h ILE 72 Cb 1.30 3.06 -0.08 0.00 -0.74 0.00 0.00 36.82 40.36 2diz h ILE 72 CO -0.61 0.53 -0.20 0.00 0.00 0.00 0.00 178.15 177.87 2diz h SER 74 N -0.15 0.74 -0.79 0.00 0.87 -0.68 -0.70 113.55 112.84 2diz h SER 74 Ca 0.18 0.04 0.06 0.00 -1.23 0.00 0.00 61.79 60.84 2diz h SER 74 Cb 0.42 -0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 62.22 2diz h SER 74 CO -0.44 0.44 0.52 0.50 -0.53 0.00 0.00 176.83 177.32 2diz h LYS 75 N 0.86 0.84 -0.89 2.24 3.11 -1.07 -0.03 116.57 121.64 2diz h LYS 75 Ca 0.39 -0.05 -0.19 0.00 -2.81 0.00 0.00 60.65 57.99 2diz h LYS 75 Cb 0.31 -0.19 -0.11 0.00 -1.00 0.00 0.00 32.23 31.23 2diz h LYS 75 CO -0.22 0.55 0.24 0.66 -2.81 0.00 0.00 179.45 177.87 2diz n TYR 76 N -4.48 1.69 -2.57 1.91 4.01 -0.36 -4.87 117.16 112.49 2diz n TYR 76 Ca 0.12 -0.98 -0.05 0.00 -0.16 0.00 0.00 57.90 56.83 2diz n TYR 76 Cb 0.21 -0.56 -0.01 0.00 -0.31 0.00 0.00 39.34 38.67 2diz n TYR 76 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2diz n SER 77 N -0.15 -1.01 -4.58 7.72 2.88 -0.02 -4.77 113.62 113.69 2diz n SER 77 Ca 0.29 0.27 -0.41 0.00 -1.33 0.00 0.00 58.87 57.70 2diz n SER 77 Cb 1.08 -0.98 -0.03 0.00 -0.75 0.00 0.00 64.21 63.53 2diz n SER 77 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2diz s VAL 78 N -1.98 3.65 0.00 2.46 1.01 -0.65 -4.72 120.40 120.16 2diz s VAL 78 Ca 0.09 0.56 0.00 0.00 0.00 0.00 0.00 61.98 62.63 2diz s VAL 78 Cb -0.05 -4.19 0.00 0.00 0.00 0.00 0.00 36.38 32.14 2diz s VAL 78 CO 0.11 -0.97 0.00 0.54 0.00 0.00 0.00 175.10 174.78 2diz n ARG 79 N 8.70 3.43 -3.45 2.72 1.74 -1.26 -4.68 116.66 123.85 2diz n ARG 79 Ca 0.16 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.81 2diz n ARG 79 Cb 0.49 -0.98 -0.08 0.00 -1.02 0.00 0.00 32.46 30.87 2diz n ARG 79 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2diz s GLY 80 N -3.05 2.04 0.13 -0.13 0.00 -1.26 -5.07 107.32 99.98 2diz s GLY 80 Ca 0.00 -2.34 0.02 0.00 0.00 0.00 0.00 44.72 42.40 2diz s GLY 80 CO 0.00 1.09 0.27 -0.19 0.00 0.00 0.00 173.10 174.27 2diz s TYR 81 N 1.52 3.49 0.73 1.90 2.02 -1.26 -3.99 117.35 121.76 2diz s TYR 81 Ca 0.04 0.15 -0.12 0.00 -0.37 0.00 0.00 57.07 56.77 2diz s TYR 81 Cb -0.26 -1.69 0.04 0.00 -0.40 0.00 0.00 41.96 39.65 2diz s TYR 81 CO 0.03 0.53 1.10 -1.25 -1.57 0.00 0.00 175.55 174.39 2diz s PRO 82 N -3.06 2.44 -0.07 -1.71 0.04 -1.26 -4.83 135.00 126.54 2diz s PRO 82 Ca 0.35 1.25 0.01 0.00 0.04 0.00 0.00 61.00 62.64 2diz s PRO 82 Cb -0.11 -1.91 0.02 0.00 0.04 0.00 0.00 34.50 32.53 2diz s PRO 82 CO 0.28 -1.51 -0.07 0.99 0.04 0.00 0.00 177.00 176.73 2diz s THR 83 N -2.70 0.82 -0.07 1.26 2.01 -0.38 -5.01 115.64 111.57 2diz s THR 83 Ca 0.63 -0.24 0.03 0.00 0.31 0.00 0.00 61.69 62.42 2diz s THR 83 Cb -0.18 -0.82 -0.02 0.00 0.01 0.00 0.00 72.50 71.48 2diz s THR 83 CO 0.51 0.30 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.84 2diz s LEU 84 N 1.16 2.74 -0.16 4.42 1.43 -1.26 -0.35 118.68 126.66 2diz s LEU 84 Ca -0.06 -0.22 -0.08 0.00 -1.03 0.00 0.00 54.13 52.74 2diz s LEU 84 Cb -0.14 -1.57 0.06 0.00 0.03 0.00 0.00 46.19 44.57 2diz s LEU 84 CO -0.01 0.31 0.37 -0.76 0.23 0.00 0.00 176.35 176.49 2diz s LEU 85 N -0.51 -0.15 0.15 1.79 1.43 -1.10 -3.52 118.68 116.76 2diz s LEU 85 Ca 0.07 0.83 -0.08 0.00 -1.03 0.00 0.00 54.13 53.92 2diz s LEU 85 Cb -0.12 1.19 -0.06 0.00 0.03 0.00 0.00 46.19 47.23 2diz s LEU 85 CO 0.02 -0.20 0.44 -0.22 0.23 0.00 0.00 176.35 176.61 2diz s LEU 86 N 1.73 4.26 -0.06 1.79 2.96 -1.04 -2.92 118.68 125.40 2diz s LEU 86 Ca -0.07 0.76 0.00 0.00 -0.22 0.00 0.00 54.13 54.60 2diz s LEU 86 Cb -0.10 -3.33 0.02 0.00 0.50 0.00 0.00 46.19 43.29 2diz s LEU 86 CO -0.12 0.05 -0.04 -0.36 -1.32 0.00 0.00 176.35 174.56 2diz s PHE 87 N -1.63 0.89 -0.18 5.38 0.40 -1.19 0.14 117.98 121.79 2diz s PHE 87 Ca 0.41 -0.30 0.01 0.00 -0.60 0.00 0.00 56.93 56.44 2diz s PHE 87 Cb -0.12 -0.82 0.03 0.00 0.51 0.00 0.00 43.02 42.62 2diz s PHE 87 CO 0.22 -0.29 -0.12 0.50 0.70 0.00 0.00 175.22 176.23 2diz s ARG 88 N 1.34 2.13 0.00 0.44 3.52 -0.29 -2.57 118.95 123.51 2diz s ARG 88 Ca -0.04 -0.73 0.00 0.00 -0.13 0.00 0.00 55.73 54.83 2diz s ARG 88 Cb -0.14 -2.29 0.00 0.00 -1.56 0.00 0.00 34.95 30.96 2diz s ARG 88 CO -0.02 -0.35 0.00 0.41 -0.81 0.00 0.00 175.30 174.52 2diz n GLY 89 N 4.72 2.97 0.00 8.12 0.00 -1.25 -3.81 105.19 115.95 2diz n GLY 89 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2diz n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2diz n GLY 90 N -0.69 0.03 3.40 -0.02 0.00 -1.08 -4.53 105.19 102.30 2diz n GLY 90 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2diz n GLY 90 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2diz s LYS 91 N 0.00 1.47 0.91 1.61 -2.85 -1.25 -4.77 119.74 114.86 2diz s LYS 91 Ca 0.00 -1.70 -0.10 0.00 -1.00 0.00 0.00 55.97 53.17 2diz s LYS 91 Cb 0.00 -1.21 0.14 0.00 -2.06 0.00 0.00 37.83 34.71 2diz s LYS 91 CO 0.00 0.13 1.15 -1.59 0.10 0.00 0.00 175.35 175.14 2diz s LYS 92 N -3.67 1.03 0.11 1.78 -2.85 -1.26 -1.14 119.74 113.74 2diz s LYS 92 Ca 0.27 1.57 0.00 0.00 -1.00 0.00 0.00 55.97 56.81 2diz s LYS 92 Cb 0.01 -1.73 0.00 0.00 -2.06 0.00 0.00 37.83 34.05 2diz s LYS 92 CO 0.10 -2.63 0.00 0.28 0.10 0.00 0.00 175.35 173.20 2diz n VAL 93 N -4.19 0.94 -3.96 1.79 0.31 0.38 -4.63 118.33 108.96 2diz n VAL 93 Ca 0.12 0.31 -0.09 0.00 -0.01 0.00 0.00 64.34 64.67 2diz n VAL 93 Cb 0.52 -1.43 -0.04 0.00 -0.91 0.00 0.00 33.84 31.98 2diz n VAL 93 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2diz s SER 94 N -5.76 -0.03 -0.29 4.52 0.15 -1.25 -5.00 113.70 106.04 2diz s SER 94 Ca 0.00 -0.93 0.03 0.00 0.70 0.00 0.00 55.95 55.75 2diz s SER 94 Cb 0.00 0.64 0.08 0.00 -1.71 0.00 0.00 66.02 65.03 2diz s SER 94 CO 0.00 -1.24 -0.02 -0.70 1.20 0.00 0.00 173.24 172.47 2diz s GLU 95 N -3.78 1.76 -0.70 5.44 2.12 -1.26 -2.50 118.70 119.79 2diz s GLU 95 Ca 0.20 -1.51 -0.32 0.00 0.36 0.00 0.00 54.97 53.70 2diz s GLU 95 Cb -0.02 -2.93 -0.16 0.00 0.26 0.00 0.00 34.13 31.28 2diz s GLU 95 CO 0.10 -0.75 2.47 1.58 -0.54 0.00 0.00 175.26 178.12 2diz n HIS 96 N 4.41 1.03 -3.48 5.30 -0.00 -1.23 -4.84 115.22 116.42 2diz n HIS 96 Ca -0.06 0.35 -0.37 0.00 -0.00 0.00 0.00 57.72 57.64 2diz n HIS 96 Cb 0.42 -2.46 -0.05 0.00 -0.00 0.00 0.00 29.99 27.91 2diz n HIS 96 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 2diz n SER 97 N 11.28 4.64 0.00 0.26 3.41 -1.26 -4.76 113.62 127.20 2diz n SER 97 Ca 0.53 -3.22 0.00 0.00 -0.26 0.00 0.00 58.87 55.92 2diz n SER 97 Cb 0.18 -1.06 0.00 0.00 -0.26 0.00 0.00 64.21 63.07 2diz n SER 97 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2diz n GLY 98 N 1.95 -0.55 3.24 5.00 0.00 -1.26 -5.13 105.19 108.45 2diz n GLY 98 Ca 0.24 -0.76 -0.47 0.00 0.00 0.00 0.00 46.02 45.03 2diz n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2diz n GLY 99 N 0.00 -1.44 0.74 -0.02 0.00 -1.26 -4.87 105.19 98.34 2diz n GLY 99 Ca 0.00 0.39 0.07 0.00 0.00 0.00 0.00 46.02 46.47 2diz n GLY 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2diz n ARG 100 N 1.03 2.90 -1.81 1.61 1.74 -1.26 -4.58 116.66 116.29 2diz n ARG 100 Ca 0.17 -2.39 -0.33 0.00 -0.77 0.00 0.00 57.85 54.54 2diz n ARG 100 Cb 0.21 -1.52 0.04 0.00 -1.02 0.00 0.00 32.46 30.17 2diz n ARG 100 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2diz s ASP 101 N -1.40 5.26 0.07 0.55 1.11 -1.26 -4.78 116.67 116.22 2diz s ASP 101 Ca 0.31 1.94 -0.15 0.00 0.18 0.00 0.00 52.55 54.83 2diz s ASP 101 Cb 0.21 -2.54 -0.04 0.00 1.07 0.00 0.00 42.92 41.62 2diz s ASP 101 CO 0.13 -1.52 1.26 0.25 1.18 0.00 0.00 175.17 176.46 2diz h LEU 102 N 0.09 -1.02 -0.56 1.23 5.85 -1.96 0.18 115.31 119.13 2diz h LEU 102 Ca -0.47 0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.44 2diz h LEU 102 Cb 1.24 0.44 -0.04 0.00 0.37 0.00 0.00 40.66 42.67 2diz h LEU 102 CO 0.55 -0.13 0.31 -2.24 -0.34 0.00 0.00 178.44 176.59 2diz h ASP 103 N -0.04 0.47 0.00 1.25 2.03 -1.96 0.15 116.42 118.32 2diz h ASP 103 Ca 0.07 0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.39 2diz h ASP 103 Cb 0.22 -0.07 0.00 0.00 -0.83 0.00 0.00 39.33 38.64 2diz h ASP 103 CO -0.42 0.32 0.11 0.28 -1.03 0.00 0.00 179.24 178.51 2diz h SER 104 N 0.60 0.00 0.34 4.15 0.02 -1.33 0.21 113.55 117.55 2diz h SER 104 Ca 0.24 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.98 2diz h SER 104 Cb 0.10 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.61 2diz h SER 104 CO -0.14 0.00 -1.84 0.18 -1.14 0.00 0.00 176.83 173.89 2diz n LEU 105 N -2.30 0.43 -0.03 5.07 4.77 0.44 -3.96 117.00 121.42 2diz n LEU 105 Ca -0.01 0.19 -0.14 0.00 -0.03 0.00 0.00 56.01 56.02 2diz n LEU 105 Cb 0.15 0.20 -0.10 0.00 -2.33 0.00 0.00 43.42 41.33 2diz n LEU 105 CO 0.09 0.24 0.53 -0.74 -1.33 0.00 0.00 177.39 176.18 2diz h HIS 106 N 0.00 0.15 -0.33 -1.77 2.76 -0.12 -3.27 115.15 112.57 2diz h HIS 106 Ca -0.26 -0.06 0.05 0.00 -2.20 0.00 0.00 60.37 57.90 2diz h HIS 106 Cb 1.70 -0.02 -0.05 0.00 1.55 0.00 0.00 27.41 30.59 2diz h HIS 106 CO 0.00 0.73 0.05 0.07 -1.30 0.00 0.00 177.93 177.48 2diz h ARG 107 N -0.48 0.15 -0.03 5.26 0.11 -1.62 -2.34 114.38 115.43 2diz h ARG 107 Ca -0.00 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.07 2diz h ARG 107 Cb 0.74 -0.03 -0.00 0.00 1.11 0.00 0.00 29.97 31.78 2diz h ARG 107 CO 0.02 0.10 -0.03 0.35 0.10 0.00 0.00 179.97 180.52 2diz h PHE 108 N 0.16 -0.08 -0.72 4.08 3.57 -1.69 0.26 116.94 122.52 2diz h PHE 108 Ca 0.16 0.00 0.16 0.00 3.53 0.00 0.00 57.97 61.82 2diz h PHE 108 Cb 0.19 0.04 -0.12 0.00 2.79 0.00 0.00 35.95 38.85 2diz h PHE 108 CO -0.19 -0.02 0.06 0.28 -2.23 0.00 0.00 178.31 176.21 2diz h VAL 109 N -0.01 0.42 -0.55 1.41 2.07 -1.59 0.59 116.25 118.59 2diz h VAL 109 Ca 0.01 -0.05 0.10 0.00 0.82 0.00 0.00 66.70 67.57 2diz h VAL 109 Cb 0.02 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 30.01 2diz h VAL 109 CO -0.03 0.03 0.37 -0.07 0.02 0.00 0.00 177.57 177.89 2diz h LEU 110 N 0.15 0.28 0.00 2.57 3.38 -0.62 0.13 115.31 121.21 2diz h LEU 110 Ca 0.40 0.01 -0.23 0.00 0.09 0.00 0.00 57.88 58.15 2diz h LEU 110 Cb 0.70 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.36 2diz h LEU 110 CO -0.59 0.17 -1.34 -1.28 0.09 0.00 0.00 178.44 175.48 2diz h SER 111 N 0.31 0.00 0.16 -0.43 0.87 0.33 -3.01 113.55 111.78 2diz h SER 111 Ca 0.25 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.81 2diz h SER 111 Cb 0.59 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.55 2diz h SER 111 CO -0.06 0.89 -0.07 1.56 -0.53 0.00 0.00 176.83 178.62 2diz h GLN 112 N 0.00 -0.20 0.33 2.24 1.08 0.13 -3.34 115.11 115.34 2diz h GLN 112 Ca -0.16 0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.04 2diz h GLN 112 Cb 1.82 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 29.30 2diz h GLN 112 CO 0.09 0.23 -0.16 0.00 -0.95 0.00 0.00 178.83 178.04 2diz h ALA 113 N -0.13 -0.44 -0.55 3.87 0.00 -0.98 -3.41 119.26 117.62 2diz h ALA 113 Ca -0.02 -0.15 -0.47 0.00 0.00 0.00 0.00 54.91 54.28 2diz h ALA 113 Cb 0.53 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.43 2diz h ALA 113 CO 0.04 -0.67 1.69 1.63 0.00 0.00 0.00 179.25 181.93 2diz n LYS 114 N -5.22 0.36 -3.88 0.00 5.02 -1.14 -4.87 118.16 108.43 2diz n LYS 114 Ca -0.10 -0.02 -0.18 0.00 -2.02 0.00 0.00 58.31 55.98 2diz n LYS 114 Cb 0.24 -2.19 -0.17 0.00 -0.02 0.00 0.00 35.03 32.89 2diz n LYS 114 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2diz s ASP 115 N 9.75 0.73 -1.14 4.39 2.15 -1.26 -4.90 116.67 126.39 2diz s ASP 115 Ca 1.22 -0.03 -0.17 0.00 0.43 0.00 0.00 52.55 54.01 2diz s ASP 115 Cb -0.85 -0.26 0.13 0.00 -0.30 0.00 0.00 42.92 41.64 2diz s ASP 115 CO 0.41 -0.13 1.42 -1.61 -0.17 0.00 0.00 175.17 175.08 2diz s GLU 116 N 1.31 3.90 0.00 4.34 0.41 -1.26 -5.25 118.70 122.15 2diz s GLU 116 Ca -0.06 -2.13 0.00 0.00 -0.41 0.00 0.00 54.97 52.38 2diz s GLU 116 Cb -0.13 -5.14 0.00 0.00 -1.78 0.00 0.00 34.13 27.07 2diz s GLU 116 CO -0.02 -1.90 0.00 -0.11 -0.49 0.00 0.00 175.26 172.73