#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dki n ARG 6 N 0.00 -0.06 -4.50 0.00 1.74 -0.53 -4.93 116.66 108.38 1dki n ARG 6 Ca 0.00 0.06 -0.25 0.00 -0.77 0.00 0.00 57.85 56.89 1dki n ARG 6 Cb 0.00 -2.42 -0.08 0.00 -1.02 0.00 0.00 32.46 28.94 1dki n ARG 6 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1dki s ASN 7 N -2.32 2.71 0.02 0.55 0.02 -1.26 -4.76 114.94 109.90 1dki s ASN 7 Ca 0.71 -1.68 -0.03 0.00 -1.02 0.00 0.00 52.86 50.84 1dki s ASN 7 Cb -0.27 0.51 -0.01 0.00 0.02 0.00 0.00 41.25 41.50 1dki s ASN 7 CO 0.53 -0.94 1.01 1.21 0.02 0.00 0.00 177.10 178.94 1dki n GLU 8 N -0.89 -0.04 0.08 -0.60 4.07 -1.26 -0.34 120.64 121.65 1dki n GLU 8 Ca -0.05 1.01 -0.12 0.00 -0.06 0.00 0.00 57.16 57.94 1dki n GLU 8 Cb 0.65 -1.51 -0.05 0.00 -0.06 0.00 0.00 31.44 30.47 1dki n GLU 8 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 1dki h LYS 9 N 0.00 -0.46 -0.46 5.31 6.56 -1.99 -1.89 116.57 123.64 1dki h LYS 9 Ca 0.02 0.03 0.08 0.00 -1.06 0.00 0.00 60.65 59.71 1dki h LYS 9 Cb 0.04 0.10 -0.10 0.00 -0.57 0.00 0.00 32.23 31.71 1dki h LYS 9 CO -0.09 -0.31 -0.42 1.05 -2.06 0.00 0.00 179.45 177.62 1dki h GLU 10 N -0.48 -0.28 0.00 3.15 -0.00 -1.77 -0.35 114.58 114.86 1dki h GLU 10 Ca 0.05 0.02 -0.03 0.00 -0.00 0.00 0.00 59.36 59.41 1dki h GLU 10 Cb 0.54 0.06 -0.00 0.00 -0.00 0.00 0.00 28.75 29.35 1dki h GLU 10 CO -0.23 -0.18 -0.12 0.00 -0.00 0.00 0.00 179.01 178.47 1dki h ALA 11 N 0.53 1.64 -2.23 1.06 0.00 -0.52 -3.47 119.26 116.26 1dki h ALA 11 Ca 0.16 -0.11 -0.49 0.00 0.00 0.00 0.00 54.91 54.46 1dki h ALA 11 Cb 0.57 -0.02 0.20 0.00 0.00 0.00 0.00 17.79 18.54 1dki h ALA 11 CO -0.61 0.15 0.16 0.21 0.00 0.00 0.00 179.25 179.16 1dki s LYS 12 N -4.61 0.40 0.00 0.00 2.47 -0.15 -4.96 119.74 112.89 1dki s LYS 12 Ca -0.04 1.33 0.00 0.00 -1.56 0.00 0.00 55.97 55.70 1dki s LYS 12 Cb 0.15 -1.67 0.00 0.00 -1.46 0.00 0.00 37.83 34.85 1dki s LYS 12 CO 0.65 -2.98 0.00 -0.25 0.16 0.00 0.00 175.35 172.93 1dki n ASP 38 N -4.45 0.00 -4.56 1.43 8.00 -1.26 -5.11 116.55 110.59 1dki n ASP 38 Ca 0.09 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.45 1dki n ASP 38 Cb 0.53 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.55 1dki n ASP 38 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1dki n LYS 39 N 0.00 0.53 -1.58 -1.24 4.81 -1.26 -3.37 118.16 116.06 1dki n LYS 39 Ca 0.00 -0.77 -0.47 0.00 -0.87 0.00 0.00 58.31 56.20 1dki n LYS 39 Cb 0.00 -3.51 -0.03 0.00 0.02 0.00 0.00 35.03 31.51 1dki n LYS 39 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1dki n VAL 40 N 8.56 1.23 -2.70 3.15 0.31 -0.28 -4.88 118.33 123.73 1dki n VAL 40 Ca 0.48 -0.31 -0.43 0.00 -0.01 0.00 0.00 64.34 64.08 1dki n VAL 40 Cb 0.41 -0.91 -0.03 0.00 -0.91 0.00 0.00 33.84 32.40 1dki n VAL 40 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1dki s ASN 41 N -0.16 6.40 0.18 4.52 3.04 -1.26 -4.68 114.94 122.97 1dki s ASN 41 Ca 0.68 -0.10 0.22 0.00 0.04 0.00 0.00 52.86 53.71 1dki s ASN 41 Cb -0.80 -2.50 -0.04 0.00 -1.54 0.00 0.00 41.25 36.38 1dki s ASN 41 CO 0.54 -1.36 0.98 0.18 -3.04 0.00 0.00 177.10 174.40 1dki n LEU 42 N 7.97 0.78 0.00 3.21 4.77 -1.26 -4.85 117.00 127.62 1dki n LEU 42 Ca 0.05 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 1dki n LEU 42 Cb 0.48 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1dki n LEU 42 CO 0.68 -0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1dki n GLY 43 N 1.20 0.32 0.00 -0.72 0.00 -1.26 -4.15 105.19 100.58 1dki n GLY 43 Ca -0.01 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1dki n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dki n GLY 44 N 0.00 0.00 0.30 -0.02 0.00 -1.26 0.10 105.19 104.31 1dki n GLY 44 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.21 1dki n GLY 44 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1dki h GLU 45 N 0.00 0.00 -1.34 1.61 -0.00 -2.00 -3.17 114.58 109.68 1dki h GLU 45 Ca 0.00 0.00 -0.51 0.00 -0.00 0.00 0.00 59.36 58.85 1dki h GLU 45 Cb 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 28.75 28.34 1dki h GLU 45 CO 0.00 0.03 -0.89 1.28 -0.00 0.00 0.00 179.01 179.43 1dki n LEU 46 N -3.26 3.60 0.36 3.06 4.77 0.28 -4.92 117.00 120.89 1dki n LEU 46 Ca -0.02 -4.70 -0.15 0.00 -0.03 0.00 0.00 56.01 51.11 1dki n LEU 46 Cb 0.17 -0.16 -0.07 0.00 -2.33 0.00 0.00 43.42 41.04 1dki n LEU 46 CO 0.25 2.01 0.39 0.77 -1.33 0.00 0.00 177.39 179.47 1dki h SER 47 N 2.72 -0.81 -0.06 -1.43 4.64 -1.49 -3.37 113.55 113.74 1dki h SER 47 Ca 0.16 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1dki h SER 47 Cb 1.01 0.21 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1dki h SER 47 CO 0.73 -0.43 0.00 0.61 -0.87 0.00 0.00 176.83 176.87 1dki n GLY 48 N -0.65 -0.53 0.61 -0.77 0.00 -1.26 -4.90 105.19 97.69 1dki n GLY 48 Ca -0.12 -0.18 0.06 0.00 0.00 0.00 0.00 46.02 45.79 1dki n GLY 48 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1dki n SER 49 N -0.19 1.71 -0.01 1.61 3.41 -1.26 -4.64 113.62 114.25 1dki n SER 49 Ca 0.00 -3.78 0.15 0.00 -0.26 0.00 0.00 58.87 54.97 1dki n SER 49 Cb 0.00 -0.51 0.75 0.00 -0.26 0.00 0.00 64.21 64.18 1dki n SER 49 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1dki n ASN 50 N -1.07 0.05 -3.61 4.04 5.03 -1.26 -4.15 115.26 114.30 1dki n ASN 50 Ca 0.18 -0.22 -0.11 0.00 0.87 0.00 0.00 54.58 55.30 1dki n ASN 50 Cb 0.71 -0.25 -0.06 0.00 -1.02 0.00 0.00 39.78 39.16 1dki n ASN 50 CO 0.00 0.00 0.00 -0.32 -1.83 0.00 0.00 177.26 175.11 1dki s MET 51 N -2.54 0.63 0.10 3.52 0.00 -1.26 -0.21 119.30 119.53 1dki s MET 51 Ca 0.29 0.48 0.05 0.00 0.00 0.00 0.00 55.69 56.52 1dki s MET 51 Cb 0.20 0.30 -0.03 0.00 0.00 0.00 0.00 34.83 35.30 1dki s MET 51 CO 0.46 -0.13 -0.13 0.71 0.00 0.00 0.00 175.02 175.93 1dki s TYR 52 N -0.28 1.25 -0.03 4.11 1.51 0.21 -4.83 117.35 119.29 1dki s TYR 52 Ca -0.00 -0.55 0.04 0.00 -1.01 0.00 0.00 57.07 55.55 1dki s TYR 52 Cb -0.03 -0.68 -0.00 0.00 -0.11 0.00 0.00 41.96 41.14 1dki s TYR 52 CO -0.01 0.08 -0.15 0.08 -1.11 0.00 0.00 175.55 174.44 1dki s VAL 53 N -1.91 1.22 -0.05 0.71 1.01 -1.26 -0.64 120.40 119.48 1dki s VAL 53 Ca 0.04 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.41 1dki s VAL 53 Cb -0.06 -1.04 0.02 0.00 0.00 0.00 0.00 36.38 35.30 1dki s VAL 53 CO 0.02 0.35 -0.05 -0.31 0.00 0.00 0.00 175.10 175.11 1dki s TYR 54 N -0.07 0.85 -0.17 5.22 1.51 -0.70 -1.12 117.35 122.86 1dki s TYR 54 Ca -0.00 -0.26 -0.14 0.00 -1.01 0.00 0.00 57.07 55.66 1dki s TYR 54 Cb -0.09 -0.74 -0.05 0.00 -0.11 0.00 0.00 41.96 40.98 1dki s TYR 54 CO 0.01 -0.22 0.30 -0.80 -1.11 0.00 0.00 175.55 173.73 1dki s ASN 55 N 0.99 6.41 0.10 2.29 0.01 -1.22 -1.13 114.94 122.39 1dki s ASN 55 Ca -0.10 0.48 -0.31 0.00 -0.71 0.00 0.00 52.86 52.22 1dki s ASN 55 Cb -0.14 -2.18 -0.07 0.00 0.41 0.00 0.00 41.25 39.26 1dki s ASN 55 CO -0.00 0.06 1.33 -0.63 -1.51 0.00 0.00 177.10 176.35 1dki s ILE 56 N 0.67 3.53 0.25 0.60 1.01 0.27 -4.87 121.20 122.65 1dki s ILE 56 Ca 0.16 1.10 -0.04 0.00 0.00 0.00 0.00 60.65 61.87 1dki s ILE 56 Cb -0.13 -3.70 0.23 0.00 0.01 0.00 0.00 42.46 38.86 1dki s ILE 56 CO 0.05 0.09 1.71 0.77 0.00 0.00 0.00 174.94 177.55 1dki h SER 57 N 6.79 0.16 1.65 3.58 4.64 -1.97 0.90 113.55 129.30 1dki h SER 57 Ca -0.42 0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1dki h SER 57 Cb 1.21 0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 1dki h SER 57 CO 0.85 0.03 -0.11 0.71 -0.87 0.00 0.00 176.83 177.44 1dki h THR 58 N 0.36 0.00 0.00 2.95 1.35 -1.98 -3.49 112.91 112.10 1dki h THR 58 Ca 0.42 -0.76 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 1dki h THR 58 Cb 0.69 1.70 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 1dki h THR 58 CO -0.46 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.42 1dki n GLY 59 N 1.20 4.69 0.00 5.82 0.00 0.31 -4.97 105.19 112.24 1dki n GLY 59 Ca 0.04 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.82 1dki n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dki n GLY 60 N -2.00 0.94 3.45 -0.02 0.00 0.24 -4.37 105.19 103.44 1dki n GLY 60 Ca 0.00 -1.90 -0.10 0.00 0.00 0.00 0.00 46.02 44.03 1dki n GLY 60 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1dki s PHE 61 N -2.22 0.06 -0.05 1.61 -0.12 -0.93 0.96 117.98 117.30 1dki s PHE 61 Ca 0.00 -0.41 -0.02 0.00 -0.05 0.00 0.00 56.93 56.45 1dki s PHE 61 Cb 0.00 0.23 0.03 0.00 -0.63 0.00 0.00 43.02 42.65 1dki s PHE 61 CO 0.00 -0.84 0.10 0.08 -0.05 0.00 0.00 175.22 174.50 1dki s VAL 62 N -3.91 -0.04 -0.27 -2.49 1.01 -0.29 -1.89 120.40 112.52 1dki s VAL 62 Ca 0.12 0.16 -0.09 0.00 0.00 0.00 0.00 61.98 62.17 1dki s VAL 62 Cb 0.01 -0.17 -0.03 0.00 0.00 0.00 0.00 36.38 36.19 1dki s VAL 62 CO -0.02 0.07 0.12 -0.63 0.00 0.00 0.00 175.10 174.64 1dki s ILE 63 N 0.96 4.62 -0.09 2.22 -1.09 0.14 -1.73 121.20 126.23 1dki s ILE 63 Ca -0.08 -0.16 0.02 0.00 -2.23 0.00 0.00 60.65 58.20 1dki s ILE 63 Cb -0.10 -3.23 -0.02 0.00 -1.58 0.00 0.00 42.46 37.53 1dki s ILE 63 CO -0.04 0.24 -0.15 -0.69 -1.23 0.00 0.00 174.94 173.07 1dki s VAL 64 N 1.65 2.93 0.42 2.92 1.01 0.19 -0.95 120.40 128.57 1dki s VAL 64 Ca 0.06 -0.73 -0.23 0.00 0.00 0.00 0.00 61.98 61.08 1dki s VAL 64 Cb -0.16 -2.19 -0.09 0.00 0.00 0.00 0.00 36.38 33.95 1dki s VAL 64 CO 0.06 0.55 1.04 -0.94 0.00 0.00 0.00 175.10 175.82 1dki s SER 65 N -0.08 6.66 0.00 3.32 1.04 -0.85 0.64 113.70 124.43 1dki s SER 65 Ca -0.03 1.99 0.12 0.00 0.48 0.00 0.00 55.95 58.51 1dki s SER 65 Cb -0.14 -2.58 0.36 0.00 0.10 0.00 0.00 66.02 63.77 1dki s SER 65 CO 0.04 -0.56 1.29 0.61 0.98 0.00 0.00 173.24 175.59 1dki n GLY 66 N 0.14 0.50 2.95 7.32 0.00 0.70 -4.76 105.19 112.05 1dki n GLY 66 Ca 0.06 -0.36 -0.15 0.00 0.00 0.00 0.00 46.02 45.57 1dki n GLY 66 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1dki s ASP 67 N -1.08 0.52 0.12 1.61 2.15 -1.26 -1.45 116.67 117.28 1dki s ASP 67 Ca 0.24 -0.11 0.21 0.00 0.43 0.00 0.00 52.55 53.32 1dki s ASP 67 Cb 0.12 -0.05 0.85 0.00 -0.30 0.00 0.00 42.92 43.55 1dki s ASP 67 CO 0.17 0.03 1.65 2.29 -0.17 0.00 0.00 175.17 179.14 1dki n LYS 68 N 2.87 0.11 -0.02 4.34 2.85 -1.26 -2.54 118.16 124.51 1dki n LYS 68 Ca -0.13 0.28 0.13 0.00 -1.05 0.00 0.00 58.31 57.54 1dki n LYS 68 Cb 0.58 -1.68 0.60 0.00 -0.65 0.00 0.00 35.03 33.88 1dki n LYS 68 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1dki n ARG 69 N -1.87 1.43 -4.36 -1.58 1.74 -1.26 -4.83 116.66 105.92 1dki n ARG 69 Ca 0.04 -0.63 -0.24 0.00 -0.77 0.00 0.00 57.85 56.25 1dki n ARG 69 Cb 0.24 -1.44 -0.11 0.00 -1.02 0.00 0.00 32.46 30.13 1dki n ARG 69 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1dki s SER 70 N -1.84 2.94 0.30 0.55 0.01 -1.05 -4.78 113.70 109.82 1dki s SER 70 Ca 0.38 -0.85 -0.28 0.00 1.31 0.00 0.00 55.95 56.50 1dki s SER 70 Cb 0.19 -0.19 -0.14 0.00 0.21 0.00 0.00 66.02 66.10 1dki s SER 70 CO 0.31 0.03 1.13 -0.81 0.41 0.00 0.00 173.24 174.30 1dki n PRO 71 N 0.32 1.62 0.17 12.44 -0.04 -1.26 -4.89 135.00 143.36 1dki n PRO 71 Ca -0.13 0.57 -0.14 0.00 -0.04 0.00 0.00 63.50 63.76 1dki n PRO 71 Cb 0.56 -2.03 -0.07 0.00 -0.04 0.00 0.00 33.50 31.93 1dki n PRO 71 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1dki h GLU 72 N 2.37 -0.57 -5.56 0.54 9.09 -1.93 -3.38 114.58 115.13 1dki h GLU 72 Ca -0.42 0.04 -0.65 0.00 0.05 0.00 0.00 59.36 58.38 1dki h GLU 72 Cb 1.32 0.13 -0.15 0.00 -1.65 0.00 0.00 28.75 28.40 1dki h GLU 72 CO 0.63 -0.38 -0.58 0.42 0.05 0.00 0.00 179.01 179.14 1dki s ILE 73 N -6.03 4.65 -0.12 -1.06 -1.09 -1.26 -2.01 121.20 114.28 1dki s ILE 73 Ca -0.16 -0.10 0.08 0.00 -2.23 0.00 0.00 60.65 58.24 1dki s ILE 73 Cb 0.07 -3.03 -0.13 0.00 -1.58 0.00 0.00 42.46 37.79 1dki s ILE 73 CO 0.64 0.53 0.00 0.18 -1.23 0.00 0.00 174.94 175.07 1dki n LEU 74 N 2.86 0.61 -3.47 2.97 4.77 -0.13 -4.94 117.00 119.67 1dki n LEU 74 Ca -0.18 -0.02 -0.11 0.00 -0.03 0.00 0.00 56.01 55.68 1dki n LEU 74 Cb 0.53 0.12 -0.02 0.00 -2.33 0.00 0.00 43.42 41.71 1dki n LEU 74 CO 0.32 0.37 0.54 -0.83 -1.33 0.00 0.00 177.39 176.46 1dki s GLY 75 N -4.57 -0.54 0.18 -0.72 0.00 -1.24 -1.65 107.32 98.78 1dki s GLY 75 Ca -0.08 0.84 -0.23 0.00 0.00 0.00 0.00 44.72 45.25 1dki s GLY 75 CO 0.43 0.34 1.01 -2.52 0.00 0.00 0.00 173.10 172.35 1dki s TYR 76 N -3.17 0.01 -0.17 1.90 -0.85 -0.66 0.23 117.35 114.64 1dki s TYR 76 Ca 0.01 -0.39 -0.30 0.00 -0.52 0.00 0.00 57.07 55.88 1dki s TYR 76 Cb -0.01 0.69 0.13 0.00 0.38 0.00 0.00 41.96 43.15 1dki s TYR 76 CO -0.09 -0.91 1.04 0.45 -1.52 0.00 0.00 175.55 174.52 1dki s SER 77 N -3.23 -0.33 -0.32 -0.18 0.15 -0.79 -1.12 113.70 107.88 1dki s SER 77 Ca 0.18 0.35 0.10 0.00 0.70 0.00 0.00 55.95 57.29 1dki s SER 77 Cb -0.02 0.27 0.74 0.00 -1.71 0.00 0.00 66.02 65.30 1dki s SER 77 CO 0.04 -0.31 1.78 0.35 1.20 0.00 0.00 173.24 176.31 1dki n THR 78 N 0.69 2.90 -3.91 6.45 -2.24 -1.26 -2.18 114.28 114.73 1dki n THR 78 Ca -0.09 -1.69 -0.09 0.00 -2.27 0.00 0.00 64.05 59.91 1dki n THR 78 Cb 0.58 -0.35 -0.02 0.00 -2.10 0.00 0.00 70.33 68.44 1dki n THR 78 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1dki s SER 79 N -1.13 -0.04 0.47 3.42 0.15 -1.26 -4.55 113.70 110.76 1dki s SER 79 Ca 0.54 -0.91 0.00 0.00 0.70 0.00 0.00 55.95 56.28 1dki s SER 79 Cb 0.44 0.72 0.00 0.00 -1.71 0.00 0.00 66.02 65.46 1dki s SER 79 CO 0.13 -1.37 0.00 0.61 1.20 0.00 0.00 173.24 173.81 1dki n GLY 80 N -0.47 1.10 3.60 9.45 0.00 -1.26 -2.44 105.19 115.17 1dki n GLY 80 Ca -0.04 -0.56 -0.09 0.00 0.00 0.00 0.00 46.02 45.33 1dki n GLY 80 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dki s SER 81 N -4.00 -0.01 -0.08 1.61 1.04 -1.26 0.82 113.70 111.83 1dki s SER 81 Ca 0.00 -0.97 0.03 0.00 0.48 0.00 0.00 55.95 55.49 1dki s SER 81 Cb 0.00 0.61 -0.02 0.00 0.10 0.00 0.00 66.02 66.71 1dki s SER 81 CO 0.00 -1.19 -0.17 0.12 0.98 0.00 0.00 173.24 172.98 1dki s PHE 82 N -3.85 2.67 -0.09 5.02 5.36 -1.26 -0.98 117.98 124.84 1dki s PHE 82 Ca 0.22 -0.46 -0.25 0.00 -0.96 0.00 0.00 56.93 55.48 1dki s PHE 82 Cb -0.01 -1.69 0.06 0.00 -0.34 0.00 0.00 43.02 41.03 1dki s PHE 82 CO 0.10 -0.05 0.58 0.34 -1.46 0.00 0.00 175.22 174.73 1dki s ASP 83 N -0.23 -0.55 0.00 6.13 -1.08 -1.26 -4.94 116.67 114.74 1dki s ASP 83 Ca 0.00 0.73 0.00 0.00 -0.52 0.00 0.00 52.55 52.76 1dki s ASP 83 Cb -0.13 0.70 0.00 0.00 -1.46 0.00 0.00 42.92 42.03 1dki s ASP 83 CO 0.03 -0.46 0.58 1.33 0.52 0.00 0.00 175.17 177.17 1dki n VAL 84 N 1.53 0.29 -1.60 1.11 0.24 -1.26 -4.76 118.33 113.89 1dki n VAL 84 Ca -0.18 -0.55 -0.45 0.00 -2.04 0.00 0.00 64.34 61.13 1dki n VAL 84 Cb 0.56 0.98 -0.04 0.00 -1.47 0.00 0.00 33.84 33.88 1dki n VAL 84 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1dki n ASN 85 N -0.15 3.30 -0.13 -1.34 4.13 -1.26 -1.32 115.26 118.50 1dki n ASN 85 Ca 0.00 0.46 -0.02 0.00 1.68 0.00 0.00 54.58 56.71 1dki n ASN 85 Cb 0.14 -1.49 -0.01 0.00 -1.54 0.00 0.00 39.78 36.89 1dki n ASN 85 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1dki n GLY 86 N 5.48 0.41 2.91 7.41 0.00 -1.26 -4.93 105.19 115.20 1dki n GLY 86 Ca 0.29 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 1dki n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dki s LYS 87 N -1.31 2.47 0.43 1.61 0.00 -0.43 -4.95 119.74 117.56 1dki s LYS 87 Ca 0.00 -3.30 0.10 0.00 0.00 0.00 0.00 55.97 52.77 1dki s LYS 87 Cb 0.00 -3.44 0.94 0.00 0.00 0.00 0.00 37.83 35.33 1dki s LYS 87 CO 0.00 -1.27 2.04 1.49 0.00 0.00 0.00 175.35 177.61 1dki h GLU 88 N 5.49 0.31 -0.26 1.78 4.57 -1.92 -1.57 114.58 122.97 1dki h GLU 88 Ca 0.13 -0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 58.21 1dki h GLU 88 Cb 0.76 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.28 1dki h GLU 88 CO 0.72 0.27 -0.13 -2.95 -1.18 0.00 0.00 179.01 175.75 1dki h ASN 89 N 0.31 0.43 -0.04 1.04 -1.07 -1.92 0.23 115.58 114.56 1dki h ASN 89 Ca 0.08 -0.11 -0.12 0.00 0.07 0.00 0.00 56.30 56.22 1dki h ASN 89 Cb 0.08 -0.11 0.01 0.00 -2.07 0.00 0.00 38.32 36.23 1dki h ASN 89 CO -0.01 0.59 -0.45 0.40 0.07 0.00 0.00 177.43 178.03 1dki h ILE 90 N 0.41 1.43 -0.72 6.14 2.04 -1.75 -2.75 117.51 122.31 1dki h ILE 90 Ca 0.08 -1.91 0.04 0.00 1.00 0.00 0.00 64.86 64.06 1dki h ILE 90 Cb 0.47 2.47 -0.05 0.00 -0.74 0.00 0.00 36.82 38.97 1dki h ILE 90 CO 0.03 0.55 0.45 0.00 0.00 0.00 0.00 178.15 179.18 1dki h ALA 91 N 0.37 0.95 -0.32 1.87 0.00 -1.07 -0.92 119.26 120.14 1dki h ALA 91 Ca -0.05 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1dki h ALA 91 Cb 1.14 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1dki h ALA 91 CO 0.09 0.21 0.21 1.03 0.00 0.00 0.00 179.25 180.78 1dki h SER 92 N 0.86 0.35 -0.60 0.00 0.87 -0.54 0.01 113.55 114.49 1dki h SER 92 Ca 0.30 -0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.78 1dki h SER 92 Cb 0.06 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 61.91 1dki h SER 92 CO -0.13 0.25 0.11 0.15 -0.53 0.00 0.00 176.83 176.69 1dki h PHE 93 N 0.42 1.05 -0.72 2.24 3.57 -1.14 -2.39 116.94 119.98 1dki h PHE 93 Ca 0.12 -0.14 -0.02 0.00 3.53 0.00 0.00 57.97 61.46 1dki h PHE 93 Cb -0.04 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 38.38 1dki h PHE 93 CO -0.06 0.90 0.38 0.52 -2.23 0.00 0.00 178.31 177.82 1dki h MET 94 N 0.90 1.01 -0.28 1.11 2.86 -0.86 -2.09 114.93 117.58 1dki h MET 94 Ca 0.18 -0.12 -0.02 0.00 -2.06 0.00 0.00 59.70 57.69 1dki h MET 94 Cb 0.41 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1dki h MET 94 CO 0.01 0.76 0.10 0.93 1.06 0.00 0.00 176.91 179.77 1dki h GLU 95 N 1.02 0.39 -0.63 1.72 5.08 -0.51 -0.93 114.58 120.72 1dki h GLU 95 Ca 0.25 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.48 1dki h GLU 95 Cb 0.06 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1dki h GLU 95 CO -0.04 0.33 0.02 0.66 -1.00 0.00 0.00 179.01 178.99 1dki h SER 96 N 0.39 1.06 -0.23 1.42 4.64 -0.99 -0.34 113.55 119.50 1dki h SER 96 Ca 0.10 -0.30 0.05 0.00 -0.47 0.00 0.00 61.79 61.17 1dki h SER 96 Cb 0.10 -0.29 -0.05 0.00 -0.31 0.00 0.00 62.40 61.86 1dki h SER 96 CO -0.01 1.10 -0.07 1.88 -0.87 0.00 0.00 176.83 178.86 1dki h TYR 97 N 1.00 -0.14 -0.53 4.77 0.99 -0.94 -1.36 116.97 120.75 1dki h TYR 97 Ca 0.18 0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.89 1dki h TYR 97 Cb 0.54 0.10 -0.03 0.00 1.00 0.00 0.00 36.73 38.34 1dki h TYR 97 CO 0.04 -0.11 0.17 0.28 -0.00 0.00 0.00 178.16 178.53 1dki h VAL 98 N -0.01 1.21 0.00 -2.88 2.07 -1.06 0.11 116.25 115.69 1dki h VAL 98 Ca 0.11 -0.72 0.00 0.00 0.82 0.00 0.00 66.70 66.92 1dki h VAL 98 Cb 0.19 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1dki h VAL 98 CO -0.25 0.27 0.00 1.21 0.02 0.00 0.00 177.57 178.83 1dki n GLU 99 N -4.31 0.00 0.00 1.57 4.07 -0.16 -2.05 120.64 119.76 1dki n GLU 99 Ca 0.04 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.14 1dki n GLU 99 Cb 0.19 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.57 1dki n GLU 99 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1dki n GLN 100 N 0.00 0.00 -0.29 5.31 6.02 -0.85 -5.66 117.38 121.91 1dki n GLN 100 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.04 1dki n GLN 100 Cb 0.00 0.00 0.20 0.00 1.02 0.00 0.00 30.24 31.46 1dki n GLN 100 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1dki h ILE 101 N 0.00 0.82 -0.24 5.09 2.04 -0.61 0.31 117.51 124.92 1dki h ILE 101 Ca 0.00 -0.24 -0.14 0.00 1.00 0.00 0.00 64.86 65.47 1dki h ILE 101 Cb 0.00 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.12 1dki h ILE 101 CO 0.00 0.13 -0.43 0.11 0.00 0.00 0.00 178.15 177.96 1dki h LYS 102 N 0.71 0.60 -0.24 2.37 1.57 -1.67 -3.10 116.57 116.82 1dki h LYS 102 Ca 0.43 -0.32 0.05 0.00 -1.87 0.00 0.00 60.65 58.94 1dki h LYS 102 Cb 0.51 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.78 1dki h LYS 102 CO -0.30 0.92 -0.11 1.05 -0.57 0.00 0.00 179.45 180.44 1dki h GLU 103 N 0.49 -0.07 -0.17 3.15 4.11 -0.72 -1.90 114.58 119.47 1dki h GLU 103 Ca 0.04 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.45 1dki h GLU 103 Cb 0.95 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.21 1dki h GLU 103 CO 0.09 -0.05 0.03 -0.91 0.07 0.00 0.00 179.01 178.24 1dki h ASN 104 N -0.07 0.21 0.00 3.06 2.35 -1.05 -2.19 115.58 117.88 1dki h ASN 104 Ca 0.12 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 1dki h ASN 104 Cb 0.26 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1dki h ASN 104 CO -0.28 0.23 0.01 0.29 -1.65 0.00 0.00 177.43 176.02 1dki n LYS 105 N -4.43 0.00 -0.14 0.81 5.02 -0.71 -0.89 118.16 117.82 1dki n LYS 105 Ca -0.00 0.06 0.04 0.00 -2.02 0.00 0.00 58.31 56.39 1dki n LYS 105 Cb 0.14 -1.51 0.11 0.00 -0.02 0.00 0.00 35.03 33.76 1dki n LYS 105 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1dki n LYS 106 N -1.00 1.63 0.00 1.97 5.02 -0.83 -5.12 118.16 119.84 1dki n LYS 106 Ca 0.00 -0.93 0.00 0.00 -2.02 0.00 0.00 58.31 55.36 1dki n LYS 106 Cb 0.01 -1.23 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 1dki n LYS 106 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1dki n LEU 107 N 0.25 0.00 0.00 -0.35 0.00 -0.07 -5.19 117.00 111.65 1dki n LEU 107 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.10 1dki n LEU 107 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.65 1dki n LEU 107 CO 0.06 0.00 0.00 1.67 0.00 0.00 0.00 177.39 179.12 1dki n GLN 1 N 0.00 0.00 -1.90 1.96 7.27 -1.23 -5.11 117.38 118.36 1dki n GLN 1 Ca 0.00 0.00 -0.40 0.00 0.07 0.00 0.00 57.00 56.67 1dki n GLN 1 Cb 0.00 0.00 0.01 0.00 2.41 0.00 0.00 30.24 32.66 1dki n GLN 1 CO 0.00 0.00 0.00 -2.14 0.07 0.00 0.00 177.06 174.99 1dki s PRO 2 N -2.96 3.84 -0.23 3.69 0.02 -1.26 -4.20 135.00 133.89 1dki s PRO 2 Ca 0.00 2.32 -0.12 0.00 0.02 0.00 0.00 61.00 63.23 1dki s PRO 2 Cb 0.00 -2.73 -0.05 0.00 0.02 0.00 0.00 34.50 31.74 1dki s PRO 2 CO 0.00 -0.66 0.21 0.08 -0.33 0.00 0.00 177.00 176.31 1dki s VAL 3 N -1.22 5.32 -0.13 3.83 1.01 -1.26 -3.70 120.40 124.25 1dki s VAL 3 Ca 0.58 0.29 -0.01 0.00 0.00 0.00 0.00 61.98 62.85 1dki s VAL 3 Cb -0.42 -3.55 0.04 0.00 0.00 0.00 0.00 36.38 32.45 1dki s VAL 3 CO 0.54 0.32 -0.03 -0.69 0.00 0.00 0.00 175.10 175.25 1dki s VAL 4 N 1.12 0.76 0.30 2.92 1.01 -0.58 -4.94 120.40 121.00 1dki s VAL 4 Ca 0.10 -0.31 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 1dki s VAL 4 Cb -0.14 -0.96 -0.10 0.00 0.00 0.00 0.00 36.38 35.18 1dki s VAL 4 CO 0.05 0.16 1.38 -0.54 0.00 0.00 0.00 175.10 176.15 1dki s LYS 5 N 1.79 4.30 -0.41 2.72 1.02 -1.26 -1.20 119.74 126.69 1dki s LYS 5 Ca 0.03 2.29 -0.35 0.00 0.02 0.00 0.00 55.97 57.95 1dki s LYS 5 Cb -0.14 -3.08 -0.15 0.00 -0.52 0.00 0.00 37.83 33.94 1dki s LYS 5 CO -0.07 -0.31 1.73 0.45 -0.92 0.00 0.00 175.35 176.23 1dki n SER 6 N 1.36 0.59 -0.09 2.83 2.88 -1.26 -4.75 113.62 115.19 1dki n SER 6 Ca 0.03 0.53 -0.09 0.00 -1.33 0.00 0.00 58.87 58.01 1dki n SER 6 Cb 0.41 -0.72 -0.02 0.00 -0.75 0.00 0.00 64.21 63.13 1dki n SER 6 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1dki h LEU 7 N 7.30 0.37 -0.76 2.46 3.38 -0.68 -2.16 115.31 125.22 1dki h LEU 7 Ca -0.08 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 1dki h LEU 7 Cb 1.14 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.76 1dki h LEU 7 CO 0.88 0.32 0.25 -0.07 0.09 0.00 0.00 178.44 179.91 1dki h LEU 8 N 0.39 1.09 -1.60 1.67 3.38 -1.88 -2.65 115.31 115.70 1dki h LEU 8 Ca 0.11 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1dki h LEU 8 Cb 0.02 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1dki h LEU 8 CO -0.02 1.00 0.06 0.44 0.09 0.00 0.00 178.44 180.01 1dki h ASP 9 N 1.12 0.29 0.80 -0.43 5.19 -1.77 -1.07 116.42 120.54 1dki h ASP 9 Ca 0.25 -0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.63 1dki h ASP 9 Cb 0.29 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 39.72 1dki h ASP 9 CO -0.01 0.29 0.00 0.77 -3.12 0.00 0.00 179.24 177.17 1dki h SER 10 N 0.32 0.00 -0.10 6.45 4.64 -1.02 -2.27 113.55 121.57 1dki h SER 10 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1dki h SER 10 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1dki h SER 10 CO -0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 1dki n LYS 11 N -2.74 1.26 -2.44 4.77 5.02 -0.70 -5.00 118.16 118.33 1dki n LYS 11 Ca 0.01 -1.32 -0.12 0.00 -2.02 0.00 0.00 58.31 54.86 1dki n LYS 11 Cb 0.25 -1.15 0.01 0.00 -0.02 0.00 0.00 35.03 34.12 1dki n LYS 11 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1dki n GLY 12 N 0.28 -0.05 3.60 0.72 0.00 -0.68 -4.84 105.19 104.23 1dki n GLY 12 Ca 0.05 -0.34 -0.41 0.00 0.00 0.00 0.00 46.02 45.32 1dki n GLY 12 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dki s ILE 13 N -2.73 4.88 -0.37 -0.61 1.01 -0.50 -4.12 121.20 118.77 1dki s ILE 13 Ca 0.08 0.99 0.02 0.00 0.00 0.00 0.00 60.65 61.74 1dki s ILE 13 Cb -0.04 -4.06 0.15 0.00 0.01 0.00 0.00 42.46 38.53 1dki s ILE 13 CO 0.10 -0.18 0.34 -1.00 0.00 0.00 0.00 174.94 174.19 1dki s HIS 14 N 2.75 0.05 0.57 3.97 3.76 -0.38 -4.63 115.29 121.37 1dki s HIS 14 Ca 0.28 -1.15 -0.01 0.00 -0.15 0.00 0.00 55.06 54.03 1dki s HIS 14 Cb -0.15 -0.56 0.03 0.00 1.11 0.00 0.00 32.58 33.02 1dki s HIS 14 CO 0.12 -0.93 0.82 0.71 -0.85 0.00 0.00 174.74 174.61 1dki s TYR 15 N 1.22 2.93 0.14 1.40 4.12 -1.26 -4.52 117.35 121.37 1dki s TYR 15 Ca 0.19 0.14 0.03 0.00 0.02 0.00 0.00 57.07 57.45 1dki s TYR 15 Cb -0.16 -2.80 -0.01 0.00 -1.52 0.00 0.00 41.96 37.47 1dki s TYR 15 CO -0.02 -0.93 0.11 -1.71 0.02 0.00 0.00 175.55 173.02 1dki n ASN 16 N -2.45 -0.16 -0.00 2.29 2.85 -1.26 -2.01 115.26 114.52 1dki n ASN 16 Ca 0.07 -1.88 0.07 0.00 -0.11 0.00 0.00 54.58 52.73 1dki n ASN 16 Cb 0.60 0.65 -0.08 0.00 1.24 0.00 0.00 39.78 42.18 1dki n ASN 16 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1dki n GLN 17 N -0.27 2.11 0.00 1.20 6.02 -1.25 -4.84 117.38 120.36 1dki n GLN 17 Ca 0.03 -0.03 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1dki n GLN 17 Cb 0.24 -1.18 0.00 0.00 1.02 0.00 0.00 30.24 30.33 1dki n GLN 17 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1dki n GLY 18 N 1.40 2.59 3.77 1.08 0.00 -1.26 -1.79 105.19 110.98 1dki n GLY 18 Ca 0.02 -1.82 -0.40 0.00 0.00 0.00 0.00 46.02 43.82 1dki n GLY 18 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1dki s ASN 19 N -0.57 6.84 0.00 1.61 3.84 -1.26 -0.48 114.94 124.92 1dki s ASN 19 Ca 0.00 2.56 0.27 0.00 0.21 0.00 0.00 52.86 55.91 1dki s ASN 19 Cb 0.00 -2.64 0.95 0.00 -0.55 0.00 0.00 41.25 39.01 1dki s ASN 19 CO 0.00 -0.47 1.69 -0.81 -2.79 0.00 0.00 177.10 174.71 1dki n PRO 20 N 0.79 1.74 0.06 0.43 -0.04 -1.26 -4.88 135.00 131.84 1dki n PRO 20 Ca 0.00 -1.07 0.10 0.00 -0.04 0.00 0.00 63.50 62.49 1dki n PRO 20 Cb 0.43 -1.47 0.56 0.00 -0.04 0.00 0.00 33.50 32.97 1dki n PRO 20 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1dki h TYR 21 N 2.59 0.24 -0.61 0.54 -1.99 -1.10 -2.66 116.97 113.98 1dki h TYR 21 Ca 0.00 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.74 1dki h TYR 21 Cb 0.55 -0.08 0.00 0.00 2.00 0.00 0.00 36.73 39.20 1dki h TYR 21 CO 0.01 0.13 0.00 0.27 -0.00 0.00 0.00 178.16 178.57 1dki n ASN 22 N -4.48 5.12 0.31 3.88 6.94 -0.38 -4.35 115.26 122.29 1dki n ASN 22 Ca 0.04 -2.65 0.19 0.00 -0.02 0.00 0.00 54.58 52.14 1dki n ASN 22 Cb 0.25 -0.62 1.03 0.00 -2.36 0.00 0.00 39.78 38.08 1dki n ASN 22 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 1dki h LEU 23 N 3.98 0.00 -2.45 -4.53 3.38 -1.75 -2.39 115.31 111.55 1dki h LEU 23 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1dki h LEU 23 Cb 1.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.41 1dki h LEU 23 CO 0.33 0.00 0.00 0.18 0.09 0.00 0.00 178.44 179.04 1dki n LEU 24 N -2.91 2.11 -4.80 1.67 4.77 -1.26 -5.02 117.00 111.56 1dki n LEU 24 Ca -0.03 -1.71 -0.30 0.00 -0.03 0.00 0.00 56.01 53.94 1dki n LEU 24 Cb 0.15 -0.07 0.09 0.00 -2.33 0.00 0.00 43.42 41.26 1dki n LEU 24 CO 0.17 0.51 0.71 0.42 -1.33 0.00 0.00 177.39 177.87 1dki s THR 25 N -0.83 3.00 0.44 -5.08 -4.23 -0.90 -4.87 115.64 103.18 1dki s THR 25 Ca 0.09 0.33 -0.26 0.00 -1.18 0.00 0.00 61.69 60.66 1dki s THR 25 Cb 0.05 -3.07 -0.09 0.00 1.34 0.00 0.00 72.50 70.73 1dki s THR 25 CO 0.06 -0.42 1.44 -2.65 -0.54 0.00 0.00 174.62 172.51 1dki n PRO 26 N -3.46 2.30 -2.96 3.99 -0.02 -1.26 -4.54 135.00 129.05 1dki n PRO 26 Ca 0.07 0.82 -0.41 0.00 -2.02 0.00 0.00 63.50 61.96 1dki n PRO 26 Cb 0.56 -2.63 -0.04 0.00 -0.02 0.00 0.00 33.50 31.37 1dki n PRO 26 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1dki s VAL 27 N -1.18 4.96 0.23 -1.45 1.01 -1.26 -1.35 120.40 121.35 1dki s VAL 27 Ca 0.60 1.55 -0.31 0.00 0.00 0.00 0.00 61.98 63.82 1dki s VAL 27 Cb -0.45 -4.10 -0.11 0.00 0.00 0.00 0.00 36.38 31.72 1dki s VAL 27 CO 0.58 0.13 1.66 -0.63 0.00 0.00 0.00 175.10 176.85 1dki s ILE 28 N 1.51 2.13 -0.07 2.22 1.01 -0.18 -4.84 121.20 122.97 1dki s ILE 28 Ca 0.38 0.10 0.16 0.00 0.00 0.00 0.00 60.65 61.28 1dki s ILE 28 Cb -0.17 -3.06 -0.24 0.00 0.01 0.00 0.00 42.46 39.00 1dki s ILE 28 CO 0.16 0.01 0.26 -0.62 0.00 0.00 0.00 174.94 174.75 1dki n GLU 29 N 3.48 0.83 -4.18 2.79 1.02 -0.10 -0.99 120.64 123.50 1dki n GLU 29 Ca 0.13 -0.10 -0.13 0.00 -0.02 0.00 0.00 57.16 57.04 1dki n GLU 29 Cb 0.36 -1.40 -0.10 0.00 -0.02 0.00 0.00 31.44 30.28 1dki n GLU 29 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1dki s LYS 30 N -2.89 0.86 -0.07 3.49 1.02 -0.41 -4.90 119.74 116.83 1dki s LYS 30 Ca -0.07 -1.25 -0.13 0.00 0.02 0.00 0.00 55.97 54.54 1dki s LYS 30 Cb 0.09 -0.40 -0.05 0.00 -0.52 0.00 0.00 37.83 36.95 1dki s LYS 30 CO 0.67 0.04 0.33 0.08 -0.92 0.00 0.00 175.35 175.55 1dki s VAL 31 N -3.00 5.20 -0.06 3.17 1.01 -1.26 -4.62 120.40 120.85 1dki s VAL 31 Ca 0.09 0.64 -0.27 0.00 0.00 0.00 0.00 61.98 62.45 1dki s VAL 31 Cb 0.01 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 1dki s VAL 31 CO -0.02 0.53 0.84 -0.75 0.00 0.00 0.00 175.10 175.71 1dki s LYS 32 N -0.65 4.47 -0.00 2.72 2.20 -1.26 -4.95 119.74 122.27 1dki s LYS 32 Ca 0.20 1.13 -0.37 0.00 -0.36 0.00 0.00 55.97 56.58 1dki s LYS 32 Cb -0.15 -3.47 -0.15 0.00 -1.51 0.00 0.00 37.83 32.54 1dki s LYS 32 CO 0.09 -0.05 1.53 -2.30 -0.36 0.00 0.00 175.35 174.26 1dki n PRO 33 N 4.09 1.42 -0.37 4.03 -0.02 -1.26 -1.26 135.00 141.62 1dki n PRO 33 Ca 0.03 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 1dki n PRO 33 Cb 0.51 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 1dki n PRO 33 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dki n GLY 34 N 3.25 0.73 3.37 -1.23 0.00 -1.26 -5.06 105.19 104.98 1dki n GLY 34 Ca 0.20 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 1dki n GLY 34 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1dki s GLU 35 N -0.60 1.37 0.78 1.61 2.12 -0.39 -5.13 118.70 118.45 1dki s GLU 35 Ca 0.00 -1.47 -0.11 0.00 0.36 0.00 0.00 54.97 53.75 1dki s GLU 35 Cb 0.00 -1.49 0.06 0.00 0.26 0.00 0.00 34.13 32.96 1dki s GLU 35 CO 0.00 0.30 1.09 -0.65 -0.54 0.00 0.00 175.26 175.46 1dki s GLN 36 N -2.85 2.21 0.20 4.30 -0.21 -1.26 -4.63 119.66 117.42 1dki s GLN 36 Ca 0.18 1.12 -0.30 0.00 0.02 0.00 0.00 55.36 56.39 1dki s GLN 36 Cb -0.06 -1.90 -0.08 0.00 1.00 0.00 0.00 33.01 31.97 1dki s GLN 36 CO 0.08 -1.66 1.07 0.45 -2.12 0.00 0.00 175.29 173.11 1dki s SER 37 N -3.43 7.33 -0.06 5.90 0.15 -1.26 -4.73 113.70 117.60 1dki s SER 37 Ca 0.61 2.08 0.09 0.00 0.70 0.00 0.00 55.95 59.44 1dki s SER 37 Cb -0.17 -2.61 0.14 0.00 -1.71 0.00 0.00 66.02 61.68 1dki s SER 37 CO 0.56 -0.15 1.04 0.49 1.20 0.00 0.00 173.24 176.38 1dki n PHE 38 N 2.08 0.00 -1.73 3.44 3.01 -1.26 -5.07 117.46 117.93 1dki n PHE 38 Ca 0.01 -0.66 -0.42 0.00 1.01 0.00 0.00 57.45 57.40 1dki n PHE 38 Cb 0.46 -0.10 -0.02 0.00 -0.01 0.00 0.00 39.48 39.82 1dki n PHE 38 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1dki n VAL 39 N -0.88 0.74 0.00 -4.37 0.31 -1.26 -1.48 118.33 111.39 1dki n VAL 39 Ca 0.08 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 1dki n VAL 39 Cb 0.51 -1.93 0.00 0.00 -0.91 0.00 0.00 33.84 31.51 1dki n VAL 39 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1dki n GLY 40 N 2.63 1.16 3.89 2.92 0.00 -0.16 -4.99 105.19 110.65 1dki n GLY 40 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1dki n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dki s GLN 41 N -0.67 3.68 0.32 1.61 -0.21 -0.55 -4.82 119.66 119.01 1dki s GLN 41 Ca 0.00 0.04 -0.28 0.00 0.02 0.00 0.00 55.36 55.14 1dki s GLN 41 Cb 0.00 -2.76 -0.09 0.00 1.00 0.00 0.00 33.01 31.15 1dki s GLN 41 CO 0.00 0.40 1.10 -1.01 -2.12 0.00 0.00 175.29 173.66 1dki s HIS 42 N -1.74 3.46 0.71 0.91 3.76 -1.26 -1.02 115.29 120.11 1dki s HIS 42 Ca 0.43 1.67 -0.13 0.00 -0.15 0.00 0.00 55.06 56.88 1dki s HIS 42 Cb -0.12 -3.27 0.02 0.00 1.11 0.00 0.00 32.58 30.33 1dki s HIS 42 CO 0.24 -0.65 1.10 0.00 -0.85 0.00 0.00 174.74 174.58 1dki s ALA 43 N -1.29 2.37 0.62 -1.40 0.00 -0.46 -4.88 121.76 116.73 1dki s ALA 43 Ca 0.48 0.44 -0.19 0.00 0.00 0.00 0.00 51.96 52.69 1dki s ALA 43 Cb -0.30 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.50 1dki s ALA 43 CO 0.38 -1.49 1.29 0.00 0.00 0.00 0.00 175.76 175.94 1dki s ALA 44 N -2.56 2.49 0.35 0.00 0.00 -0.55 -4.77 121.76 116.72 1dki s ALA 44 Ca 0.65 1.19 0.18 0.00 0.00 0.00 0.00 51.96 53.98 1dki s ALA 44 Cb -0.19 -3.54 0.95 0.00 0.00 0.00 0.00 23.12 20.34 1dki s ALA 44 CO 0.47 -1.47 1.89 1.79 0.00 0.00 0.00 175.76 178.45 1dki h THR 45 N 0.77 0.97 0.00 0.00 1.35 -1.70 -3.42 112.91 110.89 1dki h THR 45 Ca -0.51 -1.05 0.00 0.00 -0.55 0.00 0.00 66.41 64.30 1dki h THR 45 Cb 1.32 1.61 0.00 0.00 -1.73 0.00 0.00 68.15 69.35 1dki h THR 45 CO 0.54 0.28 0.00 0.61 -0.25 0.00 0.00 175.52 176.70 1dki n GLY 46 N -0.44 0.95 0.28 5.82 0.00 -1.26 -4.38 105.19 106.16 1dki n GLY 46 Ca -0.02 -1.40 0.07 0.00 0.00 0.00 0.00 46.02 44.68 1dki n GLY 46 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1dki h SER 47 N 0.00 0.15 -0.46 1.61 4.64 -1.90 -0.71 113.55 116.87 1dki h SER 47 Ca 0.00 -0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1dki h SER 47 Cb 0.00 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.04 1dki h SER 47 CO 0.00 0.11 -0.05 0.58 -0.87 0.00 0.00 176.83 176.59 1dki h VAL 48 N 0.18 1.27 -0.27 0.95 2.07 -1.85 -1.39 116.25 117.20 1dki h VAL 48 Ca 0.06 -1.14 -0.19 0.00 0.82 0.00 0.00 66.70 66.25 1dki h VAL 48 Cb 0.02 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1dki h VAL 48 CO -0.01 0.39 -0.56 0.00 0.02 0.00 0.00 177.57 177.41 1dki h ALA 49 N 0.89 0.43 -0.39 1.67 0.00 -1.56 -2.13 119.26 118.18 1dki h ALA 49 Ca 0.12 -0.52 -0.11 0.00 0.00 0.00 0.00 54.91 54.41 1dki h ALA 49 Cb 0.58 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1dki h ALA 49 CO 0.03 0.66 -0.20 1.15 0.00 0.00 0.00 179.25 180.89 1dki h THR 50 N 0.63 1.27 -0.03 0.00 2.02 -1.10 -0.21 112.91 115.48 1dki h THR 50 Ca 0.01 -1.29 -0.01 0.00 0.77 0.00 0.00 66.41 65.89 1dki h THR 50 Cb 1.17 1.18 -0.00 0.00 -1.74 0.00 0.00 68.15 68.76 1dki h THR 50 CO 0.12 0.43 -0.01 0.00 0.37 0.00 0.00 175.52 176.44 1dki h ALA 51 N 1.11 0.05 -0.82 6.16 0.00 -1.25 -1.99 119.26 122.51 1dki h ALA 51 Ca 0.10 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.86 1dki h ALA 51 Cb 0.70 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 1dki h ALA 51 CO 0.05 -0.26 0.52 1.15 0.00 0.00 0.00 179.25 180.71 1dki h THR 52 N -0.27 1.12 -0.71 0.00 2.02 -1.29 -2.30 112.91 111.49 1dki h THR 52 Ca 0.01 -0.35 -0.05 0.00 0.77 0.00 0.00 66.41 66.79 1dki h THR 52 Cb 0.37 0.02 -0.03 0.00 -1.74 0.00 0.00 68.15 66.77 1dki h THR 52 CO 0.00 0.19 0.23 0.00 0.37 0.00 0.00 175.52 176.31 1dki h ALA 53 N 1.34 0.93 -0.61 6.16 0.00 -0.96 0.24 119.26 126.36 1dki h ALA 53 Ca 0.33 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1dki h ALA 53 Cb 0.01 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1dki h ALA 53 CO -0.12 0.60 0.22 1.96 0.00 0.00 0.00 179.25 181.91 1dki h GLN 54 N 1.04 0.93 -0.64 0.00 4.20 -1.04 0.03 115.11 119.62 1dki h GLN 54 Ca 0.23 -0.18 -0.09 0.00 0.06 0.00 0.00 58.65 58.67 1dki h GLN 54 Cb 0.29 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 1dki h GLN 54 CO -0.01 0.81 0.06 0.82 -0.67 0.00 0.00 178.83 179.84 1dki h ILE 55 N 0.86 1.26 -0.41 2.54 2.04 -1.08 -1.52 117.51 121.21 1dki h ILE 55 Ca 0.20 -1.09 -0.05 0.00 1.00 0.00 0.00 64.86 64.92 1dki h ILE 55 Cb 0.25 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 1dki h ILE 55 CO -0.01 0.40 0.04 0.24 0.00 0.00 0.00 178.15 178.83 1dki h MET 56 N 1.00 0.63 -0.05 2.37 2.86 -0.54 -2.35 114.93 118.85 1dki h MET 56 Ca 0.19 -0.13 -0.13 0.00 -2.06 0.00 0.00 59.70 57.57 1dki h MET 56 Cb 0.49 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 1dki h MET 56 CO 0.02 0.62 -0.56 -0.22 1.06 0.00 0.00 176.91 177.83 1dki h LYS 57 N 0.60 0.15 0.00 1.72 1.63 -0.58 0.22 116.57 120.32 1dki h LYS 57 Ca 0.13 -0.10 -0.03 0.00 -0.85 0.00 0.00 60.65 59.81 1dki h LYS 57 Cb 0.31 0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 31.95 1dki h LYS 57 CO 0.01 0.67 -0.13 -0.92 -3.45 0.00 0.00 179.45 175.63 1dki h TYR 58 N 0.12 0.00 0.00 1.91 3.20 -0.74 -2.40 116.97 119.06 1dki h TYR 58 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1dki h TYR 58 Cb 1.02 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.29 1dki h TYR 58 CO 0.01 0.13 -1.08 0.72 -1.64 0.00 0.00 178.16 176.30 1dki n HIS 59 N -4.26 0.00 -3.84 -3.82 8.25 -1.05 -4.99 115.22 105.51 1dki n HIS 59 Ca -0.03 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.18 1dki n HIS 59 Cb 0.20 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.25 1dki n HIS 59 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1dki n ASN 60 N -1.57 -1.37 -3.86 0.41 3.02 0.04 -4.97 115.26 106.96 1dki n ASN 60 Ca 0.03 -0.96 -0.11 0.00 -0.03 0.00 0.00 54.58 53.50 1dki n ASN 60 Cb 0.34 -3.37 -0.10 0.00 -0.61 0.00 0.00 39.78 36.05 1dki n ASN 60 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1dki s TYR 61 N -3.80 0.01 0.69 3.10 5.04 -1.11 -4.67 117.35 116.61 1dki s TYR 61 Ca 0.08 -0.06 -0.04 0.00 -2.44 0.00 0.00 57.07 54.61 1dki s TYR 61 Cb -0.03 -0.03 0.08 0.00 0.35 0.00 0.00 41.96 42.33 1dki s TYR 61 CO 0.86 -0.27 0.98 -1.25 -1.34 0.00 0.00 175.55 174.53 1dki s PRO 62 N -1.25 2.07 0.02 4.97 0.04 -1.26 -4.76 135.00 134.83 1dki s PRO 62 Ca -0.13 -0.54 0.07 0.00 0.04 0.00 0.00 61.00 60.43 1dki s PRO 62 Cb -0.07 -2.25 -0.23 0.00 0.04 0.00 0.00 34.50 31.99 1dki s PRO 62 CO 0.02 -1.24 0.89 -0.91 0.04 0.00 0.00 177.00 175.80 1dki h ASN 63 N -0.51 0.10 -3.63 6.66 4.21 -1.85 -3.42 115.58 117.14 1dki h ASN 63 Ca -0.42 -0.15 -0.47 0.00 1.21 0.00 0.00 56.30 56.47 1dki h ASN 63 Cb 1.30 -0.03 -0.32 0.00 -1.12 0.00 0.00 38.32 38.14 1dki h ASN 63 CO 0.53 1.12 -0.80 -0.54 -1.29 0.00 0.00 177.43 176.45 1dki s LYS 64 N -2.64 1.32 0.55 0.81 1.02 -1.26 -1.04 119.74 118.51 1dki s LYS 64 Ca -0.04 -0.35 -0.17 0.00 0.02 0.00 0.00 55.97 55.42 1dki s LYS 64 Cb 0.08 -1.16 -0.06 0.00 -0.52 0.00 0.00 37.83 36.18 1dki s LYS 64 CO 0.83 0.07 1.04 0.20 -0.92 0.00 0.00 175.35 176.57 1dki s GLY 65 N 0.45 2.20 -0.25 -3.33 0.00 -0.70 -4.83 107.32 100.87 1dki s GLY 65 Ca -0.09 0.40 -0.11 0.00 0.00 0.00 0.00 44.72 44.92 1dki s GLY 65 CO 0.02 0.71 -0.15 1.04 0.00 0.00 0.00 173.10 174.71 1dki n LEU 66 N -1.70 2.26 -3.94 0.66 4.77 0.10 -4.36 117.00 114.79 1dki n LEU 66 Ca 0.08 0.22 -0.12 0.00 -0.03 0.00 0.00 56.01 56.17 1dki n LEU 66 Cb 0.53 -0.90 -0.13 0.00 -2.33 0.00 0.00 43.42 40.59 1dki n LEU 66 CO 0.45 0.64 -0.37 -0.54 -1.33 0.00 0.00 177.39 176.24 1dki s LYS 67 N -2.49 0.23 1.00 3.23 3.01 -1.18 -4.43 119.74 119.11 1dki s LYS 67 Ca -0.35 -0.33 -0.12 0.00 -1.01 0.00 0.00 55.97 54.16 1dki s LYS 67 Cb 0.11 -0.06 0.19 0.00 -1.01 0.00 0.00 37.83 37.06 1dki s LYS 67 CO 0.56 0.01 1.09 -0.51 0.51 0.00 0.00 175.35 177.01 1dki s ASP 68 N -0.71 2.59 -0.09 2.83 1.01 -1.26 -4.03 116.67 117.01 1dki s ASP 68 Ca -0.06 1.28 -0.11 0.00 0.71 0.00 0.00 52.55 54.36 1dki s ASP 68 Cb -0.05 -1.96 0.03 0.00 1.01 0.00 0.00 42.92 41.95 1dki s ASP 68 CO -0.00 -3.17 0.30 -0.47 0.21 0.00 0.00 175.17 172.04 1dki s TYR 69 N -2.91 -0.28 -0.01 4.23 5.04 -0.72 -4.90 117.35 117.80 1dki s TYR 69 Ca 0.65 0.65 -0.07 0.00 -2.44 0.00 0.00 57.07 55.86 1dki s TYR 69 Cb -0.19 0.10 0.00 0.00 0.35 0.00 0.00 41.96 42.23 1dki s TYR 69 CO 0.58 -0.22 0.15 -0.08 -1.34 0.00 0.00 175.55 174.64 1dki s THR 70 N -0.26 0.07 0.20 4.34 -1.32 -1.26 -0.83 115.64 116.59 1dki s THR 70 Ca -0.04 -0.59 -0.19 0.00 -1.21 0.00 0.00 61.69 59.66 1dki s THR 70 Cb -0.03 -0.41 0.04 0.00 -1.51 0.00 0.00 72.50 70.58 1dki s THR 70 CO 0.01 -0.33 0.57 -0.72 -2.21 0.00 0.00 174.62 171.95 1dki s TYR 71 N -1.19 -0.24 -0.18 9.09 -0.85 -0.82 -5.00 117.35 118.17 1dki s TYR 71 Ca -0.13 -0.09 -0.08 0.00 -0.52 0.00 0.00 57.07 56.25 1dki s TYR 71 Cb -0.07 0.48 -0.04 0.00 0.38 0.00 0.00 41.96 42.71 1dki s TYR 71 CO 0.01 -0.94 0.09 0.99 -1.52 0.00 0.00 175.55 174.19 1dki s THR 72 N -3.85 5.09 0.40 -3.49 2.01 -1.26 -0.93 115.64 113.62 1dki s THR 72 Ca 0.07 0.07 -0.26 0.00 0.31 0.00 0.00 61.69 61.88 1dki s THR 72 Cb -0.02 -3.30 -0.09 0.00 0.01 0.00 0.00 72.50 69.10 1dki s THR 72 CO -0.04 0.46 1.33 -0.22 -0.69 0.00 0.00 174.62 175.47 1dki s LEU 73 N 0.26 4.23 0.12 4.42 2.96 0.14 -4.89 118.68 125.93 1dki s LEU 73 Ca 0.06 2.72 -0.35 0.00 -0.22 0.00 0.00 54.13 56.35 1dki s LEU 73 Cb -0.12 -3.87 -0.16 0.00 0.50 0.00 0.00 46.19 42.54 1dki s LEU 73 CO -0.01 -0.87 1.25 -0.24 -1.32 0.00 0.00 176.35 175.16 1dki n SER 74 N 0.16 1.47 0.29 3.68 2.88 -1.26 -4.71 113.62 116.14 1dki n SER 74 Ca 0.03 1.13 0.16 0.00 -1.33 0.00 0.00 58.87 58.87 1dki n SER 74 Cb 0.43 -1.20 0.90 0.00 -0.75 0.00 0.00 64.21 63.60 1dki n SER 74 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1dki h SER 75 N 3.99 0.00 0.09 -3.46 4.64 -1.99 -1.97 113.55 114.84 1dki h SER 75 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1dki h SER 75 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 1dki h SER 75 CO 0.74 0.04 -0.03 0.59 -0.87 0.00 0.00 176.83 177.30 1dki n ASN 76 N -3.54 0.71 -4.65 4.97 5.03 -1.26 -4.86 115.26 111.67 1dki n ASN 76 Ca -0.02 -1.09 -0.43 0.00 0.87 0.00 0.00 54.58 53.91 1dki n ASN 76 Cb 0.15 -0.01 -0.03 0.00 -1.02 0.00 0.00 39.78 38.87 1dki n ASN 76 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1dki s ASN 77 N -2.12 6.52 0.00 6.41 3.84 -0.74 -4.88 114.94 123.97 1dki s ASN 77 Ca 0.39 2.00 0.30 0.00 0.21 0.00 0.00 52.86 55.76 1dki s ASN 77 Cb 0.21 -2.53 1.49 0.00 -0.55 0.00 0.00 41.25 39.87 1dki s ASN 77 CO 0.38 -1.08 2.00 -0.81 -2.79 0.00 0.00 177.10 174.81 1dki n PRO 78 N 7.37 0.95 0.01 0.43 -0.04 -1.26 -3.96 135.00 138.50 1dki n PRO 78 Ca 0.18 -0.25 0.11 0.00 -0.04 0.00 0.00 63.50 63.51 1dki n PRO 78 Cb 0.44 -1.49 0.09 0.00 -0.04 0.00 0.00 33.50 32.49 1dki n PRO 78 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1dki n TYR 79 N -0.81 0.06 -4.22 0.54 4.02 -1.26 -4.59 117.16 110.91 1dki n TYR 79 Ca 0.19 0.02 -0.16 0.00 -0.01 0.00 0.00 57.90 57.94 1dki n TYR 79 Cb 0.22 -0.22 -0.11 0.00 -0.02 0.00 0.00 39.34 39.22 1dki n TYR 79 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1dki s PHE 80 N -3.04 1.24 0.41 -0.72 0.40 -1.25 -0.92 117.98 114.09 1dki s PHE 80 Ca 0.08 -0.64 -0.23 0.00 -0.60 0.00 0.00 56.93 55.54 1dki s PHE 80 Cb 0.16 -0.65 -0.09 0.00 0.51 0.00 0.00 43.02 42.95 1dki s PHE 80 CO 0.77 0.08 1.01 -0.80 0.70 0.00 0.00 175.22 176.98 1dki s ASN 81 N -2.62 6.83 0.15 1.36 0.01 -1.26 -4.95 114.94 114.46 1dki s ASN 81 Ca 0.09 1.91 0.08 0.00 -0.71 0.00 0.00 52.86 54.24 1dki s ASN 81 Cb -0.02 -2.57 -0.04 0.00 0.41 0.00 0.00 41.25 39.02 1dki s ASN 81 CO 0.01 -0.43 -0.12 -1.00 -1.51 0.00 0.00 177.10 174.05 1dki s HIS 82 N -1.81 2.63 0.43 2.20 3.76 -1.26 -4.06 115.29 117.18 1dki s HIS 82 Ca 0.59 -0.22 -0.22 0.00 -0.15 0.00 0.00 55.06 55.06 1dki s HIS 82 Cb -0.18 -1.33 -0.10 0.00 1.11 0.00 0.00 32.58 32.08 1dki s HIS 82 CO 0.23 0.46 0.97 -1.25 -0.85 0.00 0.00 174.74 174.30 1dki s PRO 83 N -2.50 4.18 -0.15 8.40 0.04 -1.26 -5.18 135.00 138.54 1dki s PRO 83 Ca 0.22 1.22 -0.01 0.00 0.04 0.00 0.00 61.00 62.48 1dki s PRO 83 Cb -0.10 -2.26 0.04 0.00 0.04 0.00 0.00 34.50 32.21 1dki s PRO 83 CO 0.13 -0.08 -0.05 0.21 0.04 0.00 0.00 177.00 177.25 1dki s LYS 84 N -3.00 1.39 -0.15 4.56 2.47 -1.26 -5.06 119.74 118.70 1dki s LYS 84 Ca 0.61 -0.40 -0.04 0.00 -1.56 0.00 0.00 55.97 54.59 1dki s LYS 84 Cb -0.13 -1.83 -0.03 0.00 -1.46 0.00 0.00 37.83 34.39 1dki s LYS 84 CO 0.17 -0.38 -0.03 1.21 0.16 0.00 0.00 175.35 176.48 1dki s ASN 85 N 1.68 4.90 0.00 1.43 3.84 -1.26 0.29 114.94 125.82 1dki s ASN 85 Ca 0.02 -0.08 0.03 0.00 0.21 0.00 0.00 52.86 53.05 1dki s ASN 85 Cb -0.14 -1.73 -0.03 0.00 -0.55 0.00 0.00 41.25 38.79 1dki s ASN 85 CO -0.08 0.20 -0.08 -0.76 -2.79 0.00 0.00 177.10 173.60 1dki s LEU 86 N 0.16 3.11 -0.01 3.21 1.02 -0.11 -4.98 118.68 121.09 1dki s LEU 86 Ca -0.01 -0.17 -0.00 0.00 0.02 0.00 0.00 54.13 53.97 1dki s LEU 86 Cb -0.14 -1.78 0.01 0.00 0.02 0.00 0.00 46.19 44.31 1dki s LEU 86 CO 0.03 0.29 0.02 0.12 0.02 0.00 0.00 176.35 176.82 1dki s PHE 87 N -0.98 -0.01 -0.13 0.29 5.36 -1.26 -1.93 117.98 119.32 1dki s PHE 87 Ca 0.16 0.06 -0.00 0.00 -0.96 0.00 0.00 56.93 56.19 1dki s PHE 87 Cb -0.11 -0.05 0.03 0.00 -0.34 0.00 0.00 43.02 42.55 1dki s PHE 87 CO 0.07 -0.03 -0.08 0.00 -1.46 0.00 0.00 175.22 173.72 1dki s ALA 88 N 0.27 1.46 -1.52 11.12 0.00 -0.01 -5.01 121.76 128.08 1dki s ALA 88 Ca -0.02 -0.69 -0.09 0.00 0.00 0.00 0.00 51.96 51.16 1dki s ALA 88 Cb -0.03 -1.00 -0.08 0.00 0.00 0.00 0.00 23.12 22.02 1dki s ALA 88 CO -0.01 -0.52 2.94 0.00 0.00 0.00 0.00 175.76 178.17 1dki n ALA 89 N 4.90 7.45 0.25 0.00 0.00 -1.26 -1.75 120.51 130.09 1dki n ALA 89 Ca -0.13 -3.51 0.09 0.00 0.00 0.00 0.00 53.44 49.89 1dki n ALA 89 Cb 0.49 -3.26 0.63 0.00 0.00 0.00 0.00 19.45 17.31 1dki n ALA 89 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1dki h ILE 90 N 2.91 0.91 0.00 0.00 2.04 -1.91 -2.13 117.51 119.32 1dki h ILE 90 Ca 0.83 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 66.24 1dki h ILE 90 Cb 0.34 1.25 -0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1dki h ILE 90 CO 1.68 0.12 -0.05 0.77 0.00 0.00 0.00 178.15 180.67 1dki h SER 91 N 0.00 0.00 -0.09 1.72 4.64 -1.76 -2.38 113.55 115.69 1dki h SER 91 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1dki h SER 91 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1dki h SER 91 CO 0.02 0.05 0.00 0.35 -0.87 0.00 0.00 176.83 176.37 1dki n THR 92 N -3.20 0.09 -2.78 2.95 -2.24 -0.80 -4.68 114.28 103.61 1dki n THR 92 Ca -0.00 -0.39 -0.41 0.00 -2.27 0.00 0.00 64.05 60.97 1dki n THR 92 Cb 0.27 0.79 -0.03 0.00 -2.10 0.00 0.00 70.33 69.26 1dki n THR 92 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1dki s ARG 93 N -1.91 4.55 -0.40 -0.78 1.81 -0.89 -4.98 118.95 116.34 1dki s ARG 93 Ca 0.34 1.31 0.03 0.00 -1.72 0.00 0.00 55.73 55.70 1dki s ARG 93 Cb 0.20 -3.45 0.11 0.00 -0.45 0.00 0.00 34.95 31.36 1dki s ARG 93 CO 0.31 0.00 0.12 -0.65 -0.68 0.00 0.00 175.30 174.41 1dki s GLN 94 N 0.85 1.67 -0.08 3.54 -0.21 -1.26 -1.71 119.66 122.46 1dki s GLN 94 Ca 0.49 -2.07 -0.30 0.00 0.02 0.00 0.00 55.36 53.50 1dki s GLN 94 Cb -0.21 -3.28 -0.02 0.00 1.00 0.00 0.00 33.01 30.50 1dki s GLN 94 CO 0.26 -1.00 1.07 0.71 -2.12 0.00 0.00 175.29 174.21 1dki s TYR 95 N 0.61 3.42 -0.48 0.91 1.51 -0.20 -5.00 117.35 118.12 1dki s TYR 95 Ca 0.12 1.48 -0.16 0.00 -1.01 0.00 0.00 57.07 57.50 1dki s TYR 95 Cb -0.21 -3.26 0.07 0.00 -0.11 0.00 0.00 41.96 38.45 1dki s TYR 95 CO -0.06 -0.56 0.45 1.21 -1.11 0.00 0.00 175.55 175.48 1dki s ASN 96 N 1.21 6.16 0.00 2.29 3.84 -1.26 -4.74 114.94 122.43 1dki s ASN 96 Ca 0.51 -1.27 0.21 0.00 0.21 0.00 0.00 52.86 52.52 1dki s ASN 96 Cb -0.20 -2.21 1.21 0.00 -0.55 0.00 0.00 41.25 39.50 1dki s ASN 96 CO 0.20 -0.71 1.65 0.79 -2.79 0.00 0.00 177.10 176.24 1dki n TRP 97 N 5.40 0.00 0.04 0.43 7.02 -1.26 -1.87 117.44 127.20 1dki n TRP 97 Ca -0.11 0.00 -0.10 0.00 -1.02 0.00 0.00 57.50 56.27 1dki n TRP 97 Cb 0.44 -0.07 -0.13 0.00 -2.42 0.00 0.00 31.31 29.12 1dki n TRP 97 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 1dki h ASN 98 N 0.00 0.10 1.35 -0.99 -0.26 -2.01 -3.31 115.58 110.46 1dki h ASN 98 Ca 0.00 -0.14 -0.07 0.00 -0.56 0.00 0.00 56.30 55.53 1dki h ASN 98 Cb 0.05 -0.03 -0.01 0.00 -1.06 0.00 0.00 38.32 37.26 1dki h ASN 98 CO 0.00 1.11 -0.68 0.78 -1.06 0.00 0.00 177.43 177.58 1dki h ASN 99 N 0.02 0.00 -2.57 5.81 2.35 -1.75 -3.41 115.58 116.03 1dki h ASN 99 Ca -0.13 0.00 -0.68 0.00 -0.55 0.00 0.00 56.30 54.94 1dki h ASN 99 Cb 1.89 0.00 -0.17 0.00 0.05 0.00 0.00 38.32 40.09 1dki h ASN 99 CO 0.13 0.29 0.66 -0.63 -1.65 0.00 0.00 177.43 176.23 1dki s ILE 100 N -3.10 4.68 0.77 2.81 1.01 -1.03 -4.39 121.20 121.94 1dki s ILE 100 Ca 0.02 -1.27 -0.11 0.00 0.00 0.00 0.00 60.65 59.29 1dki s ILE 100 Cb 0.08 -4.72 0.05 0.00 0.01 0.00 0.00 42.46 37.88 1dki s ILE 100 CO 0.75 -1.44 1.10 -0.76 0.00 0.00 0.00 174.94 174.59 1dki s LEU 101 N 2.90 3.06 0.43 2.97 1.43 -1.26 -4.89 118.68 123.33 1dki s LEU 101 Ca 0.27 1.86 0.23 0.00 -1.03 0.00 0.00 54.13 55.46 1dki s LEU 101 Cb -0.10 -4.53 0.94 0.00 0.03 0.00 0.00 46.19 42.54 1dki s LEU 101 CO -0.03 -2.05 1.85 1.55 0.23 0.00 0.00 176.35 177.90 1dki h PRO 102 N -1.04 0.00 -2.93 1.29 0.13 -1.88 -3.46 132.00 124.11 1dki h PRO 102 Ca -0.44 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.72 1dki h PRO 102 Cb 1.23 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.27 1dki h PRO 102 CO 0.51 0.26 0.24 -0.08 -0.23 0.00 0.00 178.00 178.70 1dki s THR 103 N -3.77 0.00 -0.01 1.56 -1.32 -1.26 -1.25 115.64 109.58 1dki s THR 103 Ca -0.00 -0.36 0.04 0.00 -1.21 0.00 0.00 61.69 60.16 1dki s THR 103 Cb 0.11 -1.37 -0.01 0.00 -1.51 0.00 0.00 72.50 69.72 1dki s THR 103 CO 0.65 0.00 -0.13 -0.31 -2.21 0.00 0.00 174.62 172.62 1dki s TYR 104 N -3.75 1.18 -0.14 9.09 1.51 -1.26 -5.01 117.35 118.96 1dki s TYR 104 Ca 0.05 -0.24 0.17 0.00 -1.01 0.00 0.00 57.07 56.04 1dki s TYR 104 Cb -0.03 -0.77 -0.24 0.00 -0.11 0.00 0.00 41.96 40.81 1dki s TYR 104 CO -0.06 -0.04 0.31 -1.13 -1.11 0.00 0.00 175.55 173.52 1dki n SER 105 N 2.85 0.25 0.00 2.29 3.41 -1.26 -5.00 113.62 116.17 1dki n SER 105 Ca -0.15 0.12 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 1dki n SER 105 Cb 0.55 0.82 0.00 0.00 -0.26 0.00 0.00 64.21 65.32 1dki n SER 105 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dki n GLY 106 N 1.62 0.69 1.05 5.00 0.00 -1.26 -4.96 105.19 107.33 1dki n GLY 106 Ca -0.24 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.89 1dki n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dki n ARG 107 N -1.11 2.35 -1.46 1.61 1.74 -1.26 -4.99 116.66 113.54 1dki n ARG 107 Ca 0.00 -2.06 -0.33 0.00 -0.77 0.00 0.00 57.85 54.70 1dki n ARG 107 Cb 0.00 -1.48 0.08 0.00 -1.02 0.00 0.00 32.46 30.04 1dki n ARG 107 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1dki s GLU 108 N -1.42 2.34 0.99 5.56 8.01 -1.26 -5.05 118.70 127.87 1dki s GLU 108 Ca 0.39 1.44 -0.16 0.00 0.01 0.00 0.00 54.97 56.65 1dki s GLU 108 Cb 0.21 -1.89 0.20 0.00 -4.31 0.00 0.00 34.13 28.35 1dki s GLU 108 CO 0.29 -1.61 1.28 -1.54 0.01 0.00 0.00 175.26 173.69 1dki s SER 109 N -2.64 2.90 0.25 -0.19 1.04 -1.26 -4.79 113.70 109.00 1dki s SER 109 Ca 0.67 0.36 -0.06 0.00 0.48 0.00 0.00 55.95 57.41 1dki s SER 109 Cb -0.22 -0.47 0.28 0.00 0.10 0.00 0.00 66.02 65.71 1dki s SER 109 CO 0.47 -2.87 1.91 0.78 0.98 0.00 0.00 173.24 174.51 1dki h ASN 110 N -1.74 1.08 -0.24 7.02 2.35 -1.98 -1.92 115.58 120.15 1dki h ASN 110 Ca -0.45 -0.02 0.06 0.00 -0.55 0.00 0.00 56.30 55.34 1dki h ASN 110 Cb 1.25 -0.26 -0.06 0.00 0.05 0.00 0.00 38.32 39.30 1dki h ASN 110 CO 0.40 0.76 -0.17 0.58 -1.65 0.00 0.00 177.43 177.35 1dki h VAL 111 N 1.26 0.53 -0.14 2.81 2.07 -1.98 0.24 116.25 121.04 1dki h VAL 111 Ca 0.37 0.00 -0.20 0.00 0.82 0.00 0.00 66.70 67.69 1dki h VAL 111 Cb -0.07 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1dki h VAL 111 CO -0.10 0.00 -0.71 1.56 0.02 0.00 0.00 177.57 178.34 1dki h GLN 112 N -0.15 0.64 -0.42 1.57 7.50 -1.72 -2.44 115.11 120.09 1dki h GLN 112 Ca 0.14 -0.49 -0.12 0.00 0.50 0.00 0.00 58.65 58.67 1dki h GLN 112 Cb 0.36 0.09 -0.01 0.00 0.05 0.00 0.00 27.48 27.97 1dki h GLN 112 CO -0.34 1.11 -0.22 0.87 -1.50 0.00 0.00 178.83 178.75 1dki h LYS 113 N 0.45 0.88 -0.47 1.46 1.57 -1.09 -2.61 116.57 116.75 1dki h LYS 113 Ca -0.03 -0.39 -0.10 0.00 -1.87 0.00 0.00 60.65 58.26 1dki h LYS 113 Cb 1.31 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.58 1dki h LYS 113 CO 0.14 1.04 -0.10 1.98 -0.57 0.00 0.00 179.45 181.94 1dki h MET 114 N 0.71 0.85 -0.08 3.15 4.05 -0.59 -1.60 114.93 121.42 1dki h MET 114 Ca 0.09 -0.29 0.00 0.00 -0.28 0.00 0.00 59.70 59.22 1dki h MET 114 Cb 0.79 -0.07 -0.00 0.00 -0.80 0.00 0.00 31.60 31.51 1dki h MET 114 CO 0.06 0.91 0.05 0.00 0.23 0.00 0.00 176.91 178.17 1dki h ALA 115 N 1.12 0.11 -0.30 0.39 0.00 -1.26 0.19 119.26 119.50 1dki h ALA 115 Ca 0.13 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.86 1dki h ALA 115 Cb 0.60 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1dki h ALA 115 CO 0.04 -0.39 -0.44 0.97 0.00 0.00 0.00 179.25 179.43 1dki h ILE 116 N 0.09 1.29 -0.04 0.00 6.09 -1.45 -2.74 117.51 120.75 1dki h ILE 116 Ca 0.03 -1.62 -0.10 0.00 -1.37 0.00 0.00 64.86 61.80 1dki h ILE 116 Cb 0.01 1.59 -0.01 0.00 0.47 0.00 0.00 36.82 38.87 1dki h ILE 116 CO -0.01 0.53 -0.42 0.77 -3.07 0.00 0.00 178.15 175.95 1dki h SER 117 N 0.60 0.09 -0.41 2.19 4.64 -1.19 -1.29 113.55 118.19 1dki h SER 117 Ca 0.03 -0.04 -0.13 0.00 -0.47 0.00 0.00 61.79 61.18 1dki h SER 117 Cb 1.04 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.09 1dki h SER 117 CO 0.10 0.51 -0.27 -0.08 -0.87 0.00 0.00 176.83 176.22 1dki h GLU 118 N 0.08 0.91 -0.18 4.77 4.81 -0.97 -1.30 114.58 122.69 1dki h GLU 118 Ca 0.00 -0.43 -0.01 0.00 -0.13 0.00 0.00 59.36 58.80 1dki h GLU 118 Cb 0.78 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 1dki h GLU 118 CO 0.06 1.08 0.09 1.25 -0.73 0.00 0.00 179.01 180.76 1dki h LEU 119 N 0.73 0.23 -0.99 1.64 5.85 -1.12 -0.20 115.31 121.44 1dki h LEU 119 Ca 0.08 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 1dki h LEU 119 Cb 0.85 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.78 1dki h LEU 119 CO 0.07 0.28 0.37 0.24 -0.34 0.00 0.00 178.44 179.06 1dki h MET 120 N 0.17 1.09 -0.27 1.25 2.86 -1.18 -0.49 114.93 118.36 1dki h MET 120 Ca 0.06 -0.15 -0.19 0.00 -2.06 0.00 0.00 59.70 57.37 1dki h MET 120 Cb 0.10 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.56 1dki h MET 120 CO -0.01 0.83 -0.57 0.00 1.06 0.00 0.00 176.91 178.22 1dki h ALA 121 N 1.33 0.46 -0.29 6.32 0.00 -1.06 -0.99 119.26 125.04 1dki h ALA 121 Ca 0.26 -0.53 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 1dki h ALA 121 Cb 0.10 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1dki h ALA 121 CO -0.04 0.68 0.04 -0.44 0.00 0.00 0.00 179.25 179.49 1dki h ASP 122 N 0.65 0.47 -0.12 0.00 3.32 -0.66 -1.21 116.42 118.86 1dki h ASP 122 Ca 0.01 -0.27 -0.00 0.00 0.02 0.00 0.00 57.03 56.78 1dki h ASP 122 Cb 1.18 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 1dki h ASP 122 CO 0.13 0.62 0.06 0.58 -1.72 0.00 0.00 179.24 178.91 1dki h VAL 123 N 0.30 1.12 -0.79 -1.35 2.07 -1.10 -1.50 116.25 115.00 1dki h VAL 123 Ca 0.09 -0.35 0.04 0.00 0.82 0.00 0.00 66.70 67.30 1dki h VAL 123 Cb 0.36 1.13 -0.05 0.00 -1.52 0.00 0.00 31.29 31.21 1dki h VAL 123 CO 0.01 0.11 0.49 1.23 0.02 0.00 0.00 177.57 179.43 1dki h GLY 124 N 0.07 1.16 1.18 2.17 0.00 -1.09 -1.86 103.07 104.70 1dki h GLY 124 Ca 0.04 -0.37 -0.08 0.00 0.00 0.00 0.00 47.33 46.92 1dki h GLY 124 CO -0.01 0.29 0.03 -2.22 0.00 0.00 0.00 176.54 174.64 1dki h ILE 125 N 0.94 1.26 0.00 2.60 2.04 -0.99 -1.74 117.51 121.61 1dki h ILE 125 Ca 0.33 -1.07 0.00 0.00 1.00 0.00 0.00 64.86 65.11 1dki h ILE 125 Cb 0.07 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 1dki h ILE 125 CO -0.13 0.39 0.00 0.77 0.00 0.00 0.00 178.15 179.18 1dki h SER 126 N 0.91 0.00 -0.28 1.72 4.64 -0.45 -1.62 113.55 118.47 1dki h SER 126 Ca 0.17 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.40 1dki h SER 126 Cb 0.49 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.52 1dki h SER 126 CO 0.02 0.00 -0.05 1.33 -0.87 0.00 0.00 176.83 177.26 1dki n VAL 127 N -2.57 2.39 -3.88 0.95 0.24 -0.98 -4.71 118.33 109.77 1dki n VAL 127 Ca -0.00 -2.40 -0.25 0.00 -2.04 0.00 0.00 64.34 59.65 1dki n VAL 127 Cb 0.15 -0.29 -0.01 0.00 -1.47 0.00 0.00 33.84 32.22 1dki n VAL 127 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1dki n ASP 128 N -0.94 -0.71 -4.74 -1.34 10.43 -0.61 -4.54 116.55 114.10 1dki n ASP 128 Ca 0.27 -0.97 -0.42 0.00 2.57 0.00 0.00 54.79 56.25 1dki n ASP 128 Cb 0.94 -3.30 -0.02 0.00 1.84 0.00 0.00 41.12 40.59 1dki n ASP 128 CO 0.00 0.00 0.00 0.80 -1.07 0.00 0.00 177.20 176.93 1dki n MET 129 N -4.36 2.74 -3.18 -1.24 1.56 -0.69 -4.79 117.12 107.15 1dki n MET 129 Ca -0.30 0.98 -0.46 0.00 -0.27 0.00 0.00 57.70 57.65 1dki n MET 129 Cb 0.68 -2.79 -0.02 0.00 2.15 0.00 0.00 33.22 33.25 1dki n MET 129 CO 0.00 0.00 0.00 0.34 -0.73 0.00 0.00 175.97 175.58 1dki s ASP 130 N 0.73 6.76 0.42 6.12 2.15 0.15 -4.93 116.67 128.07 1dki s ASP 130 Ca 0.68 -2.54 -0.25 0.00 0.43 0.00 0.00 52.55 50.87 1dki s ASP 130 Cb -0.50 -2.28 -0.08 0.00 -0.30 0.00 0.00 42.92 39.76 1dki s ASP 130 CO 0.43 -0.73 1.28 -0.31 -0.17 0.00 0.00 175.17 175.68 1dki s TYR 131 N 0.98 2.80 0.00 -5.34 1.51 -1.26 -1.76 117.35 114.28 1dki s TYR 131 Ca 0.25 1.43 0.00 0.00 -1.01 0.00 0.00 57.07 57.74 1dki s TYR 131 Cb -0.08 -3.63 0.00 0.00 -0.11 0.00 0.00 41.96 38.14 1dki s TYR 131 CO -0.09 -2.04 0.00 0.41 -1.11 0.00 0.00 175.55 172.72 1dki n GLY 132 N 0.65 0.74 0.34 0.71 0.00 -1.26 -4.81 105.19 101.56 1dki n GLY 132 Ca 0.05 -0.82 0.09 0.00 0.00 0.00 0.00 46.02 45.34 1dki n GLY 132 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1dki h PRO 133 N 0.00 0.46 -6.64 1.61 0.11 -1.94 -1.45 132.00 124.14 1dki h PRO 133 Ca 0.00 -0.03 -0.65 0.00 0.11 0.00 0.00 66.00 65.44 1dki h PRO 133 Cb 0.00 -0.10 -0.21 0.00 0.11 0.00 0.00 31.00 30.79 1dki h PRO 133 CO 0.00 0.30 -0.85 -1.54 -0.21 0.00 0.00 178.00 175.70 1dki s SER 134 N -6.37 3.11 -0.05 -2.05 1.04 -1.26 -4.18 113.70 103.94 1dki s SER 134 Ca -0.08 -0.75 0.03 0.00 0.48 0.00 0.00 55.95 55.63 1dki s SER 134 Cb 0.19 -0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.11 1dki s SER 134 CO 0.74 0.13 -0.14 -0.44 0.98 0.00 0.00 173.24 174.52 1dki s SER 135 N -2.13 1.82 0.17 7.02 0.01 -1.26 -4.79 113.70 114.55 1dki s SER 135 Ca 0.13 -0.30 0.11 0.00 1.31 0.00 0.00 55.95 57.20 1dki s SER 135 Cb -0.10 -0.64 -0.04 0.00 0.21 0.00 0.00 66.02 65.46 1dki s SER 135 CO 0.06 0.09 -0.25 -0.83 0.41 0.00 0.00 173.24 172.72 1dki s GLY 136 N 0.31 1.67 0.03 3.44 0.00 -0.72 -4.26 107.32 107.77 1dki s GLY 136 Ca -0.08 -1.59 -0.09 0.00 0.00 0.00 0.00 44.72 42.96 1dki s GLY 136 CO 0.02 -1.60 0.19 -0.45 0.00 0.00 0.00 173.10 171.26 1dki s SER 137 N -2.48 0.02 0.61 1.64 0.15 -1.26 0.32 113.70 112.70 1dki s SER 137 Ca 0.19 -0.30 0.34 0.00 0.70 0.00 0.00 55.95 56.88 1dki s SER 137 Cb -0.09 0.27 1.98 0.00 -1.71 0.00 0.00 66.02 66.47 1dki s SER 137 CO 0.09 -0.50 2.28 0.00 1.20 0.00 0.00 173.24 176.30 1dki h ALA 138 N 3.70 1.34 0.00 5.45 0.00 -1.86 0.25 119.26 128.14 1dki h ALA 138 Ca -0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1dki h ALA 138 Cb 1.19 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1dki h ALA 138 CO 0.46 0.01 0.00 0.41 0.00 0.00 0.00 179.25 180.13 1dki n GLY 139 N -1.18 1.56 0.22 0.00 0.00 -1.26 -3.79 105.19 100.74 1dki n GLY 139 Ca -0.03 -0.69 -0.01 0.00 0.00 0.00 0.00 46.02 45.29 1dki n GLY 139 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1dki n SER 140 N 6.48 -0.40 -0.34 1.61 7.64 -1.26 -0.46 113.62 126.89 1dki n SER 140 Ca 0.00 1.00 -0.03 0.00 1.01 0.00 0.00 58.87 60.85 1dki n SER 140 Cb 0.00 -0.22 0.09 0.00 -1.01 0.00 0.00 64.21 63.07 1dki n SER 140 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1dki h SER 141 N 0.00 1.11 -0.15 6.43 4.64 -1.96 -0.88 113.55 122.73 1dki h SER 141 Ca 0.19 -0.07 -0.16 0.00 -0.47 0.00 0.00 61.79 61.28 1dki h SER 141 Cb 0.33 -0.28 0.01 0.00 -0.31 0.00 0.00 62.40 62.15 1dki h SER 141 CO -0.57 0.85 -0.52 0.03 -0.87 0.00 0.00 176.83 175.75 1dki h ARG 142 N 1.27 0.62 -0.12 4.77 2.47 -1.10 -3.13 114.38 119.16 1dki h ARG 142 Ca 0.33 -0.46 0.00 0.00 -1.26 0.00 0.00 59.98 58.59 1dki h ARG 142 Cb -0.06 0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 28.34 1dki h ARG 142 CO -0.06 1.09 0.08 0.28 0.56 0.00 0.00 179.97 181.91 1dki h VAL 143 N 0.28 1.03 -0.81 2.04 2.07 -0.70 0.15 116.25 120.31 1dki h VAL 143 Ca -0.02 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 1dki h VAL 143 Cb 1.15 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 31.74 1dki h VAL 143 CO 0.11 0.03 0.37 0.06 0.02 0.00 0.00 177.57 178.17 1dki h GLN 144 N 0.16 1.18 -0.29 1.57 -0.00 -1.26 -0.71 115.11 115.76 1dki h GLN 144 Ca 0.04 -0.18 -0.04 0.00 -0.00 0.00 0.00 58.65 58.47 1dki h GLN 144 Cb -0.02 -0.21 -0.01 0.00 -0.00 0.00 0.00 27.48 27.25 1dki h GLN 144 CO -0.01 0.92 0.03 -0.09 -0.00 0.00 0.00 178.83 179.68 1dki h ARG 145 N 1.16 0.50 -0.12 0.06 2.43 -1.44 -3.04 114.38 113.92 1dki h ARG 145 Ca 0.28 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1dki h ARG 145 Cb 0.14 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1dki h ARG 145 CO -0.03 0.62 0.08 0.00 -1.51 0.00 0.00 179.97 179.12 1dki h ALA 146 N 0.86 0.15 -0.93 2.80 0.00 -0.31 0.30 119.26 122.12 1dki h ALA 146 Ca 0.09 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.11 1dki h ALA 146 Cb 0.38 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.04 1dki h ALA 146 CO 0.01 -0.35 0.60 -0.07 0.00 0.00 0.00 179.25 179.44 1dki h LEU 147 N 0.15 0.76 0.00 0.00 3.38 -1.15 -0.21 115.31 118.24 1dki h LEU 147 Ca 0.04 0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 1dki h LEU 147 Cb 0.00 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1dki h LEU 147 CO -0.01 0.39 -0.65 0.11 0.09 0.00 0.00 178.44 178.37 1dki h LYS 148 N 0.80 0.00 -0.27 1.13 1.57 -1.37 0.21 116.57 118.65 1dki h LYS 148 Ca 0.47 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 59.12 1dki h LYS 148 Cb 0.64 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.95 1dki h LYS 148 CO -0.23 0.72 -0.35 1.49 -0.57 0.00 0.00 179.45 180.51 1dki h GLU 149 N -1.00 0.71 0.01 3.15 4.81 -0.95 -2.10 114.58 119.21 1dki h GLU 149 Ca -0.16 -0.40 -0.35 0.00 -0.13 0.00 0.00 59.36 58.32 1dki h GLU 149 Cb 0.94 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 30.29 1dki h GLU 149 CO -0.09 1.02 -2.15 0.09 -0.73 0.00 0.00 179.01 177.15 1dki n ASN 150 N -4.22 0.68 -0.65 1.04 4.13 -0.18 -3.84 115.26 112.23 1dki n ASN 150 Ca -0.04 0.14 0.08 0.00 1.68 0.00 0.00 54.58 56.43 1dki n ASN 150 Cb 0.51 0.34 0.07 0.00 -1.54 0.00 0.00 39.78 39.16 1dki n ASN 150 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1dki n PHE 151 N -2.96 0.02 -2.44 3.10 3.01 -0.67 0.02 117.46 117.54 1dki n PHE 151 Ca -0.29 -0.02 -0.15 0.00 1.01 0.00 0.00 57.45 58.00 1dki n PHE 151 Cb 1.10 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.57 1dki n PHE 151 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1dki n GLY 152 N 0.90 -0.23 3.85 1.37 0.00 -0.75 -4.32 105.19 106.01 1dki n GLY 152 Ca 0.10 -0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 1dki n GLY 152 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dki s TYR 153 N -2.82 2.95 0.68 1.61 1.51 0.68 -4.95 117.35 117.00 1dki s TYR 153 Ca 0.06 0.96 -0.17 0.00 -1.01 0.00 0.00 57.07 56.91 1dki s TYR 153 Cb -0.03 -3.26 0.00 0.00 -0.11 0.00 0.00 41.96 38.57 1dki s TYR 153 CO 0.08 -1.71 1.21 -1.71 -1.11 0.00 0.00 175.55 172.31 1dki n ASN 154 N -3.34 1.60 0.16 2.29 5.15 -0.55 -4.55 115.26 116.04 1dki n ASN 154 Ca 0.07 0.77 0.12 0.00 -0.60 0.00 0.00 54.58 54.94 1dki n ASN 154 Cb 0.58 -1.52 0.59 0.00 -0.53 0.00 0.00 39.78 38.91 1dki n ASN 154 CO 0.00 0.00 0.00 1.56 1.40 0.00 0.00 177.26 180.22 1dki h GLN 155 N 0.21 0.00 0.00 1.20 1.08 -1.91 -2.34 115.11 113.34 1dki h GLN 155 Ca -0.50 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.70 1dki h GLN 155 Cb 1.34 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.77 1dki h GLN 155 CO 0.51 0.00 0.00 0.66 -0.95 0.00 0.00 178.83 179.05 1dki h SER 156 N 0.00 0.00 -2.66 1.46 4.64 -1.91 -3.43 113.55 111.65 1dki h SER 156 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1dki h SER 156 Cb 0.13 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.25 1dki h SER 156 CO 0.00 0.00 1.02 -0.69 -0.87 0.00 0.00 176.83 176.29 1dki s VAL 157 N -3.56 2.94 0.07 0.95 1.01 -0.88 -4.28 120.40 116.65 1dki s VAL 157 Ca 0.01 0.41 -0.26 0.00 0.00 0.00 0.00 61.98 62.14 1dki s VAL 157 Cb 0.09 -3.26 0.08 0.00 0.00 0.00 0.00 36.38 33.28 1dki s VAL 157 CO 0.41 -0.00 0.67 -1.38 0.00 0.00 0.00 175.10 174.80 1dki s HIS 158 N 2.63 -0.55 0.16 5.22 -3.43 -0.71 -5.00 115.29 113.62 1dki s HIS 158 Ca 0.75 0.56 -0.24 0.00 -0.80 0.00 0.00 55.06 55.33 1dki s HIS 158 Cb -0.41 0.51 -0.08 0.00 -1.43 0.00 0.00 32.58 31.17 1dki s HIS 158 CO 0.33 -0.73 0.74 -1.14 -2.00 0.00 0.00 174.74 171.94 1dki s GLN 159 N -2.84 4.48 0.08 -0.38 0.74 -1.26 -1.34 119.66 119.13 1dki s GLN 159 Ca -0.02 1.07 0.06 0.00 0.05 0.00 0.00 55.36 56.52 1dki s GLN 159 Cb -0.01 -3.20 -0.03 0.00 1.10 0.00 0.00 33.01 30.87 1dki s GLN 159 CO -0.05 0.55 -0.17 0.96 -0.55 0.00 0.00 175.29 176.03 1dki s ILE 160 N -1.20 1.38 -0.08 -2.34 -4.36 -0.28 -4.97 121.20 109.35 1dki s ILE 160 Ca 0.36 -1.34 0.03 0.00 -0.26 0.00 0.00 60.65 59.43 1dki s ILE 160 Cb -0.22 -1.28 -0.02 0.00 1.25 0.00 0.00 42.46 42.20 1dki s ILE 160 CO 0.25 -0.09 -0.16 0.20 0.24 0.00 0.00 174.94 175.37 1dki s ASN 161 N -1.67 3.79 0.29 4.36 -0.87 -1.26 -0.99 114.94 118.59 1dki s ASN 161 Ca 0.02 -0.33 0.04 0.00 -1.57 0.00 0.00 52.86 51.03 1dki s ASN 161 Cb -0.10 -1.17 0.66 0.00 -0.02 0.00 0.00 41.25 40.63 1dki s ASN 161 CO 0.03 0.25 1.80 -0.09 -2.57 0.00 0.00 177.10 176.51 1dki h ARG 162 N 6.09 0.83 0.00 -0.60 9.65 -1.59 -0.53 114.38 128.23 1dki h ARG 162 Ca -0.34 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.49 1dki h ARG 162 Cb 1.18 -0.19 0.00 0.00 -1.39 0.00 0.00 29.97 29.58 1dki h ARG 162 CO 0.52 0.55 0.00 0.41 2.80 0.00 0.00 179.97 184.24 1dki n GLY 163 N -1.33 -0.85 0.18 2.80 0.00 -1.26 -1.58 105.19 103.14 1dki n GLY 163 Ca 0.22 0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.42 1dki n GLY 163 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1dki n ASP 164 N -1.84 0.84 -4.26 1.61 10.43 -0.21 -4.96 116.55 118.17 1dki n ASP 164 Ca 0.01 -0.71 -0.15 0.00 2.57 0.00 0.00 54.79 56.51 1dki n ASP 164 Cb 0.09 0.13 -0.10 0.00 1.84 0.00 0.00 41.12 43.07 1dki n ASP 164 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1dki s PHE 165 N -2.61 1.33 0.58 1.24 0.40 -0.61 -5.07 117.98 113.24 1dki s PHE 165 Ca 0.22 -0.72 -0.08 0.00 -0.60 0.00 0.00 56.93 55.75 1dki s PHE 165 Cb 0.19 -0.67 -0.02 0.00 0.51 0.00 0.00 43.02 43.03 1dki s PHE 165 CO 0.55 0.13 0.93 -1.54 0.70 0.00 0.00 175.22 175.99 1dki s SER 166 N -3.14 6.04 0.21 1.36 1.04 -1.26 -4.85 113.70 113.10 1dki s SER 166 Ca 0.17 1.10 -0.12 0.00 0.48 0.00 0.00 55.95 57.58 1dki s SER 166 Cb 0.02 -2.20 0.28 0.00 0.10 0.00 0.00 66.02 64.22 1dki s SER 166 CO 0.02 -0.86 1.65 0.11 0.98 0.00 0.00 173.24 175.14 1dki h LYS 167 N -0.15 0.07 -0.42 4.02 1.57 -1.99 -1.22 116.57 118.45 1dki h LYS 167 Ca -0.45 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.32 1dki h LYS 167 Cb 1.21 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.49 1dki h LYS 167 CO 0.62 0.05 0.24 1.96 -0.57 0.00 0.00 179.45 181.74 1dki h GLN 168 N 0.08 0.58 0.00 3.15 4.20 -1.99 -1.03 115.11 120.10 1dki h GLN 168 Ca 0.32 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.91 1dki h GLN 168 Cb 0.51 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 1dki h GLN 168 CO -0.57 0.46 -0.27 -0.44 -0.67 0.00 0.00 178.83 177.34 1dki h ASP 169 N 0.55 0.00 0.48 1.46 3.45 -1.82 -1.12 116.42 119.42 1dki h ASP 169 Ca 0.15 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.58 1dki h ASP 169 Cb 0.04 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.81 1dki h ASP 169 CO -0.02 0.27 -0.23 -0.25 -1.57 0.00 0.00 179.24 177.44 1dki h TRP 170 N 0.00 -0.59 -0.77 4.55 -0.00 -0.77 -2.71 115.95 115.66 1dki h TRP 170 Ca -0.00 -0.01 0.17 0.00 -0.00 0.00 0.00 58.89 59.04 1dki h TRP 170 Cb 0.61 0.20 -0.05 0.00 -0.00 0.00 0.00 29.16 29.92 1dki h TRP 170 CO 0.00 -0.36 0.52 0.93 -0.00 0.00 0.00 178.44 179.53 1dki h GLU 171 N -1.17 0.33 -0.60 2.65 5.08 -1.15 0.05 114.58 119.78 1dki h GLU 171 Ca -0.07 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.18 1dki h GLU 171 Cb 0.50 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 1dki h GLU 171 CO 0.11 0.22 0.02 0.00 -1.00 0.00 0.00 179.01 178.36 1dki h ALA 172 N 1.64 0.90 -0.64 3.43 0.00 -1.21 0.14 119.26 123.52 1dki h ALA 172 Ca 0.38 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1dki h ALA 172 Cb 1.00 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1dki h ALA 172 CO -0.11 0.66 0.21 1.96 0.00 0.00 0.00 179.25 181.96 1dki h GLN 173 N 0.95 0.96 -0.02 0.00 1.08 -0.65 -0.24 115.11 117.21 1dki h GLN 173 Ca 0.18 -0.18 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 1dki h GLN 173 Cb 0.52 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.80 1dki h GLN 173 CO 0.03 0.82 -0.03 0.82 -0.95 0.00 0.00 178.83 179.52 1dki h ILE 174 N 0.94 1.45 -0.86 2.54 2.04 -1.11 -2.78 117.51 119.72 1dki h ILE 174 Ca 0.21 -1.37 0.07 0.00 1.00 0.00 0.00 64.86 64.77 1dki h ILE 174 Cb 0.25 2.34 -0.06 0.00 -0.74 0.00 0.00 36.82 38.62 1dki h ILE 174 CO -0.01 0.36 0.56 0.44 0.00 0.00 0.00 178.15 179.50 1dki h ASP 175 N -0.51 0.83 -0.47 1.72 3.32 -0.61 -1.42 116.42 119.28 1dki h ASP 175 Ca 0.00 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 1dki h ASP 175 Cb 0.61 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 1dki h ASP 175 CO 0.01 0.53 0.26 0.50 -1.72 0.00 0.00 179.24 178.81 1dki h LYS 176 N 0.94 0.66 -0.47 3.56 3.64 -1.02 0.02 116.57 123.90 1dki h LYS 176 Ca 0.37 -0.08 0.01 0.00 -1.27 0.00 0.00 60.65 59.68 1dki h LYS 176 Cb 0.24 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1dki h LYS 176 CO -0.14 0.53 0.31 0.93 -2.27 0.00 0.00 179.45 178.80 1dki h GLU 177 N 0.62 0.61 -0.60 1.90 4.39 -1.00 -2.64 114.58 117.87 1dki h GLU 177 Ca 0.17 -0.04 -0.07 0.00 0.34 0.00 0.00 59.36 59.76 1dki h GLU 177 Cb 0.06 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.55 1dki h GLU 177 CO -0.03 0.40 0.09 -0.07 -1.16 0.00 0.00 179.01 178.24 1dki h LEU 178 N 0.63 0.92 -2.49 1.33 3.38 -1.04 -1.10 115.31 116.95 1dki h LEU 178 Ca 0.18 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1dki h LEU 178 Cb -0.06 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.45 1dki h LEU 178 CO -0.05 0.93 0.00 0.77 0.09 0.00 0.00 178.44 180.19 1dki h SER 179 N 0.91 0.00 -0.35 -0.43 4.64 -0.63 0.14 113.55 117.83 1dki h SER 179 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1dki h SER 179 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1dki h SER 179 CO 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 1dki n GLN 180 N -2.85 3.27 -3.76 4.77 6.02 -0.76 -4.96 117.38 119.11 1dki n GLN 180 Ca -0.02 -2.78 -0.23 0.00 -0.01 0.00 0.00 57.00 53.96 1dki n GLN 180 Cb 0.07 -1.82 0.02 0.00 1.02 0.00 0.00 30.24 29.53 1dki n GLN 180 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1dki n ASN 181 N -0.06 -1.30 -3.91 1.08 3.02 0.51 -4.96 115.26 109.64 1dki n ASN 181 Ca 0.21 -0.85 -0.31 0.00 -0.03 0.00 0.00 54.58 53.61 1dki n ASN 181 Cb 0.87 -3.87 -0.15 0.00 -0.61 0.00 0.00 39.78 36.02 1dki n ASN 181 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1dki s GLN 182 N -6.13 1.19 0.59 3.52 -0.21 -0.49 -5.02 119.66 113.11 1dki s GLN 182 Ca 0.06 -1.56 -0.19 0.00 0.02 0.00 0.00 55.36 53.69 1dki s GLN 182 Cb -0.03 -2.73 -0.05 0.00 1.00 0.00 0.00 33.01 31.20 1dki s GLN 182 CO 0.83 -0.95 1.03 -2.30 -2.12 0.00 0.00 175.29 171.78 1dki n PRO 183 N 4.49 1.01 -4.66 2.91 -0.02 -1.26 -4.05 135.00 133.41 1dki n PRO 183 Ca 0.01 0.39 -0.33 0.00 -2.02 0.00 0.00 63.50 61.55 1dki n PRO 183 Cb 0.42 -2.23 -0.13 0.00 -0.02 0.00 0.00 33.50 31.53 1dki n PRO 183 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1dki s VAL 184 N -1.47 3.36 -0.07 -1.45 1.01 -0.31 -4.77 120.40 116.70 1dki s VAL 184 Ca 0.75 -0.56 -0.28 0.00 0.00 0.00 0.00 61.98 61.89 1dki s VAL 184 Cb -0.42 -2.42 -0.02 0.00 0.00 0.00 0.00 36.38 33.52 1dki s VAL 184 CO 0.47 0.53 0.93 -0.47 0.00 0.00 0.00 175.10 176.56 1dki s TYR 185 N 0.17 3.57 0.04 5.22 5.04 -1.12 -0.97 117.35 129.29 1dki s TYR 185 Ca -0.05 1.54 0.03 0.00 -2.44 0.00 0.00 57.07 56.15 1dki s TYR 185 Cb -0.15 -3.08 -0.02 0.00 0.35 0.00 0.00 41.96 39.06 1dki s TYR 185 CO 0.04 -0.10 -0.11 -0.47 -1.34 0.00 0.00 175.55 173.58 1dki s TYR 186 N 1.47 0.92 0.08 4.97 5.04 -0.05 -0.98 117.35 128.79 1dki s TYR 186 Ca 0.47 -0.39 -0.21 0.00 -2.44 0.00 0.00 57.07 54.50 1dki s TYR 186 Cb -0.19 -0.54 0.05 0.00 0.35 0.00 0.00 41.96 41.63 1dki s TYR 186 CO 0.21 -0.01 0.51 1.14 -1.34 0.00 0.00 175.55 176.06 1dki s GLN 187 N -1.26 1.07 0.36 4.97 -2.07 -0.71 -0.57 119.66 121.46 1dki s GLN 187 Ca -0.03 -0.35 0.08 0.00 -1.82 0.00 0.00 55.36 53.24 1dki s GLN 187 Cb -0.08 0.49 -0.04 0.00 -1.09 0.00 0.00 33.01 32.28 1dki s GLN 187 CO 0.01 -0.41 0.17 0.20 -1.32 0.00 0.00 175.29 173.94 1dki s GLY 188 N -2.22 2.01 -0.05 2.60 0.00 -0.86 -1.78 107.32 107.02 1dki s GLY 188 Ca -0.03 -1.87 0.05 0.00 0.00 0.00 0.00 44.72 42.87 1dki s GLY 188 CO -0.05 -1.77 -0.20 0.14 0.00 0.00 0.00 173.10 171.22 1dki s VAL 189 N -2.45 2.53 0.04 1.40 1.01 -0.73 -0.32 120.40 121.87 1dki s VAL 189 Ca 0.39 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.46 1dki s VAL 189 Cb -0.02 -1.95 -0.00 0.00 0.00 0.00 0.00 36.38 34.41 1dki s VAL 189 CO 0.23 0.58 0.01 0.61 0.00 0.00 0.00 175.10 176.53 1dki n GLY 190 N 2.61 4.04 0.36 4.51 0.00 -0.04 -4.82 105.19 111.86 1dki n GLY 190 Ca -0.17 -1.96 -0.01 0.00 0.00 0.00 0.00 46.02 43.88 1dki n GLY 190 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1dki h LYS 191 N 0.00 1.16 -0.00 1.61 1.79 -2.01 -2.82 116.57 116.29 1dki h LYS 191 Ca -0.03 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.36 1dki h LYS 191 Cb 0.11 -0.25 0.00 0.00 -1.58 0.00 0.00 32.23 30.50 1dki h LYS 191 CO 0.04 0.78 -0.25 1.33 -1.08 0.00 0.00 179.45 180.28 1dki n VAL 192 N -4.39 0.00 0.00 0.50 0.24 -1.26 -5.05 118.33 108.38 1dki n VAL 192 Ca 0.10 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.37 1dki n VAL 192 Cb 0.04 -0.02 0.00 0.00 -1.47 0.00 0.00 33.84 32.38 1dki n VAL 192 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1dki n GLY 193 N 1.44 0.78 3.75 7.63 0.00 -1.07 -4.16 105.19 113.55 1dki n GLY 193 Ca 0.09 -1.83 -0.40 0.00 0.00 0.00 0.00 46.02 43.88 1dki n GLY 193 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1dki s GLY 194 N 0.00 3.10 -0.42 -0.02 0.00 0.88 -0.86 107.32 110.00 1dki s GLY 194 Ca 0.00 0.65 -0.04 0.00 0.00 0.00 0.00 44.72 45.33 1dki s GLY 194 CO 0.00 1.26 0.24 0.30 0.00 0.00 0.00 173.10 174.90 1dki s HIS 195 N -1.06 3.55 0.30 1.90 3.76 0.56 -4.60 115.29 119.69 1dki s HIS 195 Ca 0.42 -2.28 0.03 0.00 -0.15 0.00 0.00 55.06 53.08 1dki s HIS 195 Cb -0.27 -3.29 -0.03 0.00 1.11 0.00 0.00 32.58 30.11 1dki s HIS 195 CO 0.33 -0.98 0.47 0.00 -0.85 0.00 0.00 174.74 173.71 1dki s ALA 196 N 1.20 3.80 0.26 -1.40 0.00 -1.26 -2.02 121.76 122.34 1dki s ALA 196 Ca 0.08 -1.06 -0.21 0.00 0.00 0.00 0.00 51.96 50.76 1dki s ALA 196 Cb -0.24 -1.94 0.03 0.00 0.00 0.00 0.00 23.12 20.98 1dki s ALA 196 CO -0.03 0.09 0.78 -0.59 0.00 0.00 0.00 175.76 176.00 1dki s PHE 197 N -2.17 -0.15 -0.13 0.00 -0.12 0.27 -4.76 117.98 110.92 1dki s PHE 197 Ca 0.37 -0.29 -0.01 0.00 -0.05 0.00 0.00 56.93 56.95 1dki s PHE 197 Cb -0.09 0.71 -0.02 0.00 -0.63 0.00 0.00 43.02 42.98 1dki s PHE 197 CO 0.33 -1.18 -0.09 0.08 -0.05 0.00 0.00 175.22 174.31 1dki s VAL 198 N -3.65 3.44 -0.28 -2.49 1.01 -0.79 -0.87 120.40 116.77 1dki s VAL 198 Ca 0.12 -0.53 -0.11 0.00 0.00 0.00 0.00 61.98 61.46 1dki s VAL 198 Cb -0.05 -2.46 -0.05 0.00 0.00 0.00 0.00 36.38 33.82 1dki s VAL 198 CO 0.06 0.52 0.18 -0.63 0.00 0.00 0.00 175.10 175.24 1dki s ILE 199 N 0.17 5.22 -0.03 2.22 1.01 -0.15 -1.22 121.20 128.43 1dki s ILE 199 Ca -0.05 0.11 0.05 0.00 0.00 0.00 0.00 60.65 60.76 1dki s ILE 199 Cb -0.14 -3.50 0.07 0.00 0.01 0.00 0.00 42.46 38.90 1dki s ILE 199 CO 0.04 0.24 0.97 -0.90 0.00 0.00 0.00 174.94 175.29 1dki n ASP 200 N 5.05 0.70 -3.66 3.58 5.75 -0.67 -1.16 116.55 126.14 1dki n ASP 200 Ca -0.14 -2.14 -0.00 0.00 -0.01 0.00 0.00 54.79 52.50 1dki n ASP 200 Cb 0.52 -0.22 -0.01 0.00 -1.03 0.00 0.00 41.12 40.38 1dki n ASP 200 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1dki s GLY 201 N -1.34 -0.31 -0.11 6.12 0.00 -1.24 0.06 107.32 110.49 1dki s GLY 201 Ca 0.08 0.42 -0.10 0.00 0.00 0.00 0.00 44.72 45.12 1dki s GLY 201 CO 0.01 0.48 0.29 0.00 0.00 0.00 0.00 173.10 173.88 1dki s ALA 202 N -2.66 -0.72 -2.13 3.20 0.00 -0.34 0.37 121.76 119.47 1dki s ALA 202 Ca 0.15 0.82 0.28 0.00 0.00 0.00 0.00 51.96 53.20 1dki s ALA 202 Cb 0.02 -0.47 1.04 0.00 0.00 0.00 0.00 23.12 23.71 1dki s ALA 202 CO -0.01 -0.14 1.73 -0.40 0.00 0.00 0.00 175.76 176.94 1dki n ASP 203 N 2.91 1.13 -0.19 0.00 5.75 -0.68 -1.52 116.55 123.95 1dki n ASP 203 Ca -0.13 -1.17 -0.02 0.00 -0.01 0.00 0.00 54.79 53.46 1dki n ASP 203 Cb 0.58 0.03 -0.01 0.00 -1.03 0.00 0.00 41.12 40.69 1dki n ASP 203 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1dki n GLY 204 N 1.23 0.56 1.65 6.12 0.00 -1.24 -4.84 105.19 108.66 1dki n GLY 204 Ca 0.17 -0.32 0.02 0.00 0.00 0.00 0.00 46.02 45.89 1dki n GLY 204 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dki n ARG 205 N -2.26 0.70 -0.87 1.61 1.74 -1.26 -3.58 116.66 112.73 1dki n ARG 205 Ca -0.02 -2.56 0.00 0.00 -0.77 0.00 0.00 57.85 54.50 1dki n ARG 205 Cb 0.17 -0.62 0.00 0.00 -1.02 0.00 0.00 32.46 30.98 1dki n ARG 205 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1dki n ASN 206 N 0.02 -1.33 -4.66 0.55 4.13 -1.26 -5.05 115.26 107.66 1dki n ASN 206 Ca 0.10 0.00 -0.32 0.00 1.68 0.00 0.00 54.58 56.03 1dki n ASN 206 Cb 1.01 -0.22 -0.09 0.00 -1.54 0.00 0.00 39.78 38.94 1dki n ASN 206 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 1dki s PHE 207 N -2.86 3.03 0.05 3.10 0.40 -1.26 -4.47 117.98 115.96 1dki s PHE 207 Ca 0.00 0.05 0.08 0.00 -0.60 0.00 0.00 56.93 56.45 1dki s PHE 207 Cb 0.00 -1.65 -0.03 0.00 0.51 0.00 0.00 43.02 41.85 1dki s PHE 207 CO 0.00 0.44 -0.20 0.71 0.70 0.00 0.00 175.22 176.88 1dki s TYR 208 N -1.08 2.51 0.00 0.36 1.51 -0.11 -1.69 117.35 118.85 1dki s TYR 208 Ca 0.19 -0.28 -0.28 0.00 -1.01 0.00 0.00 57.07 55.69 1dki s TYR 208 Cb -0.11 -1.44 -0.04 0.00 -0.11 0.00 0.00 41.96 40.27 1dki s TYR 208 CO 0.10 0.25 0.91 -1.58 -1.11 0.00 0.00 175.55 174.12 1dki s HIS 209 N -0.93 3.66 -0.00 2.71 2.46 0.16 -0.37 115.29 122.98 1dki s HIS 209 Ca 0.14 1.60 0.08 0.00 0.47 0.00 0.00 55.06 57.36 1dki s HIS 209 Cb -0.10 -3.03 -0.02 0.00 -0.13 0.00 0.00 32.58 29.29 1dki s HIS 209 CO 0.05 0.05 -0.24 0.08 -2.47 0.00 0.00 174.74 172.21 1dki s VAL 210 N 0.80 2.26 -0.29 0.89 1.01 0.76 -1.67 120.40 124.16 1dki s VAL 210 Ca 0.48 -1.15 0.01 0.00 0.00 0.00 0.00 61.98 61.32 1dki s VAL 210 Cb -0.21 -1.83 0.07 0.00 0.00 0.00 0.00 36.38 34.41 1dki s VAL 210 CO 0.26 0.50 -0.04 0.21 0.00 0.00 0.00 175.10 176.03 1dki s ASN 211 N -0.87 4.67 0.00 3.32 3.84 -0.35 -2.88 114.94 122.66 1dki s ASN 211 Ca 0.11 -1.51 0.25 0.00 0.21 0.00 0.00 52.86 51.93 1dki s ASN 211 Cb -0.10 -1.62 1.18 0.00 -0.55 0.00 0.00 41.25 40.15 1dki s ASN 211 CO 0.01 -0.26 1.83 0.79 -2.79 0.00 0.00 177.10 176.68 1dki n TRP 212 N 4.47 0.00 -1.93 0.43 7.02 -1.26 -1.89 117.44 124.27 1dki n TRP 212 Ca -0.10 0.00 -0.06 0.00 -1.02 0.00 0.00 57.50 56.31 1dki n TRP 212 Cb 0.42 -0.40 -0.01 0.00 -2.42 0.00 0.00 31.31 28.91 1dki n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1dki n GLY 213 N 0.99 0.26 1.15 6.99 0.00 -1.26 -4.86 105.19 108.46 1dki n GLY 213 Ca 0.09 -0.66 -0.06 0.00 0.00 0.00 0.00 46.02 45.40 1dki n GLY 213 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1dki n TRP 214 N -3.77 1.06 0.00 1.61 7.02 -1.23 -3.85 117.44 118.28 1dki n TRP 214 Ca -0.07 -1.77 0.00 0.00 -1.02 0.00 0.00 57.50 54.64 1dki n TRP 214 Cb 0.49 -0.34 0.00 0.00 -2.42 0.00 0.00 31.31 29.04 1dki n TRP 214 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1dki n GLY 215 N -0.99 1.90 0.00 6.99 0.00 -0.85 -3.90 105.19 108.35 1dki n GLY 215 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.32 1dki n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dki n GLY 216 N -2.00 1.18 3.74 -0.02 0.00 -1.26 -4.92 105.19 101.91 1dki n GLY 216 Ca 0.00 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1dki n GLY 216 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1dki n VAL 217 N 0.00 1.67 -0.12 1.61 3.14 -1.25 -2.09 118.33 121.29 1dki n VAL 217 Ca 0.00 -0.42 0.00 0.00 -2.96 0.00 0.00 64.34 60.96 1dki n VAL 217 Cb 0.00 -1.85 0.00 0.00 -1.06 0.00 0.00 33.84 30.93 1dki n VAL 217 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1dki n SER 218 N 1.09 0.00 -4.75 6.55 7.64 -0.16 -4.72 113.62 119.27 1dki n SER 218 Ca 0.05 0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.53 1dki n SER 218 Cb 0.37 -0.46 0.03 0.00 -1.01 0.00 0.00 64.21 63.15 1dki n SER 218 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1dki n ASP 219 N 0.00 2.98 0.00 6.43 9.92 -0.89 -4.90 116.55 130.09 1dki n ASP 219 Ca 0.00 1.04 0.00 0.00 -0.53 0.00 0.00 54.79 55.30 1dki n ASP 219 Cb 0.00 -1.59 0.00 0.00 -0.64 0.00 0.00 41.12 38.89 1dki n ASP 219 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1dki n GLY 220 N 0.68 -0.53 3.73 0.44 0.00 -1.14 -4.87 105.19 103.51 1dki n GLY 220 Ca 0.08 -0.87 -0.35 0.00 0.00 0.00 0.00 46.02 44.88 1dki n GLY 220 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1dki s PHE 221 N -3.04 3.36 0.02 1.61 0.40 -0.28 -0.17 117.98 119.88 1dki s PHE 221 Ca 0.00 0.27 0.01 0.00 -0.60 0.00 0.00 56.93 56.61 1dki s PHE 221 Cb 0.00 -2.00 -0.01 0.00 0.51 0.00 0.00 43.02 41.51 1dki s PHE 221 CO 0.00 0.40 -0.04 -0.06 0.70 0.00 0.00 175.22 176.22 1dki s PHE 222 N -0.24 0.34 0.47 0.36 0.40 0.50 -1.65 117.98 118.16 1dki s PHE 222 Ca 0.09 -0.30 -0.21 0.00 -0.60 0.00 0.00 56.93 55.92 1dki s PHE 222 Cb -0.12 -0.22 -0.09 0.00 0.51 0.00 0.00 43.02 43.10 1dki s PHE 222 CO 0.01 -0.08 1.03 1.03 0.70 0.00 0.00 175.22 177.92 1dki s ARG 223 N -0.84 3.88 0.28 0.44 0.52 -0.66 -0.94 118.95 121.63 1dki s ARG 223 Ca -0.07 1.35 0.25 0.00 -0.52 0.00 0.00 55.73 56.74 1dki s ARG 223 Cb -0.06 -2.15 1.00 0.00 0.52 0.00 0.00 34.95 34.26 1dki s ARG 223 CO -0.00 -0.36 1.74 -0.07 0.02 0.00 0.00 175.30 176.63 1dki h LEU 224 N 1.69 0.00 0.00 2.53 3.38 -1.92 -3.45 115.31 117.55 1dki h LEU 224 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1dki h LEU 224 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1dki h LEU 224 CO 0.60 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.60 1dki n ASP 225 N -2.32 0.00 0.00 -0.43 8.00 -1.26 -5.01 116.55 115.53 1dki n ASP 225 Ca 0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.52 1dki n ASP 225 Cb 0.26 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.36 1dki n ASP 225 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1dki n ALA 226 N 0.00 0.00 -2.30 2.24 0.00 -1.26 -5.66 120.51 113.53 1dki n ALA 226 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 1dki n ALA 226 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1dki n ALA 226 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1dki s LEU 227 N 0.00 4.26 -0.24 0.00 2.96 -1.26 -4.17 118.68 120.22 1dki s LEU 227 Ca 0.00 1.11 -0.05 0.00 -0.22 0.00 0.00 54.13 54.98 1dki s LEU 227 Cb 0.00 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 43.15 1dki s LEU 227 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.35 175.24 1dki s ASN 228 N -1.95 4.62 -1.02 3.68 3.84 -1.26 -4.90 114.94 117.94 1dki s ASN 228 Ca 0.43 -0.49 -0.23 0.00 0.21 0.00 0.00 52.86 52.78 1dki s ASN 228 Cb -0.14 -1.79 -0.03 0.00 -0.55 0.00 0.00 41.25 38.74 1dki s ASN 228 CO 0.20 -0.07 1.84 -2.16 -2.79 0.00 0.00 177.10 174.12 1dki s PRO 229 N 1.49 2.83 0.00 0.43 0.04 -1.26 -4.96 135.00 133.57 1dki s PRO 229 Ca 0.05 -0.77 0.00 0.00 0.04 0.00 0.00 61.00 60.32 1dki s PRO 229 Cb -0.15 -5.19 0.00 0.00 0.04 0.00 0.00 34.50 29.20 1dki s PRO 229 CO -0.01 -3.23 0.00 0.34 0.04 0.00 0.00 177.00 174.14 1dki n PHE 241 N 12.77 0.00 -0.68 0.56 7.35 -1.26 -5.23 117.46 130.97 1dki n PHE 241 Ca 0.41 0.00 0.07 0.00 -0.76 0.00 0.00 57.45 57.16 1dki n PHE 241 Cb 0.47 0.00 0.13 0.00 0.35 0.00 0.00 39.48 40.43 1dki n PHE 241 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 1dki n ASN 242 N 0.02 2.62 -2.62 -2.13 6.94 -1.26 -4.86 115.26 113.97 1dki n ASN 242 Ca 0.00 -2.67 -0.15 0.00 -0.02 0.00 0.00 54.58 51.73 1dki n ASN 242 Cb 0.00 -0.32 -0.00 0.00 -2.36 0.00 0.00 39.78 37.10 1dki n ASN 242 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1dki n GLY 243 N -0.80 -0.50 3.20 4.83 0.00 -1.26 -1.39 105.19 109.27 1dki n GLY 243 Ca 0.12 0.02 -0.18 0.00 0.00 0.00 0.00 46.02 45.99 1dki n GLY 243 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1dki n TYR 244 N -3.59 -1.69 -1.84 1.61 4.02 -1.26 -1.78 117.16 112.63 1dki n TYR 244 Ca -0.13 0.29 -0.37 0.00 -0.01 0.00 0.00 57.90 57.69 1dki n TYR 244 Cb 0.61 -1.99 0.05 0.00 -0.02 0.00 0.00 39.34 37.98 1dki n TYR 244 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 1dki s GLN 245 N -5.80 2.77 0.31 -0.72 -0.21 -0.49 -4.39 119.66 111.14 1dki s GLN 245 Ca 0.30 2.01 -0.07 0.00 0.02 0.00 0.00 55.36 57.63 1dki s GLN 245 Cb -0.17 -1.93 0.00 0.00 1.00 0.00 0.00 33.01 31.91 1dki s GLN 245 CO 0.37 -1.41 0.50 -1.54 -2.12 0.00 0.00 175.29 171.09 1dki s SER 246 N -1.39 0.46 0.21 5.90 1.04 -0.74 -1.40 113.70 117.78 1dki s SER 246 Ca 0.79 -1.26 -0.16 0.00 0.48 0.00 0.00 55.95 55.80 1dki s SER 246 Cb -0.36 0.65 0.02 0.00 0.10 0.00 0.00 66.02 66.43 1dki s SER 246 CO 0.39 -1.28 0.51 0.00 0.98 0.00 0.00 173.24 173.85 1dki s ALA 247 N -3.32 -0.74 -0.17 5.32 0.00 -0.16 -1.73 121.76 120.96 1dki s ALA 247 Ca 0.26 -0.43 0.01 0.00 0.00 0.00 0.00 51.96 51.80 1dki s ALA 247 Cb -0.01 0.90 0.03 0.00 0.00 0.00 0.00 23.12 24.04 1dki s ALA 247 CO 0.15 -0.83 -0.12 0.08 0.00 0.00 0.00 175.76 175.04 1dki s VAL 248 N -3.92 1.59 0.52 0.00 1.01 -0.15 -1.12 120.40 118.33 1dki s VAL 248 Ca 0.13 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.34 1dki s VAL 248 Cb -0.01 -1.57 0.00 0.00 0.00 0.00 0.00 36.38 34.80 1dki s VAL 248 CO 0.01 0.33 0.10 0.68 0.00 0.00 0.00 175.10 176.23 1dki s VAL 249 N 1.45 1.28 -0.91 2.92 -7.23 -0.45 -2.81 120.40 114.65 1dki s VAL 249 Ca 0.02 -1.87 0.00 0.00 -1.81 0.00 0.00 61.98 58.32 1dki s VAL 249 Cb -0.14 -2.15 0.00 0.00 0.56 0.00 0.00 36.38 34.65 1dki s VAL 249 CO -0.10 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.30 1dki n GLY 250 N -1.39 0.67 3.61 2.32 0.00 -1.26 -1.73 105.19 107.40 1dki n GLY 250 Ca -0.15 -0.57 -0.43 0.00 0.00 0.00 0.00 46.02 44.87 1dki n GLY 250 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dki s ILE 251 N -2.39 4.32 -0.09 -0.61 1.01 -1.26 -2.38 121.20 119.80 1dki s ILE 251 Ca 0.00 1.30 -0.30 0.00 0.00 0.00 0.00 60.65 61.65 1dki s ILE 251 Cb 0.00 -4.53 0.12 0.00 0.01 0.00 0.00 42.46 38.05 1dki s ILE 251 CO 0.00 -0.85 0.96 -1.59 0.00 0.00 0.00 174.94 173.46 1dki s LYS 252 N 4.16 0.68 0.00 2.79 -2.85 -1.26 -4.79 119.74 118.47 1dki s LYS 252 Ca 0.46 -0.08 0.00 0.00 -1.00 0.00 0.00 55.97 55.35 1dki s LYS 252 Cb -0.09 0.32 0.00 0.00 -2.06 0.00 0.00 37.83 36.00 1dki s LYS 252 CO 0.27 -0.26 0.46 -2.30 0.10 0.00 0.00 175.35 173.61