#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eob h SER 2 N 0.00 0.00 -3.76 1.61 4.64 -2.14 -3.41 113.55 110.49 2eob h SER 2 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 2eob h SER 2 Cb 0.00 0.00 0.20 0.00 -0.31 0.00 0.00 62.40 62.29 2eob h SER 2 CO 0.00 0.00 -0.20 -1.54 -0.87 0.00 0.00 176.83 174.22 2eob n SER 3 N -3.40 -0.87 -0.13 4.97 3.41 -1.26 -5.03 113.62 111.32 2eob n SER 3 Ca 0.17 0.41 0.00 0.00 -0.26 0.00 0.00 58.87 59.19 2eob n SER 3 Cb 1.18 -1.33 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 2eob n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eob n GLY 4 N 1.00 4.66 3.79 5.00 0.00 -1.26 -5.19 105.19 113.18 2eob n GLY 4 Ca 0.09 -1.33 -0.08 0.00 0.00 0.00 0.00 46.02 44.70 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 0.90 -0.17 -0.13 1.61 0.01 -1.26 -5.16 113.70 109.50 2eob s SER 5 Ca 0.00 -0.76 -0.03 0.00 1.31 0.00 0.00 55.95 56.47 2eob s SER 5 Cb 0.00 0.71 -0.03 0.00 0.21 0.00 0.00 66.02 66.91 2eob s SER 5 CO 0.00 -1.34 -0.01 -0.94 0.41 0.00 0.00 173.24 171.35 2eob s SER 6 N -2.97 5.05 0.00 2.44 1.04 -1.26 -4.88 113.70 113.12 2eob s SER 6 Ca 0.14 -0.00 0.00 0.00 0.48 0.00 0.00 55.95 56.57 2eob s SER 6 Cb -0.05 -1.67 0.00 0.00 0.10 0.00 0.00 66.02 64.40 2eob s SER 6 CO 0.08 0.25 0.00 0.61 0.98 0.00 0.00 173.24 175.16 2eob n GLY 7 N 3.01 1.19 3.01 7.32 0.00 -1.26 -5.05 105.19 113.41 2eob n GLY 7 Ca -0.18 -0.72 -0.13 0.00 0.00 0.00 0.00 46.02 44.99 2eob n GLY 7 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2eob s ASP 8 N -4.00 0.66 0.70 1.61 1.47 -1.26 -5.15 116.67 110.69 2eob s ASP 8 Ca 0.00 -0.36 -0.14 0.00 1.18 0.00 0.00 52.55 53.24 2eob s ASP 8 Cb 0.00 0.00 0.02 0.00 -0.34 0.00 0.00 42.92 42.60 2eob s ASP 8 CO 0.00 -0.11 1.10 -2.16 0.68 0.00 0.00 175.17 174.68 2eob s PRO 9 N -0.98 2.62 0.59 2.11 0.04 -1.26 -4.99 135.00 133.13 2eob s PRO 9 Ca -0.06 1.32 -0.20 0.00 0.04 0.00 0.00 61.00 62.10 2eob s PRO 9 Cb -0.07 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.51 2eob s PRO 9 CO 0.00 -1.38 1.29 0.14 0.04 0.00 0.00 177.00 177.08 2eob s VAL 10 N -2.52 2.27 0.25 -0.36 -7.23 -1.26 -4.96 120.40 106.59 2eob s VAL 10 Ca 0.65 0.18 -0.30 0.00 -1.81 0.00 0.00 61.98 60.70 2eob s VAL 10 Cb -0.19 -3.08 -0.09 0.00 0.56 0.00 0.00 36.38 33.57 2eob s VAL 10 CO 0.46 -0.02 1.27 -2.16 -0.31 0.00 0.00 175.10 174.34 2eob s PRO 11 N -3.17 4.43 -0.18 4.82 0.04 -1.26 -5.03 135.00 134.65 2eob s PRO 11 Ca 0.76 2.05 -0.07 0.00 0.04 0.00 0.00 61.00 63.79 2eob s PRO 11 Cb -0.36 -3.16 -0.04 0.00 0.04 0.00 0.00 34.50 30.98 2eob s PRO 11 CO 0.40 -0.15 0.05 1.21 0.04 0.00 0.00 177.00 178.55 2eob s ASN 12 N -0.11 5.47 0.00 6.66 3.84 -1.26 -4.97 114.94 124.57 2eob s ASN 12 Ca 0.52 0.03 0.15 0.00 0.21 0.00 0.00 52.86 53.78 2eob s ASN 12 Cb -0.37 -1.93 0.84 0.00 -0.55 0.00 0.00 41.25 39.24 2eob s ASN 12 CO 0.43 0.16 1.37 -0.81 -2.79 0.00 0.00 177.10 175.46 2eob n PRO 13 N 3.63 0.35 -3.54 0.43 -0.04 -1.26 -4.32 135.00 130.25 2eob n PRO 13 Ca -0.17 0.07 -0.41 0.00 -0.04 0.00 0.00 63.50 62.95 2eob n PRO 13 Cb 0.52 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.42 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 -2.28 5.90 0.07 3.54 -0.87 -1.26 -4.92 114.94 115.13 2eob s ASN 14 Ca 0.19 -2.66 -0.18 0.00 -1.57 0.00 0.00 52.86 48.64 2eob s ASN 14 Cb 0.10 -2.02 -0.11 0.00 -0.02 0.00 0.00 41.25 39.20 2eob s ASN 14 CO 0.20 -0.50 1.38 1.55 -2.57 0.00 0.00 177.10 177.17 2eob h PRO 15 N 7.52 0.53 -0.88 -0.60 0.13 -2.02 -3.20 132.00 133.49 2eob h PRO 15 Ca 0.00 -0.28 0.19 0.00 -0.87 0.00 0.00 66.00 65.05 2eob h PRO 15 Cb 1.00 0.01 -0.11 0.00 0.13 0.00 0.00 31.00 32.03 2eob h PRO 15 CO 0.75 0.86 0.40 1.12 -0.23 0.00 0.00 178.00 180.91 2eob h HIS 16 N 0.21 0.69 -0.53 1.56 2.07 -1.96 0.48 115.15 117.68 2eob h HIS 16 Ca 0.03 0.04 0.15 0.00 -2.85 0.00 0.00 60.37 57.75 2eob h HIS 16 Cb 0.77 -0.17 -0.02 0.00 2.57 0.00 0.00 27.41 30.56 2eob h HIS 16 CO 0.08 0.03 0.44 0.93 -3.07 0.00 0.00 177.93 176.34 2eob h GLU 17 N 0.47 0.00 0.18 5.12 5.08 -1.95 -0.82 114.58 122.67 2eob h GLU 17 Ca 0.52 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.55 2eob h GLU 17 Cb 0.92 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.17 2eob h GLU 17 CO -0.47 0.00 -1.66 0.77 -1.00 0.00 0.00 179.01 176.65 2eob h SER 18 N 0.00 0.59 -1.27 1.42 0.02 -0.18 -3.47 113.55 110.65 2eob h SER 18 Ca 0.25 -0.92 -0.49 0.00 -0.84 0.00 0.00 61.79 59.79 2eob h SER 18 Cb 1.13 -0.19 0.12 0.00 0.14 0.00 0.00 62.40 63.60 2eob h SER 18 CO -0.00 1.75 -0.72 0.29 -1.14 0.00 0.00 176.83 177.01 2eob n LYS 19 N -3.67 0.00 0.02 3.45 4.76 -0.31 -4.84 118.16 117.56 2eob n LYS 19 Ca -0.24 0.00 -0.06 0.00 -2.87 0.00 0.00 58.31 55.13 2eob n LYS 19 Cb 1.04 -0.78 0.12 0.00 -1.84 0.00 0.00 35.03 33.57 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 0.29 0.48 0.00 1.97 0.13 -1.92 -2.69 132.00 130.26 2eob h PRO 20 Ca -0.28 -0.25 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 2eob h PRO 20 Cb 1.13 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2eob h PRO 20 CO 0.37 0.83 0.00 -2.67 -0.23 0.00 0.00 178.00 176.30 2eob n TRP 21 N -4.01 0.00 -3.38 1.56 4.27 -1.25 -4.31 117.44 110.33 2eob n TRP 21 Ca -0.02 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.16 2eob n TRP 21 Cb 0.53 0.00 -0.09 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 -2.00 3.20 -0.11 -2.67 6.14 -1.01 -3.03 117.35 117.86 2eob s TYR 22 Ca 0.12 -0.45 -0.04 0.00 0.64 0.00 0.00 57.07 57.34 2eob s TYR 22 Cb 0.05 -2.77 -0.04 0.00 0.42 0.00 0.00 41.96 39.63 2eob s TYR 22 CO 0.09 -0.65 0.04 0.71 0.64 0.00 0.00 175.55 176.38 2eob s TYR 23 N 1.96 3.28 -0.05 4.97 2.02 -0.74 -4.92 117.35 123.87 2eob s TYR 23 Ca 0.09 0.24 0.01 0.00 -0.37 0.00 0.00 57.07 57.04 2eob s TYR 23 Cb -0.18 -1.87 -0.03 0.00 -0.40 0.00 0.00 41.96 39.47 2eob s TYR 23 CO 0.12 0.47 -0.04 -3.47 -1.57 0.00 0.00 175.55 171.07 2eob n ASP 24 N 2.36 3.67 -2.15 2.29 2.03 -1.26 -2.73 116.55 120.75 2eob n ASP 24 Ca -0.19 -0.02 -0.28 0.00 0.52 0.00 0.00 54.79 54.82 2eob n ASP 24 Cb 0.54 0.00 0.11 0.00 -0.72 0.00 0.00 41.12 41.05 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 -2.59 2.57 -4.19 -0.67 1.85 -1.26 -4.68 116.66 107.69 2eob n ARG 25 Ca -0.08 -3.29 -0.30 0.00 -1.00 0.00 0.00 57.85 53.18 2eob n ARG 25 Cb 0.60 -2.21 -0.09 0.00 -1.05 0.00 0.00 32.46 29.71 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 3.18 0.06 2.89 2.96 -1.26 -5.13 118.68 117.78 2eob s LEU 26 Ca 0.59 -0.33 0.05 0.00 -0.22 0.00 0.00 54.13 54.23 2eob s LEU 26 Cb 0.48 -1.95 -0.03 0.00 0.50 0.00 0.00 46.19 45.19 2eob s LEU 26 CO 0.03 0.17 -0.14 -0.55 -1.32 0.00 0.00 176.35 174.54 2eob s SER 27 N -2.30 1.70 0.58 3.68 0.15 -1.26 -4.77 113.70 111.48 2eob s SER 27 Ca 0.23 -0.57 0.35 0.00 0.70 0.00 0.00 55.95 56.66 2eob s SER 27 Cb -0.11 -0.07 1.40 0.00 -1.71 0.00 0.00 66.02 65.53 2eob s SER 27 CO 0.15 -0.04 1.65 0.08 1.20 0.00 0.00 173.24 176.29 2eob h ARG 28 N 4.49 0.00 -0.80 5.44 0.11 -1.97 0.45 114.38 122.10 2eob h ARG 28 Ca -0.40 0.00 0.09 0.00 0.10 0.00 0.00 59.98 59.76 2eob h ARG 28 Cb 1.19 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 32.21 2eob h ARG 28 CO 0.41 0.00 0.52 0.78 0.10 0.00 0.00 179.97 181.79 2eob h GLY 29 N 0.00 1.08 0.00 0.08 0.00 -2.01 -3.00 103.07 99.22 2eob h GLY 29 Ca 0.53 -0.32 -0.35 0.00 0.00 0.00 0.00 47.33 47.19 2eob h GLY 29 CO -0.01 0.20 -2.21 1.18 0.00 0.00 0.00 176.54 175.70 2eob n GLU 30 N -4.50 0.49 -0.14 4.80 -0.58 0.14 -4.46 120.64 116.39 2eob n GLU 30 Ca 0.13 0.17 -0.04 0.00 -0.42 0.00 0.00 57.16 57.01 2eob n GLU 30 Cb 0.29 -1.33 -0.03 0.00 -0.57 0.00 0.00 31.44 29.79 2eob n GLU 30 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2eob n ALA 31 N -3.66 -0.21 -0.30 0.62 0.00 -0.19 0.25 120.51 117.02 2eob n ALA 31 Ca -0.41 0.28 0.14 0.00 0.00 0.00 0.00 53.44 53.44 2eob n ALA 31 Cb 0.84 0.26 0.30 0.00 0.00 0.00 0.00 19.45 20.84 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 0.16 0.40 0.00 5.08 -1.78 -0.85 114.58 117.60 2eob h GLU 32 Ca 0.05 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 2eob h GLU 32 Cb 0.13 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 2eob h GLU 32 CO -0.30 0.11 -0.52 0.22 -1.00 0.00 0.00 179.01 177.52 2eob h ASP 33 N 0.17 -1.46 -0.83 1.42 1.82 -0.42 -2.76 116.42 114.36 2eob h ASP 33 Ca 0.57 0.13 0.08 0.00 -0.39 0.00 0.00 57.03 57.42 2eob h ASP 33 Cb 1.17 0.50 -0.10 0.00 0.68 0.00 0.00 39.33 41.57 2eob h ASP 33 CO -0.70 -0.65 -0.46 0.23 -1.61 0.00 0.00 179.24 176.06 2eob n MET 34 N -5.55 -0.34 -0.21 0.28 2.81 -0.34 0.67 117.12 114.45 2eob n MET 34 Ca -0.11 1.25 -0.00 0.00 -1.81 0.00 0.00 57.70 57.03 2eob n MET 34 Cb 0.45 -1.85 0.07 0.00 -0.71 0.00 0.00 33.22 31.19 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 -0.53 -1.98 4.03 -0.00 -1.40 0.59 115.31 116.02 2eob h LEU 35 Ca 0.16 0.18 0.16 0.00 -0.00 0.00 0.00 57.88 58.38 2eob h LEU 35 Cb 0.36 0.37 -0.02 0.00 -0.00 0.00 0.00 40.66 41.37 2eob h LEU 35 CO -0.79 -0.19 0.41 0.24 -0.00 0.00 0.00 178.44 178.11 2eob h MET 36 N 0.02 0.02 0.17 1.13 2.86 0.51 -0.80 114.93 118.84 2eob h MET 36 Ca 0.31 -0.00 -0.30 0.00 -2.06 0.00 0.00 59.70 57.65 2eob h MET 36 Cb 0.48 -0.00 0.03 0.00 0.06 0.00 0.00 31.60 32.17 2eob h MET 36 CO -0.63 0.01 -1.27 0.00 1.06 0.00 0.00 176.91 176.08 2eob h ARG 37 N 0.02 0.56 -6.07 1.72 -0.00 0.93 -3.44 114.38 108.10 2eob h ARG 37 Ca 0.27 -0.83 -0.58 0.00 -0.50 0.00 0.00 59.98 58.34 2eob h ARG 37 Cb 1.07 0.29 -0.01 0.00 0.00 0.00 0.00 29.97 31.32 2eob h ARG 37 CO -0.01 1.39 1.43 0.42 0.00 0.00 0.00 179.97 183.20 2eob s ILE 38 N -2.78 3.12 -2.00 2.04 -1.09 -0.26 -4.82 121.20 115.41 2eob s ILE 38 Ca -0.10 0.13 0.10 0.00 -2.23 0.00 0.00 60.65 58.55 2eob s ILE 38 Cb 0.04 -3.16 0.28 0.00 -1.58 0.00 0.00 42.46 38.04 2eob s ILE 38 CO 0.93 -0.10 1.03 -0.81 -1.23 0.00 0.00 174.94 174.76 2eob n PRO 39 N 8.63 0.49 -3.48 2.79 -0.04 -1.26 -4.59 135.00 137.53 2eob n PRO 39 Ca 0.28 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.32 2eob n PRO 39 Cb 0.45 -1.32 -0.10 0.00 -0.04 0.00 0.00 33.50 32.49 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 3.19 0.24 0.54 1.81 -1.26 -5.06 118.95 116.41 2eob s ARG 40 Ca 0.15 -0.85 -0.30 0.00 -1.72 0.00 0.00 55.73 53.01 2eob s ARG 40 Cb 0.07 -3.91 -0.09 0.00 -0.45 0.00 0.00 34.95 30.57 2eob s ARG 40 CO 0.12 -0.63 1.31 0.16 -0.68 0.00 0.00 175.30 175.57 2eob s ASP 41 N 1.70 6.88 0.00 0.23 -4.77 -1.26 -3.01 116.67 116.44 2eob s ASP 41 Ca 0.06 2.48 0.00 0.00 -3.30 0.00 0.00 52.55 51.78 2eob s ASP 41 Cb -0.18 -2.62 0.00 0.00 -1.09 0.00 0.00 42.92 39.03 2eob s ASP 41 CO 0.10 -0.52 0.00 0.61 0.70 0.00 0.00 175.17 176.07 2eob n GLY 42 N 1.93 2.21 3.21 2.12 0.00 -1.23 -4.87 105.19 108.55 2eob n GLY 42 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.43 -4.05 -3.54 4.61 0.00 -1.16 -4.07 120.51 110.87 2eob n ALA 43 Ca 0.00 -0.63 -0.09 0.00 0.00 0.00 0.00 53.44 52.72 2eob n ALA 43 Cb 0.00 -1.46 -0.03 0.00 0.00 0.00 0.00 19.45 17.96 2eob n ALA 43 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2eob s PHE 44 N -2.18 -0.17 -0.28 0.00 -0.71 -1.12 -0.97 117.98 112.56 2eob s PHE 44 Ca 0.49 -0.21 -0.17 0.00 -1.04 0.00 0.00 56.93 56.01 2eob s PHE 44 Cb -0.20 0.53 0.08 0.00 -1.21 0.00 0.00 43.02 42.22 2eob s PHE 44 CO 0.75 -1.05 0.68 -0.48 -1.34 0.00 0.00 175.22 173.78 2eob s LEU 45 N -2.89 -0.91 -0.26 -1.99 0.05 0.11 0.13 118.68 112.92 2eob s LEU 45 Ca 0.10 1.50 -0.12 0.00 0.05 0.00 0.00 54.13 55.66 2eob s LEU 45 Cb -0.03 2.37 -0.05 0.00 -2.05 0.00 0.00 46.19 46.43 2eob s LEU 45 CO 0.01 -0.24 0.24 -0.63 -0.55 0.00 0.00 176.35 175.17 2eob s ILE 46 N 1.53 5.29 0.05 1.48 1.01 -1.17 -0.88 121.20 128.51 2eob s ILE 46 Ca -0.09 0.29 0.06 0.00 0.00 0.00 0.00 60.65 60.91 2eob s ILE 46 Cb -0.05 -3.57 -0.02 0.00 0.01 0.00 0.00 42.46 38.82 2eob s ILE 46 CO -0.18 0.25 -0.17 0.00 0.00 0.00 0.00 174.94 174.84 2eob s ARG 47 N 1.63 1.12 0.03 2.79 1.70 -1.13 -1.79 118.95 123.30 2eob s ARG 47 Ca 0.10 -0.88 -0.30 0.00 -0.47 0.00 0.00 55.73 54.17 2eob s ARG 47 Cb -0.15 -1.20 -0.05 0.00 -0.57 0.00 0.00 34.95 32.98 2eob s ARG 47 CO 0.09 0.30 1.28 0.21 -1.08 0.00 0.00 175.30 176.10 2eob s LYS 48 N -1.27 4.36 -1.02 3.89 2.20 -1.10 -3.43 119.74 123.37 2eob s LYS 48 Ca 0.04 1.85 -0.23 0.00 -0.36 0.00 0.00 55.97 57.27 2eob s LYS 48 Cb -0.09 -3.44 0.05 0.00 -1.51 0.00 0.00 37.83 32.85 2eob s LYS 48 CO 0.02 -0.41 1.44 0.50 -0.36 0.00 0.00 175.35 176.54 2eob s ARG 49 N 1.67 3.59 0.30 4.03 3.52 -1.25 -4.91 118.95 125.90 2eob s ARG 49 Ca 0.60 -1.12 -0.17 0.00 -0.13 0.00 0.00 55.73 54.91 2eob s ARG 49 Cb -0.30 -5.35 -0.12 0.00 -1.56 0.00 0.00 34.95 27.62 2eob s ARG 49 CO 0.27 -2.20 0.09 -0.85 -0.81 0.00 0.00 175.30 171.79 2eob n GLU 50 N 8.86 0.00 0.00 5.12 0.28 -1.26 -3.33 120.64 130.31 2eob n GLU 50 Ca 0.33 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.33 2eob n GLU 50 Cb 0.51 -0.77 0.00 0.00 1.43 0.00 0.00 31.44 32.61 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 1.78 1.31 3.78 -1.84 0.00 -1.26 -4.94 105.19 104.01 2eob n GLY 51 Ca 0.09 -0.40 -0.31 0.00 0.00 0.00 0.00 46.02 45.39 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 3.49 0.15 2.61 -4.23 -1.21 -4.96 115.64 111.50 2eob s THR 52 Ca 0.00 0.54 0.13 0.00 -1.18 0.00 0.00 61.69 61.18 2eob s THR 52 Cb 0.00 -3.08 -0.00 0.00 1.34 0.00 0.00 72.50 70.75 2eob s THR 52 CO 0.00 -0.58 1.56 -0.78 -0.54 0.00 0.00 174.62 174.28 2eob h ASP 53 N -0.72 0.00 -3.37 3.99 1.82 -1.92 -3.43 116.42 112.79 2eob h ASP 53 Ca -0.44 0.00 -0.57 0.00 -0.39 0.00 0.00 57.03 55.62 2eob h ASP 53 Cb 1.23 0.00 0.14 0.00 0.68 0.00 0.00 39.33 41.38 2eob h ASP 53 CO 0.53 0.61 0.22 -0.24 -1.61 0.00 0.00 179.24 178.75 2eob n SER 54 N -3.55 1.34 -4.69 2.28 2.88 -1.26 -4.87 113.62 105.75 2eob n SER 54 Ca -0.00 0.96 -0.23 0.00 -1.33 0.00 0.00 58.87 58.27 2eob n SER 54 Cb 0.67 -1.40 -0.07 0.00 -0.75 0.00 0.00 64.21 62.66 2eob n SER 54 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2eob s TYR 55 N -1.35 2.82 -0.01 0.66 1.51 -1.20 -3.88 117.35 115.90 2eob s TYR 55 Ca 0.67 -0.18 0.03 0.00 -1.01 0.00 0.00 57.07 56.58 2eob s TYR 55 Cb -0.49 -1.28 -0.00 0.00 -0.11 0.00 0.00 41.96 40.08 2eob s TYR 55 CO 0.53 0.58 -0.09 0.00 -1.11 0.00 0.00 175.55 175.46 2eob s ALA 56 N -2.17 0.76 -0.10 3.71 0.00 -1.22 -0.41 121.76 122.33 2eob s ALA 56 Ca 0.31 -0.37 0.00 0.00 0.00 0.00 0.00 51.96 51.90 2eob s ALA 56 Cb -0.07 -0.21 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 2eob s ALA 56 CO 0.21 0.17 -0.10 -1.50 0.00 0.00 0.00 175.76 174.54 2eob s ILE 57 N -0.14 3.34 0.08 0.00 2.07 -1.15 -2.83 121.20 122.57 2eob s ILE 57 Ca 0.02 -0.59 0.02 0.00 -1.41 0.00 0.00 60.65 58.70 2eob s ILE 57 Cb -0.04 -2.38 -0.04 0.00 0.13 0.00 0.00 42.46 40.12 2eob s ILE 57 CO -0.00 0.55 0.11 -0.89 -1.91 0.00 0.00 174.94 172.80 2eob s THR 58 N -0.18 4.73 0.18 4.00 2.01 -0.06 -2.19 115.64 124.12 2eob s THR 58 Ca 0.01 -0.68 -0.11 0.00 0.31 0.00 0.00 61.69 61.22 2eob s THR 58 Cb -0.13 -3.29 -0.00 0.00 0.01 0.00 0.00 72.50 69.09 2eob s THR 58 CO 0.03 0.12 0.34 0.72 -0.69 0.00 0.00 174.62 175.15 2eob s PHE 59 N -1.42 0.29 -0.27 4.92 -0.71 -1.11 -0.71 117.98 118.97 2eob s PHE 59 Ca 0.31 -0.65 -0.11 0.00 -1.04 0.00 0.00 56.93 55.44 2eob s PHE 59 Cb -0.12 0.05 -0.05 0.00 -1.21 0.00 0.00 43.02 41.69 2eob s PHE 59 CO 0.23 -0.78 0.17 0.50 -1.34 0.00 0.00 175.22 174.01 2eob s ARG 60 N -3.95 3.93 -0.85 1.99 3.52 -0.14 -2.45 118.95 121.00 2eob s ARG 60 Ca 0.16 -0.33 -0.06 0.00 -0.13 0.00 0.00 55.73 55.37 2eob s ARG 60 Cb 0.02 -3.61 0.21 0.00 -1.56 0.00 0.00 34.95 30.02 2eob s ARG 60 CO 0.00 -0.15 0.75 0.00 -0.81 0.00 0.00 175.30 175.09 2eob s ALA 61 N 1.65 4.13 -1.61 6.12 0.00 0.36 -3.54 121.76 128.87 2eob s ALA 61 Ca 0.07 -3.58 -0.15 0.00 0.00 0.00 0.00 51.96 48.29 2eob s ALA 61 Cb -0.16 -3.06 0.12 0.00 0.00 0.00 0.00 23.12 20.02 2eob s ALA 61 CO 0.09 -2.18 0.85 -2.13 0.00 0.00 0.00 175.76 172.39 2eob n ARG 62 N 3.05 -4.18 0.00 0.00 0.00 -1.26 -2.47 116.66 111.79 2eob n ARG 62 Ca 0.17 0.47 0.00 0.00 -0.00 0.00 0.00 57.85 58.49 2eob n ARG 62 Cb 0.40 -5.23 0.00 0.00 0.00 0.00 0.00 32.46 27.63 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 -1.56 2.63 3.42 5.14 0.00 -1.26 -5.08 105.19 108.48 2eob n GLY 63 Ca 0.03 -0.81 -0.30 0.00 0.00 0.00 0.00 46.02 44.94 2eob n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eob s LYS 64 N 0.00 -2.22 0.01 1.61 -2.85 -1.03 -4.62 119.74 110.64 2eob s LYS 64 Ca 0.00 0.11 0.03 0.00 -1.00 0.00 0.00 55.97 55.11 2eob s LYS 64 Cb 0.00 -1.46 -0.01 0.00 -2.06 0.00 0.00 37.83 34.29 2eob s LYS 64 CO 0.00 -4.40 -0.10 0.08 0.10 0.00 0.00 175.35 171.03 2eob s VAL 65 N -2.55 0.77 0.38 1.79 1.01 -1.26 -0.48 120.40 120.06 2eob s VAL 65 Ca 0.69 -0.58 0.04 0.00 0.00 0.00 0.00 61.98 62.13 2eob s VAL 65 Cb -0.13 -0.67 -0.03 0.00 0.00 0.00 0.00 36.38 35.55 2eob s VAL 65 CO 0.58 0.10 0.13 -0.54 0.00 0.00 0.00 175.10 175.36 2eob s LYS 66 N -0.54 1.85 0.05 2.72 -0.14 -1.02 -4.95 119.74 117.71 2eob s LYS 66 Ca 0.02 -2.11 -0.05 0.00 -1.36 0.00 0.00 55.97 52.47 2eob s LYS 66 Cb -0.05 -0.55 -0.02 0.00 -1.68 0.00 0.00 37.83 35.53 2eob s LYS 66 CO 0.00 -0.45 0.08 -1.01 -0.76 0.00 0.00 175.35 173.21 2eob s HIS 67 N -3.28 0.29 0.16 3.18 3.76 -1.26 -2.74 115.29 115.40 2eob s HIS 67 Ca 0.27 -0.70 0.02 0.00 -0.15 0.00 0.00 55.06 54.50 2eob s HIS 67 Cb 0.04 -0.20 -0.04 0.00 1.11 0.00 0.00 32.58 33.48 2eob s HIS 67 CO 0.15 -0.41 -0.00 0.00 -0.85 0.00 0.00 174.74 173.63 2eob s ARG 69 N -3.92 3.41 0.02 0.00 6.06 -1.26 -2.95 118.95 120.31 2eob s ARG 69 Ca 0.22 -0.16 0.07 0.00 -2.50 0.00 0.00 55.73 53.37 2eob s ARG 69 Cb 0.06 -3.16 -0.02 0.00 0.06 0.00 0.00 34.95 31.89 2eob s ARG 69 CO 0.03 0.77 -0.22 0.42 -2.50 0.00 0.00 175.30 173.80 2eob s ILE 70 N -1.04 1.72 0.53 4.11 1.01 0.45 -4.72 121.20 123.27 2eob s ILE 70 Ca 0.15 -1.11 0.07 0.00 0.00 0.00 0.00 60.65 59.76 2eob s ILE 70 Cb -0.12 -1.47 0.07 0.00 0.01 0.00 0.00 42.46 40.95 2eob s ILE 70 CO 0.05 0.32 0.58 0.59 0.00 0.00 0.00 174.94 176.48 2eob n ASN 71 N 2.10 2.27 -3.42 3.58 4.13 0.12 -3.24 115.26 120.80 2eob n ASN 71 Ca -0.16 -2.58 -0.14 0.00 1.68 0.00 0.00 54.58 53.37 2eob n ASN 71 Cb 0.53 -0.23 -0.10 0.00 -1.54 0.00 0.00 39.78 38.43 2eob n ASN 71 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 2eob s ARG 72 N -4.29 0.27 -0.08 3.52 6.06 -1.26 -2.39 118.95 120.77 2eob s ARG 72 Ca 0.44 0.34 -0.00 0.00 -2.50 0.00 0.00 55.73 54.01 2eob s ARG 72 Cb -0.03 -0.85 0.06 0.00 0.06 0.00 0.00 34.95 34.18 2eob s ARG 72 CO 0.28 -0.67 1.93 -3.47 -2.50 0.00 0.00 175.30 170.87 2eob n ASP 73 N 5.34 5.43 0.00 -2.12 2.03 0.40 -4.88 116.55 122.74 2eob n ASP 73 Ca -0.04 -2.55 0.00 0.00 0.52 0.00 0.00 54.79 52.72 2eob n ASP 73 Cb 0.50 -1.06 0.00 0.00 -0.72 0.00 0.00 41.12 39.83 2eob n ASP 73 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2eob n GLY 74 N 1.13 0.32 0.15 0.27 0.00 -1.26 -3.05 105.19 102.75 2eob n GLY 74 Ca 0.08 0.28 -0.10 0.00 0.00 0.00 0.00 46.02 46.27 2eob n GLY 74 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2eob h ARG 75 N 0.00 0.32 -5.04 1.61 2.43 -1.98 -3.47 114.38 108.26 2eob h ARG 75 Ca 0.00 -0.32 -0.54 0.00 -0.81 0.00 0.00 59.98 58.31 2eob h ARG 75 Cb 0.00 0.09 -0.13 0.00 -0.42 0.00 0.00 29.97 29.50 2eob h ARG 75 CO 0.00 1.00 -0.52 -1.01 -1.51 0.00 0.00 179.97 177.93 2eob s HIS 76 N -3.34 1.78 -0.06 2.20 3.76 -1.17 -4.89 115.29 113.57 2eob s HIS 76 Ca -0.05 -1.28 0.02 0.00 -0.15 0.00 0.00 55.06 53.60 2eob s HIS 76 Cb 0.10 -1.13 -0.03 0.00 1.11 0.00 0.00 32.58 32.63 2eob s HIS 76 CO 0.84 -0.31 -0.10 -0.06 -0.85 0.00 0.00 174.74 174.26 2eob s PHE 77 N -3.26 2.83 -0.33 1.40 0.40 -1.19 0.15 117.98 117.98 2eob s PHE 77 Ca 0.26 -0.08 -0.03 0.00 -0.60 0.00 0.00 56.93 56.49 2eob s PHE 77 Cb 0.03 -1.68 0.06 0.00 0.51 0.00 0.00 43.02 41.94 2eob s PHE 77 CO 0.15 0.25 0.05 0.08 0.70 0.00 0.00 175.22 176.46 2eob s VAL 78 N -0.74 3.20 0.03 -0.44 1.01 -1.01 -3.36 120.40 119.10 2eob s VAL 78 Ca 0.11 -1.44 -0.18 0.00 0.00 0.00 0.00 61.98 60.47 2eob s VAL 78 Cb -0.11 -2.89 -0.10 0.00 0.00 0.00 0.00 36.38 33.28 2eob s VAL 78 CO 0.01 -0.22 1.27 0.25 0.00 0.00 0.00 175.10 176.42 2eob h LEU 79 N 8.05 -0.58 0.00 3.92 7.12 -1.83 0.35 115.31 132.35 2eob h LEU 79 Ca -0.20 0.03 0.00 0.00 0.13 0.00 0.00 57.88 57.83 2eob h LEU 79 Cb 1.06 0.16 0.00 0.00 -0.53 0.00 0.00 40.66 41.35 2eob h LEU 79 CO 0.57 -0.38 0.00 0.61 -0.13 0.00 0.00 178.44 179.11 2eob n GLY 80 N -1.31 0.50 2.98 3.75 0.00 -1.26 -4.13 105.19 105.72 2eob n GLY 80 Ca -0.08 -0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.67 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 0.01 1.20 -0.97 2.61 2.01 -1.26 -4.76 115.64 114.47 2eob s THR 81 Ca 0.00 -0.44 -0.05 0.00 0.31 0.00 0.00 61.69 61.51 2eob s THR 81 Cb 0.00 -1.14 0.01 0.00 0.01 0.00 0.00 72.50 71.37 2eob s THR 81 CO 0.00 0.39 0.84 -0.24 -0.69 0.00 0.00 174.62 174.92 2eob n SER 82 N 4.47 -4.66 -4.16 3.53 2.88 -1.26 -5.01 113.62 109.41 2eob n SER 82 Ca -0.17 -0.40 -0.33 0.00 -1.33 0.00 0.00 58.87 56.63 2eob n SER 82 Cb 0.51 -3.82 -0.16 0.00 -0.75 0.00 0.00 64.21 59.99 2eob n SER 82 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2eob s ALA 83 N -3.24 2.36 -0.06 -1.46 0.00 -1.26 -5.07 121.76 113.03 2eob s ALA 83 Ca 0.36 -1.18 0.02 0.00 0.00 0.00 0.00 51.96 51.15 2eob s ALA 83 Cb -0.16 -1.19 0.02 0.00 0.00 0.00 0.00 23.12 21.79 2eob s ALA 83 CO 0.53 -0.27 -0.09 0.71 0.00 0.00 0.00 175.76 176.64 2eob s TYR 84 N 1.17 1.20 -0.20 0.00 1.51 -1.26 -4.04 117.35 115.74 2eob s TYR 84 Ca 0.02 -0.43 -0.05 0.00 -1.01 0.00 0.00 57.07 55.60 2eob s TYR 84 Cb -0.14 -0.93 0.10 0.00 -0.11 0.00 0.00 41.96 40.88 2eob s TYR 84 CO -0.09 -0.26 0.35 -0.06 -1.11 0.00 0.00 175.55 174.38 2eob s PHE 85 N 0.81 -0.66 0.31 2.71 0.08 -1.21 -4.92 117.98 115.09 2eob s PHE 85 Ca -0.12 1.03 0.05 0.00 0.12 0.00 0.00 56.93 58.00 2eob s PHE 85 Cb -0.15 0.06 0.82 0.00 -0.57 0.00 0.00 43.02 43.18 2eob s PHE 85 CO 0.02 -0.54 1.51 -1.91 -0.10 0.00 0.00 175.22 174.20 2eob n GLU 86 N 5.37 -0.07 -3.82 0.44 2.13 -1.26 -3.19 120.64 120.23 2eob n GLU 86 Ca -0.06 1.43 -0.12 0.00 0.66 0.00 0.00 57.16 59.06 2eob n GLU 86 Cb 0.50 -2.31 -0.12 0.00 0.27 0.00 0.00 31.44 29.78 2eob n GLU 86 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 2eob s SER 87 N -4.94 -0.16 0.37 4.31 1.04 -1.26 -4.69 113.70 108.38 2eob s SER 87 Ca -0.12 0.28 0.30 0.00 0.48 0.00 0.00 55.95 56.89 2eob s SER 87 Cb 0.29 0.34 1.23 0.00 0.10 0.00 0.00 66.02 67.98 2eob s SER 87 CO 0.75 -0.10 1.23 0.18 0.98 0.00 0.00 173.24 176.29 2eob n LEU 88 N 2.79 0.12 -0.10 2.42 4.77 -1.26 -0.45 117.00 125.30 2eob n LEU 88 Ca -0.14 1.01 -0.09 0.00 -0.03 0.00 0.00 56.01 56.77 2eob n LEU 88 Cb 0.58 -0.50 -0.07 0.00 -2.33 0.00 0.00 43.42 41.11 2eob n LEU 88 CO 0.21 -1.08 0.50 0.58 -1.33 0.00 0.00 177.39 176.26 2eob h VAL 89 N 0.00 0.00 0.01 4.08 2.07 -1.95 0.16 116.25 120.62 2eob h VAL 89 Ca 0.71 0.00 0.03 0.00 0.82 0.00 0.00 66.70 68.26 2eob h VAL 89 Cb 2.45 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 32.19 2eob h VAL 89 CO -0.27 0.00 -0.18 -0.33 0.02 0.00 0.00 177.57 176.81 2eob h GLU 90 N -0.26 -0.28 -0.73 1.57 5.08 -1.14 -0.76 114.58 118.06 2eob h GLU 90 Ca 0.05 0.02 0.15 0.00 -1.00 0.00 0.00 59.36 58.58 2eob h GLU 90 Cb 0.39 0.06 -0.13 0.00 0.50 0.00 0.00 28.75 29.57 2eob h GLU 90 CO -0.40 -0.19 -0.12 1.25 -1.00 0.00 0.00 179.01 178.55 2eob h LEU 91 N -0.29 -0.56 0.49 1.33 6.46 -1.38 0.69 115.31 122.05 2eob h LEU 91 Ca 0.05 0.21 -0.02 0.00 -0.12 0.00 0.00 57.88 58.00 2eob h LEU 91 Cb 0.36 0.41 0.00 0.00 -0.73 0.00 0.00 40.66 40.71 2eob h LEU 91 CO -0.16 -0.22 -0.24 0.58 -0.62 0.00 0.00 178.44 177.78 2eob h VAL 92 N 0.03 0.47 0.00 1.05 2.07 -0.23 -2.32 116.25 117.33 2eob h VAL 92 Ca 0.37 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.60 2eob h VAL 92 Cb 0.60 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 2eob h VAL 92 CO -0.72 0.05 0.00 -1.20 0.02 0.00 0.00 177.57 175.72 2eob n SER 93 N -5.30 0.00 0.01 0.57 7.64 -0.33 -1.33 113.62 114.88 2eob n SER 93 Ca -0.11 0.17 -0.02 0.00 1.01 0.00 0.00 58.87 59.91 2eob n SER 93 Cb 0.31 -0.28 -0.10 0.00 -1.01 0.00 0.00 64.21 63.13 2eob n SER 93 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2eob n TYR 94 N -1.28 0.95 -0.03 1.43 4.19 0.23 -4.33 117.16 118.32 2eob n TYR 94 Ca 0.04 0.32 -0.21 0.00 3.31 0.00 0.00 57.90 61.35 2eob n TYR 94 Cb 0.06 -1.10 -0.13 0.00 0.49 0.00 0.00 39.34 38.65 2eob n TYR 94 CO 0.00 0.00 0.00 1.88 0.91 0.00 0.00 176.86 179.65 2eob h TYR 95 N 0.00 0.31 -0.98 2.98 0.05 -0.88 -3.26 116.97 115.19 2eob h TYR 95 Ca -0.20 -0.23 0.33 0.00 0.05 0.00 0.00 58.73 58.68 2eob h TYR 95 Cb 1.70 -0.01 -0.09 0.00 1.01 0.00 0.00 36.73 39.34 2eob h TYR 95 CO 0.00 1.60 0.64 -0.85 -1.05 0.00 0.00 178.16 178.51 2eob n GLU 96 N -3.95 -0.02 -0.05 4.88 -0.00 -0.94 0.16 120.64 120.72 2eob n GLU 96 Ca -0.29 0.82 -0.22 0.00 -0.00 0.00 0.00 57.16 57.47 2eob n GLU 96 Cb 0.87 -1.66 -0.13 0.00 -0.00 0.00 0.00 31.44 30.53 2eob n GLU 96 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2eob n LYS 97 N -3.91 0.66 -3.20 3.44 4.76 -1.26 -4.32 118.16 114.34 2eob n LYS 97 Ca 0.27 0.41 -0.39 0.00 -2.87 0.00 0.00 58.31 55.73 2eob n LYS 97 Cb 1.09 -1.72 -0.06 0.00 -1.84 0.00 0.00 35.03 32.50 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 -2.46 3.42 0.48 2.13 3.76 0.43 -5.02 115.29 118.02 2eob s HIS 98 Ca -0.26 0.89 -0.18 0.00 -0.15 0.00 0.00 55.06 55.36 2eob s HIS 98 Cb 0.06 -2.71 -0.15 0.00 1.11 0.00 0.00 32.58 30.90 2eob s HIS 98 CO 0.68 -0.06 -0.09 0.00 -0.85 0.00 0.00 174.74 174.42 2eob n ALA 99 N 4.59 -3.03 0.05 -1.40 0.00 -1.26 -4.57 120.51 114.90 2eob n ALA 99 Ca -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2eob n ALA 99 Cb 0.50 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2eob n ALA 99 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2eob n LEU 100 N 2.44 0.71 -4.01 0.00 7.94 -0.22 -4.96 117.00 118.89 2eob n LEU 100 Ca 0.08 0.14 -0.10 0.00 -1.11 0.00 0.00 56.01 55.03 2eob n LEU 100 Cb 0.45 -0.18 -0.05 0.00 0.53 0.00 0.00 43.42 44.17 2eob n LEU 100 CO 0.53 -0.70 0.16 -0.47 -1.11 0.00 0.00 177.39 175.81 2eob s TYR 101 N -1.75 0.44 -0.94 1.96 5.04 -1.03 -4.95 117.35 116.13 2eob s TYR 101 Ca 0.00 -0.79 -0.12 0.00 -2.44 0.00 0.00 57.07 53.71 2eob s TYR 101 Cb 0.00 0.15 0.02 0.00 0.35 0.00 0.00 41.96 42.48 2eob s TYR 101 CO 0.00 -1.00 0.23 -2.13 -1.34 0.00 0.00 175.55 171.32 2eob n ARG 102 N -0.39 -0.71 -4.06 4.97 3.00 -1.26 0.12 116.66 118.33 2eob n ARG 102 Ca -0.01 -0.04 -0.28 0.00 -0.00 0.00 0.00 57.85 57.51 2eob n ARG 102 Cb 0.62 -1.89 -0.08 0.00 0.00 0.00 0.00 32.46 31.11 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 -3.61 -0.91 -3.82 -0.14 4.76 -1.26 -4.89 118.16 108.29 2eob n LYS 103 Ca -0.15 0.09 -0.09 0.00 -2.87 0.00 0.00 58.31 55.28 2eob n LYS 103 Cb 0.43 -3.24 -0.07 0.00 -1.84 0.00 0.00 35.03 30.31 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 -6.64 0.96 0.03 1.97 0.23 0.33 -5.03 119.30 111.14 2eob s MET 104 Ca 0.15 -0.94 0.01 0.00 -1.03 0.00 0.00 55.69 53.87 2eob s MET 104 Cb -0.09 0.38 -0.03 0.00 -1.53 0.00 0.00 34.83 33.57 2eob s MET 104 CO 0.85 -0.33 -0.04 -0.98 -2.03 0.00 0.00 175.02 172.49 2eob s ARG 105 N -3.87 0.44 -0.73 3.16 1.70 -1.26 -1.05 118.95 117.33 2eob s ARG 105 Ca 0.07 -0.78 -0.32 0.00 -0.47 0.00 0.00 55.73 54.23 2eob s ARG 105 Cb 0.04 0.01 -0.17 0.00 -0.57 0.00 0.00 34.95 34.26 2eob s ARG 105 CO -0.09 -0.03 2.49 1.28 -1.08 0.00 0.00 175.30 177.87 2eob n LEU 106 N 1.26 1.06 -0.12 -1.89 4.77 -1.26 -4.74 117.00 116.07 2eob n LEU 106 Ca -0.22 0.12 -0.24 0.00 -0.03 0.00 0.00 56.01 55.65 2eob n LEU 106 Cb 0.56 -1.11 -0.09 0.00 -2.33 0.00 0.00 43.42 40.45 2eob n LEU 106 CO 0.22 -0.92 -1.32 0.54 -1.33 0.00 0.00 177.39 174.58 2eob n ARG 107 N 8.44 0.53 -3.74 3.23 5.12 -1.26 -4.08 116.66 124.90 2eob n ARG 107 Ca 0.55 0.21 -0.29 0.00 -1.93 0.00 0.00 57.85 56.38 2eob n ARG 107 Cb 0.16 -1.39 -0.16 0.00 -1.16 0.00 0.00 32.46 29.92 2eob n ARG 107 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 2eob s TYR 108 N -2.45 1.47 -0.44 -1.55 2.02 -1.26 -5.04 117.35 110.10 2eob s TYR 108 Ca -0.33 -1.41 -0.28 0.00 -0.37 0.00 0.00 57.07 54.67 2eob s TYR 108 Cb 0.12 -1.44 -0.01 0.00 -0.40 0.00 0.00 41.96 40.22 2eob s TYR 108 CO 0.45 -0.78 1.75 -1.25 -1.57 0.00 0.00 175.55 174.15 2eob s PRO 109 N 1.70 3.13 0.36 -1.71 0.04 -1.26 -2.80 135.00 134.47 2eob s PRO 109 Ca 0.05 1.06 -0.21 0.00 0.04 0.00 0.00 61.00 61.94 2eob s PRO 109 Cb -0.17 -4.23 -0.15 0.00 0.04 0.00 0.00 34.50 29.98 2eob s PRO 109 CO -0.19 -2.11 0.14 0.28 0.04 0.00 0.00 177.00 175.16 2eob n VAL 110 N 7.29 0.79 -3.73 -0.36 0.31 0.34 -4.74 118.33 118.23 2eob n VAL 110 Ca 0.21 -0.48 -0.11 0.00 -0.01 0.00 0.00 64.34 63.94 2eob n VAL 110 Cb 0.49 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 33.35 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 -1.54 0.08 -2.00 2.52 -4.23 -1.26 -3.84 115.64 105.37 2eob s THR 111 Ca 0.58 -0.68 0.12 0.00 -1.18 0.00 0.00 61.69 60.53 2eob s THR 111 Cb -0.65 -1.01 0.33 0.00 1.34 0.00 0.00 72.50 72.51 2eob s THR 111 CO 0.60 -0.37 1.13 -0.81 -0.54 0.00 0.00 174.62 174.63 2eob n PRO 112 N 0.39 0.49 -0.04 3.99 -0.04 -1.26 -2.20 135.00 136.33 2eob n PRO 112 Ca -0.18 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.27 2eob n PRO 112 Cb 0.60 -1.38 -0.10 0.00 -0.04 0.00 0.00 33.50 32.59 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 -0.88 1.40 -0.04 0.54 -0.58 -1.26 -4.56 120.64 115.26 2eob n GLU 113 Ca 0.09 -0.05 -0.16 0.00 -0.42 0.00 0.00 57.16 56.62 2eob n GLU 113 Cb 0.04 -1.31 -0.07 0.00 -0.57 0.00 0.00 31.44 29.53 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 0.82 -0.59 -4.62 5.85 -1.85 -2.60 115.31 112.32 2eob h LEU 114 Ca -0.21 -0.60 0.12 0.00 0.84 0.00 0.00 57.88 58.03 2eob h LEU 114 Cb 1.32 -0.24 -0.10 0.00 0.37 0.00 0.00 40.66 42.01 2eob h LEU 114 CO 0.01 1.28 0.01 -0.07 -0.34 0.00 0.00 178.44 179.33 2eob h LEU 115 N 0.41 -0.25 0.45 2.25 -0.00 -1.80 -0.70 115.31 115.67 2eob h LEU 115 Ca -0.02 0.14 -0.02 0.00 -0.00 0.00 0.00 57.88 57.98 2eob h LEU 115 Cb 1.21 0.25 0.00 0.00 -0.00 0.00 0.00 40.66 42.13 2eob h LEU 115 CO 0.12 -0.10 -0.21 -0.33 -0.00 0.00 0.00 178.44 177.92 2eob h GLU 116 N 0.12 -0.58 -0.93 1.13 3.07 -1.80 0.24 114.58 115.84 2eob h GLU 116 Ca 0.31 0.04 0.39 0.00 -0.50 0.00 0.00 59.36 59.59 2eob h GLU 116 Cb 0.49 0.13 -0.17 0.00 -0.84 0.00 0.00 28.75 28.36 2eob h GLU 116 CO -0.50 -0.39 0.49 -2.13 -1.40 0.00 0.00 179.01 175.08 2eob n ARG 117 N -4.55 -0.06 -0.07 2.33 0.63 -0.98 -0.25 116.66 113.71 2eob n ARG 117 Ca -0.07 1.28 -0.14 0.00 -0.92 0.00 0.00 57.85 58.00 2eob n ARG 117 Cb 0.24 -2.29 -0.11 0.00 0.45 0.00 0.00 32.46 30.74 2eob n ARG 117 CO 0.00 0.00 0.00 1.88 -2.51 0.00 0.00 177.63 177.00 2eob h TYR 118 N 0.00 0.00 -0.90 -0.14 -1.99 -1.12 -3.16 116.97 109.66 2eob h TYR 118 Ca 0.78 0.00 0.36 0.00 2.00 0.00 0.00 58.73 61.87 2eob h TYR 118 Cb 2.06 0.00 -0.15 0.00 2.00 0.00 0.00 36.73 40.64 2eob h TYR 118 CO -0.02 0.96 0.50 0.45 -0.00 0.00 0.00 178.16 180.05 2eob n SER 119 N -4.60 0.28 -4.98 3.88 2.88 0.84 -4.36 113.62 107.55 2eob n SER 119 Ca -0.12 1.37 -0.20 0.00 -1.33 0.00 0.00 58.87 58.59 2eob n SER 119 Cb 0.46 -0.67 0.02 0.00 -0.75 0.00 0.00 64.21 63.27 2eob n SER 119 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2eob s GLY 120 N -4.25 1.77 0.00 0.46 0.00 -0.80 -4.98 107.32 99.51 2eob s GLY 120 Ca -0.07 -1.38 0.15 0.00 0.00 0.00 0.00 44.72 43.42 2eob s GLY 120 CO 0.67 -1.17 1.41 -1.55 0.00 0.00 0.00 173.10 172.45 2eob n PRO 121 N -2.05 0.18 -0.20 2.90 -0.04 -1.26 -3.89 135.00 130.64 2eob n PRO 121 Ca 0.05 0.16 -0.09 0.00 -0.04 0.00 0.00 63.50 63.58 2eob n PRO 121 Cb 0.59 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.47 2eob n PRO 121 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2eob h SER 122 N 0.00 -1.47 -3.38 3.54 0.87 -1.87 -3.38 113.55 107.85 2eob h SER 122 Ca 0.00 0.21 -0.55 0.00 -1.23 0.00 0.00 61.79 60.22 2eob h SER 122 Cb 0.15 0.63 -0.04 0.00 -0.44 0.00 0.00 62.40 62.70 2eob h SER 122 CO 0.00 -0.24 0.09 -0.55 -0.53 0.00 0.00 176.83 175.60 2eob s SER 123 N -4.62 7.15 0.00 6.23 0.15 -1.19 -5.11 113.70 116.31 2eob s SER 123 Ca -0.10 1.37 0.00 0.00 0.70 0.00 0.00 55.95 57.92 2eob s SER 123 Cb 0.07 -2.43 0.00 0.00 -1.71 0.00 0.00 66.02 61.95 2eob s SER 123 CO 0.45 0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.60