#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eob n SER 2 N 0.00 5.79 0.13 1.61 3.41 -1.26 -4.51 113.62 118.79 2eob n SER 2 Ca 0.00 -2.69 -0.13 0.00 -0.26 0.00 0.00 58.87 55.78 2eob n SER 2 Cb 0.00 -1.15 -0.07 0.00 -0.26 0.00 0.00 64.21 62.73 2eob n SER 2 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2eob h SER 3 N 1.57 -0.38 -3.30 4.04 0.02 -2.12 -3.35 113.55 110.02 2eob h SER 3 Ca 0.15 0.03 -0.76 0.00 -0.84 0.00 0.00 61.79 60.38 2eob h SER 3 Cb 1.02 0.13 -0.24 0.00 0.14 0.00 0.00 62.40 63.45 2eob h SER 3 CO 0.34 -0.23 0.04 -0.83 -1.14 0.00 0.00 176.83 175.01 2eob s GLY 4 N -2.26 2.25 -0.13 -3.77 0.00 -1.26 -5.00 107.32 97.15 2eob s GLY 4 Ca -0.15 -2.82 -0.09 0.00 0.00 0.00 0.00 44.72 41.66 2eob s GLY 4 CO 0.65 1.34 0.33 -1.35 0.00 0.00 0.00 173.10 174.08 2eob s SER 5 N 3.04 -0.37 -0.19 1.64 1.04 -1.26 -5.06 113.70 112.54 2eob s SER 5 Ca 0.12 0.69 -0.09 0.00 0.48 0.00 0.00 55.95 57.15 2eob s SER 5 Cb -0.19 0.63 -0.08 0.00 0.10 0.00 0.00 66.02 66.47 2eob s SER 5 CO -0.02 -0.15 -0.25 -1.54 0.98 0.00 0.00 173.24 172.26 2eob n SER 6 N 3.64 1.41 0.00 7.02 3.41 -1.26 -5.14 113.62 122.70 2eob n SER 6 Ca -0.19 0.22 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 2eob n SER 6 Cb 0.56 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2eob n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eob n GLY 7 N 1.82 0.08 3.53 5.00 0.00 -1.26 -5.04 105.19 109.33 2eob n GLY 7 Ca -0.38 -2.11 -0.29 0.00 0.00 0.00 0.00 46.02 43.24 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 4.12 0.49 1.61 1.11 -1.26 -5.12 116.67 113.63 2eob s ASP 8 Ca 0.00 -0.50 -0.21 0.00 0.18 0.00 0.00 52.55 52.01 2eob s ASP 8 Cb 0.00 -0.67 -0.07 0.00 1.07 0.00 0.00 42.92 43.25 2eob s ASP 8 CO 0.00 0.17 1.15 -2.16 1.18 0.00 0.00 175.17 175.51 2eob s PRO 9 N -2.27 3.59 0.19 8.23 0.04 -1.26 -4.92 135.00 138.60 2eob s PRO 9 Ca 0.20 1.70 -0.27 0.00 0.04 0.00 0.00 61.00 62.67 2eob s PRO 9 Cb -0.10 -2.24 -0.16 0.00 0.04 0.00 0.00 34.50 32.04 2eob s PRO 9 CO 0.12 -0.67 0.50 1.33 0.04 0.00 0.00 177.00 178.32 2eob n VAL 10 N -0.83 1.90 -2.07 -0.36 0.24 -1.26 -4.76 118.33 111.19 2eob n VAL 10 Ca 0.09 -0.48 -0.41 0.00 -2.04 0.00 0.00 64.34 61.50 2eob n VAL 10 Cb 0.49 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.84 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 -0.95 3.08 -0.24 7.34 0.04 -1.26 -4.97 135.00 138.04 2eob s PRO 11 Ca 0.61 1.02 -0.29 0.00 0.04 0.00 0.00 61.00 62.38 2eob s PRO 11 Cb -0.89 -4.25 0.01 0.00 0.04 0.00 0.00 34.50 29.41 2eob s PRO 11 CO 0.54 -2.17 1.05 1.21 0.04 0.00 0.00 177.00 177.66 2eob s ASN 12 N 6.57 7.07 0.00 6.66 2.47 -1.26 -4.90 114.94 131.55 2eob s ASN 12 Ca 0.72 1.33 0.15 0.00 0.42 0.00 0.00 52.86 55.48 2eob s ASN 12 Cb -0.17 -2.54 0.85 0.00 -1.45 0.00 0.00 41.25 37.94 2eob s ASN 12 CO 0.28 -0.71 1.37 -0.81 -3.72 0.00 0.00 177.10 173.51 2eob n PRO 13 N 6.41 0.37 -3.70 0.43 -0.04 -1.26 -4.11 135.00 133.11 2eob n PRO 13 Ca 0.12 0.06 -0.35 0.00 -0.04 0.00 0.00 63.50 63.29 2eob n PRO 13 Cb 0.46 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.34 2eob n PRO 13 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2eob s ASN 14 N -2.23 5.68 0.51 3.54 0.01 -1.26 -4.89 114.94 116.30 2eob s ASN 14 Ca 0.20 -3.61 0.30 0.00 -0.71 0.00 0.00 52.86 49.03 2eob s ASN 14 Cb 0.10 -1.85 1.25 0.00 0.41 0.00 0.00 41.25 41.16 2eob s ASN 14 CO 0.20 -0.19 1.95 1.55 -1.51 0.00 0.00 177.10 179.09 2eob h PRO 15 N 6.07 0.00 -0.57 -0.60 0.13 -2.00 -3.25 132.00 131.77 2eob h PRO 15 Ca 0.13 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 65.37 2eob h PRO 15 Cb 0.82 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.84 2eob h PRO 15 CO 0.81 0.10 -0.28 1.12 -0.23 0.00 0.00 178.00 179.51 2eob h HIS 16 N 0.00 -0.75 -0.41 1.56 2.07 -1.95 0.22 115.15 115.89 2eob h HIS 16 Ca -0.00 0.07 -0.16 0.00 -2.85 0.00 0.00 60.37 57.43 2eob h HIS 16 Cb 0.56 0.42 -0.01 0.00 2.57 0.00 0.00 27.41 30.95 2eob h HIS 16 CO 0.00 -0.35 -0.35 1.05 -3.07 0.00 0.00 177.93 175.20 2eob h GLU 17 N -0.13 0.96 -0.29 5.12 4.11 -2.00 -2.95 114.58 119.40 2eob h GLU 17 Ca 0.25 -0.49 0.06 0.00 0.07 0.00 0.00 59.36 59.25 2eob h GLU 17 Cb 0.53 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 2eob h GLU 17 CO -0.65 1.15 0.20 0.77 0.07 0.00 0.00 179.01 180.55 2eob h SER 18 N 0.79 0.10 -2.53 3.06 0.02 -1.20 -3.43 113.55 110.37 2eob h SER 18 Ca 0.07 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 60.43 2eob h SER 18 Cb 0.95 -0.02 0.16 0.00 0.14 0.00 0.00 62.40 63.63 2eob h SER 18 CO 0.09 0.07 -0.54 0.29 -1.14 0.00 0.00 176.83 175.60 2eob n LYS 19 N -4.47 0.43 0.02 3.45 4.76 0.62 -4.88 118.16 118.09 2eob n LYS 19 Ca 0.03 0.16 -0.06 0.00 -2.87 0.00 0.00 58.31 55.58 2eob n LYS 19 Cb 0.29 -1.49 0.13 0.00 -1.84 0.00 0.00 35.03 32.12 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 0.41 0.46 -0.24 1.97 0.13 -1.89 -2.73 132.00 130.11 2eob h PRO 20 Ca -0.43 -0.24 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 2eob h PRO 20 Cb 1.41 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.55 2eob h PRO 20 CO 0.48 0.81 0.00 -2.67 -0.23 0.00 0.00 178.00 176.39 2eob n TRP 21 N -4.01 0.00 -3.49 1.56 4.27 -1.26 -4.63 117.44 109.87 2eob n TRP 21 Ca -0.02 0.00 -0.38 0.00 -3.89 0.00 0.00 57.50 53.21 2eob n TRP 21 Cb 0.52 -0.02 -0.06 0.00 -1.36 0.00 0.00 31.31 30.39 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 -1.76 3.69 -0.07 -2.67 5.04 -1.03 -3.42 117.35 117.14 2eob s TYR 22 Ca 0.00 0.95 0.03 0.00 -2.44 0.00 0.00 57.07 55.61 2eob s TYR 22 Cb 0.00 -2.31 0.01 0.00 0.35 0.00 0.00 41.96 40.01 2eob s TYR 22 CO 0.00 0.58 -0.16 0.71 -1.34 0.00 0.00 175.55 175.34 2eob s TYR 23 N -0.83 1.78 -0.09 4.97 2.02 -0.80 -5.00 117.35 119.40 2eob s TYR 23 Ca 0.23 -0.66 0.03 0.00 -0.37 0.00 0.00 57.07 56.30 2eob s TYR 23 Cb -0.16 -1.25 -0.08 0.00 -0.40 0.00 0.00 41.96 40.07 2eob s TYR 23 CO 0.12 -0.29 -0.05 -3.47 -1.57 0.00 0.00 175.55 170.29 2eob n ASP 24 N 3.62 3.15 -2.33 2.29 -0.08 -1.26 -1.08 116.55 120.87 2eob n ASP 24 Ca -0.21 -0.04 -0.27 0.00 -1.51 0.00 0.00 54.79 52.76 2eob n ASP 24 Cb 0.52 0.14 0.01 0.00 2.34 0.00 0.00 41.12 44.13 2eob n ASP 24 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 2eob n ARG 25 N -2.62 3.43 -3.96 -0.67 1.85 -1.26 -4.64 116.66 108.79 2eob n ARG 25 Ca -0.16 -4.28 -0.29 0.00 -1.00 0.00 0.00 57.85 52.12 2eob n ARG 25 Cb 0.71 -2.26 -0.04 0.00 -1.05 0.00 0.00 32.46 29.82 2eob n ARG 25 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 2eob s LEU 26 N -3.60 4.23 0.23 2.89 2.96 -1.26 -5.12 118.68 119.01 2eob s LEU 26 Ca 0.50 0.17 0.10 0.00 -0.22 0.00 0.00 54.13 54.69 2eob s LEU 26 Cb 0.41 -2.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.22 2eob s LEU 26 CO -0.11 0.13 -0.13 -0.44 -1.32 0.00 0.00 176.35 174.48 2eob s SER 27 N -2.75 3.98 0.04 3.68 0.01 -1.26 -4.87 113.70 112.53 2eob s SER 27 Ca 0.34 -0.77 -0.20 0.00 1.31 0.00 0.00 55.95 56.62 2eob s SER 27 Cb -0.12 -0.55 -0.10 0.00 0.21 0.00 0.00 66.02 65.46 2eob s SER 27 CO 0.27 0.07 1.31 0.03 0.41 0.00 0.00 173.24 175.33 2eob h ARG 28 N 2.56 -0.61 -1.18 12.44 3.08 -2.00 0.33 114.38 129.00 2eob h ARG 28 Ca -0.44 0.04 0.34 0.00 0.07 0.00 0.00 59.98 59.99 2eob h ARG 28 Cb 1.23 0.14 -0.05 0.00 0.08 0.00 0.00 29.97 31.37 2eob h ARG 28 CO 0.56 -0.41 1.17 0.41 -1.07 0.00 0.00 179.97 180.63 2eob n GLY 29 N -1.34 -0.75 0.13 0.04 0.00 -1.26 0.12 105.19 102.14 2eob n GLY 29 Ca -0.08 0.41 -0.21 0.00 0.00 0.00 0.00 46.02 46.15 2eob n GLY 29 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2eob n GLU 30 N -3.25 0.68 0.15 1.61 1.02 -0.75 -3.82 120.64 116.29 2eob n GLU 30 Ca 0.27 0.25 -0.12 0.00 -0.02 0.00 0.00 57.16 57.54 2eob n GLU 30 Cb 1.52 -1.62 -0.07 0.00 -0.02 0.00 0.00 31.44 31.25 2eob n GLU 30 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2eob h ALA 31 N -0.11 -0.96 -0.15 0.62 0.00 0.49 0.20 119.26 119.35 2eob h ALA 31 Ca -0.50 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 54.35 2eob h ALA 31 Cb 1.87 0.64 -0.06 0.00 0.00 0.00 0.00 17.79 20.25 2eob h ALA 31 CO -0.06 -1.00 -0.24 0.93 0.00 0.00 0.00 179.25 178.88 2eob h GLU 32 N -0.61 -0.29 -0.17 0.00 5.08 -1.59 -2.57 114.58 114.43 2eob h GLU 32 Ca -0.03 0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.40 2eob h GLU 32 Cb 0.56 0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.80 2eob h GLU 32 CO -0.10 -0.19 -0.37 0.22 -1.00 0.00 0.00 179.01 177.57 2eob h ASP 33 N -0.30 -1.17 -0.76 1.42 3.58 -1.62 -2.38 116.42 115.20 2eob h ASP 33 Ca 0.11 0.17 0.08 0.00 0.42 0.00 0.00 57.03 57.80 2eob h ASP 33 Cb 0.46 0.49 -0.10 0.00 1.72 0.00 0.00 39.33 41.90 2eob h ASP 33 CO -0.32 -0.39 -0.41 0.23 -2.88 0.00 0.00 179.24 175.47 2eob n MET 34 N -5.42 -0.30 -0.27 0.28 2.81 0.70 0.23 117.12 115.15 2eob n MET 34 Ca -0.03 1.15 0.09 0.00 -1.81 0.00 0.00 57.70 57.10 2eob n MET 34 Cb 0.35 -1.69 0.34 0.00 -0.71 0.00 0.00 33.22 31.50 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 0.73 -2.48 4.03 -0.00 -1.36 0.18 115.31 116.40 2eob h LEU 35 Ca 0.15 0.03 -0.00 0.00 -0.00 0.00 0.00 57.88 58.06 2eob h LEU 35 Cb 0.34 -0.12 -0.00 0.00 -0.00 0.00 0.00 40.66 40.88 2eob h LEU 35 CO -0.72 0.41 -0.02 0.24 -0.00 0.00 0.00 178.44 178.35 2eob h MET 36 N 0.79 0.00 0.19 1.13 2.86 0.33 -2.29 114.93 117.94 2eob h MET 36 Ca 0.42 0.00 -0.33 0.00 -2.06 0.00 0.00 59.70 57.73 2eob h MET 36 Cb 0.52 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.20 2eob h MET 36 CO -0.18 0.02 -1.61 0.00 1.06 0.00 0.00 176.91 176.20 2eob h ARG 37 N 0.00 0.40 -6.18 1.72 3.08 0.22 -3.44 114.38 110.18 2eob h ARG 37 Ca -0.00 -0.69 -0.58 0.00 0.07 0.00 0.00 59.98 58.79 2eob h ARG 37 Cb 0.07 0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 2eob h ARG 37 CO 0.00 1.33 1.33 0.42 -1.07 0.00 0.00 179.97 181.98 2eob s ILE 38 N -2.56 3.31 -2.00 2.04 -1.09 -0.86 -4.83 121.20 115.21 2eob s ILE 38 Ca -0.15 0.32 0.11 0.00 -2.23 0.00 0.00 60.65 58.70 2eob s ILE 38 Cb 0.05 -3.39 0.31 0.00 -1.58 0.00 0.00 42.46 37.84 2eob s ILE 38 CO 0.86 -0.23 1.08 -0.81 -1.23 0.00 0.00 174.94 174.61 2eob n PRO 39 N 8.40 0.49 -3.45 2.79 -0.04 -1.26 -4.61 135.00 137.31 2eob n PRO 39 Ca 0.25 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.30 2eob n PRO 39 Cb 0.46 -1.35 -0.10 0.00 -0.04 0.00 0.00 33.50 32.47 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 -2.00 3.48 -0.38 0.54 1.81 -1.26 -5.04 118.95 116.10 2eob s ARG 40 Ca 0.16 -0.56 -0.29 0.00 -1.72 0.00 0.00 55.73 53.32 2eob s ARG 40 Cb 0.07 -3.82 0.01 0.00 -0.45 0.00 0.00 34.95 30.76 2eob s ARG 40 CO 0.12 -0.52 1.38 0.16 -0.68 0.00 0.00 175.30 175.76 2eob s ASP 41 N 1.73 6.43 0.00 0.23 -4.77 -1.26 -3.19 116.67 115.84 2eob s ASP 41 Ca 0.09 0.93 0.00 0.00 -3.30 0.00 0.00 52.55 50.27 2eob s ASP 41 Cb -0.17 -2.54 0.00 0.00 -1.09 0.00 0.00 42.92 39.12 2eob s ASP 41 CO 0.11 -1.34 0.00 0.61 0.70 0.00 0.00 175.17 175.26 2eob n GLY 42 N 4.87 1.30 3.34 2.12 0.00 -1.25 -4.89 105.19 110.69 2eob n GLY 42 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 2eob n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2eob n ALA 43 N 0.00 -2.75 -4.16 4.61 0.00 -1.19 -4.11 120.51 112.90 2eob n ALA 43 Ca 0.00 -0.43 -0.18 0.00 0.00 0.00 0.00 53.44 52.83 2eob n ALA 43 Cb 0.00 -1.66 -0.05 0.00 0.00 0.00 0.00 19.45 17.73 2eob n ALA 43 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 2eob n PHE 44 N -2.73 -1.17 -3.50 0.00 -1.74 -1.13 -1.94 117.46 105.25 2eob n PHE 44 Ca 0.06 -2.61 0.00 0.00 -0.56 0.00 0.00 57.45 54.35 2eob n PHE 44 Cb 0.52 0.44 -0.05 0.00 1.52 0.00 0.00 39.48 41.91 2eob n PHE 44 CO 0.00 0.00 0.00 -0.48 -0.56 0.00 0.00 176.76 175.72 2eob s LEU 45 N 0.00 -0.50 -0.41 5.98 0.05 0.04 -0.98 118.68 122.86 2eob s LEU 45 Ca 0.35 0.73 -0.18 0.00 0.05 0.00 0.00 54.13 55.08 2eob s LEU 45 Cb 0.00 1.63 0.02 0.00 -2.05 0.00 0.00 46.19 45.79 2eob s LEU 45 CO 0.25 -0.11 0.47 -0.63 -0.55 0.00 0.00 176.35 175.78 2eob s ILE 46 N 1.91 5.04 0.21 1.48 1.01 -1.22 -1.11 121.20 128.52 2eob s ILE 46 Ca -0.05 -0.18 0.03 0.00 0.00 0.00 0.00 60.65 60.44 2eob s ILE 46 Cb -0.05 -4.04 -0.03 0.00 0.01 0.00 0.00 42.46 38.34 2eob s ILE 46 CO -0.16 -0.41 0.35 0.00 0.00 0.00 0.00 174.94 174.72 2eob s ARG 47 N 2.27 3.46 -0.03 2.79 1.70 -1.04 -1.91 118.95 126.19 2eob s ARG 47 Ca 0.14 -0.60 -0.08 0.00 -0.47 0.00 0.00 55.73 54.73 2eob s ARG 47 Cb -0.16 -2.89 -0.05 0.00 -0.57 0.00 0.00 34.95 31.27 2eob s ARG 47 CO 0.14 0.44 0.26 0.21 -1.08 0.00 0.00 175.30 175.27 2eob s LYS 48 N -3.60 3.60 -0.67 3.89 2.20 -0.24 -3.28 119.74 121.62 2eob s LYS 48 Ca 0.35 -0.01 -0.18 0.00 -0.36 0.00 0.00 55.97 55.77 2eob s LYS 48 Cb -0.10 -3.13 0.12 0.00 -1.51 0.00 0.00 37.83 33.21 2eob s LYS 48 CO 0.29 0.69 0.79 1.03 -0.36 0.00 0.00 175.35 177.79 2eob s ARG 49 N -1.45 3.20 0.28 4.03 1.81 -1.22 -4.83 118.95 120.77 2eob s ARG 49 Ca 0.23 -1.51 -0.07 0.00 -1.72 0.00 0.00 55.73 52.67 2eob s ARG 49 Cb -0.13 -4.38 0.49 0.00 -0.45 0.00 0.00 34.95 30.47 2eob s ARG 49 CO 0.12 -1.56 1.54 -0.85 -0.68 0.00 0.00 175.30 173.87 2eob n GLU 50 N 6.14 -0.09 0.00 3.54 0.28 -1.26 -3.82 120.64 125.43 2eob n GLU 50 Ca -0.01 1.53 0.00 0.00 -0.16 0.00 0.00 57.16 58.51 2eob n GLU 50 Cb 0.44 -2.30 0.00 0.00 1.43 0.00 0.00 31.44 31.01 2eob n GLU 50 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2eob n GLY 51 N -1.61 1.44 3.21 -1.84 0.00 -1.26 -4.92 105.19 100.22 2eob n GLY 51 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 2eob n GLY 51 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2eob n THR 52 N 0.00 0.31 -0.12 2.61 5.66 -1.25 -4.81 114.28 116.68 2eob n THR 52 Ca 0.00 -0.48 -0.08 0.00 -3.05 0.00 0.00 64.05 60.43 2eob n THR 52 Cb 0.00 -0.13 0.12 0.00 -1.55 0.00 0.00 70.33 68.78 2eob n THR 52 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2eob n ASP 53 N 2.31 3.42 -4.88 1.09 8.00 -1.26 -4.53 116.55 120.69 2eob n ASP 53 Ca 0.05 -2.75 -0.27 0.00 0.71 0.00 0.00 54.79 52.53 2eob n ASP 53 Cb 0.50 -0.66 -0.02 0.00 -0.02 0.00 0.00 41.12 40.93 2eob n ASP 53 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2eob s SER 54 N -0.25 4.58 0.05 -2.24 1.04 -1.26 -4.87 113.70 110.74 2eob s SER 54 Ca 0.29 -1.28 0.04 0.00 0.48 0.00 0.00 55.95 55.48 2eob s SER 54 Cb 0.24 0.40 -0.02 0.00 0.10 0.00 0.00 66.02 66.74 2eob s SER 54 CO 0.06 -1.06 -0.12 -0.31 0.98 0.00 0.00 173.24 172.79 2eob s TYR 55 N -2.78 1.07 -0.13 5.02 2.02 -1.20 -3.45 117.35 117.89 2eob s TYR 55 Ca 0.31 -0.42 0.01 0.00 -0.37 0.00 0.00 57.07 56.60 2eob s TYR 55 Cb -0.02 -0.62 0.02 0.00 -0.40 0.00 0.00 41.96 40.94 2eob s TYR 55 CO 0.19 0.02 -0.16 0.00 -1.57 0.00 0.00 175.55 174.03 2eob s ALA 56 N -1.13 1.85 -0.17 3.71 0.00 -1.21 -0.65 121.76 124.17 2eob s ALA 56 Ca -0.03 -0.86 -0.14 0.00 0.00 0.00 0.00 51.96 50.94 2eob s ALA 56 Cb -0.09 -0.96 -0.05 0.00 0.00 0.00 0.00 23.12 22.02 2eob s ALA 56 CO 0.01 -0.21 0.28 -1.50 0.00 0.00 0.00 175.76 174.34 2eob s ILE 57 N 1.20 5.31 0.17 0.00 2.07 -0.79 -2.48 121.20 126.68 2eob s ILE 57 Ca -0.01 0.51 0.07 0.00 -1.41 0.00 0.00 60.65 59.81 2eob s ILE 57 Cb -0.14 -3.62 -0.04 0.00 0.13 0.00 0.00 42.46 38.79 2eob s ILE 57 CO -0.06 0.38 0.05 -0.89 -1.91 0.00 0.00 174.94 172.51 2eob s THR 58 N 0.53 3.99 0.29 4.00 2.01 -0.27 -1.04 115.64 125.15 2eob s THR 58 Ca 0.16 -1.32 -0.15 0.00 0.31 0.00 0.00 61.69 60.69 2eob s THR 58 Cb -0.13 -3.02 0.01 0.00 0.01 0.00 0.00 72.50 69.37 2eob s THR 58 CO 0.03 -0.12 0.61 0.72 -0.69 0.00 0.00 174.62 175.18 2eob s PHE 59 N -1.76 0.21 -0.30 4.92 -0.71 -1.04 -0.78 117.98 118.51 2eob s PHE 59 Ca 0.29 -0.65 -0.12 0.00 -1.04 0.00 0.00 56.93 55.41 2eob s PHE 59 Cb -0.09 0.45 -0.04 0.00 -1.21 0.00 0.00 43.02 42.13 2eob s PHE 59 CO 0.20 -1.19 0.23 0.50 -1.34 0.00 0.00 175.22 173.62 2eob s ARG 60 N -3.58 3.78 -0.47 1.99 3.52 -0.82 -2.64 118.95 120.73 2eob s ARG 60 Ca 0.18 -0.41 -0.02 0.00 -0.13 0.00 0.00 55.73 55.36 2eob s ARG 60 Cb -0.03 -3.72 0.12 0.00 -1.56 0.00 0.00 34.95 29.76 2eob s ARG 60 CO 0.10 -0.29 0.25 0.00 -0.81 0.00 0.00 175.30 174.55 2eob s ALA 61 N 1.78 3.25 -1.30 6.12 0.00 0.11 -3.79 121.76 127.93 2eob s ALA 61 Ca 0.07 -2.79 -0.13 0.00 0.00 0.00 0.00 51.96 49.12 2eob s ALA 61 Cb -0.16 -2.41 0.00 0.00 0.00 0.00 0.00 23.12 20.55 2eob s ALA 61 CO 0.11 -1.89 0.54 -2.13 0.00 0.00 0.00 175.76 172.39 2eob n ARG 62 N 4.14 -1.88 0.00 0.00 0.00 -1.26 -0.72 116.66 116.94 2eob n ARG 62 Ca 0.02 0.33 0.00 0.00 -0.00 0.00 0.00 57.85 58.20 2eob n ARG 62 Cb 0.40 -3.96 0.00 0.00 0.00 0.00 0.00 32.46 28.89 2eob n ARG 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2eob n GLY 63 N -1.97 2.08 3.74 5.14 0.00 -1.26 -4.99 105.19 107.92 2eob n GLY 63 Ca -0.21 -0.42 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 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 -0.00 -0.15 1.61 1.02 0.10 -4.83 119.74 117.48 2eob s LYS 64 Ca 0.00 -0.03 -0.01 0.00 0.02 0.00 0.00 55.97 55.95 2eob s LYS 64 Cb 0.00 -1.74 0.04 0.00 -0.52 0.00 0.00 37.83 35.62 2eob s LYS 64 CO 0.00 -2.91 -0.02 0.08 -0.92 0.00 0.00 175.35 171.58 2eob s VAL 65 N -3.31 0.83 0.39 3.17 1.01 -1.26 0.04 120.40 121.27 2eob s VAL 65 Ca 0.69 -0.47 0.08 0.00 0.00 0.00 0.00 61.98 62.28 2eob s VAL 65 Cb -0.10 -1.08 -0.01 0.00 0.00 0.00 0.00 36.38 35.19 2eob s VAL 65 CO 0.55 0.07 0.42 -0.54 0.00 0.00 0.00 175.10 175.60 2eob s LYS 66 N 1.75 2.71 0.01 2.72 1.02 -1.08 -4.96 119.74 121.91 2eob s LYS 66 Ca 0.01 -1.36 0.01 0.00 0.02 0.00 0.00 55.97 54.65 2eob s LYS 66 Cb -0.15 -2.55 -0.01 0.00 -0.52 0.00 0.00 37.83 34.60 2eob s LYS 66 CO -0.07 -0.14 -0.03 -1.01 -0.92 0.00 0.00 175.35 173.18 2eob s HIS 67 N -2.38 0.27 -0.11 3.18 3.76 -1.26 -2.51 115.29 116.25 2eob s HIS 67 Ca 0.48 -0.27 0.02 0.00 -0.15 0.00 0.00 55.06 55.14 2eob s HIS 67 Cb -0.06 -0.18 0.01 0.00 1.11 0.00 0.00 32.58 33.46 2eob s HIS 67 CO 0.29 -0.08 -0.17 0.00 -0.85 0.00 0.00 174.74 173.94 2eob s ARG 69 N 0.88 4.53 0.00 0.00 6.06 -1.26 -1.89 118.95 127.27 2eob s ARG 69 Ca -0.08 1.89 0.07 0.00 -2.50 0.00 0.00 55.73 55.10 2eob s ARG 69 Cb -0.15 -3.11 -0.02 0.00 0.06 0.00 0.00 34.95 31.73 2eob s ARG 69 CO -0.00 0.08 -0.21 0.42 -2.50 0.00 0.00 175.30 173.09 2eob s ILE 70 N -1.19 1.65 0.28 4.11 1.01 0.18 -4.23 121.20 123.00 2eob s ILE 70 Ca 0.47 -0.98 0.10 0.00 0.00 0.00 0.00 60.65 60.23 2eob s ILE 70 Cb -0.33 -1.39 -0.05 0.00 0.01 0.00 0.00 42.46 40.70 2eob s ILE 70 CO 0.43 0.38 -0.16 0.20 0.00 0.00 0.00 174.94 175.79 2eob s ASN 71 N -0.70 3.36 -0.14 3.58 -0.87 -0.28 -3.27 114.94 116.61 2eob s ASN 71 Ca 0.08 -1.07 0.01 0.00 -1.57 0.00 0.00 52.86 50.31 2eob s ASN 71 Cb -0.08 -0.27 -0.00 0.00 -0.02 0.00 0.00 41.25 40.88 2eob s ASN 71 CO 0.00 -0.07 -0.18 -0.60 -2.57 0.00 0.00 177.10 173.68 2eob s ARG 72 N -3.57 3.17 -0.56 -0.60 3.52 -1.26 0.22 118.95 119.87 2eob s ARG 72 Ca 0.29 -0.79 -0.07 0.00 -0.13 0.00 0.00 55.73 55.03 2eob s ARG 72 Cb -0.02 -2.52 0.15 0.00 -1.56 0.00 0.00 34.95 30.99 2eob s ARG 72 CO 0.13 0.08 0.41 0.34 -0.81 0.00 0.00 175.30 175.46 2eob s ASP 73 N 0.64 5.64 0.68 -2.12 -1.08 0.15 -4.91 116.67 115.66 2eob s ASP 73 Ca -0.09 -2.34 0.00 0.00 -0.52 0.00 0.00 52.55 49.59 2eob s ASP 73 Cb -0.16 -1.96 0.00 0.00 -1.46 0.00 0.00 42.92 39.34 2eob s ASP 73 CO 0.02 -0.55 0.00 0.61 0.52 0.00 0.00 175.17 175.77 2eob n GLY 74 N 4.27 0.37 0.61 2.66 0.00 -1.26 -0.89 105.19 110.95 2eob n GLY 74 Ca 0.01 0.63 0.05 0.00 0.00 0.00 0.00 46.02 46.71 2eob n GLY 74 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2eob n ARG 75 N 0.00 1.70 -4.13 1.61 1.85 -1.26 -5.02 116.66 111.42 2eob n ARG 75 Ca 0.00 -3.03 -0.09 0.00 -1.00 0.00 0.00 57.85 53.73 2eob n ARG 75 Cb 0.00 -1.66 -0.10 0.00 -1.05 0.00 0.00 32.46 29.65 2eob n ARG 75 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 2eob s HIS 76 N -3.10 0.71 -0.22 2.89 3.76 -0.07 -4.86 115.29 114.39 2eob s HIS 76 Ca 0.38 -1.08 -0.05 0.00 -0.15 0.00 0.00 55.06 54.17 2eob s HIS 76 Cb 0.35 -0.45 -0.02 0.00 1.11 0.00 0.00 32.58 33.57 2eob s HIS 76 CO -0.01 -0.36 -0.01 -0.06 -0.85 0.00 0.00 174.74 173.45 2eob s PHE 77 N -3.88 3.00 -0.12 1.40 0.08 -1.10 0.31 117.98 117.67 2eob s PHE 77 Ca 0.13 -0.70 -0.05 0.00 0.12 0.00 0.00 56.93 56.42 2eob s PHE 77 Cb 0.07 -2.13 -0.04 0.00 -0.57 0.00 0.00 43.02 40.35 2eob s PHE 77 CO -0.05 -0.43 0.08 0.08 -0.10 0.00 0.00 175.22 174.79 2eob s VAL 78 N 1.40 5.00 0.05 -0.44 1.01 0.13 -3.34 120.40 124.22 2eob s VAL 78 Ca 0.05 0.02 0.04 0.00 0.00 0.00 0.00 61.98 62.08 2eob s VAL 78 Cb -0.15 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.04 2eob s VAL 78 CO -0.00 0.59 -0.11 -0.22 0.00 0.00 0.00 175.10 175.36 2eob s LEU 79 N -0.75 2.25 0.00 3.92 2.96 -1.16 -1.13 118.68 124.78 2eob s LEU 79 Ca 0.13 -0.56 0.00 0.00 -0.22 0.00 0.00 54.13 53.48 2eob s LEU 79 Cb -0.12 -0.34 0.00 0.00 0.50 0.00 0.00 46.19 46.23 2eob s LEU 79 CO 0.03 -0.13 0.00 0.61 -1.32 0.00 0.00 176.35 175.54 2eob n GLY 80 N 1.46 0.45 3.64 7.98 0.00 -1.26 -4.04 105.19 113.41 2eob n GLY 80 Ca -0.22 0.60 -0.09 0.00 0.00 0.00 0.00 46.02 46.31 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 0.00 0.00 -1.37 2.61 2.01 -1.26 -4.96 115.64 112.67 2eob s THR 81 Ca 0.00 0.00 -0.07 0.00 0.31 0.00 0.00 61.69 61.93 2eob s THR 81 Cb 0.00 -1.00 0.03 0.00 0.01 0.00 0.00 72.50 71.54 2eob s THR 81 CO 0.00 0.00 1.03 -1.20 -0.69 0.00 0.00 174.62 173.76 2eob n SER 82 N 3.07 -4.40 -3.68 3.53 7.64 -1.26 -4.98 113.62 113.54 2eob n SER 82 Ca -0.16 -0.66 -0.28 0.00 1.01 0.00 0.00 58.87 58.78 2eob n SER 82 Cb 0.57 -4.60 -0.16 0.00 -1.01 0.00 0.00 64.21 59.01 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 -3.37 1.00 0.10 -0.43 0.00 -1.26 -5.08 121.76 112.72 2eob s ALA 83 Ca 0.42 -1.01 0.05 0.00 0.00 0.00 0.00 51.96 51.42 2eob s ALA 83 Cb -0.19 -1.33 -0.04 0.00 0.00 0.00 0.00 23.12 21.55 2eob s ALA 83 CO 0.77 -1.42 -0.00 0.71 0.00 0.00 0.00 175.76 175.82 2eob s TYR 84 N 1.88 2.97 -0.29 0.00 1.51 -1.26 -3.00 117.35 119.16 2eob s TYR 84 Ca 0.04 -0.04 -0.12 0.00 -1.01 0.00 0.00 57.07 55.95 2eob s TYR 84 Cb -0.17 -1.52 0.11 0.00 -0.11 0.00 0.00 41.96 40.27 2eob s TYR 84 CO -0.19 0.48 0.65 -0.06 -1.11 0.00 0.00 175.55 175.32 2eob s PHE 85 N -1.35 -1.23 0.36 2.71 0.40 -1.21 -4.93 117.98 112.73 2eob s PHE 85 Ca 0.26 2.23 0.17 0.00 -0.60 0.00 0.00 56.93 58.99 2eob s PHE 85 Cb -0.11 0.73 1.22 0.00 0.51 0.00 0.00 43.02 45.37 2eob s PHE 85 CO 0.18 -0.61 1.59 1.49 0.70 0.00 0.00 175.22 178.57 2eob h GLU 86 N 7.66 0.04 -3.10 0.44 4.22 -1.90 -2.92 114.58 119.02 2eob h GLU 86 Ca -0.22 -0.00 -0.07 0.00 0.08 0.00 0.00 59.36 59.15 2eob h GLU 86 Cb 1.15 -0.01 -0.15 0.00 0.50 0.00 0.00 28.75 30.23 2eob h GLU 86 CO 0.12 0.03 -0.07 -1.54 -2.18 0.00 0.00 179.01 175.37 2eob s SER 87 N -4.64 -0.30 0.37 1.04 1.04 -1.26 -4.55 113.70 105.40 2eob s SER 87 Ca -0.10 -0.07 0.17 0.00 0.48 0.00 0.00 55.95 56.44 2eob s SER 87 Cb 0.33 0.45 1.10 0.00 0.10 0.00 0.00 66.02 68.00 2eob s SER 87 CO 0.78 -0.73 1.70 -0.07 0.98 0.00 0.00 173.24 175.90 2eob h LEU 88 N 2.78 0.49 -0.41 2.42 3.38 -1.93 0.13 115.31 122.16 2eob h LEU 88 Ca -0.32 0.14 0.08 0.00 0.09 0.00 0.00 57.88 57.87 2eob h LEU 88 Cb 1.22 0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.98 2eob h LEU 88 CO 0.44 -0.02 -0.05 0.58 0.09 0.00 0.00 178.44 179.47 2eob h VAL 89 N 0.36 0.64 -0.35 1.22 2.07 -1.95 -1.92 116.25 116.32 2eob h VAL 89 Ca 0.69 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 68.18 2eob h VAL 89 Cb 1.67 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 2eob h VAL 89 CO -0.46 0.01 0.19 -0.33 0.02 0.00 0.00 177.57 177.00 2eob h GLU 90 N 0.05 0.50 -0.97 1.57 5.08 -1.13 -2.22 114.58 117.46 2eob h GLU 90 Ca 0.20 -0.06 0.22 0.00 -1.00 0.00 0.00 59.36 58.72 2eob h GLU 90 Cb 0.30 -0.10 -0.12 0.00 0.50 0.00 0.00 28.75 29.33 2eob h GLU 90 CO -0.38 0.42 0.54 1.25 -1.00 0.00 0.00 179.01 179.85 2eob h LEU 91 N 0.44 0.62 0.15 1.33 6.46 -1.02 -1.34 115.31 121.94 2eob h LEU 91 Ca 0.12 0.13 -0.01 0.00 -0.12 0.00 0.00 57.88 58.00 2eob h LEU 91 Cb 0.08 0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.04 2eob h LEU 91 CO -0.02 0.13 -0.07 0.58 -0.62 0.00 0.00 178.44 178.44 2eob h VAL 92 N 0.59 0.00 -0.83 1.05 2.07 -1.03 -2.91 116.25 115.19 2eob h VAL 92 Ca 0.60 -0.17 0.27 0.00 0.82 0.00 0.00 66.70 68.21 2eob h VAL 92 Cb 1.06 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.68 2eob h VAL 92 CO -0.46 0.00 0.17 -1.54 0.02 0.00 0.00 177.57 175.77 2eob n SER 93 N -3.04 0.04 0.29 0.57 3.41 -0.87 -0.30 113.62 113.73 2eob n SER 93 Ca -0.03 1.40 -0.11 0.00 -0.26 0.00 0.00 58.87 59.87 2eob n SER 93 Cb 0.08 -0.57 -0.05 0.00 -0.26 0.00 0.00 64.21 63.41 2eob n SER 93 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2eob h TYR 94 N 0.00 -0.69 -0.71 7.33 3.20 -1.31 -3.11 116.97 121.68 2eob h TYR 94 Ca 0.58 -0.02 0.14 0.00 3.14 0.00 0.00 58.73 62.57 2eob h TYR 94 Cb 1.34 0.23 -0.09 0.00 1.54 0.00 0.00 36.73 39.74 2eob h TYR 94 CO -0.27 -0.42 0.24 1.88 -1.64 0.00 0.00 178.16 177.94 2eob h TYR 95 N -0.73 0.39 -1.39 -3.82 0.05 -0.58 -0.57 116.97 110.32 2eob h TYR 95 Ca -0.07 0.04 0.43 0.00 0.05 0.00 0.00 58.73 59.17 2eob h TYR 95 Cb 0.56 -0.07 -0.08 0.00 1.01 0.00 0.00 36.73 38.15 2eob h TYR 95 CO 0.10 0.02 0.96 0.39 -1.05 0.00 0.00 178.16 178.58 2eob n GLU 96 N -5.06 -0.01 -0.11 4.88 -0.58 0.59 -0.47 120.64 119.88 2eob n GLU 96 Ca 0.13 0.92 -0.19 0.00 -0.42 0.00 0.00 57.16 57.60 2eob n GLU 96 Cb 0.40 -1.99 -0.07 0.00 -0.57 0.00 0.00 31.44 29.21 2eob n GLU 96 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2eob n LYS 97 N -3.84 0.55 -3.00 3.49 4.76 -0.25 -4.79 118.16 115.08 2eob n LYS 97 Ca 0.34 0.37 -0.40 0.00 -2.87 0.00 0.00 58.31 55.75 2eob n LYS 97 Cb 1.47 -1.57 -0.05 0.00 -1.84 0.00 0.00 35.03 33.04 2eob n LYS 97 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 2eob s HIS 98 N -2.53 3.66 -0.13 2.13 3.76 0.37 -4.98 115.29 117.58 2eob s HIS 98 Ca -0.30 1.39 -0.39 0.00 -0.15 0.00 0.00 55.06 55.61 2eob s HIS 98 Cb 0.08 -2.83 -0.16 0.00 1.11 0.00 0.00 32.58 30.78 2eob s HIS 98 CO 0.45 0.18 1.60 0.00 -0.85 0.00 0.00 174.74 176.12 2eob n ALA 99 N 3.30 -0.41 -0.09 -1.40 0.00 -1.26 -4.42 120.51 116.23 2eob n ALA 99 Ca -0.01 0.43 -0.18 0.00 0.00 0.00 0.00 53.44 53.68 2eob n ALA 99 Cb 0.51 -2.18 -0.12 0.00 0.00 0.00 0.00 19.45 17.65 2eob n ALA 99 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2eob h LEU 100 N 6.30 0.00 0.00 0.00 5.85 -1.67 -3.48 115.31 122.31 2eob h LEU 100 Ca -0.47 -0.76 -0.29 0.00 0.84 0.00 0.00 57.88 57.20 2eob h LEU 100 Cb 1.32 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.35 2eob h LEU 100 CO 0.89 1.24 -0.08 0.00 -0.34 0.00 0.00 178.44 180.15 2eob n TYR 101 N -4.53 -2.02 0.00 1.25 9.36 -0.36 -5.02 117.16 115.85 2eob n TYR 101 Ca -0.21 -1.21 0.00 0.00 3.32 0.00 0.00 57.90 59.80 2eob n TYR 101 Cb 0.58 -0.28 0.00 0.00 -0.63 0.00 0.00 39.34 39.00 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 -1.52 0.00 -2.99 2.98 3.00 -1.26 -3.61 116.66 113.25 2eob n ARG 102 Ca 0.05 0.66 -0.22 0.00 -0.01 0.00 0.00 57.85 58.33 2eob n ARG 102 Cb 0.34 -1.10 -0.03 0.00 0.00 0.00 0.00 32.46 31.67 2eob n ARG 102 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2eob n LYS 103 N -1.89 2.19 -3.60 5.56 4.76 -1.26 -5.06 118.16 118.86 2eob n LYS 103 Ca 0.00 -4.13 -0.03 0.00 -2.87 0.00 0.00 58.31 51.28 2eob n LYS 103 Cb 0.00 -1.96 -0.02 0.00 -1.84 0.00 0.00 35.03 31.22 2eob n LYS 103 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2eob s MET 104 N -3.03 0.51 0.33 1.97 0.23 -1.24 -5.07 119.30 113.00 2eob s MET 104 Ca 0.44 -0.23 -0.10 0.00 -1.03 0.00 0.00 55.69 54.76 2eob s MET 104 Cb 0.33 0.21 0.02 0.00 -1.53 0.00 0.00 34.83 33.86 2eob s MET 104 CO -0.11 -0.23 0.59 -0.98 -2.03 0.00 0.00 175.02 172.26 2eob s ARG 105 N -2.63 1.92 -1.00 3.16 1.70 -1.26 -1.22 118.95 119.61 2eob s ARG 105 Ca 0.10 -1.48 -0.23 0.00 -0.47 0.00 0.00 55.73 53.65 2eob s ARG 105 Cb 0.01 0.52 0.03 0.00 -0.57 0.00 0.00 34.95 34.93 2eob s ARG 105 CO -0.04 -0.84 1.57 -0.51 -1.08 0.00 0.00 175.30 174.40 2eob s LEU 106 N -3.11 3.43 -0.26 -1.89 1.43 -1.26 -4.50 118.68 112.53 2eob s LEU 106 Ca 0.22 -1.32 -0.12 0.00 -1.03 0.00 0.00 54.13 51.89 2eob s LEU 106 Cb -0.02 -2.57 -0.15 0.00 0.03 0.00 0.00 46.19 43.48 2eob s LEU 106 CO 0.14 -1.78 -0.20 -1.14 0.23 0.00 0.00 176.35 173.60 2eob n ARG 107 N 8.86 0.61 -3.87 1.70 0.63 -1.26 -4.34 116.66 118.98 2eob n ARG 107 Ca 0.35 0.30 -0.34 0.00 -0.92 0.00 0.00 57.85 57.23 2eob n ARG 107 Cb 0.50 -1.55 -0.13 0.00 0.45 0.00 0.00 32.46 31.73 2eob n ARG 107 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2eob s TYR 108 N -2.49 3.61 -0.68 -0.14 2.02 -1.26 -5.03 117.35 113.38 2eob s TYR 108 Ca -0.36 -2.56 -0.26 0.00 -0.37 0.00 0.00 57.07 53.52 2eob s TYR 108 Cb 0.12 -3.00 -0.03 0.00 -0.40 0.00 0.00 41.96 38.65 2eob s TYR 108 CO 0.54 -0.95 1.89 -1.25 -1.57 0.00 0.00 175.55 174.21 2eob s PRO 109 N 1.07 2.60 -0.33 -1.71 0.04 -1.26 -2.83 135.00 132.59 2eob s PRO 109 Ca 0.08 0.41 -0.34 0.00 0.04 0.00 0.00 61.00 61.18 2eob s PRO 109 Cb -0.21 -4.55 -0.15 0.00 0.04 0.00 0.00 34.50 29.63 2eob s PRO 109 CO -0.05 -2.89 1.15 0.28 0.04 0.00 0.00 177.00 175.52 2eob n VAL 110 N 7.37 0.00 -4.35 -0.36 0.31 -0.15 -4.78 118.33 116.38 2eob n VAL 110 Ca 0.25 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.37 2eob n VAL 110 Cb 0.51 -0.33 -0.11 0.00 -0.91 0.00 0.00 33.84 33.00 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 1.97 1.84 -1.40 2.52 -4.23 -1.26 -4.42 115.64 110.66 2eob s THR 111 Ca 0.77 -2.03 0.15 0.00 -1.18 0.00 0.00 61.69 59.39 2eob s THR 111 Cb -1.10 -1.93 0.25 0.00 1.34 0.00 0.00 72.50 71.06 2eob s THR 111 CO 0.59 -0.40 1.41 -0.81 -0.54 0.00 0.00 174.62 174.87 2eob n PRO 112 N 0.04 0.19 -0.08 3.99 -0.04 -1.26 -2.47 135.00 135.37 2eob n PRO 112 Ca -0.11 0.15 -0.11 0.00 -0.04 0.00 0.00 63.50 63.39 2eob n PRO 112 Cb 0.58 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.39 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 -1.30 0.67 -0.12 0.54 -0.58 -1.26 -4.38 120.64 114.21 2eob n GLU 113 Ca 0.07 0.10 -0.11 0.00 -0.42 0.00 0.00 57.16 56.80 2eob n GLU 113 Cb 0.12 -1.60 -0.03 0.00 -0.57 0.00 0.00 31.44 29.36 2eob n GLU 113 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2eob h LEU 114 N 0.00 0.68 -0.68 -4.62 5.85 -1.90 -1.50 115.31 113.15 2eob h LEU 114 Ca -0.48 -0.36 0.13 0.00 0.84 0.00 0.00 57.88 58.01 2eob h LEU 114 Cb 2.13 -0.19 -0.13 0.00 0.37 0.00 0.00 40.66 42.85 2eob h LEU 114 CO 0.03 0.89 -0.19 -0.07 -0.34 0.00 0.00 178.44 178.75 2eob h LEU 115 N 0.46 -0.71 0.30 2.25 3.38 -1.75 0.20 115.31 119.44 2eob h LEU 115 Ca 0.09 0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 2eob h LEU 115 Cb 0.59 0.45 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2eob h LEU 115 CO 0.03 -0.24 -0.15 -0.33 0.09 0.00 0.00 178.44 177.85 2eob h GLU 116 N -0.02 -0.39 -1.21 1.13 4.39 -1.75 0.54 114.58 117.25 2eob h GLU 116 Ca 0.32 0.03 0.43 0.00 0.34 0.00 0.00 59.36 60.48 2eob h GLU 116 Cb 0.51 0.09 -0.15 0.00 -0.10 0.00 0.00 28.75 29.11 2eob h GLU 116 CO -0.71 -0.17 0.74 -0.09 -1.16 0.00 0.00 179.01 177.62 2eob h ARG 117 N -1.06 0.06 0.06 2.33 2.43 -0.95 0.23 114.38 117.49 2eob h ARG 117 Ca -0.04 -0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 58.95 2eob h ARG 117 Cb 0.40 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 2eob h ARG 117 CO 0.07 0.04 -0.89 1.88 -1.51 0.00 0.00 179.97 179.56 2eob h TYR 118 N 0.07 0.24 -0.84 2.20 -1.99 -0.65 -3.35 116.97 112.64 2eob h TYR 118 Ca 0.84 -0.17 0.21 0.00 2.00 0.00 0.00 58.73 61.60 2eob h TYR 118 Cb 2.46 -0.01 -0.13 0.00 2.00 0.00 0.00 36.73 41.05 2eob h TYR 118 CO -0.01 1.35 0.25 1.03 -0.00 0.00 0.00 178.16 180.78 2eob h SER 119 N -0.66 0.08 -3.27 3.88 0.87 0.17 -3.42 113.55 111.20 2eob h SER 119 Ca -0.20 0.17 -0.46 0.00 -1.23 0.00 0.00 61.79 60.06 2eob h SER 119 Cb 1.43 0.22 0.22 0.00 -0.44 0.00 0.00 62.40 63.82 2eob h SER 119 CO -0.00 -0.08 -0.20 0.61 -0.53 0.00 0.00 176.83 176.62 2eob n GLY 120 N -1.36 -1.80 0.19 5.77 0.00 -0.14 -4.88 105.19 102.96 2eob n GLY 120 Ca 0.19 -0.99 0.14 0.00 0.00 0.00 0.00 46.02 45.36 2eob n GLY 120 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eob h PRO 121 N -2.36 0.00 -5.29 1.61 0.13 -1.89 -3.43 132.00 120.77 2eob h PRO 121 Ca -0.56 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.18 2eob h PRO 121 Cb 1.32 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.41 2eob h PRO 121 CO 0.45 0.00 1.50 0.45 -0.23 0.00 0.00 178.00 180.16 2eob n SER 122 N -2.56 1.10 -4.66 1.44 2.88 -1.26 -4.89 113.62 105.67 2eob n SER 122 Ca 0.01 -0.42 -0.29 0.00 -1.33 0.00 0.00 58.87 56.85 2eob n SER 122 Cb 0.25 -1.25 0.18 0.00 -0.75 0.00 0.00 64.21 62.65 2eob n SER 122 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2eob s SER 123 N 9.51 2.43 0.00 -3.46 1.04 -1.26 -4.88 113.70 117.07 2eob s SER 123 Ca 1.14 1.19 0.00 0.00 0.48 0.00 0.00 55.95 58.76 2eob s SER 123 Cb -0.62 -1.86 0.00 0.00 0.10 0.00 0.00 66.02 63.64 2eob s SER 123 CO 0.35 -3.25 0.00 0.61 0.98 0.00 0.00 173.24 171.93