#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eob s SER 2 N 0.00 6.21 0.07 1.61 0.01 -1.26 -5.02 113.70 115.33 2eob s SER 2 Ca 0.00 -1.43 0.07 0.00 1.31 0.00 0.00 55.95 55.89 2eob s SER 2 Cb 0.00 -2.32 -0.03 0.00 0.21 0.00 0.00 66.02 63.88 2eob s SER 2 CO 0.00 -1.15 -0.18 -0.94 0.41 0.00 0.00 173.24 171.39 2eob s SER 3 N 3.60 2.10 0.00 2.44 1.04 -1.26 -5.11 113.70 116.52 2eob s SER 3 Ca 0.14 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 55.97 2eob s SER 3 Cb -0.22 -0.11 0.00 0.00 0.10 0.00 0.00 66.02 65.79 2eob s SER 3 CO 0.06 0.02 0.00 0.61 0.98 0.00 0.00 173.24 174.91 2eob n GLY 4 N 1.39 0.81 2.84 7.32 0.00 -1.26 -5.17 105.19 111.13 2eob n GLY 4 Ca -0.19 0.54 -0.15 0.00 0.00 0.00 0.00 46.02 46.22 2eob n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eob s SER 5 N 0.00 0.23 0.04 1.61 0.01 -1.26 -5.13 113.70 109.20 2eob s SER 5 Ca 0.00 -0.01 -0.30 0.00 1.31 0.00 0.00 55.95 56.95 2eob s SER 5 Cb 0.00 -0.10 -0.04 0.00 0.21 0.00 0.00 66.02 66.08 2eob s SER 5 CO 0.00 -0.06 1.06 -0.44 0.41 0.00 0.00 173.24 174.21 2eob s SER 6 N 0.61 7.28 0.00 2.44 0.01 -1.26 -4.51 113.70 118.27 2eob s SER 6 Ca -0.06 1.82 0.00 0.00 1.31 0.00 0.00 55.95 59.02 2eob s SER 6 Cb -0.08 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.57 2eob s SER 6 CO -0.01 -0.30 0.00 0.61 0.41 0.00 0.00 173.24 173.94 2eob n GLY 7 N 2.87 1.37 3.81 3.44 0.00 -1.26 -5.08 105.19 110.34 2eob n GLY 7 Ca 0.06 -0.53 -0.35 0.00 0.00 0.00 0.00 46.02 45.20 2eob n GLY 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2eob s ASP 8 N -4.00 7.06 0.81 1.61 1.01 -1.26 -5.06 116.67 116.84 2eob s ASP 8 Ca 0.00 1.51 -0.11 0.00 0.71 0.00 0.00 52.55 54.66 2eob s ASP 8 Cb 0.00 -2.46 0.08 0.00 1.01 0.00 0.00 42.92 41.55 2eob s ASP 8 CO 0.00 -0.06 1.09 -2.16 0.21 0.00 0.00 175.17 174.25 2eob s PRO 9 N -2.27 1.97 0.40 8.23 0.04 -1.26 -4.88 135.00 137.24 2eob s PRO 9 Ca 0.48 1.07 -0.22 0.00 0.04 0.00 0.00 61.00 62.36 2eob s PRO 9 Cb -0.15 -1.87 -0.13 0.00 0.04 0.00 0.00 34.50 32.38 2eob s PRO 9 CO 0.20 -1.81 0.44 1.33 0.04 0.00 0.00 177.00 177.20 2eob n VAL 10 N -3.63 1.52 -2.18 -0.36 0.24 -1.26 -4.85 118.33 107.81 2eob n VAL 10 Ca 0.08 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.34 61.46 2eob n VAL 10 Cb 0.54 -0.39 -0.03 0.00 -1.47 0.00 0.00 33.84 32.49 2eob n VAL 10 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2eob s PRO 11 N -1.42 4.29 -0.05 7.34 0.04 -1.26 -5.02 135.00 138.92 2eob s PRO 11 Ca 0.62 2.03 -0.02 0.00 0.04 0.00 0.00 61.00 63.67 2eob s PRO 11 Cb -0.63 -3.47 0.04 0.00 0.04 0.00 0.00 34.50 30.47 2eob s PRO 11 CO 0.59 -0.54 0.09 1.21 0.04 0.00 0.00 177.00 178.39 2eob s ASN 12 N 1.68 0.53 0.00 6.66 2.47 -1.26 -5.01 114.94 120.02 2eob s ASN 12 Ca 0.65 0.17 0.15 0.00 0.42 0.00 0.00 52.86 54.25 2eob s ASN 12 Cb -0.34 0.04 0.70 0.00 -1.45 0.00 0.00 41.25 40.20 2eob s ASN 12 CO 0.28 -0.20 1.43 -0.81 -3.72 0.00 0.00 177.10 174.08 2eob n PRO 13 N 4.81 0.13 -3.35 0.43 -0.04 -1.26 -3.76 135.00 131.96 2eob n PRO 13 Ca -0.14 0.18 -0.30 0.00 -0.04 0.00 0.00 63.50 63.20 2eob n PRO 13 Cb 0.50 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.40 2eob n PRO 13 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2eob n ASN 14 N -1.36 4.26 0.24 3.54 4.13 -1.26 -4.86 115.26 119.95 2eob n ASN 14 Ca 0.06 -3.44 0.11 0.00 1.68 0.00 0.00 54.58 52.99 2eob n ASN 14 Cb 0.14 -0.78 0.54 0.00 -1.54 0.00 0.00 39.78 38.14 2eob n ASN 14 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2eob h PRO 15 N 4.41 0.00 0.00 3.52 0.13 -2.01 -2.84 132.00 135.21 2eob h PRO 15 Ca 0.20 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.33 2eob h PRO 15 Cb 0.65 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.78 2eob h PRO 15 CO 0.93 0.19 -0.01 1.12 -0.23 0.00 0.00 178.00 180.00 2eob h HIS 16 N 0.00 0.00 0.00 1.56 2.07 -1.94 -0.12 115.15 116.72 2eob h HIS 16 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2eob h HIS 16 Cb 0.64 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.62 2eob h HIS 16 CO 0.00 0.01 0.00 0.93 -3.07 0.00 0.00 177.93 175.80 2eob h GLU 17 N 0.00 0.00 0.00 5.12 5.08 -1.92 -3.06 114.58 119.80 2eob h GLU 17 Ca -0.00 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.03 2eob h GLU 17 Cb 0.05 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.23 2eob h GLU 17 CO 0.00 0.00 -2.24 0.43 -1.00 0.00 0.00 179.01 176.20 2eob n SER 18 N -2.85 1.32 -4.02 1.42 7.64 -0.10 -5.01 113.62 112.01 2eob n SER 18 Ca 0.00 -0.05 -0.41 0.00 1.01 0.00 0.00 58.87 59.43 2eob n SER 18 Cb 0.25 0.40 -0.01 0.00 -1.01 0.00 0.00 64.21 63.84 2eob n SER 18 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2eob n LYS 19 N -2.86 0.00 0.01 1.43 4.76 -0.92 -4.86 118.16 115.72 2eob n LYS 19 Ca -0.33 0.00 -0.07 0.00 -2.87 0.00 0.00 58.31 55.04 2eob n LYS 19 Cb 1.01 -0.93 0.12 0.00 -1.84 0.00 0.00 35.03 33.39 2eob n LYS 19 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 2eob h PRO 20 N 0.52 0.49 -0.48 1.97 0.13 -1.94 -2.76 132.00 129.93 2eob h PRO 20 Ca -0.31 -0.26 0.00 0.00 -0.87 0.00 0.00 66.00 64.56 2eob h PRO 20 Cb 1.34 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.48 2eob h PRO 20 CO 0.47 0.83 0.00 -2.67 -0.23 0.00 0.00 178.00 176.40 2eob n TRP 21 N -4.01 0.10 -4.12 1.56 4.27 -1.26 -4.54 117.44 109.45 2eob n TRP 21 Ca -0.02 -0.04 -0.34 0.00 -3.89 0.00 0.00 57.50 53.21 2eob n TRP 21 Cb 0.52 -0.06 -0.11 0.00 -1.36 0.00 0.00 31.31 30.31 2eob n TRP 21 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 2eob s TYR 22 N -1.55 3.16 0.05 -2.67 6.14 -1.04 -2.45 117.35 118.99 2eob s TYR 22 Ca 0.04 -0.09 0.09 0.00 0.64 0.00 0.00 57.07 57.75 2eob s TYR 22 Cb 0.02 -2.05 -0.03 0.00 0.42 0.00 0.00 41.96 40.32 2eob s TYR 22 CO 0.02 0.05 -0.25 0.71 0.64 0.00 0.00 175.55 176.72 2eob s TYR 23 N 0.46 2.16 0.00 4.97 2.02 -0.45 -4.94 117.35 121.58 2eob s TYR 23 Ca 0.01 -0.40 0.00 0.00 -0.37 0.00 0.00 57.07 56.31 2eob s TYR 23 Cb -0.13 -1.28 0.00 0.00 -0.40 0.00 0.00 41.96 40.15 2eob s TYR 23 CO 0.01 0.13 0.00 -3.47 -1.57 0.00 0.00 175.55 170.66 2eob n ASP 24 N 1.72 0.40 -0.00 2.29 2.03 -1.26 -2.04 116.55 119.69 2eob n ASP 24 Ca -0.17 -0.40 0.00 0.00 0.52 0.00 0.00 54.79 54.74 2eob n ASP 24 Cb 0.52 0.89 -0.01 0.00 -0.72 0.00 0.00 41.12 41.80 2eob n ASP 24 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 2eob n ARG 25 N -0.93 4.05 -1.96 -0.67 0.00 -1.26 -4.76 116.66 111.14 2eob n ARG 25 Ca 0.00 -0.00 -0.38 0.00 -0.00 0.00 0.00 57.85 57.47 2eob n ARG 25 Cb 0.00 -0.73 0.02 0.00 -0.00 0.00 0.00 32.46 31.75 2eob n ARG 25 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 2eob s LEU 26 N -2.44 3.88 0.06 2.89 2.96 -1.26 -5.04 118.68 119.72 2eob s LEU 26 Ca 0.00 2.57 0.02 0.00 -0.22 0.00 0.00 54.13 56.50 2eob s LEU 26 Cb 0.01 -4.30 -0.03 0.00 0.50 0.00 0.00 46.19 42.36 2eob s LEU 26 CO 0.03 -1.37 -0.08 -0.44 -1.32 0.00 0.00 176.35 173.18 2eob s SER 27 N -1.16 0.94 0.42 3.68 0.01 -1.26 -4.55 113.70 111.78 2eob s SER 27 Ca 0.70 -0.66 0.32 0.00 1.31 0.00 0.00 55.95 57.62 2eob s SER 27 Cb -0.35 0.05 1.41 0.00 0.21 0.00 0.00 66.02 67.33 2eob s SER 27 CO 0.42 -0.26 1.45 -1.14 0.41 0.00 0.00 173.24 174.12 2eob n ARG 28 N 1.11 -0.03 -0.05 12.44 0.63 -1.26 0.12 116.66 129.62 2eob n ARG 28 Ca -0.20 1.15 -0.09 0.00 -0.92 0.00 0.00 57.85 57.79 2eob n ARG 28 Cb 0.56 -2.30 -0.02 0.00 0.45 0.00 0.00 32.46 31.15 2eob n ARG 28 CO 0.00 0.00 0.00 0.78 -2.51 0.00 0.00 177.63 175.90 2eob h GLY 29 N 0.00 -0.23 0.66 5.14 0.00 -2.01 -2.53 103.07 104.10 2eob h GLY 29 Ca 0.82 0.33 -0.35 0.00 0.00 0.00 0.00 47.33 48.14 2eob h GLY 29 CO -0.39 -0.21 -1.86 0.83 0.00 0.00 0.00 176.54 174.92 2eob h GLU 30 N -0.28 0.29 -0.98 4.80 5.08 -0.73 -3.36 114.58 119.39 2eob h GLU 30 Ca 0.13 -0.49 0.09 0.00 -1.00 0.00 0.00 59.36 58.09 2eob h GLU 30 Cb 0.49 0.18 -0.12 0.00 0.50 0.00 0.00 28.75 29.80 2eob h GLU 30 CO -0.40 1.23 -0.57 0.00 -1.00 0.00 0.00 179.01 178.27 2eob n ALA 31 N -2.98 -0.62 0.04 3.43 0.00 0.53 -0.38 120.51 120.53 2eob n ALA 31 Ca -0.30 0.83 -0.12 0.00 0.00 0.00 0.00 53.44 53.85 2eob n ALA 31 Cb 1.03 -0.14 -0.06 0.00 0.00 0.00 0.00 19.45 20.28 2eob n ALA 31 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2eob h GLU 32 N 0.00 -0.49 -0.38 0.00 5.08 -1.65 -2.43 114.58 114.72 2eob h GLU 32 Ca 0.16 0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.63 2eob h GLU 32 Cb 0.40 0.11 -0.09 0.00 0.50 0.00 0.00 28.75 29.67 2eob h GLU 32 CO -0.92 -0.32 -0.32 0.22 -1.00 0.00 0.00 179.01 176.67 2eob h ASP 33 N -0.50 -1.04 -0.80 1.42 1.82 -1.19 -2.28 116.42 113.85 2eob h ASP 33 Ca 0.06 0.19 0.07 0.00 -0.39 0.00 0.00 57.03 56.96 2eob h ASP 33 Cb 0.61 0.49 -0.10 0.00 0.68 0.00 0.00 39.33 41.01 2eob h ASP 33 CO -0.32 -0.32 -0.47 0.23 -1.61 0.00 0.00 179.24 176.75 2eob n MET 34 N -5.41 -0.35 -0.34 0.28 2.81 0.49 0.70 117.12 115.30 2eob n MET 34 Ca 0.01 1.40 0.14 0.00 -1.81 0.00 0.00 57.70 57.44 2eob n MET 34 Cb 0.33 -2.06 0.34 0.00 -0.71 0.00 0.00 33.22 31.12 2eob n MET 34 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 2eob h LEU 35 N 0.00 0.69 -1.70 4.03 -0.00 -1.22 0.71 115.31 117.81 2eob h LEU 35 Ca 0.13 0.12 -0.03 0.00 -0.00 0.00 0.00 57.88 58.09 2eob h LEU 35 Cb 0.33 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.99 2eob h LEU 35 CO -0.76 0.18 -0.15 0.24 -0.00 0.00 0.00 178.44 177.96 2eob h MET 36 N 0.66 0.00 0.00 1.13 2.86 0.71 -1.81 114.93 118.48 2eob h MET 36 Ca 0.60 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.24 2eob h MET 36 Cb 1.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.68 2eob h MET 36 CO -0.43 0.15 -0.16 0.00 1.06 0.00 0.00 176.91 177.53 2eob h ARG 37 N 0.00 0.00 -5.60 1.72 3.08 0.27 -3.44 114.38 110.42 2eob h ARG 37 Ca -0.00 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.43 2eob h ARG 37 Cb 0.45 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.38 2eob h ARG 37 CO 0.02 0.00 0.23 0.42 -1.07 0.00 0.00 179.97 179.57 2eob s ILE 38 N -3.15 4.86 -1.50 2.04 -1.09 -0.68 -4.92 121.20 116.77 2eob s ILE 38 Ca 0.09 0.83 0.15 0.00 -2.23 0.00 0.00 60.65 59.49 2eob s ILE 38 Cb 0.11 -4.09 0.28 0.00 -1.58 0.00 0.00 42.46 37.18 2eob s ILE 38 CO 0.64 -0.27 1.40 -0.81 -1.23 0.00 0.00 174.94 174.67 2eob n PRO 39 N 6.09 0.24 -2.95 2.79 -0.04 -1.26 -4.71 135.00 135.16 2eob n PRO 39 Ca 0.00 0.13 -0.40 0.00 -0.04 0.00 0.00 63.50 63.19 2eob n PRO 39 Cb 0.48 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.40 2eob n PRO 39 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2eob s ARG 40 N -2.50 4.48 -1.37 0.54 1.81 -1.26 -4.97 118.95 115.67 2eob s ARG 40 Ca 0.15 1.05 -0.09 0.00 -1.72 0.00 0.00 55.73 55.12 2eob s ARG 40 Cb 0.10 -3.44 0.09 0.00 -0.45 0.00 0.00 34.95 31.25 2eob s ARG 40 CO 0.22 0.05 2.28 -0.25 -0.68 0.00 0.00 175.30 176.92 2eob n ASP 41 N 3.71 6.60 0.00 0.23 8.00 -1.26 -3.79 116.55 130.04 2eob n ASP 41 Ca 0.01 -3.00 0.00 0.00 0.71 0.00 0.00 54.79 52.50 2eob n ASP 41 Cb 0.51 -1.47 0.00 0.00 -0.02 0.00 0.00 41.12 40.14 2eob n ASP 41 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2eob n GLY 42 N 2.69 0.00 3.87 0.44 0.00 -1.24 -4.78 105.19 106.16 2eob n GLY 42 Ca 0.56 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.27 2eob n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2eob s ALA 43 N 0.00 3.17 0.02 4.61 0.00 -1.25 -2.35 121.76 125.96 2eob s ALA 43 Ca 0.00 -0.09 -0.19 0.00 0.00 0.00 0.00 51.96 51.68 2eob s ALA 43 Cb 0.00 -2.97 0.04 0.00 0.00 0.00 0.00 23.12 20.19 2eob s ALA 43 CO 0.00 -0.42 0.42 -0.59 0.00 0.00 0.00 175.76 175.16 2eob s PHE 44 N -2.85 -0.28 -0.16 0.00 -0.12 -1.11 -2.16 117.98 111.30 2eob s PHE 44 Ca 0.54 0.32 -0.14 0.00 -0.05 0.00 0.00 56.93 57.60 2eob s PHE 44 Cb -0.10 0.21 0.04 0.00 -0.63 0.00 0.00 43.02 42.54 2eob s PHE 44 CO 0.43 -0.54 0.43 -0.48 -0.05 0.00 0.00 175.22 175.01 2eob s LEU 45 N -1.80 0.33 -0.31 -1.99 0.05 -0.32 -0.82 118.68 113.82 2eob s LEU 45 Ca -0.07 0.87 -0.01 0.00 0.05 0.00 0.00 54.13 54.96 2eob s LEU 45 Cb -0.02 1.46 0.06 0.00 -2.05 0.00 0.00 46.19 45.65 2eob s LEU 45 CO 0.00 -0.15 0.01 -0.63 -0.55 0.00 0.00 176.35 175.03 2eob s ILE 46 N 0.32 2.85 0.37 1.48 1.01 -1.03 -1.41 121.20 124.80 2eob s ILE 46 Ca -0.01 -1.59 0.08 0.00 0.00 0.00 0.00 60.65 59.14 2eob s ILE 46 Cb -0.03 -2.72 -0.06 0.00 0.01 0.00 0.00 42.46 39.66 2eob s ILE 46 CO -0.00 -0.21 0.05 0.00 0.00 0.00 0.00 174.94 174.78 2eob s ARG 47 N 1.19 2.09 -0.05 2.79 1.70 -1.20 -1.33 118.95 124.13 2eob s ARG 47 Ca -0.03 -1.84 0.01 0.00 -0.47 0.00 0.00 55.73 53.40 2eob s ARG 47 Cb -0.20 -1.89 -0.03 0.00 -0.57 0.00 0.00 34.95 32.26 2eob s ARG 47 CO -0.03 0.04 -0.06 0.21 -1.08 0.00 0.00 175.30 174.39 2eob s LYS 48 N -3.76 2.74 -0.21 3.89 2.36 -0.86 -3.48 119.74 120.41 2eob s LYS 48 Ca 0.36 -0.57 -0.10 0.00 -2.55 0.00 0.00 55.97 53.11 2eob s LYS 48 Cb 0.03 -2.60 -0.05 0.00 -1.05 0.00 0.00 37.83 34.16 2eob s LYS 48 CO 0.20 0.65 0.13 1.03 1.55 0.00 0.00 175.35 178.92 2eob s ARG 49 N -0.99 4.13 0.33 4.03 0.52 -1.26 -4.75 118.95 120.96 2eob s ARG 49 Ca 0.14 -0.25 -0.28 0.00 -0.52 0.00 0.00 55.73 54.82 2eob s ARG 49 Cb -0.11 -3.44 -0.09 0.00 0.52 0.00 0.00 34.95 31.83 2eob s ARG 49 CO 0.03 0.22 1.14 -1.83 0.02 0.00 0.00 175.30 174.88 2eob s GLU 50 N 0.59 4.42 0.00 3.54 -1.05 -1.26 -3.87 118.70 121.07 2eob s GLU 50 Ca 0.07 1.84 0.00 0.00 -0.15 0.00 0.00 54.97 56.74 2eob s GLU 50 Cb -0.12 -2.99 0.00 0.00 -0.44 0.00 0.00 34.13 30.58 2eob s GLU 50 CO 0.00 -0.00 0.00 0.41 0.95 0.00 0.00 175.26 176.62 2eob n GLY 51 N 0.91 2.55 3.93 -3.83 0.00 -1.26 -5.01 105.19 102.48 2eob n GLY 51 Ca 0.01 -0.65 -0.29 0.00 0.00 0.00 0.00 46.02 45.09 2eob n GLY 51 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2eob s THR 52 N 0.00 2.03 -0.22 2.61 -4.23 -1.25 -5.01 115.64 109.57 2eob s THR 52 Ca 0.00 -0.08 0.12 0.00 -1.18 0.00 0.00 61.69 60.55 2eob s THR 52 Cb 0.00 -2.95 0.43 0.00 1.34 0.00 0.00 72.50 71.32 2eob s THR 52 CO 0.00 0.00 1.30 0.47 -0.54 0.00 0.00 174.62 175.85 2eob n ASP 53 N -3.54 2.26 -4.19 3.99 9.92 -1.26 -4.89 116.55 118.84 2eob n ASP 53 Ca 0.14 -3.63 -0.22 0.00 -0.53 0.00 0.00 54.79 50.54 2eob n ASP 53 Cb 0.60 -0.54 -0.14 0.00 -0.64 0.00 0.00 41.12 40.40 2eob n ASP 53 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 2eob s SER 54 N -2.84 2.02 0.48 -2.24 0.15 -1.26 -4.95 113.70 105.07 2eob s SER 54 Ca 0.39 -0.49 0.08 0.00 0.70 0.00 0.00 55.95 56.63 2eob s SER 54 Cb 0.36 -0.15 0.04 0.00 -1.71 0.00 0.00 66.02 64.56 2eob s SER 54 CO -0.02 0.09 0.66 -0.31 1.20 0.00 0.00 173.24 174.86 2eob s TYR 55 N -0.84 2.32 -0.14 3.44 1.51 -1.15 -4.25 117.35 118.25 2eob s TYR 55 Ca 0.04 -0.49 -0.16 0.00 -1.01 0.00 0.00 57.07 55.46 2eob s TYR 55 Cb -0.08 -2.35 0.04 0.00 -0.11 0.00 0.00 41.96 39.46 2eob s TYR 55 CO 0.02 -0.71 0.43 0.00 -1.11 0.00 0.00 175.55 174.17 2eob s ALA 56 N -2.49 -1.06 -0.02 3.71 0.00 -1.23 -0.31 121.76 120.37 2eob s ALA 56 Ca 0.58 1.12 0.01 0.00 0.00 0.00 0.00 51.96 53.66 2eob s ALA 56 Cb -0.08 -0.59 -0.03 0.00 0.00 0.00 0.00 23.12 22.41 2eob s ALA 56 CO 0.35 -0.22 -0.02 -1.50 0.00 0.00 0.00 175.76 174.38 2eob s ILE 57 N -0.01 4.04 -0.11 0.00 2.07 -1.09 -3.26 121.20 122.84 2eob s ILE 57 Ca -0.02 -0.57 0.02 0.00 -1.41 0.00 0.00 60.65 58.67 2eob s ILE 57 Cb -0.03 -2.76 0.01 0.00 0.13 0.00 0.00 42.46 39.81 2eob s ILE 57 CO 0.01 0.44 -0.15 -0.89 -1.91 0.00 0.00 174.94 172.44 2eob s THR 58 N -1.01 1.51 0.37 4.00 2.01 -0.50 -1.93 115.64 120.09 2eob s THR 58 Ca 0.17 -0.65 0.04 0.00 0.31 0.00 0.00 61.69 61.57 2eob s THR 58 Cb -0.11 -1.38 -0.06 0.00 0.01 0.00 0.00 72.50 70.95 2eob s THR 58 CO 0.08 0.44 0.05 0.72 -0.69 0.00 0.00 174.62 175.22 2eob s PHE 59 N 1.00 2.06 -0.31 4.92 -0.71 -1.14 -1.17 117.98 122.62 2eob s PHE 59 Ca -0.06 -0.93 -0.04 0.00 -1.04 0.00 0.00 56.93 54.85 2eob s PHE 59 Cb -0.15 -1.40 0.04 0.00 -1.21 0.00 0.00 43.02 40.30 2eob s PHE 59 CO -0.02 0.09 0.04 0.50 -1.34 0.00 0.00 175.22 174.49 2eob s ARG 60 N -3.83 2.64 -0.58 1.99 3.52 -0.92 -3.03 118.95 118.74 2eob s ARG 60 Ca 0.32 -1.14 -0.18 0.00 -0.13 0.00 0.00 55.73 54.60 2eob s ARG 60 Cb 0.08 -3.28 0.11 0.00 -1.56 0.00 0.00 34.95 30.30 2eob s ARG 60 CO 0.15 -0.58 0.65 0.00 -0.81 0.00 0.00 175.30 174.70 2eob s ALA 61 N 1.35 3.48 -1.40 6.12 0.00 0.21 -3.68 121.76 127.84 2eob s ALA 61 Ca -0.02 -2.32 -0.13 0.00 0.00 0.00 0.00 51.96 49.50 2eob s ALA 61 Cb -0.19 -3.46 0.13 0.00 0.00 0.00 0.00 23.12 19.60 2eob s ALA 61 CO 0.00 -2.26 0.31 0.54 0.00 0.00 0.00 175.76 174.36 2eob n ARG 62 N 6.03 -0.83 0.00 0.00 5.12 -1.26 -0.36 116.66 125.36 2eob n ARG 62 Ca -0.11 0.10 0.00 0.00 -1.93 0.00 0.00 57.85 55.91 2eob n ARG 62 Cb 0.42 -3.43 0.00 0.00 -1.16 0.00 0.00 32.46 28.29 2eob n ARG 62 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2eob n GLY 63 N -1.39 2.90 3.50 -0.13 0.00 -1.26 -5.08 105.19 103.73 2eob n GLY 63 Ca -0.03 -0.83 -0.28 0.00 0.00 0.00 0.00 46.02 44.88 2eob n GLY 63 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eob s LYS 64 N 0.00 -0.97 -0.19 1.61 -0.14 0.52 -4.86 119.74 115.71 2eob s LYS 64 Ca 0.00 0.65 -0.05 0.00 -1.36 0.00 0.00 55.97 55.21 2eob s LYS 64 Cb 0.00 -1.56 0.07 0.00 -1.68 0.00 0.00 37.83 34.65 2eob s LYS 64 CO 0.00 -3.70 0.09 0.08 -0.76 0.00 0.00 175.35 171.06 2eob s VAL 65 N -2.56 -0.06 0.52 3.17 1.01 -1.26 0.68 120.40 121.90 2eob s VAL 65 Ca 0.68 -0.26 0.09 0.00 0.00 0.00 0.00 61.98 62.49 2eob s VAL 65 Cb -0.22 -0.65 0.06 0.00 0.00 0.00 0.00 36.38 35.57 2eob s VAL 65 CO 0.63 -0.34 0.72 -0.54 0.00 0.00 0.00 175.10 175.56 2eob s LYS 66 N 2.12 2.49 0.00 2.72 1.02 -1.17 -4.94 119.74 121.98 2eob s LYS 66 Ca 0.03 -1.47 -0.01 0.00 0.02 0.00 0.00 55.97 54.54 2eob s LYS 66 Cb -0.16 -2.68 -0.00 0.00 -0.52 0.00 0.00 37.83 34.47 2eob s LYS 66 CO -0.13 -0.66 0.01 -1.01 -0.92 0.00 0.00 175.35 172.65 2eob s HIS 67 N -2.56 0.07 -0.24 3.18 3.76 -1.26 -2.91 115.29 115.32 2eob s HIS 67 Ca 0.59 -0.13 0.01 0.00 -0.15 0.00 0.00 55.06 55.38 2eob s HIS 67 Cb -0.07 -0.05 0.06 0.00 1.11 0.00 0.00 32.58 33.63 2eob s HIS 67 CO 0.37 -0.08 -0.04 0.00 -0.85 0.00 0.00 174.74 174.14 2eob n ARG 69 N 4.66 1.92 -5.14 0.00 3.00 -1.26 -2.67 116.66 117.17 2eob n ARG 69 Ca -0.11 0.69 -0.32 0.00 -0.00 0.00 0.00 57.85 58.11 2eob n ARG 69 Cb 0.44 -2.41 -0.16 0.00 0.00 0.00 0.00 32.46 30.33 2eob n ARG 69 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2eob s ILE 70 N -1.21 2.28 0.47 5.15 1.01 0.58 -4.76 121.20 124.72 2eob s ILE 70 Ca 0.62 -0.95 0.03 0.00 0.00 0.00 0.00 60.65 60.35 2eob s ILE 70 Cb -0.50 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.06 2eob s ILE 70 CO 0.57 0.56 0.01 0.21 0.00 0.00 0.00 174.94 176.29 2eob s ASN 71 N 0.17 4.02 -0.05 3.58 2.47 0.04 -2.94 114.94 122.24 2eob s ASN 71 Ca -0.12 -1.54 -0.00 0.00 0.42 0.00 0.00 52.86 51.61 2eob s ASN 71 Cb -0.16 0.16 0.03 0.00 -1.45 0.00 0.00 41.25 39.82 2eob s ASN 71 CO 0.07 -0.69 -0.00 -0.13 -3.72 0.00 0.00 177.10 172.62 2eob s ARG 72 N -3.81 0.52 -0.18 0.43 0.52 -1.26 0.35 118.95 115.52 2eob s ARG 72 Ca 0.17 0.08 0.06 0.00 -0.52 0.00 0.00 55.73 55.52 2eob s ARG 72 Cb 0.05 -0.79 0.44 0.00 0.52 0.00 0.00 34.95 35.17 2eob s ARG 72 CO 0.09 -0.22 1.33 -3.47 0.02 0.00 0.00 175.30 173.05 2eob n ASP 73 N 4.68 3.61 0.00 0.23 -0.08 -0.46 -4.94 116.55 119.59 2eob n ASP 73 Ca -0.15 -2.68 0.00 0.00 -1.51 0.00 0.00 54.79 50.45 2eob n ASP 73 Cb 0.50 -0.64 0.00 0.00 2.34 0.00 0.00 41.12 43.32 2eob n ASP 73 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2eob n GLY 74 N 0.06 2.18 0.18 0.27 0.00 -1.26 -4.46 105.19 102.15 2eob n GLY 74 Ca 0.23 -0.12 -0.06 0.00 0.00 0.00 0.00 46.02 46.06 2eob n GLY 74 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2eob h ARG 75 N 0.00 0.43 0.00 1.61 3.08 -2.00 -3.46 114.38 114.04 2eob h ARG 75 Ca 0.00 -0.03 -0.25 0.00 0.07 0.00 0.00 59.98 59.77 2eob h ARG 75 Cb 0.00 -0.10 -0.06 0.00 0.08 0.00 0.00 29.97 29.89 2eob h ARG 75 CO 0.00 0.28 -0.18 0.72 -1.07 0.00 0.00 179.97 179.73 2eob n HIS 76 N -4.90 -1.03 -2.54 3.04 8.25 -1.26 -4.86 115.22 111.93 2eob n HIS 76 Ca 0.02 -1.87 -0.25 0.00 -0.26 0.00 0.00 57.72 55.36 2eob n HIS 76 Cb 0.09 0.36 0.03 0.00 1.12 0.00 0.00 29.99 31.59 2eob n HIS 76 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2eob s PHE 77 N -3.31 3.20 -0.02 4.41 0.40 0.43 -1.36 117.98 121.73 2eob s PHE 77 Ca 0.24 0.49 -0.01 0.00 -0.60 0.00 0.00 56.93 57.05 2eob s PHE 77 Cb -0.00 -2.66 0.02 0.00 0.51 0.00 0.00 43.02 40.88 2eob s PHE 77 CO 0.17 -0.75 0.05 0.08 0.70 0.00 0.00 175.22 175.47 2eob s VAL 78 N -2.89 -0.03 -0.01 -0.44 1.01 0.16 -2.96 120.40 115.24 2eob s VAL 78 Ca 0.53 0.10 -0.02 0.00 0.00 0.00 0.00 61.98 62.59 2eob s VAL 78 Cb -0.10 -0.09 -0.01 0.00 0.00 0.00 0.00 36.38 36.18 2eob s VAL 78 CO 0.43 0.04 -0.03 -0.11 0.00 0.00 0.00 175.10 175.43 2eob n LEU 79 N 3.59 0.18 0.00 3.92 7.94 -1.25 -0.78 117.00 130.60 2eob n LEU 79 Ca -0.19 0.03 0.00 0.00 -1.11 0.00 0.00 56.01 54.74 2eob n LEU 79 Cb 0.55 -0.49 0.00 0.00 0.53 0.00 0.00 43.42 44.02 2eob n LEU 79 CO 0.23 -0.48 0.00 0.61 -1.11 0.00 0.00 177.39 176.64 2eob n GLY 80 N 1.64 0.75 3.03 -3.96 0.00 -1.26 -4.69 105.19 100.70 2eob n GLY 80 Ca -0.01 -0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 2eob n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eob s THR 81 N 0.27 1.10 -1.39 2.61 2.01 -1.26 -4.79 115.64 114.18 2eob s THR 81 Ca 0.00 -0.48 -0.05 0.00 0.31 0.00 0.00 61.69 61.47 2eob s THR 81 Cb 0.00 -0.99 0.03 0.00 0.01 0.00 0.00 72.50 71.55 2eob s THR 81 CO 0.00 0.34 0.82 -1.20 -0.69 0.00 0.00 174.62 173.89 2eob n SER 82 N 3.64 -2.64 -3.90 3.53 7.64 -1.26 -4.96 113.62 115.67 2eob n SER 82 Ca -0.22 -0.80 -0.30 0.00 1.01 0.00 0.00 58.87 58.56 2eob n SER 82 Cb 0.52 -4.03 -0.15 0.00 -1.01 0.00 0.00 64.21 59.55 2eob n SER 82 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2eob s ALA 83 N -3.53 2.42 -0.11 -0.43 0.00 -1.26 -5.10 121.76 113.76 2eob s ALA 83 Ca 0.26 -2.30 -0.03 0.00 0.00 0.00 0.00 51.96 49.88 2eob s ALA 83 Cb -0.13 -1.86 -0.03 0.00 0.00 0.00 0.00 23.12 21.10 2eob s ALA 83 CO 0.82 -1.73 0.03 0.71 0.00 0.00 0.00 175.76 175.59 2eob s TYR 84 N 1.02 3.24 -0.28 0.00 1.51 -1.26 -3.88 117.35 117.70 2eob s TYR 84 Ca 0.11 0.21 -0.11 0.00 -1.01 0.00 0.00 57.07 56.28 2eob s TYR 84 Cb -0.19 -1.85 0.11 0.00 -0.11 0.00 0.00 41.96 39.92 2eob s TYR 84 CO -0.13 0.46 0.62 -0.06 -1.11 0.00 0.00 175.55 175.33 2eob s PHE 85 N -0.71 -1.21 0.46 2.71 0.08 -1.15 -4.90 117.98 113.25 2eob s PHE 85 Ca 0.12 2.17 0.35 0.00 0.12 0.00 0.00 56.93 59.69 2eob s PHE 85 Cb -0.12 0.70 1.52 0.00 -0.57 0.00 0.00 43.02 44.56 2eob s PHE 85 CO 0.02 -0.61 1.59 1.49 -0.10 0.00 0.00 175.22 177.61 2eob h GLU 86 N 7.83 0.02 -2.65 0.44 4.57 -1.89 0.12 114.58 123.03 2eob h GLU 86 Ca -0.20 -0.00 0.11 0.00 -1.18 0.00 0.00 59.36 58.09 2eob h GLU 86 Cb 1.12 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.66 2eob h GLU 86 CO 0.12 0.02 0.41 -1.54 -1.18 0.00 0.00 179.01 176.83 2eob s SER 87 N -4.28 -0.12 0.44 1.04 1.04 -1.26 -4.43 113.70 106.13 2eob s SER 87 Ca -0.07 -0.65 0.16 0.00 0.48 0.00 0.00 55.95 55.87 2eob s SER 87 Cb 0.30 0.61 1.08 0.00 0.10 0.00 0.00 66.02 68.11 2eob s SER 87 CO 0.84 -1.17 1.95 -0.07 0.98 0.00 0.00 173.24 175.76 2eob h LEU 88 N 2.00 0.34 -0.04 2.42 3.38 -1.97 -2.46 115.31 118.99 2eob h LEU 88 Ca -0.25 0.02 0.03 0.00 0.09 0.00 0.00 57.88 57.76 2eob h LEU 88 Cb 1.24 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.87 2eob h LEU 88 CO 0.30 0.19 -0.47 0.58 0.09 0.00 0.00 178.44 179.12 2eob h VAL 89 N 0.37 0.08 0.50 1.22 2.07 -1.95 -0.39 116.25 118.15 2eob h VAL 89 Ca 0.33 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.83 2eob h VAL 89 Cb 0.77 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 2eob h VAL 89 CO -0.09 0.00 -0.39 -0.33 0.02 0.00 0.00 177.57 176.78 2eob h GLU 90 N -0.60 -0.84 -0.90 1.57 4.39 -1.83 0.25 114.58 116.62 2eob h GLU 90 Ca 0.04 0.06 0.23 0.00 0.34 0.00 0.00 59.36 60.03 2eob h GLU 90 Cb 0.68 0.19 -0.16 0.00 -0.10 0.00 0.00 28.75 29.36 2eob h GLU 90 CO -0.36 -0.56 0.05 1.25 -1.16 0.00 0.00 179.01 178.23 2eob h LEU 91 N -0.87 -0.38 0.53 1.33 6.46 -1.34 0.49 115.31 121.53 2eob h LEU 91 Ca -0.05 0.24 -0.03 0.00 -0.12 0.00 0.00 57.88 57.92 2eob h LEU 91 Cb 0.74 0.42 0.01 0.00 -0.73 0.00 0.00 40.66 41.09 2eob h LEU 91 CO 0.00 -0.27 -0.26 0.58 -0.62 0.00 0.00 178.44 177.88 2eob h VAL 92 N 0.07 0.22 -0.59 1.05 2.07 -0.70 -1.03 116.25 117.33 2eob h VAL 92 Ca 0.53 -0.45 0.17 0.00 0.82 0.00 0.00 66.70 67.77 2eob h VAL 92 Cb 1.05 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 2eob h VAL 92 CO -0.81 0.04 0.53 0.77 0.02 0.00 0.00 177.57 178.12 2eob h SER 93 N -1.09 0.00 0.03 0.57 4.64 0.25 -1.24 113.55 116.72 2eob h SER 93 Ca -0.07 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2eob h SER 93 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 2eob h SER 93 CO 0.12 0.00 -0.02 0.22 -0.87 0.00 0.00 176.83 176.28 2eob h TYR 94 N 0.00 -0.04 -0.25 4.77 3.20 0.05 -3.30 116.97 121.39 2eob h TYR 94 Ca 0.28 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.23 2eob h TYR 94 Cb 1.35 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.62 2eob h TYR 94 CO 0.00 -0.03 0.68 1.88 -1.64 0.00 0.00 178.16 179.05 2eob h TYR 95 N -0.45 0.00 -0.82 -3.82 -1.99 -0.84 0.17 116.97 109.22 2eob h TYR 95 Ca -0.00 0.00 0.24 0.00 2.00 0.00 0.00 58.73 60.96 2eob h TYR 95 Cb 0.04 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 38.73 2eob h TYR 95 CO 0.01 0.00 0.59 0.93 -0.00 0.00 0.00 178.16 179.69 2eob h GLU 96 N 0.00 0.01 0.00 4.88 5.08 -1.32 -2.63 114.58 120.60 2eob h GLU 96 Ca 0.12 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.42 2eob h GLU 96 Cb 1.48 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.72 2eob h GLU 96 CO -0.00 0.01 -0.59 0.87 -1.00 0.00 0.00 179.01 178.29 2eob h LYS 97 N 0.01 0.00 0.00 2.33 6.56 -0.86 -3.45 116.57 121.16 2eob h LYS 97 Ca 0.39 0.00 -0.43 0.00 -1.06 0.00 0.00 60.65 59.55 2eob h LYS 97 Cb 1.55 0.00 0.18 0.00 -0.57 0.00 0.00 32.23 33.39 2eob h LYS 97 CO -0.01 0.36 0.36 0.72 -2.06 0.00 0.00 179.45 178.81 2eob n HIS 98 N -4.59 -3.98 -2.09 -1.35 8.25 -0.99 -5.06 115.22 105.41 2eob n HIS 98 Ca -0.13 -1.15 -0.29 0.00 -0.26 0.00 0.00 57.72 55.89 2eob n HIS 98 Cb 0.35 -1.08 0.04 0.00 1.12 0.00 0.00 29.99 30.43 2eob n HIS 98 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2eob s ALA 99 N -3.75 3.04 0.00 -1.41 0.00 -1.26 -4.79 121.76 113.60 2eob s ALA 99 Ca 0.76 -0.51 -0.03 0.00 0.00 0.00 0.00 51.96 52.18 2eob s ALA 99 Cb -0.03 -2.85 -0.02 0.00 0.00 0.00 0.00 23.12 20.22 2eob s ALA 99 CO 0.54 -1.05 -0.07 -0.11 0.00 0.00 0.00 175.76 175.08 2eob n LEU 100 N -2.86 0.84 0.00 0.00 7.94 -0.92 -4.96 117.00 117.03 2eob n LEU 100 Ca 0.06 0.12 0.00 0.00 -1.11 0.00 0.00 56.01 55.08 2eob n LEU 100 Cb 0.58 -0.29 0.00 0.00 0.53 0.00 0.00 43.42 44.24 2eob n LEU 100 CO 0.56 -0.30 0.00 0.00 -1.11 0.00 0.00 177.39 176.53 2eob n TYR 101 N -3.47 0.00 0.00 1.96 9.36 -1.26 -5.06 117.16 118.70 2eob n TYR 101 Ca -0.06 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.16 2eob n TYR 101 Cb 0.32 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.03 2eob n TYR 101 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2eob n ARG 102 N -2.46 0.00 -0.00 2.98 1.74 -1.26 -4.99 116.66 112.67 2eob n ARG 102 Ca 0.00 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.09 2eob n ARG 102 Cb 0.00 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.41 2eob n ARG 102 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2eob n LYS 103 N -1.80 0.68 -1.67 5.56 5.02 -1.26 -4.90 118.16 119.79 2eob n LYS 103 Ca 0.00 -0.03 -0.19 0.00 -2.02 0.00 0.00 58.31 56.07 2eob n LYS 103 Cb 0.00 -1.09 0.12 0.00 -0.02 0.00 0.00 35.03 34.04 2eob n LYS 103 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2eob n MET 104 N -1.72 -0.43 -3.48 1.97 0.00 -1.26 -4.91 117.12 107.30 2eob n MET 104 Ca -0.02 -1.69 0.01 0.00 0.00 0.00 0.00 57.70 56.00 2eob n MET 104 Cb 0.19 -0.73 0.01 0.00 0.00 0.00 0.00 33.22 32.69 2eob n MET 104 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 175.97 178.86 2eob n ARG 105 N -2.67 0.28 -1.82 3.17 1.85 -1.26 -2.16 116.66 114.05 2eob n ARG 105 Ca 0.12 -0.81 -0.43 0.00 -1.00 0.00 0.00 57.85 55.73 2eob n ARG 105 Cb 0.42 1.22 -0.03 0.00 -1.05 0.00 0.00 32.46 33.02 2eob n ARG 105 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2eob s LEU 106 N 0.00 3.70 0.00 2.89 1.43 -1.26 -4.68 118.68 120.76 2eob s LEU 106 Ca 0.22 1.81 0.00 0.00 -1.03 0.00 0.00 54.13 55.13 2eob s LEU 106 Cb -0.01 -3.52 0.00 0.00 0.03 0.00 0.00 46.19 42.69 2eob s LEU 106 CO 0.01 -1.61 0.00 0.54 0.23 0.00 0.00 176.35 175.52 2eob n ARG 107 N 8.26 0.82 -3.74 1.70 1.74 -0.99 -4.70 116.66 119.76 2eob n ARG 107 Ca 0.24 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 57.03 2eob n ARG 107 Cb 0.45 -0.74 -0.14 0.00 -1.02 0.00 0.00 32.46 31.01 2eob n ARG 107 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2eob s TYR 108 N -1.47 1.91 -0.49 -1.55 2.02 -1.17 -5.04 117.35 111.55 2eob s TYR 108 Ca 0.00 -2.06 -0.27 0.00 -0.37 0.00 0.00 57.07 54.37 2eob s TYR 108 Cb 0.00 -1.83 -0.02 0.00 -0.40 0.00 0.00 41.96 39.71 2eob s TYR 108 CO 0.00 -0.85 1.79 -1.25 -1.57 0.00 0.00 175.55 173.67 2eob s PRO 109 N 1.11 2.97 -0.19 -1.71 0.04 -1.26 -2.74 135.00 133.23 2eob s PRO 109 Ca 0.13 0.92 -0.41 0.00 0.04 0.00 0.00 61.00 61.68 2eob s PRO 109 Cb -0.20 -4.28 -0.18 0.00 0.04 0.00 0.00 34.50 29.88 2eob s PRO 109 CO -0.14 -2.31 1.47 0.28 0.04 0.00 0.00 177.00 176.34 2eob n VAL 110 N 7.27 0.09 -4.40 -0.36 0.31 -0.00 -4.82 118.33 116.41 2eob n VAL 110 Ca 0.21 -0.02 -0.22 0.00 -0.01 0.00 0.00 64.34 64.30 2eob n VAL 110 Cb 0.50 -0.69 -0.10 0.00 -0.91 0.00 0.00 33.84 32.64 2eob n VAL 110 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2eob s THR 111 N 1.92 2.09 -0.59 2.52 -4.23 -1.26 -4.37 115.64 111.72 2eob s THR 111 Ca 0.95 -2.21 0.21 0.00 -1.18 0.00 0.00 61.69 59.46 2eob s THR 111 Cb -1.19 -2.11 0.22 0.00 1.34 0.00 0.00 72.50 70.76 2eob s THR 111 CO 0.63 -0.42 1.65 -0.81 -0.54 0.00 0.00 174.62 175.13 2eob n PRO 112 N -0.28 0.15 -0.03 3.99 -0.04 -1.26 -2.54 135.00 134.99 2eob n PRO 112 Ca -0.08 0.39 -0.09 0.00 -0.04 0.00 0.00 63.50 63.68 2eob n PRO 112 Cb 0.59 -1.79 -0.14 0.00 -0.04 0.00 0.00 33.50 32.12 2eob n PRO 112 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2eob n GLU 113 N -2.08 0.64 0.09 0.54 1.02 -1.26 -4.16 120.64 115.42 2eob n GLU 113 Ca 0.02 0.27 -0.13 0.00 -0.02 0.00 0.00 57.16 57.31 2eob n GLU 113 Cb 0.21 -1.77 -0.08 0.00 -0.02 0.00 0.00 31.44 29.78 2eob n GLU 113 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2eob h LEU 114 N 0.00 -0.19 -0.88 -4.62 5.85 -1.91 -1.27 115.31 112.29 2eob h LEU 114 Ca -0.31 -0.27 0.24 0.00 0.84 0.00 0.00 57.88 58.38 2eob h LEU 114 Cb 2.03 0.05 -0.15 0.00 0.37 0.00 0.00 40.66 42.97 2eob h LEU 114 CO 0.08 0.18 0.18 -0.07 -0.34 0.00 0.00 178.44 178.47 2eob h LEU 115 N -0.60 -0.11 0.00 2.25 -0.00 -1.73 0.73 115.31 115.85 2eob h LEU 115 Ca -0.02 0.21 -0.00 0.00 -0.00 0.00 0.00 57.88 58.07 2eob h LEU 115 Cb 0.45 0.31 0.00 0.00 -0.00 0.00 0.00 40.66 41.42 2eob h LEU 115 CO 0.04 -0.20 -0.00 -0.33 -0.00 0.00 0.00 178.44 177.95 2eob h GLU 116 N 0.16 -0.00 -0.01 1.13 4.39 -1.71 -2.78 114.58 115.76 2eob h GLU 116 Ca 0.55 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.25 2eob h GLU 116 Cb 1.11 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.76 2eob h GLU 116 CO -0.70 0.55 0.02 -0.09 -1.16 0.00 0.00 179.01 177.63 2eob h ARG 117 N -0.56 0.00 -0.56 2.33 2.43 0.17 0.98 114.38 119.17 2eob h ARG 117 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2eob h ARG 117 Cb 0.56 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.11 2eob h ARG 117 CO 0.00 0.00 0.00 0.66 -1.51 0.00 0.00 179.97 179.12 2eob n TYR 118 N -3.60 1.79 -1.29 2.20 4.02 0.24 -4.58 117.16 115.94 2eob n TYR 118 Ca -0.03 -0.71 -0.25 0.00 -0.01 0.00 0.00 57.90 56.91 2eob n TYR 118 Cb 0.10 -0.42 -0.01 0.00 -0.02 0.00 0.00 39.34 38.99 2eob n TYR 118 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2eob n SER 119 N 0.64 6.61 0.00 7.72 2.88 0.34 -4.98 113.62 126.83 2eob n SER 119 Ca 0.27 -3.23 0.00 0.00 -1.33 0.00 0.00 58.87 54.57 2eob n SER 119 Cb 1.08 -1.15 0.00 0.00 -0.75 0.00 0.00 64.21 63.39 2eob n SER 119 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2eob n GLY 120 N 0.50 -1.90 0.00 0.46 0.00 -1.26 -4.34 105.19 98.65 2eob n GLY 120 Ca 0.44 -2.00 0.07 0.00 0.00 0.00 0.00 46.02 44.53 2eob n GLY 120 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2eob n PRO 121 N 0.00 0.49 -1.45 1.61 -0.04 -1.26 -4.80 135.00 129.55 2eob n PRO 121 Ca 0.00 0.00 -0.48 0.00 -0.04 0.00 0.00 63.50 62.98 2eob n PRO 121 Cb 0.00 -1.46 -0.09 0.00 -0.04 0.00 0.00 33.50 31.92 2eob n PRO 121 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2eob n SER 122 N -0.96 1.65 -4.36 3.54 2.88 -1.26 -4.92 113.62 110.20 2eob n SER 122 Ca 0.11 0.25 -0.19 0.00 -1.33 0.00 0.00 58.87 57.71 2eob n SER 122 Cb 0.05 -1.21 0.09 0.00 -0.75 0.00 0.00 64.21 62.39 2eob n SER 122 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2eob n SER 123 N 10.67 1.40 0.00 -3.46 7.64 -1.26 -4.85 113.62 123.75 2eob n SER 123 Ca 0.47 -2.11 0.00 0.00 1.01 0.00 0.00 58.87 58.24 2eob n SER 123 Cb 0.21 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 2eob n SER 123 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64