#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 6.25 -0.49 1.61 1.04 -1.26 -4.98 113.70 115.88 2eob s SER 2 Ca 0.00 -0.53 -0.05 0.00 0.48 0.00 0.00 55.95 55.85 2eob s SER 2 Cb 0.00 -2.48 0.13 0.00 0.10 0.00 0.00 66.02 63.77 2eob s SER 2 CO 0.00 -1.49 0.31 -0.55 0.98 0.00 0.00 173.24 172.49 2eob s SER 3 N 3.37 5.43 -0.84 7.02 0.15 -1.26 -4.98 113.70 122.58 2eob s SER 3 Ca 0.31 -2.19 0.01 0.00 0.70 0.00 0.00 55.95 54.78 2eob s SER 3 Cb -0.12 -1.90 0.32 0.00 -1.71 0.00 0.00 66.02 62.61 2eob s SER 3 CO 0.16 -0.55 1.36 0.61 1.20 0.00 0.00 173.24 176.01 2eob n GLY 4 N 4.43 5.66 4.49 9.45 0.00 -1.26 -4.85 105.19 123.11 2eob n GLY 4 Ca -0.01 -2.69 -0.40 0.00 0.00 0.00 0.00 46.02 42.92 2eob n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2eob n SER 5 N 0.21 -1.25 -4.72 1.61 2.88 -1.26 -4.90 113.62 106.19 2eob n SER 5 Ca 0.36 -1.25 -0.24 0.00 -1.33 0.00 0.00 58.87 56.41 2eob n SER 5 Cb 0.33 -1.59 -0.07 0.00 -0.75 0.00 0.00 64.21 62.13 2eob n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2eob s SER 6 N -3.48 4.49 0.00 -3.46 0.15 -1.26 -4.99 113.70 105.15 2eob s SER 6 Ca 0.66 -0.93 0.00 0.00 0.70 0.00 0.00 55.95 56.38 2eob s SER 6 Cb -0.39 -0.59 0.00 0.00 -1.71 0.00 0.00 66.02 63.33 2eob s SER 6 CO 1.02 -0.39 0.00 0.61 1.20 0.00 0.00 173.24 175.68 2eob n GLY 7 N -1.15 0.23 2.98 9.45 0.00 -1.26 -5.12 105.19 110.33 2eob n GLY 7 Ca -0.02 -0.14 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 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 0.00 0.21 1.02 1.61 1.01 -1.26 -5.16 116.67 114.10 2eob s ASP 8 Ca 0.00 -0.45 -0.13 0.00 0.71 0.00 0.00 52.55 52.68 2eob s ASP 8 Cb 0.00 0.10 0.20 0.00 1.01 0.00 0.00 42.92 44.23 2eob s ASP 8 CO 0.00 -0.29 1.09 -2.16 0.21 0.00 0.00 175.17 174.03 2eob s PRO 9 N -1.37 0.24 -0.03 8.23 0.04 -1.26 -5.07 135.00 135.78 2eob s PRO 9 Ca -0.15 0.47 0.06 0.00 0.04 0.00 0.00 61.00 61.41 2eob s PRO 9 Cb -0.09 -1.72 -0.01 0.00 0.04 0.00 0.00 34.50 32.72 2eob s PRO 9 CO -0.01 -2.85 -0.20 0.54 0.04 0.00 0.00 177.00 174.53 2eob s VAL 10 N -2.96 1.62 1.17 -0.36 0.11 -1.26 -5.14 120.40 113.57 2eob s VAL 10 Ca 0.66 -0.85 -0.18 0.00 -2.93 0.00 0.00 61.98 58.68 2eob s VAL 10 Cb -0.18 -1.36 0.27 0.00 -1.53 0.00 0.00 36.38 33.58 2eob s VAL 10 CO 0.58 0.46 1.11 -2.16 -3.33 0.00 0.00 175.10 171.75 2eob s PRO 11 N -0.25 -1.00 -0.23 1.54 0.04 -1.26 -5.09 135.00 128.74 2eob s PRO 11 Ca 0.02 0.01 -0.10 0.00 0.04 0.00 0.00 61.00 60.98 2eob s PRO 11 Cb -0.10 -1.61 0.09 0.00 0.04 0.00 0.00 34.50 32.92 2eob s PRO 11 CO 0.01 -3.58 0.53 1.21 0.04 0.00 0.00 177.00 175.21 2eob s ASN 12 N -3.83 -0.67 0.00 6.66 3.84 -1.26 -5.01 114.94 114.67 2eob s ASN 12 Ca 0.70 1.22 0.09 0.00 0.21 0.00 0.00 52.86 55.09 2eob s ASN 12 Cb -0.11 1.49 0.56 0.00 -0.55 0.00 0.00 41.25 42.64 2eob s ASN 12 CO 0.56 -0.22 1.01 -0.81 -2.79 0.00 0.00 177.10 174.85 2eob n PRO 13 N 4.98 0.49 -3.59 0.43 -0.04 -1.26 -4.18 135.00 131.82 2eob n PRO 13 Ca -0.15 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 62.94 2eob n PRO 13 Cb 0.52 -1.30 -0.06 0.00 -0.04 0.00 0.00 33.50 32.62 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 -1.81 6.18 0.39 3.54 0.02 -1.26 -4.87 114.94 117.13 2eob s ASN 14 Ca 0.14 -3.66 0.18 0.00 -1.02 0.00 0.00 52.86 48.50 2eob s ASN 14 Cb 0.06 -1.95 0.78 0.00 0.02 0.00 0.00 41.25 40.16 2eob s ASN 14 CO 0.11 -0.21 1.80 1.55 0.02 0.00 0.00 177.10 180.37 2eob h PRO 15 N 6.17 0.00 0.00 -0.60 0.13 -2.00 -2.91 132.00 132.79 2eob h PRO 15 Ca 0.15 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.26 2eob h PRO 15 Cb 0.83 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.96 2eob h PRO 15 CO 0.87 0.36 -0.11 1.12 -0.23 0.00 0.00 178.00 180.01 2eob h HIS 16 N 0.00 0.00 -0.39 1.56 2.07 -1.96 -1.96 115.15 114.48 2eob h HIS 16 Ca -0.00 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.51 2eob h HIS 16 Cb 0.77 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.73 2eob h HIS 16 CO 0.00 0.11 0.22 0.93 -3.07 0.00 0.00 177.93 176.12 2eob h GLU 17 N 0.00 0.52 -1.12 5.12 5.08 -1.93 -1.85 114.58 120.40 2eob h GLU 17 Ca -0.00 -0.04 -0.49 0.00 -1.00 0.00 0.00 59.36 57.83 2eob h GLU 17 Cb 0.20 -0.11 -0.24 0.00 0.50 0.00 0.00 28.75 29.10 2eob h GLU 17 CO 0.01 0.38 0.63 -1.13 -1.00 0.00 0.00 179.01 177.90 2eob n SER 18 N -4.44 5.73 -4.81 1.42 3.41 -0.74 -4.93 113.62 109.26 2eob n SER 18 Ca 0.03 -3.42 -0.26 0.00 -0.26 0.00 0.00 58.87 54.96 2eob n SER 18 Cb 0.09 -0.91 -0.05 0.00 -0.26 0.00 0.00 64.21 63.08 2eob n SER 18 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2eob s LYS 19 N -2.88 2.93 0.10 4.33 -0.14 -0.70 -5.04 119.74 118.34 2eob s LYS 19 Ca 0.49 -0.87 -0.15 0.00 -1.36 0.00 0.00 55.97 54.08 2eob s LYS 19 Cb 0.40 -2.65 -0.09 0.00 -1.68 0.00 0.00 37.83 33.81 2eob s LYS 19 CO 0.03 0.48 1.42 -1.00 -0.76 0.00 0.00 175.35 175.52 2eob h PRO 20 N 2.32 0.69 -0.61 -1.68 0.13 -1.92 -2.91 132.00 128.03 2eob h PRO 20 Ca -0.48 -0.36 0.00 0.00 -0.87 0.00 0.00 66.00 64.29 2eob h PRO 20 Cb 1.20 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2eob h PRO 20 CO 0.63 0.97 0.00 -2.67 -0.23 0.00 0.00 178.00 176.70 2eob n TRP 21 N -4.28 0.18 -3.73 1.56 4.27 -1.26 -4.31 117.44 109.86 2eob n TRP 21 Ca -0.04 -0.07 -0.37 0.00 -3.89 0.00 0.00 57.50 53.14 2eob n TRP 21 Cb 0.46 -0.09 -0.07 0.00 -1.36 0.00 0.00 31.31 30.26 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 -1.47 3.57 -0.03 -2.67 5.04 -1.10 -3.40 117.35 117.30 2eob s TYR 22 Ca 0.06 0.59 0.03 0.00 -2.44 0.00 0.00 57.07 55.31 2eob s TYR 22 Cb 0.04 -2.10 -0.00 0.00 0.35 0.00 0.00 41.96 40.24 2eob s TYR 22 CO 0.02 0.57 -0.11 0.71 -1.34 0.00 0.00 175.55 175.40 2eob s TYR 23 N -0.57 1.12 -0.06 4.97 2.02 -0.82 -4.93 117.35 119.09 2eob s TYR 23 Ca 0.16 -0.27 0.00 0.00 -0.37 0.00 0.00 57.07 56.58 2eob s TYR 23 Cb -0.13 -0.77 -0.04 0.00 -0.40 0.00 0.00 41.96 40.62 2eob s TYR 23 CO 0.05 -0.09 -0.06 -0.40 -1.57 0.00 0.00 175.55 173.48 2eob n ASP 24 N 3.15 3.38 -0.02 2.29 5.68 -1.26 -1.60 116.55 128.16 2eob n ASP 24 Ca -0.17 -0.03 -0.09 0.00 -0.50 0.00 0.00 54.79 54.00 2eob n ASP 24 Cb 0.54 -0.10 -0.14 0.00 -1.14 0.00 0.00 41.12 40.28 2eob n ASP 24 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2eob n ARG 25 N -2.71 0.64 -1.30 0.11 1.74 -1.26 -4.58 116.66 109.29 2eob n ARG 25 Ca -0.11 0.28 -0.44 0.00 -0.77 0.00 0.00 57.85 56.81 2eob n ARG 25 Cb 0.62 -1.78 -0.02 0.00 -1.02 0.00 0.00 32.46 30.26 2eob n ARG 25 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2eob n LEU 26 N -3.05 -1.55 -4.08 0.55 7.94 -1.26 -4.98 117.00 110.57 2eob n LEU 26 Ca -0.18 1.00 -0.14 0.00 -1.11 0.00 0.00 56.01 55.57 2eob n LEU 26 Cb 1.06 -0.89 -0.12 0.00 0.53 0.00 0.00 43.42 44.01 2eob n LEU 26 CO 0.45 -3.11 -0.41 -0.44 -1.11 0.00 0.00 177.39 172.77 2eob s SER 27 N -0.95 1.01 0.26 1.96 0.01 -1.26 -4.80 113.70 109.93 2eob s SER 27 Ca 0.60 -0.56 0.01 0.00 1.31 0.00 0.00 55.95 57.31 2eob s SER 27 Cb -0.82 0.02 0.64 0.00 0.21 0.00 0.00 66.02 66.07 2eob s SER 27 CO 0.55 -0.17 1.33 -2.11 0.41 0.00 0.00 173.24 173.25 2eob n ARG 28 N 1.45 -0.07 -0.37 12.44 1.85 -1.26 0.11 116.66 130.81 2eob n ARG 28 Ca -0.22 1.28 0.03 0.00 -1.00 0.00 0.00 57.85 57.94 2eob n ARG 28 Cb 0.55 -2.02 0.10 0.00 -1.05 0.00 0.00 32.46 30.03 2eob n ARG 28 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2eob n GLY 29 N -1.43 -1.82 0.11 2.89 0.00 -1.26 -1.68 105.19 102.00 2eob n GLY 29 Ca 0.20 1.08 -0.23 0.00 0.00 0.00 0.00 46.02 47.07 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 -5.55 0.59 -0.27 1.61 1.02 0.12 -4.09 120.64 114.07 2eob n GLU 30 Ca 0.13 0.51 -0.07 0.00 -0.02 0.00 0.00 57.16 57.72 2eob n GLU 30 Cb 0.45 -1.72 -0.06 0.00 -0.02 0.00 0.00 31.44 30.09 2eob n GLU 30 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2eob n ALA 31 N -3.46 -0.41 -0.03 0.62 0.00 0.49 0.54 120.51 118.26 2eob n ALA 31 Ca -0.35 0.54 -0.08 0.00 0.00 0.00 0.00 53.44 53.55 2eob n ALA 31 Cb 0.74 -0.06 -0.02 0.00 0.00 0.00 0.00 19.45 20.11 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 -0.18 -0.13 0.00 5.08 -1.54 -2.53 114.58 115.28 2eob h GLU 32 Ca 0.10 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.52 2eob h GLU 32 Cb 0.26 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.49 2eob h GLU 32 CO -0.60 -0.12 -0.31 0.22 -1.00 0.00 0.00 179.01 177.20 2eob h ASP 33 N -0.19 -0.95 -0.48 1.42 1.82 -0.06 -2.56 116.42 115.43 2eob h ASP 33 Ca 0.12 0.14 0.04 0.00 -0.39 0.00 0.00 57.03 56.95 2eob h ASP 33 Cb 0.37 0.40 -0.06 0.00 0.68 0.00 0.00 39.33 40.73 2eob h ASP 33 CO -0.32 -0.35 -0.28 0.23 -1.61 0.00 0.00 179.24 176.91 2eob n MET 34 N -5.40 -0.21 -0.22 0.28 2.81 0.56 0.04 117.12 114.98 2eob n MET 34 Ca -0.03 1.14 0.02 0.00 -1.81 0.00 0.00 57.70 57.02 2eob n MET 34 Cb 0.32 -1.69 0.11 0.00 -0.71 0.00 0.00 33.22 31.25 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 -0.37 -1.38 4.03 -0.00 -1.38 0.36 115.31 116.57 2eob h LEU 35 Ca 0.08 0.17 0.17 0.00 -0.00 0.00 0.00 57.88 58.30 2eob h LEU 35 Cb 0.20 0.32 -0.07 0.00 -0.00 0.00 0.00 40.66 41.11 2eob h LEU 35 CO -0.45 -0.16 0.58 0.24 -0.00 0.00 0.00 178.44 178.65 2eob h MET 36 N 0.09 0.55 -0.04 1.13 2.86 0.01 -1.73 114.93 117.80 2eob h MET 36 Ca 0.35 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.91 2eob h MET 36 Cb 0.57 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.11 2eob h MET 36 CO -0.60 0.36 -0.15 0.00 1.06 0.00 0.00 176.91 177.59 2eob h ARG 37 N 0.56 0.18 -5.84 1.72 3.08 0.14 -3.43 114.38 110.79 2eob h ARG 37 Ca 0.46 -0.13 -0.61 0.00 0.07 0.00 0.00 59.98 59.77 2eob h ARG 37 Cb 0.92 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.97 2eob h ARG 37 CO -0.20 0.76 1.49 -0.89 -1.07 0.00 0.00 179.97 180.06 2eob n ILE 38 N -4.61 0.14 0.98 2.04 2.08 -0.40 -4.77 119.36 114.81 2eob n ILE 38 Ca -0.08 -0.34 0.04 0.00 0.56 0.00 0.00 62.75 62.92 2eob n ILE 38 Cb 0.40 -1.82 0.22 0.00 -0.75 0.00 0.00 39.64 37.69 2eob n ILE 38 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 2eob n PRO 39 N 8.42 0.49 -3.55 0.38 -0.04 -1.26 -4.59 135.00 134.85 2eob n PRO 39 Ca 0.42 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.47 2eob n PRO 39 Cb 0.29 -1.24 -0.11 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 -2.00 3.16 -0.57 0.54 1.81 -1.26 -5.03 118.95 115.59 2eob s ARG 40 Ca 0.11 -0.87 -0.27 0.00 -1.72 0.00 0.00 55.73 52.98 2eob s ARG 40 Cb 0.05 -3.79 -0.00 0.00 -0.45 0.00 0.00 34.95 30.75 2eob s ARG 40 CO 0.09 -0.59 1.65 0.16 -0.68 0.00 0.00 175.30 175.93 2eob s ASP 41 N 1.65 5.73 0.00 0.23 1.47 -1.26 -3.56 116.67 120.92 2eob s ASP 41 Ca 0.05 0.38 0.00 0.00 1.18 0.00 0.00 52.55 54.16 2eob s ASP 41 Cb -0.18 -2.54 0.00 0.00 -0.34 0.00 0.00 42.92 39.86 2eob s ASP 41 CO 0.09 -2.01 0.00 0.61 0.68 0.00 0.00 175.17 174.54 2eob n GLY 42 N 5.48 0.53 3.86 2.12 0.00 -1.24 -4.99 105.19 110.95 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 s ALA 43 N -0.53 3.69 0.06 4.61 0.00 -1.23 -3.24 121.76 125.12 2eob s ALA 43 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 51.96 51.65 2eob s ALA 43 Cb 0.00 -2.34 -0.04 0.00 0.00 0.00 0.00 23.12 20.74 2eob s ALA 43 CO 0.00 0.53 -0.05 -0.59 0.00 0.00 0.00 175.76 175.66 2eob s PHE 44 N -1.39 0.62 -0.05 0.00 -0.71 -1.19 -1.94 117.98 113.32 2eob s PHE 44 Ca 0.33 -0.91 -0.21 0.00 -1.04 0.00 0.00 56.93 55.10 2eob s PHE 44 Cb -0.14 -0.41 0.04 0.00 -1.21 0.00 0.00 43.02 41.30 2eob s PHE 44 CO 0.18 -0.26 0.47 -0.48 -1.34 0.00 0.00 175.22 173.79 2eob s LEU 45 N -2.68 0.19 -0.29 -1.99 0.05 0.04 -1.17 118.68 112.83 2eob s LEU 45 Ca 0.04 0.44 0.03 0.00 0.05 0.00 0.00 54.13 54.69 2eob s LEU 45 Cb 0.04 1.80 0.08 0.00 -2.05 0.00 0.00 46.19 46.05 2eob s LEU 45 CO -0.06 -0.47 -0.03 -0.63 -0.55 0.00 0.00 176.35 174.60 2eob s ILE 46 N -1.08 2.04 -0.08 1.48 1.01 -1.22 -1.44 121.20 121.92 2eob s ILE 46 Ca -0.11 -1.82 0.03 0.00 0.00 0.00 0.00 60.65 58.75 2eob s ILE 46 Cb -0.03 -2.32 -0.02 0.00 0.01 0.00 0.00 42.46 40.10 2eob s ILE 46 CO 0.06 -0.29 -0.18 0.00 0.00 0.00 0.00 174.94 174.53 2eob s ARG 47 N 1.10 2.83 0.42 2.79 1.70 -1.24 -1.94 118.95 124.61 2eob s ARG 47 Ca -0.00 -0.78 -0.22 0.00 -0.47 0.00 0.00 55.73 54.26 2eob s ARG 47 Cb -0.19 -2.37 -0.11 0.00 -0.57 0.00 0.00 34.95 31.71 2eob s ARG 47 CO -0.07 0.38 0.96 0.21 -1.08 0.00 0.00 175.30 175.69 2eob s LYS 48 N -0.12 4.23 -0.18 3.89 2.36 -0.63 -3.75 119.74 125.54 2eob s LYS 48 Ca -0.03 1.18 -0.08 0.00 -2.55 0.00 0.00 55.97 54.48 2eob s LYS 48 Cb -0.14 -2.26 -0.04 0.00 -1.05 0.00 0.00 37.83 34.34 2eob s LYS 48 CO 0.04 -0.03 0.09 1.03 1.55 0.00 0.00 175.35 178.03 2eob s ARG 49 N -3.03 4.02 0.06 4.03 0.52 -1.26 -4.80 118.95 118.50 2eob s ARG 49 Ca 0.61 -0.29 -0.26 0.00 -0.52 0.00 0.00 55.73 55.27 2eob s ARG 49 Cb -0.11 -3.29 -0.17 0.00 0.52 0.00 0.00 34.95 31.90 2eob s ARG 49 CO 0.15 0.31 1.59 1.05 0.02 0.00 0.00 175.30 178.43 2eob h GLU 50 N 6.58 -0.26 0.00 3.54 4.11 -1.94 -3.36 114.58 123.25 2eob h GLU 50 Ca -0.39 0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.05 2eob h GLU 50 Cb 1.16 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.47 2eob h GLU 50 CO 0.72 -0.10 0.00 0.41 0.07 0.00 0.00 179.01 180.11 2eob n GLY 51 N -0.93 -2.40 3.91 1.06 0.00 -1.26 -4.76 105.19 100.81 2eob n GLY 51 Ca -0.09 0.21 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.54 4.05 0.09 2.61 -4.23 -1.26 -5.01 115.64 111.35 2eob s THR 52 Ca 0.00 0.16 -0.04 0.00 -1.18 0.00 0.00 61.69 60.63 2eob s THR 52 Cb 0.00 -3.59 -0.25 0.00 1.34 0.00 0.00 72.50 69.99 2eob s THR 52 CO 0.00 -0.63 1.19 0.44 -0.54 0.00 0.00 174.62 175.08 2eob h ASP 53 N -0.12 0.45 -2.66 3.99 3.32 -1.86 -3.39 116.42 116.15 2eob h ASP 53 Ca -0.46 -0.44 -0.60 0.00 0.02 0.00 0.00 57.03 55.56 2eob h ASP 53 Cb 1.24 -0.14 0.14 0.00 0.22 0.00 0.00 39.33 40.79 2eob h ASP 53 CO 0.61 1.31 -0.17 -1.54 -1.72 0.00 0.00 179.24 177.73 2eob n SER 54 N -3.59 -0.02 -4.93 6.45 3.41 -1.26 -4.71 113.62 108.97 2eob n SER 54 Ca -0.08 0.95 -0.20 0.00 -0.26 0.00 0.00 58.87 59.28 2eob n SER 54 Cb 0.97 -1.21 -0.02 0.00 -0.26 0.00 0.00 64.21 63.68 2eob n SER 54 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2eob s TYR 55 N -1.40 2.90 -0.08 7.33 1.51 -1.08 -4.21 117.35 122.32 2eob s TYR 55 Ca 0.64 -0.34 -0.03 0.00 -1.01 0.00 0.00 57.07 56.33 2eob s TYR 55 Cb -0.58 -2.04 0.04 0.00 -0.11 0.00 0.00 41.96 39.27 2eob s TYR 55 CO 0.57 -0.05 0.15 0.00 -1.11 0.00 0.00 175.55 175.11 2eob s ALA 56 N -2.31 -0.20 -0.25 3.71 0.00 -1.25 0.85 121.76 122.30 2eob s ALA 56 Ca 0.46 0.61 -0.13 0.00 0.00 0.00 0.00 51.96 52.90 2eob s ALA 56 Cb -0.07 -0.67 -0.04 0.00 0.00 0.00 0.00 23.12 22.34 2eob s ALA 56 CO 0.29 -0.40 0.29 -1.50 0.00 0.00 0.00 175.76 174.44 2eob s ILE 57 N 1.84 5.25 0.02 0.00 2.07 -0.83 -3.60 121.20 125.94 2eob s ILE 57 Ca -0.02 0.42 -0.01 0.00 -1.41 0.00 0.00 60.65 59.63 2eob s ILE 57 Cb -0.12 -3.62 -0.04 0.00 0.13 0.00 0.00 42.46 38.81 2eob s ILE 57 CO -0.06 0.24 0.15 -0.89 -1.91 0.00 0.00 174.94 172.47 2eob s THR 58 N 1.60 5.11 0.25 4.00 2.01 -0.52 -2.28 115.64 125.81 2eob s THR 58 Ca 0.12 -0.36 -0.11 0.00 0.31 0.00 0.00 61.69 61.65 2eob s THR 58 Cb -0.15 -3.41 -0.01 0.00 0.01 0.00 0.00 72.50 68.95 2eob s THR 58 CO 0.08 0.27 0.45 0.72 -0.69 0.00 0.00 174.62 175.45 2eob s PHE 59 N -1.34 0.46 -0.25 4.92 -0.71 -1.12 -0.78 117.98 119.17 2eob s PHE 59 Ca 0.28 -0.81 -0.06 0.00 -1.04 0.00 0.00 56.93 55.30 2eob s PHE 59 Cb -0.12 0.11 -0.01 0.00 -1.21 0.00 0.00 43.02 41.79 2eob s PHE 59 CO 0.20 -0.97 0.03 0.50 -1.34 0.00 0.00 175.22 173.63 2eob s ARG 60 N -3.98 3.41 -0.49 1.99 3.52 -0.82 -2.04 118.95 120.54 2eob s ARG 60 Ca 0.24 -0.63 -0.05 0.00 -0.13 0.00 0.00 55.73 55.17 2eob s ARG 60 Cb 0.00 -3.20 0.13 0.00 -1.56 0.00 0.00 34.95 30.31 2eob s ARG 60 CO 0.10 -0.25 0.31 0.00 -0.81 0.00 0.00 175.30 174.65 2eob s ALA 61 N 1.53 3.34 -1.30 6.12 0.00 0.14 -3.68 121.76 127.92 2eob s ALA 61 Ca 0.05 -2.73 -0.04 0.00 0.00 0.00 0.00 51.96 49.24 2eob s ALA 61 Cb -0.15 -2.61 -0.00 0.00 0.00 0.00 0.00 23.12 20.36 2eob s ALA 61 CO 0.00 -1.91 0.64 -2.13 0.00 0.00 0.00 175.76 172.36 2eob n ARG 62 N 4.39 -3.60 0.00 0.00 0.00 -1.26 -2.03 116.66 114.17 2eob n ARG 62 Ca -0.01 0.53 0.00 0.00 -0.00 0.00 0.00 57.85 58.37 2eob n ARG 62 Cb 0.41 -4.80 0.00 0.00 0.00 0.00 0.00 32.46 28.07 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 -1.71 2.51 3.61 5.14 0.00 -1.26 -5.01 105.19 108.47 2eob n GLY 63 Ca -0.26 -0.54 -0.29 0.00 0.00 0.00 0.00 46.02 44.94 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 0.07 -0.15 1.61 -0.14 -0.86 -4.72 119.74 115.55 2eob s LYS 64 Ca 0.00 0.74 -0.00 0.00 -1.36 0.00 0.00 55.97 55.35 2eob s LYS 64 Cb 0.00 -1.68 0.03 0.00 -1.68 0.00 0.00 37.83 34.51 2eob s LYS 64 CO 0.00 -3.03 -0.08 0.08 -0.76 0.00 0.00 175.35 171.56 2eob s VAL 65 N -2.76 1.19 0.45 3.17 1.01 -1.26 0.25 120.40 122.45 2eob s VAL 65 Ca 0.66 -0.55 0.08 0.00 0.00 0.00 0.00 61.98 62.17 2eob s VAL 65 Cb -0.21 -1.27 0.02 0.00 0.00 0.00 0.00 36.38 34.92 2eob s VAL 65 CO 0.60 0.25 0.57 -0.54 0.00 0.00 0.00 175.10 175.98 2eob s LYS 66 N 1.62 2.69 -0.08 2.72 1.02 -0.86 -4.96 119.74 121.88 2eob s LYS 66 Ca 0.02 -1.37 -0.06 0.00 0.02 0.00 0.00 55.97 54.59 2eob s LYS 66 Cb -0.14 -2.66 0.03 0.00 -0.52 0.00 0.00 37.83 34.54 2eob s LYS 66 CO -0.08 -0.35 0.21 -1.01 -0.92 0.00 0.00 175.35 173.19 2eob s HIS 67 N -2.43 -0.24 -0.06 3.18 3.76 -1.26 -2.78 115.29 115.45 2eob s HIS 67 Ca 0.54 0.60 0.05 0.00 -0.15 0.00 0.00 55.06 56.11 2eob s HIS 67 Cb -0.08 0.05 -0.01 0.00 1.11 0.00 0.00 32.58 33.65 2eob s HIS 67 CO 0.33 -0.15 -0.23 0.00 -0.85 0.00 0.00 174.74 173.84 2eob s ARG 69 N 0.01 4.42 -0.05 0.00 6.06 -1.26 -1.97 118.95 126.15 2eob s ARG 69 Ca -0.07 1.47 0.06 0.00 -2.50 0.00 0.00 55.73 54.69 2eob s ARG 69 Cb -0.14 -2.75 -0.01 0.00 0.06 0.00 0.00 34.95 32.11 2eob s ARG 69 CO 0.05 0.09 -0.24 0.42 -2.50 0.00 0.00 175.30 173.12 2eob s ILE 70 N -1.57 1.93 0.56 4.11 1.01 0.25 -2.53 121.20 124.96 2eob s ILE 70 Ca 0.52 -1.00 0.08 0.00 0.00 0.00 0.00 60.65 60.25 2eob s ILE 70 Cb -0.22 -1.64 0.08 0.00 0.01 0.00 0.00 42.46 40.69 2eob s ILE 70 CO 0.28 0.54 0.63 0.59 0.00 0.00 0.00 174.94 176.98 2eob n ASN 71 N 2.97 2.34 -3.53 3.58 3.02 0.14 -2.62 115.26 121.16 2eob n ASN 71 Ca -0.17 -2.65 -0.12 0.00 -0.03 0.00 0.00 54.58 51.60 2eob n ASN 71 Cb 0.52 -0.26 -0.11 0.00 -0.61 0.00 0.00 39.78 39.32 2eob n ASN 71 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2eob s ARG 72 N -4.43 0.24 -0.10 3.52 3.52 -1.26 -1.61 118.95 118.83 2eob s ARG 72 Ca 0.48 0.61 0.02 0.00 -0.13 0.00 0.00 55.73 56.70 2eob s ARG 72 Cb -0.04 -0.38 0.19 0.00 -1.56 0.00 0.00 34.95 33.16 2eob s ARG 72 CO 0.30 -0.47 1.08 -0.40 -0.81 0.00 0.00 175.30 175.01 2eob n ASP 73 N 5.35 2.84 0.00 -2.12 5.75 0.28 -4.89 116.55 123.76 2eob n ASP 73 Ca -0.06 -2.35 0.00 0.00 -0.01 0.00 0.00 54.79 52.37 2eob n ASP 73 Cb 0.50 -0.57 0.00 0.00 -1.03 0.00 0.00 41.12 40.01 2eob n ASP 73 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2eob n GLY 74 N 0.11 2.29 0.22 6.12 0.00 -1.26 -4.15 105.19 108.52 2eob n GLY 74 Ca 0.12 -0.05 -0.17 0.00 0.00 0.00 0.00 46.02 45.93 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 0.76 0.00 1.61 2.43 -1.98 -3.47 114.38 113.74 2eob h ARG 75 Ca 0.00 -0.62 -0.61 0.00 -0.81 0.00 0.00 59.98 57.94 2eob h ARG 75 Cb 0.00 0.13 -0.13 0.00 -0.42 0.00 0.00 29.97 29.55 2eob h ARG 75 CO 0.00 1.23 -0.48 0.72 -1.51 0.00 0.00 179.97 179.93 2eob n HIS 76 N -3.93 0.63 -4.88 2.20 8.25 -1.26 -4.83 115.22 111.40 2eob n HIS 76 Ca -0.07 -2.60 -0.33 0.00 -0.26 0.00 0.00 57.72 54.46 2eob n HIS 76 Cb 0.74 -0.16 -0.13 0.00 1.12 0.00 0.00 29.99 31.56 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 -2.99 2.71 -0.46 4.41 0.40 -1.19 -0.56 117.98 120.31 2eob s PHE 77 Ca 0.11 -0.23 -0.01 0.00 -0.60 0.00 0.00 56.93 56.20 2eob s PHE 77 Cb 0.01 -1.66 0.12 0.00 0.51 0.00 0.00 43.02 42.00 2eob s PHE 77 CO 0.08 0.13 0.24 0.08 0.70 0.00 0.00 175.22 176.45 2eob s VAL 78 N -0.58 3.14 -0.96 -0.44 1.01 -0.64 -3.53 120.40 118.41 2eob s VAL 78 Ca 0.08 -2.47 -0.25 0.00 0.00 0.00 0.00 61.98 59.34 2eob s VAL 78 Cb -0.11 -3.15 -0.09 0.00 0.00 0.00 0.00 36.38 33.03 2eob s VAL 78 CO 0.01 -0.73 2.04 -0.22 0.00 0.00 0.00 175.10 176.20 2eob s LEU 79 N 0.64 3.01 0.00 3.92 0.20 -1.26 0.24 118.68 125.43 2eob s LEU 79 Ca 0.12 -0.80 0.00 0.00 0.69 0.00 0.00 54.13 54.14 2eob s LEU 79 Cb -0.22 -2.57 0.00 0.00 -0.43 0.00 0.00 46.19 42.97 2eob s LEU 79 CO -0.04 -3.21 0.00 0.61 -0.29 0.00 0.00 176.35 173.42 2eob n GLY 80 N 6.55 0.24 3.81 7.98 0.00 -1.05 -4.66 105.19 118.06 2eob n GLY 80 Ca 0.43 0.61 -0.30 0.00 0.00 0.00 0.00 46.02 46.76 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 0.00 3.32 -0.72 2.61 2.01 -1.26 -4.83 115.64 116.76 2eob s THR 81 Ca 0.00 0.43 -0.36 0.00 0.31 0.00 0.00 61.69 62.07 2eob s THR 81 Cb 0.00 -3.17 -0.19 0.00 0.01 0.00 0.00 72.50 69.15 2eob s THR 81 CO 0.00 -0.56 2.43 -1.20 -0.69 0.00 0.00 174.62 174.60 2eob n SER 82 N -3.36 0.76 -3.73 3.53 7.64 -1.26 -4.88 113.62 112.33 2eob n SER 82 Ca 0.07 0.35 -0.12 0.00 1.01 0.00 0.00 58.87 60.18 2eob n SER 82 Cb 0.55 -0.99 -0.11 0.00 -1.01 0.00 0.00 64.21 62.65 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 7.92 -0.82 -0.10 -0.43 0.00 -1.26 -4.97 121.76 122.10 2eob s ALA 83 Ca 1.25 1.14 -0.01 0.00 0.00 0.00 0.00 51.96 54.34 2eob s ALA 83 Cb -1.24 -0.69 0.03 0.00 0.00 0.00 0.00 23.12 21.22 2eob s ALA 83 CO 0.54 -0.20 -0.03 0.71 0.00 0.00 0.00 175.76 176.78 2eob s TYR 84 N 0.85 1.09 -0.14 0.00 1.51 -1.25 -3.71 117.35 115.71 2eob s TYR 84 Ca -0.06 -0.51 -0.05 0.00 -1.01 0.00 0.00 57.07 55.45 2eob s TYR 84 Cb -0.06 -1.03 0.07 0.00 -0.11 0.00 0.00 41.96 40.83 2eob s TYR 84 CO -0.06 -0.44 0.26 -0.06 -1.11 0.00 0.00 175.55 174.14 2eob s PHE 85 N 1.84 -0.42 0.33 2.71 0.40 -1.23 -4.98 117.98 116.63 2eob s PHE 85 Ca 0.04 0.92 0.11 0.00 -0.60 0.00 0.00 56.93 57.40 2eob s PHE 85 Cb -0.13 -0.06 1.01 0.00 0.51 0.00 0.00 43.02 44.36 2eob s PHE 85 CO -0.07 -0.38 1.60 1.49 0.70 0.00 0.00 175.22 178.57 2eob h GLU 86 N 8.29 0.08 -3.00 0.44 4.22 -1.93 -3.14 114.58 119.54 2eob h GLU 86 Ca -0.14 -0.00 -0.13 0.00 0.08 0.00 0.00 59.36 59.16 2eob h GLU 86 Cb 1.12 -0.02 -0.22 0.00 0.50 0.00 0.00 28.75 30.13 2eob h GLU 86 CO 0.14 0.05 -0.30 -1.54 -2.18 0.00 0.00 179.01 175.19 2eob s SER 87 N -4.83 -0.25 0.44 1.04 1.04 -1.26 -4.75 113.70 105.14 2eob s SER 87 Ca -0.11 0.32 0.32 0.00 0.48 0.00 0.00 55.95 56.96 2eob s SER 87 Cb 0.31 0.46 1.49 0.00 0.10 0.00 0.00 66.02 68.38 2eob s SER 87 CO 0.78 -0.31 1.58 -0.07 0.98 0.00 0.00 173.24 176.20 2eob h LEU 88 N 4.58 0.21 -0.50 2.42 3.38 -1.99 0.20 115.31 123.60 2eob h LEU 88 Ca -0.28 0.16 0.05 0.00 0.09 0.00 0.00 57.88 57.90 2eob h LEU 88 Cb 1.18 0.17 -0.08 0.00 0.09 0.00 0.00 40.66 42.02 2eob h LEU 88 CO 0.36 -0.27 -0.50 0.58 0.09 0.00 0.00 178.44 178.69 2eob h VAL 89 N 0.01 0.00 -0.17 1.22 2.07 -1.95 0.11 116.25 117.54 2eob h VAL 89 Ca 0.88 0.00 0.04 0.00 0.82 0.00 0.00 66.70 68.44 2eob h VAL 89 Cb 2.81 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 32.55 2eob h VAL 89 CO -0.49 0.00 -0.06 -0.33 0.02 0.00 0.00 177.57 176.71 2eob h GLU 90 N -0.26 -0.03 -0.61 1.57 4.39 -1.34 -2.17 114.58 116.13 2eob h GLU 90 Ca 0.08 0.00 0.12 0.00 0.34 0.00 0.00 59.36 59.91 2eob h GLU 90 Cb 0.49 0.01 -0.12 0.00 -0.10 0.00 0.00 28.75 29.03 2eob h GLU 90 CO -0.61 -0.02 -0.15 1.25 -1.16 0.00 0.00 179.01 178.32 2eob h LEU 91 N -0.03 -0.56 0.56 1.33 6.46 -1.21 0.40 115.31 122.27 2eob h LEU 91 Ca 0.09 0.18 -0.02 0.00 -0.12 0.00 0.00 57.88 58.01 2eob h LEU 91 Cb 0.16 0.37 -0.01 0.00 -0.73 0.00 0.00 40.66 40.46 2eob h LEU 91 CO -0.19 -0.20 -0.40 0.58 -0.62 0.00 0.00 178.44 177.61 2eob h VAL 92 N 0.00 0.19 0.33 1.05 2.07 -0.37 -0.60 116.25 118.92 2eob h VAL 92 Ca 0.29 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.80 2eob h VAL 92 Cb 0.45 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 2eob h VAL 92 CO -0.62 0.00 -0.24 -1.28 0.02 0.00 0.00 177.57 175.44 2eob h SER 93 N -0.93 -0.63 -1.24 0.57 0.87 -0.76 -1.21 113.55 110.23 2eob h SER 93 Ca -0.07 0.04 0.40 0.00 -1.23 0.00 0.00 61.79 60.93 2eob h SER 93 Cb 0.78 0.19 -0.13 0.00 -0.44 0.00 0.00 62.40 62.81 2eob h SER 93 CO 0.03 -0.35 0.79 0.22 -0.53 0.00 0.00 176.83 176.98 2eob h TYR 94 N -0.55 0.59 -0.43 2.24 5.03 -0.28 0.89 116.97 124.45 2eob h TYR 94 Ca -0.04 0.02 -0.12 0.00 2.58 0.00 0.00 58.73 61.17 2eob h TYR 94 Cb 0.45 -0.15 -0.01 0.00 1.55 0.00 0.00 36.73 38.57 2eob h TYR 94 CO -0.06 -0.18 -0.21 1.88 -1.32 0.00 0.00 178.16 178.28 2eob h TYR 95 N 0.15 1.04 -0.77 -3.82 -1.99 -0.59 -3.13 116.97 107.87 2eob h TYR 95 Ca 0.78 -0.26 0.31 0.00 2.00 0.00 0.00 58.73 61.56 2eob h TYR 95 Cb 2.32 -0.24 -0.14 0.00 2.00 0.00 0.00 36.73 40.67 2eob h TYR 95 CO -0.01 1.05 0.38 0.39 -0.00 0.00 0.00 178.16 179.98 2eob n GLU 96 N -4.18 -0.05 -0.00 4.88 -0.58 0.31 0.18 120.64 121.20 2eob n GLU 96 Ca -0.01 1.06 -0.17 0.00 -0.42 0.00 0.00 57.16 57.62 2eob n GLU 96 Cb 0.44 -1.89 -0.11 0.00 -0.57 0.00 0.00 31.44 29.31 2eob n GLU 96 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2eob h LYS 97 N 0.00 0.34 -4.70 3.49 1.79 -1.62 -3.43 116.57 112.45 2eob h LYS 97 Ca 0.64 -0.38 -0.70 0.00 -2.18 0.00 0.00 60.65 58.03 2eob h LYS 97 Cb 1.66 0.11 -0.20 0.00 -1.58 0.00 0.00 32.23 32.22 2eob h LYS 97 CO -0.60 1.07 -0.32 -1.01 -1.08 0.00 0.00 179.45 177.50 2eob s HIS 98 N -3.13 3.21 -0.25 -1.35 3.76 0.48 -5.02 115.29 113.00 2eob s HIS 98 Ca -0.14 -0.45 -0.42 0.00 -0.15 0.00 0.00 55.06 53.91 2eob s HIS 98 Cb 0.03 -2.73 -0.18 0.00 1.11 0.00 0.00 32.58 30.81 2eob s HIS 98 CO 0.80 -0.62 1.55 0.00 -0.85 0.00 0.00 174.74 175.61 2eob n ALA 99 N 5.37 -1.13 0.24 -1.40 0.00 -1.25 -4.65 120.51 117.69 2eob n ALA 99 Ca -0.09 0.47 -0.16 0.00 0.00 0.00 0.00 53.44 53.66 2eob n ALA 99 Cb 0.47 -2.05 -0.08 0.00 0.00 0.00 0.00 19.45 17.80 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 5.56 -0.54-10.50 0.00 5.85 -1.65 -3.44 115.31 110.59 2eob h LEU 100 Ca -0.47 0.03 -0.44 0.00 0.84 0.00 0.00 57.88 57.84 2eob h LEU 100 Cb 1.35 0.15 0.05 0.00 0.37 0.00 0.00 40.66 42.58 2eob h LEU 100 CO 0.90 -0.36 -0.01 -0.47 -0.34 0.00 0.00 178.44 178.15 2eob s TYR 101 N -6.10 2.87 0.19 1.25 5.04 -1.24 -4.98 117.35 114.39 2eob s TYR 101 Ca -0.16 0.04 -0.20 0.00 -2.44 0.00 0.00 57.07 54.31 2eob s TYR 101 Cb 0.05 -2.79 0.14 0.00 0.35 0.00 0.00 41.96 39.70 2eob s TYR 101 CO 0.64 -0.92 1.44 0.54 -1.34 0.00 0.00 175.55 175.91 2eob n ARG 102 N -2.40 -0.28 -3.54 4.97 3.00 -1.26 -3.30 116.66 113.86 2eob n ARG 102 Ca 0.08 1.42 -0.27 0.00 -0.01 0.00 0.00 57.85 59.07 2eob n ARG 102 Cb 0.60 -2.11 -0.11 0.00 0.00 0.00 0.00 32.46 30.84 2eob n ARG 102 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2eob s LYS 103 N -5.75 1.33 -0.29 5.56 -0.14 -1.26 -5.01 119.74 114.17 2eob s LYS 103 Ca -0.12 -2.43 -0.22 0.00 -1.36 0.00 0.00 55.97 51.83 2eob s LYS 103 Cb 0.16 -1.97 0.17 0.00 -1.68 0.00 0.00 37.83 34.51 2eob s LYS 103 CO 0.64 -1.35 1.25 1.41 -0.76 0.00 0.00 175.35 176.53 2eob s MET 104 N -0.33 0.21 -0.14 1.68 1.75 -1.21 -5.01 119.30 116.25 2eob s MET 104 Ca 0.30 0.28 0.01 0.00 -1.25 0.00 0.00 55.69 55.03 2eob s MET 104 Cb 0.01 0.08 0.02 0.00 2.84 0.00 0.00 34.83 37.78 2eob s MET 104 CO -0.18 -0.03 -0.14 1.03 -0.65 0.00 0.00 175.02 175.04 2eob s ARG 105 N 0.45 2.28 -0.86 4.11 0.52 -1.26 -2.01 118.95 122.18 2eob s ARG 105 Ca 0.01 -0.56 -0.24 0.00 -0.52 0.00 0.00 55.73 54.42 2eob s ARG 105 Cb -0.04 -2.06 -0.20 0.00 0.52 0.00 0.00 34.95 33.16 2eob s ARG 105 CO -0.12 -0.20 2.48 1.28 0.02 0.00 0.00 175.30 178.75 2eob n LEU 106 N 4.66 0.53 -0.08 2.53 4.77 -1.26 -4.65 117.00 123.50 2eob n LEU 106 Ca -0.17 -0.36 -0.14 0.00 -0.03 0.00 0.00 56.01 55.31 2eob n LEU 106 Cb 0.50 -1.08 -0.07 0.00 -2.33 0.00 0.00 43.42 40.45 2eob n LEU 106 CO 0.22 -1.32 -1.05 0.54 -1.33 0.00 0.00 177.39 174.44 2eob n ARG 107 N 7.97 0.39 -3.90 3.23 1.74 -1.20 -4.78 116.66 120.10 2eob n ARG 107 Ca 0.58 0.12 -0.32 0.00 -0.77 0.00 0.00 57.85 57.45 2eob n ARG 107 Cb 0.22 -1.24 -0.13 0.00 -1.02 0.00 0.00 32.46 30.29 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 -2.32 3.45 -0.73 -1.55 2.02 -1.21 -5.05 117.35 111.96 2eob s TYR 108 Ca -0.23 -2.94 -0.26 0.00 -0.37 0.00 0.00 57.07 53.28 2eob s TYR 108 Cb 0.07 -2.98 -0.03 0.00 -0.40 0.00 0.00 41.96 38.62 2eob s TYR 108 CO 0.34 -0.85 1.90 -1.25 -1.57 0.00 0.00 175.55 174.12 2eob s PRO 109 N 0.29 2.60 -0.31 -1.71 0.04 -1.26 -3.18 135.00 131.48 2eob s PRO 109 Ca 0.14 0.25 -0.29 0.00 0.04 0.00 0.00 61.00 61.14 2eob s PRO 109 Cb -0.22 -4.66 -0.12 0.00 0.04 0.00 0.00 34.50 29.53 2eob s PRO 109 CO -0.04 -2.99 1.01 0.28 0.04 0.00 0.00 177.00 175.30 2eob n VAL 110 N 7.48 0.00 -4.35 -0.36 0.31 -0.32 -4.78 118.33 116.30 2eob n VAL 110 Ca 0.28 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.41 2eob n VAL 110 Cb 0.50 -0.31 -0.10 0.00 -0.91 0.00 0.00 33.84 33.02 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 2.01 1.84 -2.00 2.52 -4.23 -1.26 -4.39 115.64 110.13 2eob s THR 111 Ca 0.65 -2.15 0.14 0.00 -1.18 0.00 0.00 61.69 59.16 2eob s THR 111 Cb -0.92 -2.01 0.40 0.00 1.34 0.00 0.00 72.50 71.31 2eob s THR 111 CO 0.49 -0.50 1.26 -0.81 -0.54 0.00 0.00 174.62 174.53 2eob n PRO 112 N -0.21 0.49 -0.06 3.99 -0.04 -1.26 -2.24 135.00 135.66 2eob n PRO 112 Ca -0.09 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.33 2eob n PRO 112 Cb 0.59 -1.45 -0.13 0.00 -0.04 0.00 0.00 33.50 32.47 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 -0.95 1.14 -0.04 0.54 1.02 -1.26 -4.30 120.64 116.79 2eob n GLU 113 Ca 0.11 -0.04 -0.16 0.00 -0.02 0.00 0.00 57.16 57.04 2eob n GLU 113 Cb 0.05 -1.42 -0.07 0.00 -0.02 0.00 0.00 31.44 29.98 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 0.76 -0.03 -4.62 5.85 -1.86 -1.74 115.31 113.67 2eob h LEU 114 Ca -0.34 -0.60 0.02 0.00 0.84 0.00 0.00 57.88 57.80 2eob h LEU 114 Cb 1.73 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.52 2eob h LEU 114 CO 0.02 1.23 -0.07 -0.07 -0.34 0.00 0.00 178.44 179.20 2eob h LEU 115 N 0.34 -0.22 -0.34 2.25 -0.00 -1.78 0.39 115.31 115.94 2eob h LEU 115 Ca -0.02 0.04 -0.04 0.00 -0.00 0.00 0.00 57.88 57.86 2eob h LEU 115 Cb 1.16 0.10 -0.01 0.00 -0.00 0.00 0.00 40.66 41.91 2eob h LEU 115 CO 0.11 -0.11 0.06 1.05 -0.00 0.00 0.00 178.44 179.56 2eob h GLU 116 N -0.11 0.57 -0.03 1.13 4.11 -1.75 -2.72 114.58 115.77 2eob h GLU 116 Ca 0.04 -0.15 -0.04 0.00 0.07 0.00 0.00 59.36 59.29 2eob h GLU 116 Cb 0.17 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2eob h GLU 116 CO -0.10 0.64 -0.17 -0.09 0.07 0.00 0.00 179.01 179.36 2eob h ARG 117 N 0.40 0.05 -0.98 1.06 2.43 -1.07 -1.93 114.38 114.35 2eob h ARG 117 Ca 0.11 -0.01 -0.29 0.00 -0.81 0.00 0.00 59.98 58.98 2eob h ARG 117 Cb 0.34 -0.01 -0.17 0.00 -0.42 0.00 0.00 29.97 29.71 2eob h ARG 117 CO 0.01 0.22 0.37 0.66 -1.51 0.00 0.00 179.97 179.71 2eob n TYR 118 N -4.32 1.83 -0.07 2.20 4.02 0.14 -4.41 117.16 116.54 2eob n TYR 118 Ca -0.02 -1.24 -0.11 0.00 -0.01 0.00 0.00 57.90 56.52 2eob n TYR 118 Cb 0.25 -0.65 -0.04 0.00 -0.02 0.00 0.00 39.34 38.87 2eob n TYR 118 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2eob h SER 119 N 0.79 0.36 -1.53 7.72 0.87 -1.26 -3.45 113.55 117.05 2eob h SER 119 Ca 0.35 -0.25 -0.46 0.00 -1.23 0.00 0.00 61.79 60.20 2eob h SER 119 Cb 2.08 -0.10 0.04 0.00 -0.44 0.00 0.00 62.40 63.99 2eob h SER 119 CO 0.64 0.52 -0.07 -0.83 -0.53 0.00 0.00 176.83 176.57 2eob s GLY 120 N -2.97 1.80 0.00 5.77 0.00 -1.26 -4.98 107.32 105.68 2eob s GLY 120 Ca -0.14 -1.82 0.15 0.00 0.00 0.00 0.00 44.72 42.91 2eob s GLY 120 CO 0.73 -1.41 1.43 -1.55 0.00 0.00 0.00 173.10 172.29 2eob n PRO 121 N -2.33 0.13 -4.04 2.90 -0.04 -1.26 -4.47 135.00 125.90 2eob n PRO 121 Ca 0.13 0.19 -0.31 0.00 -0.04 0.00 0.00 63.50 63.46 2eob n PRO 121 Cb 0.60 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.41 2eob n PRO 121 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2eob s SER 122 N -2.73 3.99 -0.10 3.54 0.15 -1.26 -5.11 113.70 112.18 2eob s SER 122 Ca 0.11 -1.18 0.03 0.00 0.70 0.00 0.00 55.95 55.62 2eob s SER 122 Cb 0.10 -1.41 -0.01 0.00 -1.71 0.00 0.00 66.02 62.99 2eob s SER 122 CO 0.24 -0.17 -0.20 -0.55 1.20 0.00 0.00 173.24 173.75 2eob s SER 123 N 1.23 3.40 0.00 5.45 0.15 -1.26 -4.92 113.70 117.75 2eob s SER 123 Ca -0.05 -0.47 0.00 0.00 0.70 0.00 0.00 55.95 56.12 2eob s SER 123 Cb -0.18 -1.40 0.00 0.00 -1.71 0.00 0.00 66.02 62.72 2eob s SER 123 CO -0.07 0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.16